NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
592115 | 2mvz | 18628 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 1H MET 1 -9.282 3.314 -15.119 2 HA MET 1 HA MET 1 -6.660 2.433 -15.111 3 HB2 MET 1 1HB MET 1 -8.006 4.833 -13.816 4 HB3 MET 1 2HB MET 1 -6.279 4.653 -14.094 5 HG2 MET 1 1HG MET 1 -8.409 4.789 -16.248 6 HG3 MET 1 2HG MET 1 -7.331 6.101 -15.765 7 HE1 MET 1 3HE MET 1 -4.540 4.816 -15.340 8 HE2 MET 1 1HE MET 1 -3.845 4.911 -16.976 9 HE3 MET 1 2HE MET 1 -4.811 6.265 -16.339 10 H ALA 2 H ALA 2 -5.255 1.867 -13.584 11 HA ALA 2 HA ALA 2 -6.104 1.827 -10.764 12 HB1 ALA 2 3HB ALA 2 -5.355 -0.715 -12.251 13 HB2 ALA 2 1HB ALA 2 -5.598 -0.574 -10.495 14 HB3 ALA 2 2HB ALA 2 -6.964 -0.315 -11.606 15 H LYS 3 H LYS 3 -4.353 1.101 -9.311 16 HA LYS 3 HA LYS 3 -1.656 1.658 -10.491 17 HB2 LYS 3 1HB LYS 3 -2.805 2.862 -7.942 18 HB3 LYS 3 2HB LYS 3 -1.138 3.021 -8.477 19 HG2 LYS 3 1HG LYS 3 -1.842 4.276 -10.445 20 HG3 LYS 3 2HG LYS 3 -3.543 4.036 -10.021 21 HD2 LYS 3 1HD LYS 3 -3.088 5.225 -7.840 22 HD3 LYS 3 2HD LYS 3 -1.466 5.594 -8.443 23 HE2 LYS 3 1HE LYS 3 -3.895 6.310 -10.083 24 HE3 LYS 3 2HE LYS 3 -3.381 7.349 -8.752 25 HZ1 LYS 3 3HZ LYS 3 -1.710 6.561 -11.044 26 HZ2 LYS 3 1HZ LYS 3 -2.420 8.033 -10.824 27 HZ3 LYS 3 2HZ LYS 3 -1.229 7.530 -9.799 28 H LYS 4 H LYS 4 0.121 0.809 -9.402 29 HA LYS 4 HA LYS 4 -0.326 -0.692 -6.907 30 HB2 LYS 4 1HB LYS 4 0.540 -2.798 -7.712 31 HB3 LYS 4 2HB LYS 4 -0.844 -2.362 -8.704 32 HG2 LYS 4 1HG LYS 4 0.809 -1.441 -10.407 33 HG3 LYS 4 2HG LYS 4 2.083 -2.205 -9.447 34 HD2 LYS 4 1HD LYS 4 -0.330 -3.690 -10.550 35 HD3 LYS 4 2HD LYS 4 1.239 -3.602 -11.366 36 HE2 LYS 4 1HE LYS 4 2.329 -4.826 -9.654 37 HE3 LYS 4 2HE LYS 4 1.005 -4.580 -8.513 38 HZ1 LYS 4 3HZ LYS 4 0.871 -6.219 -10.954 39 HZ2 LYS 4 1HZ LYS 4 0.995 -6.789 -9.412 40 HZ3 LYS 4 2HZ LYS 4 -0.366 -5.989 -9.888 41 H GLY 5 H GLY 5 1.878 -1.886 -6.389 42 HA2 GLY 5 1HA GLY 5 4.300 -0.623 -7.237 43 HA3 GLY 5 2HA GLY 5 3.690 0.193 -5.778 44 H TYR 6 H TYR 6 5.790 -0.632 -4.926 45 HA TYR 6 HA TYR 6 5.362 -3.210 -3.548 46 HB2 TYR 6 1HB TYR 6 7.513 -4.148 -4.255 47 HB3 TYR 6 2HB TYR 6 6.450 -3.923 -5.637 48 HD1 TYR 6 1HD TYR 6 9.459 -2.678 -3.908 49 HD2 TYR 6 2HD TYR 6 6.963 -2.356 -7.384 50 HE1 TYR 6 1HE TYR 6 11.217 -1.372 -5.051 51 HE2 TYR 6 2HE TYR 6 8.722 -1.048 -8.526 52 HH TYR 6 HH TYR 6 11.644 -0.032 -6.841 53 H ILE 7 H ILE 7 6.470 -3.443 -1.666 54 HA ILE 7 HA ILE 7 8.300 -1.179 -0.909 55 HB ILE 7 HB ILE 7 6.740 -3.141 0.847 56 HG12 ILE 7 1HG1 ILE 7 6.362 -0.161 0.468 57 HG13 ILE 7 1HG2 ILE 7 5.343 -1.408 -0.236 58 HG21 ILE 7 2HG1 ILE 7 7.587 -1.791 2.724 59 HG22 ILE 7 2HG2 ILE 7 8.924 -2.531 1.814 60 HG23 ILE 7 2HG3 ILE 7 8.543 -0.808 1.590 61 HD11 ILE 7 1HD3 ILE 7 5.752 -0.921 2.724 62 HD12 ILE 7 1HD1 ILE 7 4.325 -0.467 1.762 63 HD13 ILE 7 1HD2 ILE 7 4.720 -2.185 2.011 64 H LEU 8 H LEU 8 10.214 -1.729 -1.644 65 HA LEU 8 HA LEU 8 11.329 -4.387 -1.078 66 HB2 LEU 8 1HB LEU 8 12.020 -3.078 -3.074 67 HB3 LEU 8 2HB LEU 8 12.633 -1.798 -2.023 68 HG LEU 8 HG LEU 8 14.294 -3.449 -1.095 69 HD11 LEU 8 1HD1 LEU 8 14.671 -5.517 -2.364 70 HD12 LEU 8 1HD2 LEU 8 13.057 -5.489 -1.616 71 HD13 LEU 8 1HD3 LEU 8 13.238 -5.169 -3.358 72 HD21 LEU 8 2HD3 LEU 8 14.870 -1.830 -2.873 73 HD22 LEU 8 2HD1 LEU 8 15.737 -3.367 -3.100 74 HD23 LEU 8 2HD2 LEU 8 14.319 -2.989 -4.107 75 H MET 9 H MET 9 12.143 -5.058 0.728 76 HA MET 9 HA MET 9 12.559 -3.086 2.907 77 HB2 MET 9 1HB MET 9 12.632 -6.123 2.980 78 HB3 MET 9 2HB MET 9 12.617 -5.042 4.366 79 HG2 MET 9 1HG MET 9 10.376 -5.415 2.359 80 HG3 MET 9 2HG MET 9 10.424 -6.025 4.015 81 HE1 MET 9 3HE MET 9 11.596 -3.710 5.734 82 HE2 MET 9 1HE MET 9 10.124 -2.810 6.172 83 HE3 MET 9 2HE MET 9 10.107 -4.591 6.155 84 H GLU 10 H GLU 10 14.392 -2.885 4.126 85 HA GLU 10 HA GLU 10 16.840 -2.964 2.625 86 HB2 GLU 10 1HB GLU 10 16.294 -1.386 4.537 87 HB3 GLU 10 2HB GLU 10 16.507 -2.734 5.644 88 HG2 GLU 10 1HG GLU 10 18.499 -1.395 5.608 89 HG3 GLU 10 2HG GLU 10 18.843 -2.974 4.906 90 H ASN 11 H ASN 11 15.277 -5.295 4.668 91 HA ASN 11 HA ASN 11 17.774 -6.804 5.137 92 HB2 ASN 11 1HB ASN 11 16.420 -8.281 6.453 93 HB3 ASN 11 2HB ASN 11 16.010 -6.625 6.880 94 HD21 ASN 11 2HD2 ASN 11 14.188 -8.212 7.677 95 HD22 ASN 11 2HD1 ASN 11 12.809 -8.284 6.632 96 H GLY 12 H GLY 12 15.937 -6.410 2.494 97 HA2 GLY 12 1HA GLY 12 16.560 -7.597 0.503 98 HA3 GLY 12 2HA GLY 12 16.880 -9.046 1.486 99 H GLY 13 H GLY 13 14.146 -7.952 2.803 100 HA2 GLY 13 1HA GLY 13 12.427 -9.816 1.390 101 HA3 GLY 13 2HA GLY 13 11.951 -8.708 2.699 102 H LYS 14 H LYS 14 10.194 -9.078 0.682 103 HA LYS 14 HA LYS 14 9.979 -6.358 -0.392 104 HB2 LYS 14 1HB LYS 14 11.403 -7.546 -2.100 105 HB3 LYS 14 2HB LYS 14 10.099 -8.703 -2.328 106 HG2 LYS 14 1HG LYS 14 8.622 -6.952 -3.150 107 HG3 LYS 14 2HG LYS 14 9.846 -5.720 -2.809 108 HD2 LYS 14 1HD LYS 14 11.385 -6.823 -4.418 109 HD3 LYS 14 2HD LYS 14 10.134 -8.022 -4.777 110 HE2 LYS 14 1HE LYS 14 8.628 -6.192 -5.539 111 HE3 LYS 14 2HE LYS 14 9.915 -5.023 -5.231 112 HZ1 LYS 14 3HZ LYS 14 10.060 -7.256 -7.143 113 HZ2 LYS 14 1HZ LYS 14 9.840 -5.667 -7.525 114 HZ3 LYS 14 2HZ LYS 14 11.263 -6.164 -6.855 115 H ILE 15 H ILE 15 7.984 -5.717 -0.288 116 HA ILE 15 HA ILE 15 5.816 -7.804 -0.335 117 HB ILE 15 HB ILE 15 5.875 -5.110 1.118 118 HG12 ILE 15 1HG1 ILE 15 5.880 -7.890 2.310 119 HG13 ILE 15 1HG2 ILE 15 7.318 -6.898 2.118 120 HG21 ILE 15 2HG1 ILE 15 3.722 -5.841 2.064 121 HG22 ILE 15 2HG2 ILE 15 3.635 -5.725 0.290 122 HG23 ILE 15 2HG3 ILE 15 3.783 -7.317 1.071 123 HD11 ILE 15 1HD3 ILE 15 4.878 -6.175 3.757 124 HD12 ILE 15 1HD1 ILE 15 6.443 -6.746 4.381 125 HD13 ILE 15 1HD2 ILE 15 6.334 -5.170 3.561 126 H GLU 16 H GLU 16 5.021 -7.877 -2.261 127 HA GLU 16 HA GLU 16 4.680 -5.372 -3.810 128 HB2 GLU 16 1HB GLU 16 5.537 -7.434 -4.924 129 HB3 GLU 16 2HB GLU 16 4.046 -8.271 -4.513 130 HG2 GLU 16 1HG GLU 16 2.770 -6.680 -5.892 131 HG3 GLU 16 2HG GLU 16 4.264 -5.843 -6.305 132 H PHE 17 H PHE 17 2.861 -4.338 -4.220 133 HA PHE 17 HA PHE 17 0.312 -5.473 -3.166 134 HB2 PHE 17 1HB PHE 17 -0.142 -3.478 -1.853 135 HB3 PHE 17 2HB PHE 17 1.374 -4.176 -1.308 136 HD1 PHE 17 1HD PHE 17 -0.148 -1.415 -3.220 137 HD2 PHE 17 2HD PHE 17 3.444 -3.005 -1.541 138 HE1 PHE 17 1HE PHE 17 0.977 0.757 -3.573 139 HE2 PHE 17 2HE PHE 17 4.572 -0.834 -1.890 140 HZ PHE 17 HZ PHE 17 3.337 1.048 -2.909 141 H GLU 18 H GLU 18 -1.581 -4.334 -3.814 142 HA GLU 18 HA GLU 18 -1.138 -2.471 -6.126 143 HB2 GLU 18 1HB GLU 18 -3.320 -4.568 -5.765 144 HB3 GLU 18 2HB GLU 18 -3.309 -3.350 -7.032 145 HG2 GLU 18 1HG GLU 18 -1.126 -4.299 -7.828 146 HG3 GLU 18 2HG GLU 18 -1.318 -5.592 -6.647 147 H LEU 19 H LEU 19 -2.622 -0.810 -6.433 148 HA LEU 19 HA LEU 19 -3.904 -0.002 -3.845 149 HB2 LEU 19 1HB LEU 19 -2.755 1.726 -6.075 150 HB3 LEU 19 2HB LEU 19 -3.497 2.323 -4.588 151 HG LEU 19 HG LEU 19 -0.924 0.711 -4.744 152 HD11 LEU 19 1HD1 LEU 19 0.149 2.836 -4.144 153 HD12 LEU 19 1HD2 LEU 19 -0.697 2.945 -5.705 154 HD13 LEU 19 1HD3 LEU 19 -1.424 3.660 -4.247 155 HD21 LEU 19 2HD3 LEU 19 -2.204 0.356 -2.659 156 HD22 LEU 19 2HD1 LEU 19 -0.735 1.314 -2.354 157 HD23 LEU 19 2HD2 LEU 19 -2.322 2.117 -2.431 158 H PHE 20 H PHE 20 -5.793 1.264 -3.895 159 HA PHE 20 HA PHE 20 -7.441 0.785 -6.356 160 HB2 PHE 20 1HB PHE 20 -8.322 0.387 -3.465 161 HB3 PHE 20 2HB PHE 20 -9.337 0.201 -4.886 162 HD1 PHE 20 2HD PHE 20 -9.047 -1.707 -6.396 163 HD2 PHE 20 1HD PHE 20 -6.718 -1.297 -2.838 164 HE1 PHE 20 2HE PHE 20 -8.404 -4.089 -6.546 165 HE2 PHE 20 1HE PHE 20 -6.070 -3.678 -2.986 166 HZ PHE 20 HZ PHE 20 -6.913 -5.074 -4.841 167 HA PRO 21 HA PRO 21 -7.726 5.263 -5.532 168 HB2 PRO 21 1HB PRO 21 -8.853 4.871 -8.336 169 HB3 PRO 21 2HB PRO 21 -7.741 6.123 -7.766 170 HG2 PRO 21 1HG PRO 21 -6.756 4.140 -9.241 171 HG3 PRO 21 2HG PRO 21 -5.855 4.670 -7.819 172 HD2 PRO 21 1HD PRO 21 -7.678 2.255 -8.145 173 HD3 PRO 21 2HD PRO 21 -6.082 2.374 -7.300 174 H ASN 22 H ASN 22 -9.978 2.830 -6.677 175 HA ASN 22 HA ASN 22 -12.352 4.445 -6.363 176 HB2 ASN 22 1HB ASN 22 -11.874 1.458 -6.388 177 HB3 ASN 22 2HB ASN 22 -13.472 2.167 -6.201 178 HD21 ASN 22 2HD2 ASN 22 -12.696 0.486 -8.318 179 HD22 ASN 22 2HD1 ASN 22 -12.773 1.398 -9.788 180 H GLU 23 H GLU 23 -10.418 2.528 -4.140 181 HA GLU 23 HA GLU 23 -12.347 2.710 -1.958 182 HB2 GLU 23 1HB GLU 23 -9.386 2.018 -2.084 183 HB3 GLU 23 2HB GLU 23 -10.297 2.047 -0.581 184 HG2 GLU 23 1HG GLU 23 -11.768 0.289 -1.384 185 HG3 GLU 23 2HG GLU 23 -10.979 0.308 -2.959 186 H ALA 24 H ALA 24 -9.430 4.513 -2.894 187 HA ALA 24 HA ALA 24 -10.461 6.879 -1.547 188 HB1 ALA 24 3HB ALA 24 -7.956 5.540 -0.465 189 HB2 ALA 24 1HB ALA 24 -8.554 7.151 -0.005 190 HB3 ALA 24 2HB ALA 24 -9.509 5.701 0.388 191 HA PRO 25 HA PRO 25 -8.073 7.869 -5.302 192 HB2 PRO 25 1HB PRO 25 -9.690 10.387 -4.713 193 HB3 PRO 25 2HB PRO 25 -9.436 9.585 -6.269 194 HG2 PRO 25 1HG PRO 25 -11.794 9.293 -5.078 195 HG3 PRO 25 2HG PRO 25 -11.034 7.879 -5.812 196 HD2 PRO 25 1HD PRO 25 -11.130 8.704 -2.884 197 HD3 PRO 25 2HD PRO 25 -11.334 7.061 -3.613 198 H VAL 26 H VAL 26 -8.714 9.982 -2.500 199 HA VAL 26 HA VAL 26 -6.371 11.645 -3.032 200 HB VAL 26 HB VAL 26 -8.072 11.253 -0.522 201 HG11 VAL 26 1HG1 VAL 26 -7.097 13.360 0.250 202 HG12 VAL 26 1HG2 VAL 26 -5.865 12.093 0.040 203 HG13 VAL 26 1HG3 VAL 26 -6.029 13.386 -1.173 204 HG21 VAL 26 2HG3 VAL 26 -9.333 12.146 -2.450 205 HG22 VAL 26 2HG1 VAL 26 -9.109 13.395 -1.202 206 HG23 VAL 26 2HG2 VAL 26 -8.103 13.412 -2.671 207 H THR 27 H THR 27 -7.021 8.997 -0.748 208 HA THR 27 HA THR 27 -4.462 9.180 0.545 209 HB THR 27 HB THR 27 -6.273 6.743 0.246 210 HG1 THR 27 1HG THR 27 -7.314 8.572 1.210 211 HG21 THR 27 2HG3 THR 27 -4.130 7.442 2.289 212 HG22 THR 27 2HG1 THR 27 -5.169 5.999 2.319 213 HG23 THR 27 2HG2 THR 27 -3.984 6.215 1.009 214 H VAL 28 H VAL 28 -5.607 7.112 -2.123 215 HA VAL 28 HA VAL 28 -3.110 5.734 -2.539 216 HB VAL 28 HB VAL 28 -5.377 6.468 -4.453 217 HG11 VAL 28 1HG1 VAL 28 -4.455 4.772 -5.956 218 HG12 VAL 28 1HG2 VAL 28 -3.323 6.121 -5.698 219 HG13 VAL 28 1HG3 VAL 28 -3.061 4.568 -4.868 220 HG21 VAL 28 2HG3 VAL 28 -6.024 4.967 -2.600 221 HG22 VAL 28 2HG1 VAL 28 -6.019 4.097 -4.152 222 HG23 VAL 28 2HG2 VAL 28 -4.674 3.881 -3.007 223 H ALA 29 H ALA 29 -4.389 8.702 -4.034 224 HA ALA 29 HA ALA 29 -2.183 9.119 -5.766 225 HB1 ALA 29 3HB ALA 29 -3.975 11.172 -4.421 226 HB2 ALA 29 1HB ALA 29 -2.922 11.472 -5.824 227 HB3 ALA 29 2HB ALA 29 -4.299 10.352 -5.966 228 H ASN 30 H ASN 30 -2.740 10.313 -2.450 229 HA ASN 30 HA ASN 30 -0.306 11.846 -2.327 230 HB2 ASN 30 1HB ASN 30 -2.095 10.680 -0.181 231 HB3 ASN 30 2HB ASN 30 -0.693 11.683 0.166 232 HD21 ASN 30 2HD2 ASN 30 -3.211 12.419 0.971 233 HD22 ASN 30 2HD1 ASN 30 -3.721 13.813 0.078 234 H PHE 31 H PHE 31 -1.094 8.535 -1.285 235 HA PHE 31 HA PHE 31 1.461 7.917 -0.170 236 HB2 PHE 31 1HB PHE 31 -0.611 6.507 0.052 237 HB3 PHE 31 2HB PHE 31 -0.455 6.057 -1.639 238 HD1 PHE 31 1HD PHE 31 1.068 5.755 1.705 239 HD2 PHE 31 2HD PHE 31 1.148 4.437 -2.358 240 HE1 PHE 31 1HE PHE 31 2.558 3.888 2.342 241 HE2 PHE 31 2HE PHE 31 2.634 2.566 -1.724 242 HZ PHE 31 HZ PHE 31 3.341 2.293 0.627 243 H GLU 32 H GLU 32 0.249 7.577 -3.502 244 HA GLU 32 HA GLU 32 2.644 6.460 -4.598 245 HB2 GLU 32 1HB GLU 32 0.549 6.469 -5.860 246 HB3 GLU 32 2HB GLU 32 0.495 8.225 -5.841 247 HG2 GLU 32 1HG GLU 32 2.434 8.362 -7.273 248 HG3 GLU 32 2HG GLU 32 2.678 6.619 -7.183 249 H LYS 33 H LYS 33 1.611 9.851 -4.246 250 HA LYS 33 HA LYS 33 3.848 11.003 -5.590 251 HB2 LYS 33 1HB LYS 33 2.044 12.054 -3.382 252 HB3 LYS 33 2HB LYS 33 3.293 13.030 -4.143 253 HG2 LYS 33 1HG LYS 33 2.196 12.779 -6.323 254 HG3 LYS 33 2HG LYS 33 0.958 11.747 -5.591 255 HD2 LYS 33 1HD LYS 33 0.290 13.618 -4.103 256 HD3 LYS 33 2HD LYS 33 1.513 14.648 -4.862 257 HE2 LYS 33 1HE LYS 33 0.385 14.370 -7.049 258 HE3 LYS 33 2HE LYS 33 -0.840 13.353 -6.287 259 HZ1 LYS 33 3HZ LYS 33 -0.315 16.174 -5.631 260 HZ2 LYS 33 1HZ LYS 33 -1.584 15.607 -6.518 261 HZ3 LYS 33 2HZ LYS 33 -1.459 15.224 -4.918 262 H LEU 34 H LEU 34 3.396 10.140 -2.171 263 HA LEU 34 HA LEU 34 5.973 11.127 -1.329 264 HB2 LEU 34 1HB LEU 34 4.108 9.014 -0.178 265 HB3 LEU 34 2HB LEU 34 5.579 9.568 0.628 266 HG LEU 34 HG LEU 34 3.233 11.369 -0.067 267 HD11 LEU 34 1HD1 LEU 34 2.696 11.238 2.325 268 HD12 LEU 34 1HD2 LEU 34 2.576 9.647 1.536 269 HD13 LEU 34 1HD3 LEU 34 3.987 10.034 2.549 270 HD21 LEU 34 2HD3 LEU 34 5.423 12.501 0.120 271 HD22 LEU 34 2HD1 LEU 34 4.367 12.915 1.491 272 HD23 LEU 34 2HD2 LEU 34 5.683 11.736 1.705 273 H ALA 35 H ALA 35 4.838 7.870 -2.237 274 HA ALA 35 HA ALA 35 7.276 6.539 -1.675 275 HB1 ALA 35 3HB ALA 35 5.181 5.885 -3.778 276 HB2 ALA 35 1HB ALA 35 6.433 4.773 -3.178 277 HB3 ALA 35 2HB ALA 35 5.160 5.356 -2.080 278 H ASN 36 H ASN 36 6.154 8.115 -4.661 279 HA ASN 36 HA ASN 36 8.506 7.201 -6.159 280 HB2 ASN 36 1HB ASN 36 6.214 9.068 -6.805 281 HB3 ASN 36 2HB ASN 36 7.546 8.766 -7.912 282 HD21 ASN 36 2HD2 ASN 36 4.902 8.196 -8.535 283 HD22 ASN 36 2HD1 ASN 36 4.716 6.479 -8.678 284 H GLU 37 H GLU 37 7.985 9.646 -3.920 285 HA GLU 37 HA GLU 37 10.273 11.230 -5.007 286 HB2 GLU 37 1HB GLU 37 8.300 11.693 -2.740 287 HB3 GLU 37 2HB GLU 37 9.752 12.663 -2.935 288 HG2 GLU 37 1HG GLU 37 8.999 13.412 -5.129 289 HG3 GLU 37 2HG GLU 37 7.578 12.375 -5.019 290 H GLY 38 H GLY 38 9.912 8.459 -3.368 291 HA2 GLY 38 1HA GLY 38 11.513 7.219 -2.227 292 HA3 GLY 38 2HA GLY 38 12.619 8.609 -2.326 293 H PHE 39 H PHE 39 9.454 9.180 -1.055 294 HA PHE 39 HA PHE 39 10.455 10.344 1.340 295 HB2 PHE 39 1HB PHE 39 8.238 10.900 0.429 296 HB3 PHE 39 2HB PHE 39 7.686 9.253 0.688 297 HD1 PHE 39 1HD PHE 39 8.784 12.343 2.408 298 HD2 PHE 39 2HD PHE 39 6.867 8.544 2.788 299 HE1 PHE 39 1HE PHE 39 8.013 12.961 4.674 300 HE2 PHE 39 2HE PHE 39 6.091 9.159 5.053 301 HZ PHE 39 HZ PHE 39 6.667 11.368 5.997 302 H TYR 40 H TYR 40 9.292 7.064 0.692 303 HA TYR 40 HA TYR 40 9.315 6.430 3.581 304 HB2 TYR 40 1HB TYR 40 8.538 4.874 1.091 305 HB3 TYR 40 2HB TYR 40 8.603 4.140 2.689 306 HD1 TYR 40 2HD TYR 40 7.100 4.987 4.509 307 HD2 TYR 40 1HD TYR 40 6.719 6.232 0.420 308 HE1 TYR 40 2HE TYR 40 4.801 5.773 4.962 309 HE2 TYR 40 1HE TYR 40 4.421 7.017 0.874 310 HH TYR 40 HH TYR 40 3.009 6.791 4.141 311 H ASN 41 H ASN 41 11.644 6.651 1.268 312 HA ASN 41 HA ASN 41 13.217 4.292 1.898 313 HB2 ASN 41 1HB ASN 41 13.508 5.700 -0.150 314 HB3 ASN 41 2HB ASN 41 14.144 6.987 0.866 315 HD21 ASN 41 2HD2 ASN 41 15.462 5.572 -1.277 316 HD22 ASN 41 2HD1 ASN 41 16.864 4.820 -0.590 317 H GLY 42 H GLY 42 13.600 3.861 3.951 318 HA2 GLY 42 1HA GLY 42 15.306 4.189 5.670 319 HA3 GLY 42 2HA GLY 42 15.104 5.946 5.476 320 H LEU 43 H LEU 43 12.068 4.792 5.215 321 HA LEU 43 HA LEU 43 11.441 5.300 8.061 322 HB2 LEU 43 1HB LEU 43 9.877 5.028 5.498 323 HB3 LEU 43 2HB LEU 43 9.050 4.764 7.036 324 HG LEU 43 HG LEU 43 9.711 7.059 7.752 325 HD11 LEU 43 1HD1 LEU 43 10.621 8.601 6.072 326 HD12 LEU 43 1HD2 LEU 43 11.742 7.260 6.411 327 HD13 LEU 43 1HD3 LEU 43 10.773 7.255 4.918 328 HD21 LEU 43 2HD3 LEU 43 7.527 6.613 6.680 329 HD22 LEU 43 2HD1 LEU 43 8.145 8.221 6.232 330 HD23 LEU 43 2HD2 LEU 43 8.261 6.869 5.078 331 H THR 44 H THR 44 10.460 3.913 9.464 332 HA THR 44 HA THR 44 10.970 1.037 8.766 333 HB THR 44 HB THR 44 11.669 0.675 11.057 334 HG1 THR 44 1HG THR 44 11.679 2.468 12.529 335 HG21 THR 44 2HG3 THR 44 12.935 3.229 9.995 336 HG22 THR 44 2HG1 THR 44 13.648 2.134 11.202 337 HG23 THR 44 2HG2 THR 44 13.393 1.574 9.532 338 H PHE 45 H PHE 45 9.762 -0.557 9.971 339 HA PHE 45 HA PHE 45 7.008 0.347 10.639 340 HB2 PHE 45 1HB PHE 45 8.307 -2.399 10.412 341 HB3 PHE 45 2HB PHE 45 6.660 -2.155 10.975 342 HD1 PHE 45 1HD PHE 45 8.919 -1.913 8.080 343 HD2 PHE 45 2HD PHE 45 4.889 -1.591 9.459 344 HE1 PHE 45 1HE PHE 45 8.120 -1.934 5.740 345 HE2 PHE 45 2HE PHE 45 4.084 -1.614 7.121 346 HZ PHE 45 HZ PHE 45 5.702 -1.784 5.261 347 H HIS 46 H HIS 46 6.874 1.308 12.545 348 HA HIS 46 HA HIS 46 8.801 0.584 14.650 349 HB2 HIS 46 1HB HIS 46 7.879 2.516 15.845 350 HB3 HIS 46 2HB HIS 46 8.270 2.966 14.191 351 HD2 HIS 46 2HD HIS 46 5.477 3.549 16.553 352 HE1 HIS 46 1HE HIS 46 3.630 3.489 12.712 353 H ARG 47 H ARG 47 5.640 -0.328 13.777 354 HA ARG 47 HA ARG 47 5.417 -1.770 16.388 355 HB2 ARG 47 1HB ARG 47 3.188 -0.286 14.941 356 HB3 ARG 47 2HB ARG 47 2.933 -1.412 16.265 357 HG2 ARG 47 1HG ARG 47 4.571 1.125 16.485 358 HG3 ARG 47 2HG ARG 47 2.856 0.972 16.938 359 HD2 ARG 47 1HD ARG 47 3.479 -0.801 18.522 360 HD3 ARG 47 2HD ARG 47 5.188 -0.517 18.119 361 HE ARG 47 HE ARG 47 3.422 1.190 19.707 362 HH11 ARG 47 1HH1 ARG 47 6.482 0.857 18.012 363 HH12 ARG 47 1HH2 ARG 47 7.253 2.160 18.889 364 HH21 ARG 47 2HH1 ARG 47 4.433 2.880 20.839 365 HH22 ARG 47 2HH2 ARG 47 6.095 3.305 20.489 366 H VAL 48 H VAL 48 6.370 -3.490 15.180 367 HA VAL 48 HA VAL 48 4.661 -4.718 13.063 368 HB VAL 48 HB VAL 48 7.323 -5.575 14.300 369 HG11 VAL 48 1HG1 VAL 48 7.459 -7.143 12.426 370 HG12 VAL 48 1HG2 VAL 48 6.054 -7.471 13.469 371 HG13 VAL 48 1HG3 VAL 48 5.830 -6.657 11.902 372 HG21 VAL 48 2HG3 VAL 48 7.495 -3.479 13.003 373 HG22 VAL 48 2HG1 VAL 48 8.291 -4.823 12.151 374 HG23 VAL 48 2HG2 VAL 48 6.685 -4.262 11.626 375 H ILE 49 H ILE 49 3.239 -6.197 13.332 376 HA ILE 49 HA ILE 49 3.432 -7.915 15.795 377 HB ILE 49 HB ILE 49 0.896 -7.007 14.340 378 HG12 ILE 49 1HG1 ILE 49 1.938 -6.166 17.057 379 HG13 ILE 49 1HG2 ILE 49 1.970 -5.177 15.605 380 HG21 ILE 49 2HG1 ILE 49 -0.265 -8.100 16.216 381 HG22 ILE 49 2HG2 ILE 49 0.742 -9.263 15.323 382 HG23 ILE 49 2HG3 ILE 49 1.298 -8.622 16.886 383 HD11 ILE 49 1HD3 ILE 49 -0.517 -6.237 16.966 384 HD12 ILE 49 1HD1 ILE 49 0.102 -4.571 17.039 385 HD13 ILE 49 1HD2 ILE 49 -0.484 -5.235 15.495 386 HA PRO 50 HA PRO 50 4.233 -10.739 12.405 387 HB2 PRO 50 1HB PRO 50 4.671 -12.413 14.921 388 HB3 PRO 50 2HB PRO 50 5.672 -12.343 13.465 389 HG2 PRO 50 1HG PRO 50 6.527 -11.074 15.640 390 HG3 PRO 50 2HG PRO 50 6.664 -10.266 14.076 391 HD2 PRO 50 1HD PRO 50 4.604 -9.859 16.273 392 HD3 PRO 50 2HD PRO 50 5.413 -8.627 15.224 393 H GLY 51 H GLY 51 2.621 -11.546 11.400 394 HA2 GLY 51 1HA GLY 51 1.202 -13.461 11.110 395 HA3 GLY 51 2HA GLY 51 0.945 -13.518 12.869 396 H PHE 52 H PHE 52 0.696 -10.404 12.551 397 HA PHE 52 HA PHE 52 -2.168 -10.418 11.665 398 HB2 PHE 52 1HB PHE 52 -1.044 -9.121 14.184 399 HB3 PHE 52 2HB PHE 52 -2.695 -8.967 13.606 400 HD1 PHE 52 2HD PHE 52 -4.247 -10.859 13.721 401 HD2 PHE 52 1HD PHE 52 -0.277 -11.127 15.274 402 HE1 PHE 52 2HE PHE 52 -4.885 -12.878 14.997 403 HE2 PHE 52 1HE PHE 52 -0.910 -13.147 16.550 404 HZ PHE 52 HZ PHE 52 -3.215 -14.022 16.411 405 H VAL 53 H VAL 53 -1.691 -7.565 13.101 406 HA VAL 53 HA VAL 53 -1.209 -6.298 10.409 407 HB VAL 53 HB VAL 53 -2.759 -5.240 12.821 408 HG11 VAL 53 1HG1 VAL 53 -3.575 -3.545 11.256 409 HG12 VAL 53 1HG2 VAL 53 -1.804 -3.492 11.433 410 HG13 VAL 53 1HG3 VAL 53 -2.533 -4.222 9.981 411 HG21 VAL 53 2HG3 VAL 53 -3.888 -7.198 11.823 412 HG22 VAL 53 2HG1 VAL 53 -4.784 -5.701 11.475 413 HG23 VAL 53 2HG2 VAL 53 -3.773 -6.446 10.214 414 H SER 54 H SER 54 0.546 -5.273 10.093 415 HA SER 54 HA SER 54 2.119 -4.232 12.455 416 HB2 SER 54 1HB SER 54 2.965 -4.902 9.687 417 HB3 SER 54 2HB SER 54 3.960 -4.152 10.926 418 HG SER 54 HG SER 54 4.110 -6.433 10.794 419 H GLN 55 H GLN 55 2.846 -2.130 12.484 420 HA GLN 55 HA GLN 55 1.711 -0.293 10.403 421 HB2 GLN 55 1HB GLN 55 0.469 -0.144 12.580 422 HB3 GLN 55 2HB GLN 55 1.979 0.249 13.391 423 HG2 GLN 55 1HG GLN 55 2.185 2.282 12.012 424 HG3 GLN 55 2HG GLN 55 0.623 1.888 11.240 425 HE21 GLN 55 2HE2 GLN 55 0.519 4.250 12.242 426 HE22 GLN 55 2HE1 GLN 55 -0.251 4.319 13.792 427 H GLY 56 H GLY 56 2.981 1.189 9.545 428 HA2 GLY 56 1HA GLY 56 5.618 1.734 10.780 429 HA3 GLY 56 2HA GLY 56 5.609 0.984 9.167 430 H GLY 57 H GLY 57 6.875 3.270 9.201 431 HA2 GLY 57 1HA GLY 57 6.387 4.997 7.409 432 HA3 GLY 57 2HA GLY 57 4.905 5.349 8.328 433 H CYS 58 H CYS 58 7.840 4.510 10.012 434 HA CYS 58 HA CYS 58 8.036 7.335 11.083 435 HB2 CYS 58 1HB CYS 58 8.785 4.737 12.333 436 HB3 CYS 58 2HB CYS 58 9.149 6.334 12.972 437 HG CYS 58 HG CYS 58 6.160 5.255 12.155 438 HA PRO 59 HA PRO 59 11.877 7.288 8.653 439 HB2 PRO 59 1HB PRO 59 12.033 9.946 10.130 440 HB3 PRO 59 2HB PRO 59 12.295 9.630 8.411 441 HG2 PRO 59 1HG PRO 59 10.020 10.799 9.143 442 HG3 PRO 59 2HG PRO 59 9.965 9.515 7.932 443 HD2 PRO 59 1HD PRO 59 9.339 9.369 10.909 444 HD3 PRO 59 2HD PRO 59 8.441 8.637 9.519 445 H ARG 60 H ARG 60 13.117 5.834 9.540 446 HA ARG 60 HA ARG 60 14.492 4.795 11.112 447 HB2 ARG 60 1HB ARG 60 15.322 7.688 11.570 448 HB3 ARG 60 2HB ARG 60 16.225 6.276 12.098 449 HG2 ARG 60 1HG ARG 60 16.596 5.613 9.770 450 HG3 ARG 60 2HG ARG 60 15.647 7.014 9.218 451 HD2 ARG 60 1HD ARG 60 17.257 8.468 10.437 452 HD3 ARG 60 2HD ARG 60 18.251 7.019 10.716 453 HE ARG 60 HE ARG 60 17.701 7.140 7.970 454 HH11 ARG 60 1HH1 ARG 60 19.410 9.019 10.396 455 HH12 ARG 60 1HH2 ARG 60 20.578 9.656 9.260 456 HH21 ARG 60 2HH1 ARG 60 19.222 7.974 6.505 457 HH22 ARG 60 2HH2 ARG 60 20.473 9.065 7.058 458 H GLY 61 H GLY 61 11.822 5.570 12.003 459 HA2 GLY 61 1HA GLY 61 10.686 5.208 13.998 460 HA3 GLY 61 2HA GLY 61 12.251 4.965 14.809 461 H ASN 62 H ASN 62 11.507 7.835 12.921 462 HA ASN 62 HA ASN 62 11.696 9.473 15.408 463 HB2 ASN 62 1HB ASN 62 11.929 10.153 12.468 464 HB3 ASN 62 2HB ASN 62 11.866 11.366 13.739 465 HD21 ASN 62 2HD2 ASN 62 14.004 10.872 11.891 466 HD22 ASN 62 2HD1 ASN 62 15.399 10.452 12.828 467 H GLY 63 H GLY 63 9.297 7.905 14.056 468 HA2 GLY 63 1HA GLY 63 7.077 8.170 14.819 469 HA3 GLY 63 2HA GLY 63 7.410 9.882 15.173 470 H THR 64 H THR 64 7.108 11.435 13.602 471 HA THR 64 HA THR 64 5.633 10.459 11.176 472 HB THR 64 HB THR 64 5.173 13.001 12.800 473 HG1 THR 64 1HG THR 64 3.166 11.934 13.257 474 HG21 THR 64 2HG3 THR 64 3.715 11.872 10.380 475 HG22 THR 64 2HG1 THR 64 3.244 13.319 11.300 476 HG23 THR 64 2HG2 THR 64 4.768 13.305 10.381 477 H GLY 65 H GLY 65 6.613 10.774 9.359 478 HA2 GLY 65 1HA GLY 65 8.748 12.756 9.094 479 HA3 GLY 65 2HA GLY 65 8.131 11.672 7.826 480 H ASP 66 H ASP 66 8.770 14.436 7.487 481 HA ASP 66 HA ASP 66 6.275 15.973 7.495 482 HB2 ASP 66 1HB ASP 66 8.581 16.992 7.751 483 HB3 ASP 66 2HB ASP 66 8.906 16.565 6.077 484 H ALA 67 H ALA 67 5.079 14.255 6.346 485 HA ALA 67 HA ALA 67 5.571 13.882 3.520 486 HB1 ALA 67 3HB ALA 67 3.045 13.461 5.158 487 HB2 ALA 67 1HB ALA 67 3.318 12.873 3.503 488 HB3 ALA 67 2HB ALA 67 4.304 12.245 4.845 489 H GLY 68 H GLY 68 3.435 16.013 5.400 490 HA2 GLY 68 1HA GLY 68 2.606 18.109 4.745 491 HA3 GLY 68 2HA GLY 68 3.278 17.855 3.117 492 H TYR 69 H TYR 69 1.493 15.207 4.343 493 HA TYR 69 HA TYR 69 -0.949 16.083 2.833 494 HB2 TYR 69 1HB TYR 69 0.342 13.326 2.836 495 HB3 TYR 69 2HB TYR 69 -1.196 13.730 2.083 496 HD1 TYR 69 2HD TYR 69 -1.191 15.531 0.246 497 HD2 TYR 69 1HD TYR 69 2.345 13.560 1.666 498 HE1 TYR 69 2HE TYR 69 -0.011 16.152 -1.835 499 HE2 TYR 69 1HE TYR 69 3.526 14.181 -0.414 500 HH TYR 69 HH TYR 69 3.380 15.216 -2.375 501 H THR 70 H THR 70 -2.686 16.163 3.993 502 HA THR 70 HA THR 70 -3.009 14.166 6.204 503 HB THR 70 HB THR 70 -3.801 17.112 6.294 504 HG1 THR 70 1HG THR 70 -1.844 15.632 7.762 505 HG21 THR 70 2HG3 THR 70 -4.077 14.889 8.354 506 HG22 THR 70 2HG1 THR 70 -4.485 16.602 8.606 507 HG23 THR 70 2HG2 THR 70 -5.412 15.628 7.439 508 H ILE 71 H ILE 71 -4.823 13.076 6.255 509 HA ILE 71 HA ILE 71 -7.008 13.928 4.373 510 HB ILE 71 HB ILE 71 -7.294 11.542 3.762 511 HG12 ILE 71 1HG1 ILE 71 -4.775 10.973 5.335 512 HG13 ILE 71 1HG2 ILE 71 -6.394 10.689 5.955 513 HG21 ILE 71 2HG1 ILE 71 -5.249 11.238 2.424 514 HG22 ILE 71 2HG2 ILE 71 -5.809 12.926 2.361 515 HG23 ILE 71 2HG3 ILE 71 -4.426 12.486 3.391 516 HD11 ILE 71 1HD3 ILE 71 -5.203 9.421 3.478 517 HD12 ILE 71 1HD1 ILE 71 -5.425 8.646 5.064 518 HD13 ILE 71 1HD2 ILE 71 -6.843 9.134 4.106 519 HA PRO 72 HA PRO 72 -9.675 12.863 7.691 520 HB2 PRO 72 1HB PRO 72 -12.052 12.886 6.449 521 HB3 PRO 72 2HB PRO 72 -11.098 14.374 6.401 522 HG2 PRO 72 1HG PRO 72 -11.405 12.227 4.262 523 HG3 PRO 72 2HG PRO 72 -11.493 13.982 4.077 524 HD2 PRO 72 1HD PRO 72 -9.188 12.485 3.612 525 HD3 PRO 72 2HD PRO 72 -9.182 14.239 4.056 526 H CYS 73 H CYS 73 -11.525 11.344 8.204 527 HA CYS 73 HA CYS 73 -10.811 8.559 7.581 528 HB2 CYS 73 1HB CYS 73 -11.640 9.109 9.719 529 HB3 CYS 73 2HB CYS 73 -13.140 9.719 9.031 530 HG CYS 73 HG CYS 73 -13.556 7.467 10.192 531 H GLU 74 H GLU 74 -11.185 7.811 5.559 532 HA GLU 74 HA GLU 74 -13.644 8.725 4.125 533 HB2 GLU 74 1HB GLU 74 -11.387 8.954 3.005 534 HB3 GLU 74 2HB GLU 74 -11.229 7.203 3.058 535 HG2 GLU 74 1HG GLU 74 -11.963 8.014 0.868 536 HG3 GLU 74 2HG GLU 74 -13.137 6.926 1.603 537 H THR 75 H THR 75 -15.142 7.371 3.300 538 HA THR 75 HA THR 75 -14.897 4.484 4.065 539 HB THR 75 HB THR 75 -17.287 4.468 4.667 540 HG1 THR 75 1HG THR 75 -18.366 6.516 4.827 541 HG21 THR 75 2HG3 THR 75 -15.744 6.647 6.126 542 HG22 THR 75 2HG1 THR 75 -17.155 5.767 6.757 543 HG23 THR 75 2HG2 THR 75 -15.631 4.902 6.448 544 H ASP 76 H ASP 76 -15.442 6.795 1.676 545 HA ASP 76 HA ASP 76 -16.884 4.797 -0.036 546 HB2 ASP 76 1HB ASP 76 -16.688 7.833 -0.236 547 HB3 ASP 76 2HB ASP 76 -17.427 6.807 -1.459 548 H ASN 77 H ASN 77 -14.559 4.650 -2.602 549 HA ASN 77 HA ASN 77 -17.424 4.856 -1.774 550 HB2 ASN 77 1HB ASN 77 -16.116 4.015 -4.374 551 HB3 ASN 77 2HB ASN 77 -17.842 3.902 -4.057 552 HD21 ASN 77 2HD2 ASN 77 -15.355 5.846 -5.194 553 HD22 ASN 77 2HD1 ASN 77 -16.209 7.352 -5.256 554 H ASN 78 H ASN 78 -14.756 2.685 -1.849 555 HA ASN 78 HA ASN 78 -16.571 0.318 -1.663 556 HB2 ASN 78 1HB ASN 78 -13.590 0.584 -2.133 557 HB3 ASN 78 2HB ASN 78 -14.399 -0.952 -1.849 558 HD21 ASN 78 2HD2 ASN 78 -12.951 -0.151 -4.188 559 HD22 ASN 78 2HD1 ASN 78 -14.062 -0.195 -5.515 560 HA PRO 79 HA PRO 79 -16.202 -0.184 2.667 561 HB2 PRO 79 1HB PRO 79 -15.629 -3.084 1.923 562 HB3 PRO 79 2HB PRO 79 -16.826 -2.461 3.066 563 HG2 PRO 79 1HG PRO 79 -17.679 -3.330 0.702 564 HG3 PRO 79 2HG PRO 79 -18.347 -1.828 1.346 565 HD2 PRO 79 1HD PRO 79 -16.184 -2.218 -0.759 566 HD3 PRO 79 2HD PRO 79 -17.556 -1.040 -0.738 567 H HIS 80 H HIS 80 -14.700 -0.087 4.141 568 HA HIS 80 HA HIS 80 -11.912 -0.693 3.218 569 HB2 HIS 80 1HB HIS 80 -12.968 1.392 5.174 570 HB3 HIS 80 2HB HIS 80 -11.262 1.017 4.979 571 HD2 HIS 80 2HD HIS 80 -11.585 0.960 1.434 572 HE1 HIS 80 1HE HIS 80 -12.368 5.052 2.263 573 H ARG 81 H ARG 81 -12.942 -2.906 4.000 574 HA ARG 81 HA ARG 81 -12.543 -3.322 6.888 575 HB2 ARG 81 1HB ARG 81 -12.926 -5.280 4.589 576 HB3 ARG 81 2HB ARG 81 -12.861 -5.723 6.288 577 HG2 ARG 81 1HG ARG 81 -14.897 -4.425 6.722 578 HG3 ARG 81 2HG ARG 81 -14.959 -3.954 5.006 579 HD2 ARG 81 1HD ARG 81 -16.456 -5.765 5.372 580 HD3 ARG 81 2HD ARG 81 -15.074 -6.348 4.416 581 HE ARG 81 HE ARG 81 -14.710 -6.744 7.248 582 HH11 ARG 81 1HH1 ARG 81 -16.221 -8.052 4.360 583 HH12 ARG 81 1HH2 ARG 81 -16.255 -9.691 4.968 584 HH21 ARG 81 2HH1 ARG 81 -14.758 -8.876 8.027 585 HH22 ARG 81 2HH2 ARG 81 -15.426 -10.160 7.044 586 H HIS 82 H HIS 82 -10.938 -4.465 7.882 587 HA HIS 82 HA HIS 82 -8.344 -4.407 6.431 588 HB2 HIS 82 1HB HIS 82 -9.104 -4.715 9.360 589 HB3 HIS 82 2HB HIS 82 -7.465 -4.980 8.780 590 HD2 HIS 82 2HD HIS 82 -5.961 -2.625 9.195 591 HE1 HIS 82 1HE HIS 82 -9.174 0.077 8.538 592 H VAL 83 H VAL 83 -9.118 -6.195 5.057 593 HA VAL 83 HA VAL 83 -9.086 -8.868 6.403 594 HB VAL 83 HB VAL 83 -9.777 -9.712 4.204 595 HG11 VAL 83 1HG1 VAL 83 -11.937 -8.589 3.964 596 HG12 VAL 83 1HG2 VAL 83 -11.531 -8.892 5.670 597 HG13 VAL 83 1HG3 VAL 83 -11.358 -7.256 4.990 598 HG21 VAL 83 2HG3 VAL 83 -8.432 -8.166 2.823 599 HG22 VAL 83 2HG1 VAL 83 -10.136 -8.159 2.311 600 HG23 VAL 83 2HG2 VAL 83 -9.496 -6.819 3.291 601 H THR 84 H THR 84 -8.105 -10.494 4.553 602 HA THR 84 HA THR 84 -5.364 -10.487 5.265 603 HB THR 84 HB THR 84 -6.658 -11.851 2.861 604 HG1 THR 84 1HG THR 84 -6.827 -13.610 4.364 605 HG21 THR 84 2HG3 THR 84 -4.125 -12.480 4.425 606 HG22 THR 84 2HG1 THR 84 -4.799 -13.450 3.095 607 HG23 THR 84 2HG2 THR 84 -4.189 -11.807 2.779 608 H GLY 85 H GLY 85 -3.992 -8.928 4.846 609 HA2 GLY 85 1HA GLY 85 -2.242 -8.304 3.345 610 HA3 GLY 85 2HA GLY 85 -3.331 -8.596 1.970 611 H ALA 86 H ALA 86 -5.276 -7.040 4.021 612 HA ALA 86 HA ALA 86 -5.484 -4.781 2.345 613 HB1 ALA 86 3HB ALA 86 -6.373 -5.082 5.236 614 HB2 ALA 86 1HB ALA 86 -6.944 -3.840 4.098 615 HB3 ALA 86 2HB ALA 86 -7.308 -5.556 3.799 616 H MET 87 H MET 87 -4.842 -2.686 2.421 617 HA MET 87 HA MET 87 -2.917 -1.939 4.596 618 HB2 MET 87 1HB MET 87 -2.689 -1.306 1.631 619 HB3 MET 87 2HB MET 87 -1.657 -0.641 2.888 620 HG2 MET 87 1HG MET 87 -0.794 -2.868 3.406 621 HG3 MET 87 2HG MET 87 -1.886 -3.589 2.221 622 HE1 MET 87 3HE MET 87 1.262 -1.331 2.803 623 HE2 MET 87 1HE MET 87 1.636 -0.782 1.151 624 HE3 MET 87 2HE MET 87 0.161 -0.208 1.968 625 H SER 88 H SER 88 -3.490 -0.267 5.718 626 HA SER 88 HA SER 88 -5.478 1.694 4.524 627 HB2 SER 88 1HB SER 88 -6.538 1.874 6.572 628 HB3 SER 88 2HB SER 88 -6.551 0.201 6.033 629 HG SER 88 HG SER 88 -5.975 0.116 8.084 630 H MET 89 H MET 89 -5.270 3.834 5.174 631 HA MET 89 HA MET 89 -2.619 4.618 6.259 632 HB2 MET 89 1HB MET 89 -3.585 5.761 4.251 633 HB3 MET 89 2HB MET 89 -4.920 6.327 5.244 634 HG2 MET 89 1HG MET 89 -3.325 8.102 5.001 635 HG3 MET 89 2HG MET 89 -3.293 7.553 6.678 636 HE1 MET 89 3HE MET 89 -1.413 7.774 3.277 637 HE2 MET 89 1HE MET 89 -0.029 6.682 3.523 638 HE3 MET 89 2HE MET 89 -1.676 6.016 3.391 639 H ALA 90 H ALA 90 -2.210 5.321 8.210 640 HA ALA 90 HA ALA 90 -4.200 4.874 10.251 641 HB1 ALA 90 3HB ALA 90 -1.476 6.211 10.414 642 HB2 ALA 90 1HB ALA 90 -2.455 5.676 11.800 643 HB3 ALA 90 2HB ALA 90 -1.809 4.481 10.651 644 H HIS 91 H HIS 91 -5.611 6.168 11.174 645 HA HIS 91 HA HIS 91 -5.050 9.010 11.524 646 HB2 HIS 91 1HB HIS 91 -7.075 9.819 10.364 647 HB3 HIS 91 2HB HIS 91 -5.946 9.090 9.232 648 HD2 HIS 91 2HD HIS 91 -7.131 7.084 7.587 649 HE1 HIS 91 1HE HIS 91 -10.605 6.607 9.985 650 H ARG 92 H ARG 92 -7.240 10.080 12.351 651 HA ARG 92 HA ARG 92 -8.510 8.150 14.255 652 HB2 ARG 92 1HB ARG 92 -7.411 10.907 14.933 653 HB3 ARG 92 2HB ARG 92 -8.356 9.897 16.017 654 HG2 ARG 92 1HG ARG 92 -5.679 9.076 14.870 655 HG3 ARG 92 2HG ARG 92 -5.902 9.876 16.444 656 HD2 ARG 92 1HD ARG 92 -7.361 8.031 17.136 657 HD3 ARG 92 2HD ARG 92 -7.031 7.223 15.586 658 HE ARG 92 HE ARG 92 -5.233 7.497 17.872 659 HH11 ARG 92 1HH1 ARG 92 -5.581 6.685 14.472 660 HH12 ARG 92 1HH2 ARG 92 -4.107 5.743 14.416 661 HH21 ARG 92 2HH1 ARG 92 -3.322 6.272 17.788 662 HH22 ARG 92 2HH2 ARG 92 -2.828 5.510 16.293 663 H GLY 93 H GLY 93 -8.896 10.401 11.852 664 HA2 GLY 93 1HA GLY 93 -11.630 10.342 11.696 665 HA3 GLY 93 2HA GLY 93 -11.336 11.655 12.862 666 H ARG 94 H ARG 94 -12.052 13.318 11.566 667 HA ARG 94 HA ARG 94 -11.135 13.614 8.806 668 HB2 ARG 94 1HB ARG 94 -12.609 15.497 10.688 669 HB3 ARG 94 2HB ARG 94 -12.273 15.849 9.000 670 HG2 ARG 94 1HG ARG 94 -13.658 13.966 8.296 671 HG3 ARG 94 2HG ARG 94 -13.959 13.540 9.999 672 HD2 ARG 94 1HD ARG 94 -14.653 16.196 8.772 673 HD3 ARG 94 2HD ARG 94 -15.775 14.821 8.899 674 HE ARG 94 HE ARG 94 -14.798 15.197 11.458 675 HH11 ARG 94 1HH1 ARG 94 -16.506 17.153 9.091 676 HH12 ARG 94 1HH2 ARG 94 -17.330 18.116 10.296 677 HH21 ARG 94 2HH1 ARG 94 -15.874 16.455 13.013 678 HH22 ARG 94 2HH2 ARG 94 -16.973 17.722 12.517 679 H ASP 95 H ASP 95 -9.443 14.590 8.026 680 HA ASP 95 HA ASP 95 -7.412 15.720 7.976 681 HB2 ASP 95 1HB ASP 95 -8.815 17.456 10.053 682 HB3 ASP 95 2HB ASP 95 -7.322 17.880 9.227 683 H THR 96 H THR 96 -7.080 13.479 9.241 684 HA THR 96 HA THR 96 -5.251 14.224 11.478 685 HB THR 96 HB THR 96 -6.000 12.225 12.764 686 HG1 THR 96 1HG THR 96 -8.011 12.128 10.737 687 HG21 THR 96 2HG3 THR 96 -8.236 14.185 12.121 688 HG22 THR 96 2HG1 THR 96 -8.132 13.160 13.571 689 HG23 THR 96 2HG2 THR 96 -6.933 14.447 13.303 690 H GLY 97 H GLY 97 -5.807 12.654 8.578 691 HA2 GLY 97 1HA GLY 97 -4.134 10.340 8.894 692 HA3 GLY 97 2HA GLY 97 -4.595 11.106 7.356 693 H SER 98 H SER 98 -2.086 10.013 7.671 694 HA SER 98 HA SER 98 -0.311 12.434 7.467 695 HB2 SER 98 1HB SER 98 1.294 11.659 8.929 696 HB3 SER 98 2HB SER 98 -0.233 11.842 9.777 697 HG SER 98 HG SER 98 0.517 9.939 10.383 698 H CYS 99 H CYS 99 1.585 9.873 8.035 699 HA CYS 99 HA CYS 99 1.677 8.947 5.145 700 HB2 CYS 99 1HB CYS 99 3.957 9.056 5.088 701 HB3 CYS 99 2HB CYS 99 3.372 10.627 5.619 702 HG CYS 99 HG CYS 99 3.794 10.222 8.154 703 H GLN 100 H GLN 100 1.446 8.163 8.471 704 HA GLN 100 HA GLN 100 2.797 5.566 8.302 705 HB2 GLN 100 1HB GLN 100 0.954 6.793 10.397 706 HB3 GLN 100 2HB GLN 100 1.726 5.223 10.563 707 HG2 GLN 100 1HG GLN 100 3.928 6.254 10.510 708 HG3 GLN 100 2HG GLN 100 3.183 7.856 10.252 709 HE21 GLN 100 2HE2 GLN 100 4.780 7.894 12.290 710 HE22 GLN 100 2HE1 GLN 100 3.956 7.769 13.809 711 H PHE 101 H PHE 101 1.927 3.550 8.223 712 HA PHE 101 HA PHE 101 -0.936 3.316 7.469 713 HB2 PHE 101 1HB PHE 101 -0.429 2.290 5.318 714 HB3 PHE 101 2HB PHE 101 0.259 3.905 5.357 715 HD1 PHE 101 2HD PHE 101 2.696 4.223 5.585 716 HD2 PHE 101 1HD PHE 101 0.955 0.343 5.176 717 HE1 PHE 101 2HE PHE 101 4.907 3.297 4.983 718 HE2 PHE 101 1HE PHE 101 3.166 -0.588 4.576 719 HZ PHE 101 HZ PHE 101 5.142 0.890 4.480 720 H PHE 102 H PHE 102 -1.576 1.073 7.053 721 HA PHE 102 HA PHE 102 -0.003 -0.761 8.835 722 HB2 PHE 102 1HB PHE 102 -2.981 -0.746 8.183 723 HB3 PHE 102 2HB PHE 102 -2.171 -1.927 9.200 724 HD1 PHE 102 1HD PHE 102 -3.265 1.576 8.941 725 HD2 PHE 102 2HD PHE 102 -1.527 -1.409 11.454 726 HE1 PHE 102 1HE PHE 102 -3.635 3.023 10.911 727 HE2 PHE 102 2HE PHE 102 -1.898 0.033 13.427 728 HZ PHE 102 HZ PHE 102 -2.951 2.250 13.155 729 H ILE 103 H ILE 103 0.315 -2.897 8.268 730 HA ILE 103 HA ILE 103 -0.924 -3.782 5.680 731 HB ILE 103 HB ILE 103 1.839 -4.547 6.752 732 HG12 ILE 103 1HG1 ILE 103 1.102 -2.919 4.308 733 HG13 ILE 103 1HG2 ILE 103 1.773 -2.275 5.799 734 HG21 ILE 103 2HG1 ILE 103 2.042 -5.810 4.649 735 HG22 ILE 103 2HG2 ILE 103 0.677 -6.405 5.622 736 HG23 ILE 103 2HG3 ILE 103 0.376 -5.360 4.213 737 HD11 ILE 103 1HD3 ILE 103 3.132 -4.258 3.962 738 HD12 ILE 103 1HD1 ILE 103 3.492 -2.522 4.098 739 HD13 ILE 103 1HD2 ILE 103 3.811 -3.607 5.472 740 H VAL 104 H VAL 104 -2.308 -5.292 5.879 741 HA VAL 104 HA VAL 104 -2.451 -6.755 8.480 742 HB VAL 104 HB VAL 104 -4.373 -6.678 6.104 743 HG11 VAL 104 1HG1 VAL 104 -5.993 -7.630 7.670 744 HG12 VAL 104 1HG2 VAL 104 -4.588 -8.696 7.437 745 HG13 VAL 104 1HG3 VAL 104 -4.730 -7.724 8.920 746 HG21 VAL 104 2HG3 VAL 104 -4.134 -4.460 7.166 747 HG22 VAL 104 2HG1 VAL 104 -5.727 -5.168 7.521 748 HG23 VAL 104 2HG2 VAL 104 -4.449 -5.186 8.759 749 H HIS 105 H HIS 105 -1.564 -8.601 8.770 750 HA HIS 105 HA HIS 105 -1.284 -10.464 6.468 751 HB2 HIS 105 1HB HIS 105 0.630 -10.241 8.034 752 HB3 HIS 105 2HB HIS 105 -0.403 -10.709 9.377 753 HD2 HIS 105 2HD HIS 105 1.581 -12.463 6.394 754 HE1 HIS 105 1HE HIS 105 -0.331 -15.402 8.794 755 H GLU 106 H GLU 106 -2.694 -10.495 9.757 756 HA GLU 106 HA GLU 106 -4.690 -12.485 8.736 757 HB2 GLU 106 1HB GLU 106 -3.367 -13.107 10.787 758 HB3 GLU 106 2HB GLU 106 -4.029 -11.700 11.607 759 HG2 GLU 106 1HG GLU 106 -5.336 -13.478 12.346 760 HG3 GLU 106 2HG GLU 106 -6.335 -12.683 11.132 761 HA PRO 107 HA PRO 107 -7.732 -9.316 8.430 762 HB2 PRO 107 1HB PRO 107 -9.469 -11.729 9.132 763 HB3 PRO 107 2HB PRO 107 -9.706 -10.548 7.838 764 HG2 PRO 107 1HG PRO 107 -8.769 -12.951 7.190 765 HG3 PRO 107 2HG PRO 107 -8.037 -11.526 6.447 766 HD2 PRO 107 1HD PRO 107 -7.022 -13.225 8.753 767 HD3 PRO 107 2HD PRO 107 -6.097 -12.479 7.389 768 H GLN 108 H GLN 108 -8.597 -7.966 9.774 769 HA GLN 108 HA GLN 108 -9.169 -8.927 12.553 770 HB2 GLN 108 1HB GLN 108 -7.774 -6.351 11.716 771 HB3 GLN 108 2HB GLN 108 -8.379 -6.661 13.337 772 HG2 GLN 108 1HG GLN 108 -6.369 -8.462 11.987 773 HG3 GLN 108 2HG GLN 108 -5.914 -7.034 12.959 774 HE21 GLN 108 2HE2 GLN 108 -7.709 -10.120 13.066 775 HE22 GLN 108 2HE1 GLN 108 -7.457 -10.410 14.755 776 HA PRO 109 HA PRO 109 -13.054 -7.333 10.915 777 HB2 PRO 109 1HB PRO 109 -13.833 -8.547 13.606 778 HB3 PRO 109 2HB PRO 109 -14.654 -8.716 12.050 779 HG2 PRO 109 1HG PRO 109 -13.201 -10.763 12.934 780 HG3 PRO 109 2HG PRO 109 -13.081 -10.307 11.232 781 HD2 PRO 109 1HD PRO 109 -11.180 -9.694 13.523 782 HD3 PRO 109 2HD PRO 109 -10.800 -10.151 11.813 783 H HIS 110 H HIS 110 -11.584 -6.895 14.076 784 HA HIS 110 HA HIS 110 -13.520 -4.838 14.853 785 HB2 HIS 110 1HB HIS 110 -12.132 -4.599 16.853 786 HB3 HIS 110 2HB HIS 110 -12.427 -6.303 16.542 787 HD2 HIS 110 2HD HIS 110 -10.137 -7.781 15.687 788 HE1 HIS 110 1HE HIS 110 -7.375 -4.673 16.624 789 H LEU 111 H LEU 111 -10.835 -4.886 12.828 790 HA LEU 111 HA LEU 111 -10.332 -1.973 13.248 791 HB2 LEU 111 1HB LEU 111 -8.898 -4.067 11.563 792 HB3 LEU 111 2HB LEU 111 -8.455 -2.358 11.631 793 HG LEU 111 HG LEU 111 -8.316 -4.340 13.930 794 HD11 LEU 111 1HD1 LEU 111 -5.895 -4.012 13.698 795 HD12 LEU 111 1HD2 LEU 111 -6.612 -4.684 12.215 796 HD13 LEU 111 1HD3 LEU 111 -6.172 -2.961 12.289 797 HD21 LEU 111 2HD3 LEU 111 -8.916 -2.062 14.678 798 HD22 LEU 111 2HD1 LEU 111 -7.248 -2.472 15.146 799 HD23 LEU 111 2HD2 LEU 111 -7.544 -1.398 13.757 800 H ASP 112 H ASP 112 -12.368 -3.927 11.527 801 HA ASP 112 HA ASP 112 -12.195 -2.826 8.881 802 HB2 ASP 112 1HB ASP 112 -14.520 -4.082 10.397 803 HB3 ASP 112 2HB ASP 112 -14.579 -3.656 8.692 804 H GLY 113 H GLY 113 -12.317 -0.789 8.381 805 HA2 GLY 113 1HA GLY 113 -13.636 1.107 7.861 806 HA3 GLY 113 2HA GLY 113 -14.791 0.646 9.134 807 H VAL 114 H VAL 114 -11.912 0.250 10.583 808 HA VAL 114 HA VAL 114 -12.150 2.736 12.129 809 HB VAL 114 HB VAL 114 -10.065 0.499 12.129 810 HG11 VAL 114 1HG1 VAL 114 -9.344 1.411 14.282 811 HG12 VAL 114 1HG2 VAL 114 -9.113 2.573 12.954 812 HG13 VAL 114 1HG3 VAL 114 -10.475 2.770 14.084 813 HG21 VAL 114 2HG3 VAL 114 -12.324 -0.236 12.809 814 HG22 VAL 114 2HG1 VAL 114 -11.215 -0.217 14.200 815 HG23 VAL 114 2HG2 VAL 114 -12.402 1.092 13.991 816 H HIS 115 H HIS 115 -9.787 1.453 9.803 817 HA HIS 115 HA HIS 115 -8.864 4.289 9.471 818 HB2 HIS 115 1HB HIS 115 -7.290 1.714 9.029 819 HB3 HIS 115 2HB HIS 115 -6.705 3.336 8.684 820 HD2 HIS 115 2HD HIS 115 -6.887 0.872 11.616 821 HE1 HIS 115 1HE HIS 115 -5.669 4.632 13.212 822 H THR 116 H THR 116 -7.870 4.673 7.284 823 HA THR 116 HA THR 116 -9.976 3.903 5.340 824 HB THR 116 HB THR 116 -7.748 5.983 5.197 825 HG1 THR 116 1HG THR 116 -9.534 6.404 6.658 826 HG21 THR 116 2HG3 THR 116 -10.069 5.428 3.311 827 HG22 THR 116 2HG1 THR 116 -8.922 6.781 3.185 828 HG23 THR 116 2HG2 THR 116 -8.354 5.108 2.968 829 H VAL 117 H VAL 117 -9.613 1.935 4.559 830 HA VAL 117 HA VAL 117 -6.986 1.015 3.664 831 HB VAL 117 HB VAL 117 -9.805 0.074 2.943 832 HG11 VAL 117 1HG1 VAL 117 -8.715 -2.006 2.254 833 HG12 VAL 117 1HG2 VAL 117 -8.163 -0.615 1.294 834 HG13 VAL 117 1HG3 VAL 117 -7.123 -1.278 2.577 835 HG21 VAL 117 2HG3 VAL 117 -9.333 -0.078 5.363 836 HG22 VAL 117 2HG1 VAL 117 -9.388 -1.695 4.622 837 HG23 VAL 117 2HG2 VAL 117 -7.820 -0.950 5.017 838 H PHE 118 H PHE 118 -5.937 1.223 1.873 839 HA PHE 118 HA PHE 118 -7.314 2.597 -0.402 840 HB2 PHE 118 1HB PHE 118 -5.503 4.170 -0.628 841 HB3 PHE 118 2HB PHE 118 -6.073 4.267 1.032 842 HD1 PHE 118 2HD PHE 118 -4.731 3.351 2.874 843 HD2 PHE 118 1HD PHE 118 -3.307 3.348 -1.154 844 HE1 PHE 118 2HE PHE 118 -2.432 2.946 3.689 845 HE2 PHE 118 1HE PHE 118 -1.008 2.940 -0.343 846 HZ PHE 118 HZ PHE 118 -0.570 2.739 2.079 847 H GLY 119 H GLY 119 -5.200 0.193 0.754 848 HA2 GLY 119 1HA GLY 119 -4.677 -0.661 -2.029 849 HA3 GLY 119 2HA GLY 119 -3.260 -0.343 -1.002 850 H GLN 120 H GLN 120 -3.252 -2.783 -1.868 851 HA GLN 120 HA GLN 120 -3.662 -4.361 0.562 852 HB2 GLN 120 1HB GLN 120 -5.906 -4.508 -0.566 853 HB3 GLN 120 2HB GLN 120 -5.118 -5.165 -1.992 854 HG2 GLN 120 1HG GLN 120 -4.320 -7.083 -0.651 855 HG3 GLN 120 2HG GLN 120 -5.202 -6.425 0.757 856 HE21 GLN 120 2HE2 GLN 120 -6.163 -8.667 0.566 857 HE22 GLN 120 2HE1 GLN 120 -7.572 -8.832 -0.429 858 H VAL 121 H VAL 121 -2.043 -5.672 0.829 859 HA VAL 121 HA VAL 121 -0.021 -6.122 -1.206 860 HB VAL 121 HB VAL 121 -0.640 -7.626 1.383 861 HG11 VAL 121 1HG1 VAL 121 1.657 -8.453 1.230 862 HG12 VAL 121 1HG2 VAL 121 0.663 -8.987 -0.147 863 HG13 VAL 121 1HG3 VAL 121 1.835 -7.663 -0.354 864 HG21 VAL 121 2HG3 VAL 121 -0.121 -5.237 1.737 865 HG22 VAL 121 2HG1 VAL 121 1.205 -6.271 2.319 866 HG23 VAL 121 2HG2 VAL 121 1.360 -5.413 0.767 867 H THR 122 H THR 122 0.326 -7.608 -2.643 868 HA THR 122 HA THR 122 -1.809 -9.700 -2.930 869 HB THR 122 HB THR 122 -1.410 -9.595 -5.361 870 HG1 THR 122 1HG THR 122 -0.026 -7.908 -6.148 871 HG21 THR 122 2HG3 THR 122 -1.885 -6.845 -4.151 872 HG22 THR 122 2HG1 THR 122 -2.332 -7.352 -5.796 873 HG23 THR 122 2HG2 THR 122 -3.121 -8.102 -4.387 874 H SER 123 H SER 123 1.565 -9.047 -2.647 875 HA SER 123 HA SER 123 2.148 -11.979 -2.563 876 HB2 SER 123 1HB SER 123 2.282 -11.588 -4.881 877 HB3 SER 123 2HB SER 123 3.391 -10.248 -4.632 878 HG SER 123 HG SER 123 4.441 -12.186 -5.077 879 H GLY 124 H GLY 124 3.805 -12.401 -1.209 880 HA2 GLY 124 1HA GLY 124 5.898 -12.009 -0.165 881 HA3 GLY 124 2HA GLY 124 5.787 -10.289 -0.605 882 H MET 125 H MET 125 2.864 -11.454 0.637 883 HA MET 125 HA MET 125 2.874 -9.808 2.956 884 HB2 MET 125 1HB MET 125 0.872 -10.862 1.769 885 HB3 MET 125 2HB MET 125 1.268 -12.359 2.603 886 HG2 MET 125 1HG MET 125 0.945 -11.262 4.771 887 HG3 MET 125 2HG MET 125 0.608 -9.730 3.962 888 HE1 MET 125 3HE MET 125 -0.686 -13.238 4.976 889 HE2 MET 125 1HE MET 125 -2.126 -13.453 3.952 890 HE3 MET 125 2HE MET 125 -0.502 -13.478 3.221 891 H ASP 126 H ASP 126 4.088 -13.049 2.456 892 HA ASP 126 HA ASP 126 4.270 -13.928 5.143 893 HB2 ASP 126 1HB ASP 126 6.160 -14.373 2.793 894 HB3 ASP 126 2HB ASP 126 6.277 -15.231 4.324 895 H VAL 127 H VAL 127 6.219 -11.591 3.387 896 HA VAL 127 HA VAL 127 8.413 -11.366 5.216 897 HB VAL 127 HB VAL 127 6.994 -9.238 3.540 898 HG11 VAL 127 1HG1 VAL 127 9.046 -7.927 3.781 899 HG12 VAL 127 1HG2 VAL 127 8.252 -8.215 5.347 900 HG13 VAL 127 1HG3 VAL 127 9.697 -9.152 4.896 901 HG21 VAL 127 2HG3 VAL 127 7.932 -11.102 2.218 902 HG22 VAL 127 2HG1 VAL 127 8.866 -9.608 1.965 903 HG23 VAL 127 2HG2 VAL 127 9.504 -10.887 3.027 904 H VAL 128 H VAL 128 5.148 -10.043 5.381 905 HA VAL 128 HA VAL 128 5.649 -8.314 7.655 906 HB VAL 128 HB VAL 128 3.099 -9.726 6.728 907 HG11 VAL 128 1HG1 VAL 128 1.914 -8.038 8.044 908 HG12 VAL 128 1HG2 VAL 128 2.955 -9.064 9.058 909 HG13 VAL 128 1HG3 VAL 128 3.469 -7.411 8.640 910 HG21 VAL 128 2HG3 VAL 128 4.059 -8.217 5.023 911 HG22 VAL 128 2HG1 VAL 128 2.559 -7.541 5.701 912 HG23 VAL 128 2HG2 VAL 128 4.138 -6.906 6.223 913 H ARG 129 H ARG 129 4.410 -11.647 7.451 914 HA ARG 129 HA ARG 129 4.122 -12.021 10.265 915 HB2 ARG 129 1HB ARG 129 3.278 -13.565 8.444 916 HB3 ARG 129 2HB ARG 129 4.932 -14.105 8.200 917 HG2 ARG 129 1HG ARG 129 5.022 -15.033 10.431 918 HG3 ARG 129 2HG ARG 129 3.417 -14.362 10.810 919 HD2 ARG 129 1HD ARG 129 3.217 -16.684 10.294 920 HD3 ARG 129 2HD ARG 129 2.471 -15.724 8.995 921 HE ARG 129 HE ARG 129 5.032 -17.203 8.845 922 HH11 ARG 129 1HH1 ARG 129 2.449 -15.402 7.286 923 HH12 ARG 129 1HH2 ARG 129 2.945 -15.848 5.669 924 HH21 ARG 129 2HH1 ARG 129 5.665 -17.775 6.742 925 HH22 ARG 129 2HH2 ARG 129 4.765 -17.192 5.360 926 H THR 130 H THR 130 6.939 -12.342 8.153 927 HA THR 130 HA THR 130 8.575 -13.186 10.501 928 HB THR 130 HB THR 130 10.340 -13.655 8.842 929 HG1 THR 130 1HG THR 130 9.796 -13.397 6.602 930 HG21 THR 130 2HG3 THR 130 7.638 -14.783 8.016 931 HG22 THR 130 2HG1 THR 130 9.225 -15.487 7.628 932 HG23 THR 130 2HG2 THR 130 8.672 -15.414 9.319 933 H MET 131 H MET 131 7.464 -10.380 9.570 934 HA MET 131 HA MET 131 9.864 -8.793 9.191 935 HB2 MET 131 1HB MET 131 7.521 -8.127 8.508 936 HB3 MET 131 2HB MET 131 7.145 -7.900 10.210 937 HG2 MET 131 1HG MET 131 8.854 -6.152 10.380 938 HG3 MET 131 2HG MET 131 9.302 -6.405 8.692 939 HE1 MET 131 3HE MET 131 6.784 -6.693 7.020 940 HE2 MET 131 1HE MET 131 6.339 -5.001 6.686 941 HE3 MET 131 2HE MET 131 8.051 -5.492 6.665 942 H LYS 132 H LYS 132 11.084 -7.643 10.553 943 HA LYS 132 HA LYS 132 10.775 -8.298 13.450 944 HB2 LYS 132 1HB LYS 132 13.095 -7.096 11.888 945 HB3 LYS 132 2HB LYS 132 13.094 -7.378 13.623 946 HG2 LYS 132 1HG LYS 132 12.892 -9.790 13.266 947 HG3 LYS 132 2HG LYS 132 12.803 -9.539 11.517 948 HD2 LYS 132 1HD LYS 132 15.062 -8.532 11.543 949 HD3 LYS 132 2HD LYS 132 15.151 -8.777 13.293 950 HE2 LYS 132 1HE LYS 132 14.931 -11.219 12.963 951 HE3 LYS 132 2HE LYS 132 14.846 -10.977 11.216 952 HZ1 LYS 132 3HZ LYS 132 17.133 -10.266 12.928 953 HZ2 LYS 132 1HZ LYS 132 17.048 -11.567 11.918 954 HZ3 LYS 132 2HZ LYS 132 17.053 -10.039 11.297 955 H ASN 133 H ASN 133 10.820 -6.762 15.058 956 HA ASN 133 HA ASN 133 9.300 -4.392 14.531 957 HB2 ASN 133 1HB ASN 133 9.460 -5.604 16.726 958 HB3 ASN 133 2HB ASN 133 11.079 -4.946 16.918 959 HD21 ASN 133 2HD2 ASN 133 8.883 -4.502 18.655 960 HD22 ASN 133 2HD1 ASN 133 8.527 -2.808 18.634 961 H GLY 134 H GLY 134 9.851 -2.674 13.476 962 HA2 GLY 134 1HA GLY 134 11.074 -0.674 13.181 963 HA3 GLY 134 2HA GLY 134 12.430 -1.376 14.092 964 H ASP 135 H ASP 135 11.039 -3.401 11.688 965 HA ASP 135 HA ASP 135 13.391 -3.597 10.095 966 HB2 ASP 135 1HB ASP 135 11.331 -5.169 10.183 967 HB3 ASP 135 2HB ASP 135 10.570 -4.046 9.064 968 H VAL 136 H VAL 136 14.171 -2.618 8.348 969 HA VAL 136 HA VAL 136 13.079 0.131 7.921 970 HB VAL 136 HB VAL 136 15.702 -1.152 7.019 971 HG11 VAL 136 1HG1 VAL 136 16.429 1.151 6.622 972 HG12 VAL 136 1HG2 VAL 136 15.022 0.714 5.623 973 HG13 VAL 136 1HG3 VAL 136 14.809 1.738 7.064 974 HG21 VAL 136 2HG3 VAL 136 15.539 -1.039 9.482 975 HG22 VAL 136 2HG1 VAL 136 16.725 0.138 8.867 976 HG23 VAL 136 2HG2 VAL 136 15.110 0.686 9.376 977 H MET 137 H MET 137 12.069 0.805 6.234 978 HA MET 137 HA MET 137 11.864 -0.909 3.838 979 HB2 MET 137 1HB MET 137 10.763 1.838 4.524 980 HB3 MET 137 2HB MET 137 10.492 1.031 2.985 981 HG2 MET 137 1HG MET 137 9.391 -0.845 4.203 982 HG3 MET 137 2HG MET 137 9.594 0.053 5.710 983 HE1 MET 137 3HE MET 137 8.837 2.866 5.547 984 HE2 MET 137 1HE MET 137 7.056 2.862 5.579 985 HE3 MET 137 2HE MET 137 7.968 1.723 6.600 986 H LYS 138 H LYS 138 13.051 -0.846 2.101 987 HA LYS 138 HA LYS 138 15.282 1.123 2.073 988 HB2 LYS 138 1HB LYS 138 15.851 -1.272 1.902 989 HB3 LYS 138 2HB LYS 138 14.817 -1.435 0.490 990 HG2 LYS 138 1HG LYS 138 16.263 0.066 -0.788 991 HG3 LYS 138 2HG LYS 138 17.278 0.328 0.637 992 HD2 LYS 138 1HD LYS 138 17.786 -2.112 0.692 993 HD3 LYS 138 2HD LYS 138 16.827 -2.324 -0.780 994 HE2 LYS 138 1HE LYS 138 18.334 -0.847 -2.018 995 HE3 LYS 138 2HE LYS 138 19.254 -0.508 -0.550 996 HZ1 LYS 138 3HZ LYS 138 18.993 -3.147 -1.831 997 HZ2 LYS 138 1HZ LYS 138 20.318 -2.166 -1.895 998 HZ3 LYS 138 2HZ LYS 138 19.853 -2.830 -0.459 999 H GLU 139 H GLU 139 12.734 -0.131 -0.081 1000 HA GLU 139 HA GLU 139 12.740 2.454 -1.523 1001 HB2 GLU 139 1HB GLU 139 14.443 1.163 -2.749 1002 HB3 GLU 139 2HB GLU 139 13.348 -0.205 -2.883 1003 HG2 GLU 139 1HG GLU 139 11.824 1.148 -4.264 1004 HG3 GLU 139 2HG GLU 139 12.925 2.517 -4.133 1005 H VAL 140 H VAL 140 10.709 2.986 -1.186 1006 HA VAL 140 HA VAL 140 8.594 1.017 -2.039 1007 HB VAL 140 HB VAL 140 8.327 3.649 -0.509 1008 HG11 VAL 140 1HG1 VAL 140 6.043 2.892 -0.069 1009 HG12 VAL 140 1HG2 VAL 140 6.358 3.080 -1.810 1010 HG13 VAL 140 1HG3 VAL 140 6.324 1.456 -1.082 1011 HG21 VAL 140 2HG3 VAL 140 9.517 1.948 0.829 1012 HG22 VAL 140 2HG1 VAL 140 7.878 2.226 1.464 1013 HG23 VAL 140 2HG2 VAL 140 8.221 0.774 0.493 1014 H LYS 141 H LYS 141 7.795 1.139 -3.933 1015 HA LYS 141 HA LYS 141 7.759 3.810 -5.293 1016 HB2 LYS 141 1HB LYS 141 8.649 1.151 -6.479 1017 HB3 LYS 141 2HB LYS 141 8.351 2.611 -7.413 1018 HG2 LYS 141 1HG LYS 141 10.409 2.430 -5.195 1019 HG3 LYS 141 2HG LYS 141 10.759 2.150 -6.907 1020 HD2 LYS 141 1HD LYS 141 10.036 4.425 -7.462 1021 HD3 LYS 141 2HD LYS 141 9.573 4.712 -5.777 1022 HE2 LYS 141 1HE LYS 141 11.761 5.709 -6.252 1023 HE3 LYS 141 2HE LYS 141 11.918 4.407 -5.070 1024 HZ1 LYS 141 3HZ LYS 141 12.497 4.179 -7.948 1025 HZ2 LYS 141 1HZ LYS 141 13.615 4.290 -6.741 1026 HZ3 LYS 141 2HZ LYS 141 12.641 2.962 -6.844 1027 H VAL 142 H VAL 142 6.124 4.211 -6.711 1028 HA VAL 142 HA VAL 142 4.024 2.091 -7.043 1029 HB VAL 142 HB VAL 142 3.534 4.999 -6.238 1030 HG11 VAL 142 1HG1 VAL 142 1.171 4.367 -6.184 1031 HG12 VAL 142 1HG2 VAL 142 1.874 4.182 -7.809 1032 HG13 VAL 142 1HG3 VAL 142 1.591 2.749 -6.792 1033 HG21 VAL 142 2HG3 VAL 142 4.303 3.610 -4.345 1034 HG22 VAL 142 2HG1 VAL 142 2.583 4.027 -4.171 1035 HG23 VAL 142 2HG2 VAL 142 3.053 2.402 -4.722 1036 H PHE 143 H PHE 143 3.033 1.983 -8.909 1037 HA PHE 143 HA PHE 143 3.444 4.157 -10.892 1038 HB2 PHE 143 1HB PHE 143 4.290 2.576 -12.583 1039 HB3 PHE 143 2HB PHE 143 5.395 2.681 -11.222 1040 HD1 PHE 143 2HD PHE 143 5.551 0.831 -9.591 1041 HD2 PHE 143 1HD PHE 143 3.144 0.545 -13.109 1042 HE1 PHE 143 2HE PHE 143 5.468 -1.625 -9.330 1043 HE2 PHE 143 1HE PHE 143 3.055 -1.913 -12.850 1044 HZ PHE 143 HZ PHE 143 4.217 -2.998 -10.960 1045 H ASP 144 H ASP 144 2.259 3.754 -12.917 1046 HA ASP 144 HA ASP 144 -0.470 2.943 -12.185 1047 HB2 ASP 144 1HB ASP 144 0.734 4.075 -14.744 1048 HB3 ASP 144 2HB ASP 144 -0.973 3.710 -14.542 1049 H GLU 145 H GLU 145 -1.640 1.278 -12.871 1050 HA GLU 145 HA GLU 145 -0.736 -0.457 -15.044 1051 HB2 GLU 145 1HB GLU 145 0.703 -1.251 -13.162 1052 HB3 GLU 145 2HB GLU 145 -0.734 -1.525 -12.189 1053 HG2 GLU 145 1HG GLU 145 -0.023 -3.619 -13.061 1054 HG3 GLU 145 2HG GLU 145 -1.518 -3.176 -13.883 1055 HA PRO 146 HA PRO 146 -5.331 -0.196 -14.362 1056 HB2 PRO 146 1HB PRO 146 -4.925 -0.288 -17.381 1057 HB3 PRO 146 2HB PRO 146 -6.090 0.672 -16.461 1058 HG2 PRO 146 1HG PRO 146 -3.961 1.907 -17.467 1059 HG3 PRO 146 2HG PRO 146 -4.465 2.289 -15.818 1060 HD2 PRO 146 1HD PRO 146 -2.222 0.463 -16.765 1061 HD3 PRO 146 2HD PRO 146 -2.225 1.655 -15.403 Start of MODEL 2 1 H MET 1 1H MET 1 -7.084 3.620 -16.429 2 HA MET 1 HA MET 1 -5.043 1.758 -16.298 3 HB2 MET 1 1HB MET 1 -5.356 4.570 -15.186 4 HB3 MET 1 2HB MET 1 -3.835 3.696 -15.297 5 HG2 MET 1 1HG MET 1 -5.579 4.485 -17.649 6 HG3 MET 1 2HG MET 1 -4.120 5.324 -17.115 7 HE1 MET 1 3HE MET 1 -2.085 3.103 -16.355 8 HE2 MET 1 1HE MET 1 -1.280 2.804 -17.914 9 HE3 MET 1 2HE MET 1 -1.693 4.467 -17.430 10 H ALA 2 H ALA 2 -4.139 0.614 -14.753 11 HA ALA 2 HA ALA 2 -5.429 0.710 -12.069 12 HB1 ALA 2 3HB ALA 2 -3.624 -1.388 -13.325 13 HB2 ALA 2 1HB ALA 2 -4.368 -1.490 -11.714 14 HB3 ALA 2 2HB ALA 2 -5.393 -1.487 -13.169 15 H LYS 3 H LYS 3 -4.119 0.530 -10.164 16 HA LYS 3 HA LYS 3 -1.386 1.724 -10.525 17 HB2 LYS 3 1HB LYS 3 -3.463 2.244 -8.363 18 HB3 LYS 3 2HB LYS 3 -1.781 2.741 -8.239 19 HG2 LYS 3 1HG LYS 3 -2.105 4.073 -10.362 20 HG3 LYS 3 2HG LYS 3 -3.830 3.697 -10.251 21 HD2 LYS 3 1HD LYS 3 -3.950 4.770 -8.046 22 HD3 LYS 3 2HD LYS 3 -2.209 5.085 -8.084 23 HE2 LYS 3 1HE LYS 3 -4.139 6.148 -10.172 24 HE3 LYS 3 2HE LYS 3 -3.688 7.045 -8.721 25 HZ1 LYS 3 3HZ LYS 3 -1.823 6.102 -10.795 26 HZ2 LYS 3 1HZ LYS 3 -2.339 7.655 -10.591 27 HZ3 LYS 3 2HZ LYS 3 -1.400 6.940 -9.438 28 H LYS 4 H LYS 4 0.259 0.662 -9.762 29 HA LYS 4 HA LYS 4 -0.189 -1.249 -7.507 30 HB2 LYS 4 1HB LYS 4 1.413 -1.849 -10.025 31 HB3 LYS 4 2HB LYS 4 1.317 -2.877 -8.601 32 HG2 LYS 4 1HG LYS 4 -1.119 -3.155 -8.985 33 HG3 LYS 4 2HG LYS 4 -0.983 -2.163 -10.443 34 HD2 LYS 4 1HD LYS 4 0.543 -3.774 -11.456 35 HD3 LYS 4 2HD LYS 4 0.572 -4.731 -9.967 36 HE2 LYS 4 1HE LYS 4 -1.851 -5.171 -10.202 37 HE3 LYS 4 2HE LYS 4 -1.883 -4.218 -11.688 38 HZ1 LYS 4 3HZ LYS 4 -0.319 -6.677 -11.271 39 HZ2 LYS 4 1HZ LYS 4 -1.714 -6.553 -12.142 40 HZ3 LYS 4 2HZ LYS 4 -0.348 -5.786 -12.658 41 H GLY 5 H GLY 5 2.002 -2.068 -6.690 42 HA2 GLY 5 1HA GLY 5 4.342 -0.474 -7.206 43 HA3 GLY 5 2HA GLY 5 3.566 0.028 -5.686 44 H TYR 6 H TYR 6 5.921 -0.796 -5.164 45 HA TYR 6 HA TYR 6 5.494 -3.399 -3.828 46 HB2 TYR 6 1HB TYR 6 7.524 -4.411 -4.652 47 HB3 TYR 6 2HB TYR 6 6.522 -3.984 -6.032 48 HD1 TYR 6 1HD TYR 6 9.536 -3.073 -4.099 49 HD2 TYR 6 2HD TYR 6 7.226 -2.369 -7.645 50 HE1 TYR 6 1HE TYR 6 11.421 -1.807 -5.077 51 HE2 TYR 6 2HE TYR 6 9.111 -1.104 -8.622 52 HH TYR 6 HH TYR 6 12.054 -0.461 -6.766 53 H ILE 7 H ILE 7 6.935 -3.829 -2.127 54 HA ILE 7 HA ILE 7 8.579 -1.458 -1.272 55 HB ILE 7 HB ILE 7 7.062 -3.479 0.455 56 HG12 ILE 7 1HG1 ILE 7 6.608 -0.508 0.086 57 HG13 ILE 7 1HG2 ILE 7 5.619 -1.782 -0.611 58 HG21 ILE 7 2HG1 ILE 7 7.860 -2.127 2.350 59 HG22 ILE 7 2HG2 ILE 7 9.223 -2.822 1.443 60 HG23 ILE 7 2HG3 ILE 7 8.798 -1.107 1.235 61 HD11 ILE 7 1HD3 ILE 7 6.025 -1.278 2.346 62 HD12 ILE 7 1HD1 ILE 7 4.585 -0.862 1.388 63 HD13 ILE 7 1HD2 ILE 7 5.024 -2.569 1.639 64 H LEU 8 H LEU 8 10.581 -1.820 -1.700 65 HA LEU 8 HA LEU 8 11.722 -4.513 -1.194 66 HB2 LEU 8 1HB LEU 8 12.471 -3.348 -3.205 67 HB3 LEU 8 2HB LEU 8 12.896 -1.915 -2.265 68 HG LEU 8 HG LEU 8 14.670 -3.268 -1.112 69 HD11 LEU 8 1HD1 LEU 8 15.308 -5.417 -2.110 70 HD12 LEU 8 1HD2 LEU 8 13.666 -5.472 -1.427 71 HD13 LEU 8 1HD3 LEU 8 13.894 -5.337 -3.188 72 HD21 LEU 8 2HD3 LEU 8 15.163 -1.813 -3.050 73 HD22 LEU 8 2HD1 LEU 8 16.189 -3.268 -3.063 74 HD23 LEU 8 2HD2 LEU 8 14.787 -3.157 -4.155 75 H MET 9 H MET 9 12.448 -5.114 0.669 76 HA MET 9 HA MET 9 13.058 -3.051 2.725 77 HB2 MET 9 1HB MET 9 12.889 -6.078 2.952 78 HB3 MET 9 2HB MET 9 13.073 -4.948 4.285 79 HG2 MET 9 1HG MET 9 10.672 -5.123 2.442 80 HG3 MET 9 2HG MET 9 10.773 -5.767 4.083 81 HE1 MET 9 3HE MET 9 12.218 -3.653 5.800 82 HE2 MET 9 1HE MET 9 10.871 -2.611 6.317 83 HE3 MET 9 2HE MET 9 10.655 -4.378 6.250 84 H GLU 10 H GLU 10 14.943 -3.033 3.949 85 HA GLU 10 HA GLU 10 17.354 -3.325 2.430 86 HB2 GLU 10 1HB GLU 10 16.918 -1.813 4.470 87 HB3 GLU 10 2HB GLU 10 17.155 -3.244 5.462 88 HG2 GLU 10 1HG GLU 10 19.187 -1.957 5.372 89 HG3 GLU 10 2HG GLU 10 19.426 -3.505 4.564 90 H ASN 11 H ASN 11 15.560 -5.569 4.368 91 HA ASN 11 HA ASN 11 17.878 -7.438 4.488 92 HB2 ASN 11 1HB ASN 11 15.119 -7.494 5.732 93 HB3 ASN 11 2HB ASN 11 16.253 -8.835 5.820 94 HD21 ASN 11 2HD2 ASN 11 15.168 -6.096 7.341 95 HD22 ASN 11 2HD1 ASN 11 16.501 -5.825 8.414 96 H GLY 12 H GLY 12 15.926 -6.611 2.125 97 HA2 GLY 12 1HA GLY 12 15.869 -7.737 0.066 98 HA3 GLY 12 2HA GLY 12 16.350 -9.241 0.884 99 H GLY 13 H GLY 13 13.828 -7.660 2.503 100 HA2 GLY 13 1HA GLY 13 11.957 -9.787 1.765 101 HA3 GLY 13 2HA GLY 13 11.698 -8.502 2.969 102 H LYS 14 H LYS 14 12.101 -8.906 -0.572 103 HA LYS 14 HA LYS 14 10.617 -6.424 -1.092 104 HB2 LYS 14 1HB LYS 14 12.555 -7.192 -2.498 105 HB3 LYS 14 2HB LYS 14 11.589 -8.561 -3.029 106 HG2 LYS 14 1HG LYS 14 9.969 -7.056 -4.076 107 HG3 LYS 14 2HG LYS 14 10.866 -5.651 -3.482 108 HD2 LYS 14 1HD LYS 14 12.845 -6.363 -4.791 109 HD3 LYS 14 2HD LYS 14 11.943 -7.764 -5.387 110 HE2 LYS 14 1HE LYS 14 10.278 -6.235 -6.418 111 HE3 LYS 14 2HE LYS 14 11.213 -4.849 -5.852 112 HZ1 LYS 14 3HZ LYS 14 12.178 -6.910 -7.719 113 HZ2 LYS 14 1HZ LYS 14 11.712 -5.380 -8.123 114 HZ3 LYS 14 2HZ LYS 14 13.052 -5.616 -7.189 115 H ILE 15 H ILE 15 8.534 -6.252 -1.020 116 HA ILE 15 HA ILE 15 6.877 -8.574 -1.980 117 HB ILE 15 HB ILE 15 5.160 -7.918 -0.345 118 HG12 ILE 15 1HG1 ILE 15 6.117 -6.171 1.446 119 HG13 ILE 15 1HG2 ILE 15 6.949 -5.568 0.021 120 HG21 ILE 15 2HG1 ILE 15 6.320 -8.466 1.756 121 HG22 ILE 15 2HG2 ILE 15 6.883 -9.504 0.426 122 HG23 ILE 15 2HG3 ILE 15 7.888 -8.144 0.980 123 HD11 ILE 15 1HD3 ILE 15 3.959 -5.950 0.291 124 HD12 ILE 15 1HD1 ILE 15 4.841 -4.407 0.361 125 HD13 ILE 15 1HD2 ILE 15 4.803 -5.342 -1.153 126 H GLU 16 H GLU 16 4.879 -8.120 -2.918 127 HA GLU 16 HA GLU 16 4.838 -5.414 -4.220 128 HB2 GLU 16 1HB GLU 16 4.021 -8.111 -5.383 129 HB3 GLU 16 2HB GLU 16 3.813 -6.560 -6.183 130 HG2 GLU 16 1HG GLU 16 6.278 -6.248 -6.152 131 HG3 GLU 16 2HG GLU 16 6.445 -7.847 -5.432 132 H PHE 17 H PHE 17 2.879 -4.456 -4.662 133 HA PHE 17 HA PHE 17 0.460 -5.656 -3.425 134 HB2 PHE 17 1HB PHE 17 0.050 -3.709 -2.015 135 HB3 PHE 17 2HB PHE 17 1.599 -4.415 -1.582 136 HD1 PHE 17 1HD PHE 17 -0.036 -1.605 -3.333 137 HD2 PHE 17 2HD PHE 17 3.635 -3.207 -1.844 138 HE1 PHE 17 1HE PHE 17 1.053 0.590 -3.660 139 HE2 PHE 17 2HE PHE 17 4.726 -1.013 -2.167 140 HZ PHE 17 HZ PHE 17 3.434 0.886 -3.078 141 H GLU 18 H GLU 18 -1.481 -4.364 -3.789 142 HA GLU 18 HA GLU 18 -1.246 -2.724 -6.293 143 HB2 GLU 18 1HB GLU 18 -3.442 -4.673 -5.477 144 HB3 GLU 18 2HB GLU 18 -3.539 -3.581 -6.851 145 HG2 GLU 18 1HG GLU 18 -1.576 -4.695 -7.860 146 HG3 GLU 18 2HG GLU 18 -1.524 -5.809 -6.495 147 H LEU 19 H LEU 19 -2.741 -1.058 -6.603 148 HA LEU 19 HA LEU 19 -3.812 -0.001 -4.008 149 HB2 LEU 19 1HB LEU 19 -2.802 1.507 -6.456 150 HB3 LEU 19 2HB LEU 19 -3.472 2.248 -4.999 151 HG LEU 19 HG LEU 19 -0.909 0.617 -5.105 152 HD11 LEU 19 1HD1 LEU 19 0.201 2.788 -4.818 153 HD12 LEU 19 1HD2 LEU 19 -0.721 2.716 -6.338 154 HD13 LEU 19 1HD3 LEU 19 -1.372 3.609 -4.943 155 HD21 LEU 19 2HD3 LEU 19 -2.086 0.529 -2.931 156 HD22 LEU 19 2HD1 LEU 19 -0.599 1.502 -2.816 157 HD23 LEU 19 2HD2 LEU 19 -2.185 2.306 -2.912 158 H PHE 20 H PHE 20 -5.684 1.317 -4.074 159 HA PHE 20 HA PHE 20 -7.454 0.754 -6.427 160 HB2 PHE 20 1HB PHE 20 -8.274 0.614 -3.496 161 HB3 PHE 20 2HB PHE 20 -9.319 0.347 -4.882 162 HD1 PHE 20 2HD PHE 20 -8.572 -1.570 -6.513 163 HD2 PHE 20 1HD PHE 20 -7.279 -1.193 -2.459 164 HE1 PHE 20 2HE PHE 20 -8.020 -3.980 -6.467 165 HE2 PHE 20 1HE PHE 20 -6.724 -3.602 -2.410 166 HZ PHE 20 HZ PHE 20 -7.094 -4.995 -4.414 167 HA PRO 21 HA PRO 21 -7.504 5.259 -5.531 168 HB2 PRO 21 1HB PRO 21 -7.494 5.964 -8.202 169 HB3 PRO 21 2HB PRO 21 -5.985 5.632 -7.343 170 HG2 PRO 21 1HG PRO 21 -7.622 3.774 -9.121 171 HG3 PRO 21 2HG PRO 21 -5.882 4.075 -9.162 172 HD2 PRO 21 1HD PRO 21 -6.857 1.897 -7.894 173 HD3 PRO 21 2HD PRO 21 -5.463 2.815 -7.197 174 H ASN 22 H ASN 22 -9.399 2.950 -7.230 175 HA ASN 22 HA ASN 22 -11.663 4.803 -7.600 176 HB2 ASN 22 1HB ASN 22 -11.343 1.813 -7.960 177 HB3 ASN 22 2HB ASN 22 -12.867 2.660 -8.191 178 HD21 ASN 22 2HD2 ASN 22 -11.463 1.186 -10.165 179 HD22 ASN 22 2HD1 ASN 22 -11.012 2.288 -11.423 180 H GLU 23 H GLU 23 -10.317 3.147 -5.006 181 HA GLU 23 HA GLU 23 -12.956 3.099 -3.581 182 HB2 GLU 23 1HB GLU 23 -10.325 1.718 -2.896 183 HB3 GLU 23 2HB GLU 23 -11.798 1.631 -1.941 184 HG2 GLU 23 1HG GLU 23 -11.666 0.712 -4.814 185 HG3 GLU 23 2HG GLU 23 -11.274 -0.336 -3.452 186 H ALA 24 H ALA 24 -9.617 4.259 -3.424 187 HA ALA 24 HA ALA 24 -10.585 6.392 -1.606 188 HB1 ALA 24 3HB ALA 24 -8.134 4.684 -1.051 189 HB2 ALA 24 1HB ALA 24 -8.615 6.134 -0.141 190 HB3 ALA 24 2HB ALA 24 -9.645 4.682 -0.113 191 HA PRO 25 HA PRO 25 -8.181 7.873 -5.266 192 HB2 PRO 25 1HB PRO 25 -9.946 10.233 -4.441 193 HB3 PRO 25 2HB PRO 25 -9.546 9.684 -6.074 194 HG2 PRO 25 1HG PRO 25 -11.953 9.098 -5.112 195 HG3 PRO 25 2HG PRO 25 -11.060 7.846 -5.981 196 HD2 PRO 25 1HD PRO 25 -11.438 8.209 -2.991 197 HD3 PRO 25 2HD PRO 25 -11.409 6.684 -3.965 198 H VAL 26 H VAL 26 -8.992 9.669 -2.287 199 HA VAL 26 HA VAL 26 -6.747 11.507 -2.650 200 HB VAL 26 HB VAL 26 -8.489 10.870 -0.220 201 HG11 VAL 26 1HG1 VAL 26 -7.683 12.997 0.684 202 HG12 VAL 26 1HG2 VAL 26 -6.361 11.829 0.446 203 HG13 VAL 26 1HG3 VAL 26 -6.584 13.169 -0.705 204 HG21 VAL 26 2HG3 VAL 26 -9.760 11.773 -2.137 205 HG22 VAL 26 2HG1 VAL 26 -9.655 12.968 -0.823 206 HG23 VAL 26 2HG2 VAL 26 -8.615 13.131 -2.259 207 H THR 27 H THR 27 -7.317 8.769 -0.442 208 HA THR 27 HA THR 27 -4.777 9.022 0.870 209 HB THR 27 HB THR 27 -6.533 6.551 0.516 210 HG1 THR 27 1HG THR 27 -7.630 8.222 1.585 211 HG21 THR 27 2HG3 THR 27 -4.344 7.190 2.530 212 HG22 THR 27 2HG1 THR 27 -5.370 5.737 2.529 213 HG23 THR 27 2HG2 THR 27 -4.220 6.016 1.199 214 H VAL 28 H VAL 28 -5.813 7.084 -1.923 215 HA VAL 28 HA VAL 28 -3.272 5.755 -2.321 216 HB VAL 28 HB VAL 28 -5.531 6.496 -4.243 217 HG11 VAL 28 1HG1 VAL 28 -4.530 4.898 -5.802 218 HG12 VAL 28 1HG2 VAL 28 -3.448 6.272 -5.470 219 HG13 VAL 28 1HG3 VAL 28 -3.145 4.694 -4.703 220 HG21 VAL 28 2HG3 VAL 28 -6.151 4.896 -2.465 221 HG22 VAL 28 2HG1 VAL 28 -6.095 4.094 -4.053 222 HG23 VAL 28 2HG2 VAL 28 -4.759 3.874 -2.897 223 H ALA 29 H ALA 29 -4.592 8.777 -3.652 224 HA ALA 29 HA ALA 29 -2.389 9.380 -5.323 225 HB1 ALA 29 3HB ALA 29 -4.184 11.281 -3.772 226 HB2 ALA 29 1HB ALA 29 -3.137 11.724 -5.140 227 HB3 ALA 29 2HB ALA 29 -4.510 10.620 -5.390 228 H ASN 30 H ASN 30 -2.949 10.272 -1.911 229 HA ASN 30 HA ASN 30 -0.478 11.717 -1.616 230 HB2 ASN 30 1HB ASN 30 -2.338 10.390 0.365 231 HB3 ASN 30 2HB ASN 30 -0.884 11.251 0.854 232 HD21 ASN 30 2HD2 ASN 30 -3.452 11.984 1.650 233 HD22 ASN 30 2HD1 ASN 30 -3.827 13.529 0.962 234 H PHE 31 H PHE 31 -1.348 8.332 -0.941 235 HA PHE 31 HA PHE 31 1.162 7.499 0.100 236 HB2 PHE 31 1HB PHE 31 -0.868 6.076 0.108 237 HB3 PHE 31 2HB PHE 31 -0.814 5.966 -1.644 238 HD1 PHE 31 1HD PHE 31 0.911 5.003 1.478 239 HD2 PHE 31 2HD PHE 31 0.649 4.453 -2.751 240 HE1 PHE 31 1HE PHE 31 2.365 3.012 1.648 241 HE2 PHE 31 2HE PHE 31 2.101 2.459 -2.585 242 HZ PHE 31 HZ PHE 31 2.961 1.740 -0.383 243 H GLU 32 H GLU 32 0.037 7.545 -3.289 244 HA GLU 32 HA GLU 32 2.466 6.553 -4.420 245 HB2 GLU 32 1HB GLU 32 0.356 6.691 -5.694 246 HB3 GLU 32 2HB GLU 32 0.377 8.445 -5.581 247 HG2 GLU 32 1HG GLU 32 2.394 8.549 -6.939 248 HG3 GLU 32 2HG GLU 32 2.483 6.789 -6.986 249 H LYS 33 H LYS 33 1.403 9.888 -3.765 250 HA LYS 33 HA LYS 33 3.672 11.184 -4.910 251 HB2 LYS 33 1HB LYS 33 1.809 11.979 -2.644 252 HB3 LYS 33 2HB LYS 33 3.072 13.036 -3.259 253 HG2 LYS 33 1HG LYS 33 2.028 13.025 -5.483 254 HG3 LYS 33 2HG LYS 33 0.774 11.923 -4.896 255 HD2 LYS 33 1HD LYS 33 0.070 13.620 -3.230 256 HD3 LYS 33 2HD LYS 33 1.313 14.723 -3.840 257 HE2 LYS 33 1HE LYS 33 0.240 14.693 -6.072 258 HE3 LYS 33 2HE LYS 33 -1.004 13.602 -5.459 259 HZ1 LYS 33 3HZ LYS 33 -0.495 16.332 -4.481 260 HZ2 LYS 33 1HZ LYS 33 -1.742 15.870 -5.457 261 HZ3 LYS 33 2HZ LYS 33 -1.657 15.312 -3.908 262 H LEU 34 H LEU 34 3.115 10.024 -1.588 263 HA LEU 34 HA LEU 34 5.612 10.893 -0.519 264 HB2 LEU 34 1HB LEU 34 3.814 8.535 0.160 265 HB3 LEU 34 2HB LEU 34 5.247 8.959 1.102 266 HG LEU 34 HG LEU 34 2.871 10.806 0.686 267 HD11 LEU 34 1HD1 LEU 34 2.269 10.207 2.989 268 HD12 LEU 34 1HD2 LEU 34 2.216 8.795 1.907 269 HD13 LEU 34 1HD3 LEU 34 3.586 9.012 3.023 270 HD21 LEU 34 2HD3 LEU 34 5.022 11.929 1.160 271 HD22 LEU 34 2HD1 LEU 34 3.916 12.049 2.549 272 HD23 LEU 34 2HD2 LEU 34 5.258 10.880 2.577 273 H ALA 35 H ALA 35 4.724 7.809 -2.066 274 HA ALA 35 HA ALA 35 7.283 6.595 -1.792 275 HB1 ALA 35 3HB ALA 35 5.193 6.217 -3.967 276 HB2 ALA 35 1HB ALA 35 6.553 5.120 -3.631 277 HB3 ALA 35 2HB ALA 35 5.266 5.339 -2.421 278 H ASN 36 H ASN 36 5.945 8.672 -4.346 279 HA ASN 36 HA ASN 36 8.213 8.467 -6.108 280 HB2 ASN 36 1HB ASN 36 6.029 10.531 -5.781 281 HB3 ASN 36 2HB ASN 36 7.300 10.681 -6.987 282 HD21 ASN 36 2HD2 ASN 36 4.573 10.496 -7.589 283 HD22 ASN 36 2HD1 ASN 36 4.302 9.018 -8.452 284 H GLU 37 H GLU 37 7.528 10.496 -3.319 285 HA GLU 37 HA GLU 37 9.856 12.221 -3.814 286 HB2 GLU 37 1HB GLU 37 7.964 11.921 -1.446 287 HB3 GLU 37 2HB GLU 37 9.283 13.081 -1.501 288 HG2 GLU 37 1HG GLU 37 8.271 14.215 -3.392 289 HG3 GLU 37 2HG GLU 37 6.999 12.999 -3.483 290 H GLY 38 H GLY 38 9.530 9.093 -2.785 291 HA2 GLY 38 1HA GLY 38 11.142 7.653 -1.923 292 HA3 GLY 38 2HA GLY 38 12.258 9.032 -1.778 293 H PHE 39 H PHE 39 9.065 9.233 -0.394 294 HA PHE 39 HA PHE 39 9.973 10.104 2.126 295 HB2 PHE 39 1HB PHE 39 7.661 10.441 1.409 296 HB3 PHE 39 2HB PHE 39 7.378 8.709 1.351 297 HD1 PHE 39 1HD PHE 39 8.230 11.486 3.679 298 HD2 PHE 39 2HD PHE 39 6.600 7.563 3.230 299 HE1 PHE 39 1HE PHE 39 7.470 11.535 6.030 300 HE2 PHE 39 2HE PHE 39 5.836 7.609 5.581 301 HZ PHE 39 HZ PHE 39 6.273 9.595 6.981 302 H TYR 40 H TYR 40 9.245 6.802 1.050 303 HA TYR 40 HA TYR 40 9.486 5.783 3.805 304 HB2 TYR 40 1HB TYR 40 9.164 4.237 1.206 305 HB3 TYR 40 2HB TYR 40 8.903 3.633 2.837 306 HD1 TYR 40 2HD TYR 40 6.928 4.278 4.125 307 HD2 TYR 40 1HD TYR 40 7.537 5.647 0.105 308 HE1 TYR 40 2HE TYR 40 4.550 4.936 3.989 309 HE2 TYR 40 1HE TYR 40 5.160 6.306 -0.030 310 HH TYR 40 HH TYR 40 2.869 5.456 2.474 311 H ASN 41 H ASN 41 11.597 6.423 1.217 312 HA ASN 41 HA ASN 41 13.395 4.170 1.579 313 HB2 ASN 41 1HB ASN 41 13.214 5.530 -0.512 314 HB3 ASN 41 2HB ASN 41 13.952 6.879 0.341 315 HD21 ASN 41 2HD2 ASN 41 14.917 5.456 -1.987 316 HD22 ASN 41 2HD1 ASN 41 16.467 4.811 -1.564 317 H GLY 42 H GLY 42 14.215 3.809 3.508 318 HA2 GLY 42 1HA GLY 42 16.211 4.294 4.840 319 HA3 GLY 42 2HA GLY 42 15.832 6.027 4.696 320 H LEU 43 H LEU 43 12.879 5.046 5.053 321 HA LEU 43 HA LEU 43 12.851 5.384 7.977 322 HB2 LEU 43 1HB LEU 43 10.627 4.955 5.940 323 HB3 LEU 43 2HB LEU 43 10.369 5.276 7.657 324 HG LEU 43 HG LEU 43 11.537 7.167 5.590 325 HD11 LEU 43 1HD1 LEU 43 9.569 8.513 6.172 326 HD12 LEU 43 1HD2 LEU 43 9.109 6.912 5.547 327 HD13 LEU 43 1HD3 LEU 43 9.030 7.241 7.295 328 HD21 LEU 43 2HD3 LEU 43 12.751 7.361 7.735 329 HD22 LEU 43 2HD1 LEU 43 11.709 8.778 7.457 330 HD23 LEU 43 2HD2 LEU 43 11.202 7.510 8.599 331 H THR 44 H THR 44 11.483 4.009 9.340 332 HA THR 44 HA THR 44 11.860 1.126 8.588 333 HB THR 44 HB THR 44 12.377 0.641 10.927 334 HG1 THR 44 1HG THR 44 12.585 2.422 12.399 335 HG21 THR 44 2HG3 THR 44 14.021 2.989 9.911 336 HG22 THR 44 2HG1 THR 44 14.534 1.812 11.141 337 HG23 THR 44 2HG2 THR 44 14.260 1.284 9.463 338 H PHE 45 H PHE 45 10.497 -0.386 9.782 339 HA PHE 45 HA PHE 45 7.730 0.594 10.008 340 HB2 PHE 45 1HB PHE 45 9.107 -2.090 10.225 341 HB3 PHE 45 2HB PHE 45 7.481 -1.893 10.862 342 HD1 PHE 45 1HD PHE 45 9.547 -1.808 7.812 343 HD2 PHE 45 2HD PHE 45 5.589 -1.665 9.414 344 HE1 PHE 45 1HE PHE 45 8.620 -2.157 5.547 345 HE2 PHE 45 2HE PHE 45 4.658 -2.017 7.152 346 HZ PHE 45 HZ PHE 45 6.175 -2.261 5.217 347 H HIS 46 H HIS 46 6.772 1.345 11.710 348 HA HIS 46 HA HIS 46 8.120 1.843 14.153 349 HB2 HIS 46 1HB HIS 46 6.083 3.068 13.419 350 HB3 HIS 46 2HB HIS 46 5.123 1.612 13.644 351 HD2 HIS 46 2HD HIS 46 7.594 2.105 16.541 352 HE1 HIS 46 1HE HIS 46 3.845 3.698 17.796 353 H ARG 47 H ARG 47 5.658 -0.660 13.474 354 HA ARG 47 HA ARG 47 6.945 -2.513 15.332 355 HB2 ARG 47 1HB ARG 47 5.628 -0.925 16.833 356 HB3 ARG 47 2HB ARG 47 4.169 -1.490 16.032 357 HG2 ARG 47 1HG ARG 47 4.575 -3.763 16.825 358 HG3 ARG 47 2HG ARG 47 6.094 -3.235 17.588 359 HD2 ARG 47 1HD ARG 47 4.917 -1.805 19.080 360 HD3 ARG 47 2HD ARG 47 3.381 -2.114 18.239 361 HE ARG 47 HE ARG 47 4.269 -4.606 19.005 362 HH11 ARG 47 1HH1 ARG 47 3.569 -1.583 20.653 363 HH12 ARG 47 1HH2 ARG 47 3.094 -2.361 22.146 364 HH21 ARG 47 2HH1 ARG 47 3.650 -5.605 20.949 365 HH22 ARG 47 2HH2 ARG 47 3.139 -4.638 22.315 366 H VAL 48 H VAL 48 6.634 -4.501 14.715 367 HA VAL 48 HA VAL 48 4.317 -5.063 12.866 368 HB VAL 48 HB VAL 48 7.031 -6.456 13.041 369 HG11 VAL 48 1HG1 VAL 48 6.334 -7.567 10.975 370 HG12 VAL 48 1HG2 VAL 48 5.233 -7.923 12.327 371 HG13 VAL 48 1HG3 VAL 48 4.753 -6.755 11.074 372 HG21 VAL 48 2HG3 VAL 48 7.252 -4.167 12.141 373 HG22 VAL 48 2HG1 VAL 48 7.501 -5.379 10.863 374 HG23 VAL 48 2HG2 VAL 48 5.957 -4.500 10.967 375 H ILE 49 H ILE 49 2.758 -6.072 13.768 376 HA ILE 49 HA ILE 49 3.430 -8.236 15.748 377 HB ILE 49 HB ILE 49 0.834 -6.650 15.407 378 HG12 ILE 49 1HG1 ILE 49 2.829 -6.497 17.676 379 HG13 ILE 49 1HG2 ILE 49 2.763 -5.348 16.349 380 HG21 ILE 49 2HG1 ILE 49 0.154 -7.791 17.481 381 HG22 ILE 49 2HG2 ILE 49 0.489 -8.965 16.187 382 HG23 ILE 49 2HG3 ILE 49 1.680 -8.706 17.483 383 HD11 ILE 49 1HD3 ILE 49 0.527 -5.913 18.308 384 HD12 ILE 49 1HD1 ILE 49 1.600 -4.494 18.305 385 HD13 ILE 49 1HD2 ILE 49 0.460 -4.751 16.961 386 HA PRO 50 HA PRO 50 2.287 -10.811 12.290 387 HB2 PRO 50 1HB PRO 50 2.949 -12.798 14.504 388 HB3 PRO 50 2HB PRO 50 3.480 -12.817 12.818 389 HG2 PRO 50 1HG PRO 50 5.229 -12.072 14.679 390 HG3 PRO 50 2HG PRO 50 5.143 -11.150 13.175 391 HD2 PRO 50 1HD PRO 50 3.951 -10.493 15.896 392 HD3 PRO 50 2HD PRO 50 4.787 -9.399 14.721 393 H GLY 51 H GLY 51 0.375 -11.400 11.771 394 HA2 GLY 51 1HA GLY 51 -1.714 -12.422 11.963 395 HA3 GLY 51 2HA GLY 51 -1.326 -12.858 13.644 396 H PHE 52 H PHE 52 -0.769 -9.572 12.897 397 HA PHE 52 HA PHE 52 -3.534 -8.735 13.621 398 HB2 PHE 52 1HB PHE 52 -2.222 -8.866 15.753 399 HB3 PHE 52 2HB PHE 52 -1.031 -7.770 15.072 400 HD1 PHE 52 1HD PHE 52 -4.766 -7.889 15.402 401 HD2 PHE 52 2HD PHE 52 -1.177 -5.603 15.790 402 HE1 PHE 52 1HE PHE 52 -6.084 -5.958 16.209 403 HE2 PHE 52 2HE PHE 52 -2.491 -3.672 16.600 404 HZ PHE 52 HZ PHE 52 -4.946 -3.851 16.807 405 H VAL 53 H VAL 53 -0.706 -6.678 13.770 406 HA VAL 53 HA VAL 53 -1.330 -5.484 11.108 407 HB VAL 53 HB VAL 53 -1.514 -4.002 13.774 408 HG11 VAL 53 1HG1 VAL 53 -1.878 -1.984 12.440 409 HG12 VAL 53 1HG2 VAL 53 -0.268 -2.688 12.157 410 HG13 VAL 53 1HG3 VAL 53 -1.561 -2.910 10.954 411 HG21 VAL 53 2HG3 VAL 53 -3.571 -5.211 13.134 412 HG22 VAL 53 2HG1 VAL 53 -3.799 -3.451 12.999 413 HG23 VAL 53 2HG2 VAL 53 -3.536 -4.427 11.535 414 H SER 54 H SER 54 0.330 -4.726 10.074 415 HA SER 54 HA SER 54 2.924 -4.307 11.578 416 HB2 SER 54 1HB SER 54 3.116 -5.909 9.897 417 HB3 SER 54 2HB SER 54 2.396 -4.836 8.706 418 HG SER 54 HG SER 54 4.645 -4.822 8.658 419 H GLN 55 H GLN 55 3.135 -2.221 12.185 420 HA GLN 55 HA GLN 55 1.901 -0.119 10.447 421 HB2 GLN 55 1HB GLN 55 1.025 -0.218 12.759 422 HB3 GLN 55 2HB GLN 55 2.654 -0.073 13.400 423 HG2 GLN 55 1HG GLN 55 2.870 2.165 12.549 424 HG3 GLN 55 2HG GLN 55 1.313 2.026 11.686 425 HE21 GLN 55 2HE2 GLN 55 2.898 2.785 14.650 426 HE22 GLN 55 2HE1 GLN 55 1.481 3.108 15.592 427 H GLY 56 H GLY 56 3.052 1.346 9.458 428 HA2 GLY 56 1HA GLY 56 5.963 1.090 9.526 429 HA3 GLY 56 2HA GLY 56 5.008 2.172 8.487 430 H GLY 57 H GLY 57 7.382 2.988 9.716 431 HA2 GLY 57 1HA GLY 57 6.589 4.492 12.150 432 HA3 GLY 57 2HA GLY 57 8.246 4.237 11.556 433 H CYS 58 H CYS 58 8.885 6.370 11.523 434 HA CYS 58 HA CYS 58 7.588 8.237 9.569 435 HB2 CYS 58 1HB CYS 58 7.074 9.909 11.103 436 HB3 CYS 58 2HB CYS 58 6.165 8.450 11.471 437 HG CYS 58 HG CYS 58 7.837 7.641 13.350 438 HA PRO 59 HA PRO 59 11.634 9.989 9.285 439 HB2 PRO 59 1HB PRO 59 10.251 12.649 9.844 440 HB3 PRO 59 2HB PRO 59 11.342 12.240 8.514 441 HG2 PRO 59 1HG PRO 59 8.744 12.414 7.990 442 HG3 PRO 59 2HG PRO 59 9.657 11.065 7.306 443 HD2 PRO 59 1HD PRO 59 7.834 11.107 9.742 444 HD3 PRO 59 2HD PRO 59 7.974 9.855 8.442 445 H ARG 60 H ARG 60 9.557 11.099 11.923 446 HA ARG 60 HA ARG 60 11.682 12.151 13.548 447 HB2 ARG 60 1HB ARG 60 8.942 11.019 14.210 448 HB3 ARG 60 2HB ARG 60 10.022 11.664 15.437 449 HG2 ARG 60 1HG ARG 60 10.013 13.851 14.223 450 HG3 ARG 60 2HG ARG 60 8.789 13.172 13.123 451 HD2 ARG 60 1HD ARG 60 7.297 12.798 14.978 452 HD3 ARG 60 2HD ARG 60 8.528 13.401 16.111 453 HE ARG 60 HE ARG 60 7.901 15.299 14.032 454 HH11 ARG 60 1HH1 ARG 60 6.865 14.022 17.135 455 HH12 ARG 60 1HH2 ARG 60 6.007 15.477 17.589 456 HH21 ARG 60 2HH1 ARG 60 6.784 17.183 14.632 457 HH22 ARG 60 2HH2 ARG 60 5.960 17.267 16.173 458 H GLY 61 H GLY 61 10.450 8.893 13.060 459 HA2 GLY 61 1HA GLY 61 11.381 6.866 13.748 460 HA3 GLY 61 2HA GLY 61 12.697 7.761 14.543 461 H ASN 62 H ASN 62 9.618 8.952 15.349 462 HA ASN 62 HA ASN 62 9.815 7.632 18.028 463 HB2 ASN 62 1HB ASN 62 8.464 10.187 17.120 464 HB3 ASN 62 2HB ASN 62 8.285 9.497 18.728 465 HD21 ASN 62 2HD2 ASN 62 9.420 12.053 17.911 466 HD22 ASN 62 2HD1 ASN 62 11.043 12.077 18.517 467 H GLY 63 H GLY 63 8.209 7.264 15.163 468 HA2 GLY 63 1HA GLY 63 6.533 5.652 14.770 469 HA3 GLY 63 2HA GLY 63 6.142 5.645 16.505 470 H THR 64 H THR 64 6.423 8.812 15.501 471 HA THR 64 HA THR 64 3.474 9.012 14.970 472 HB THR 64 HB THR 64 5.280 10.987 16.436 473 HG1 THR 64 1HG THR 64 3.915 10.387 18.212 474 HG21 THR 64 2HG3 THR 64 2.293 11.042 15.863 475 HG22 THR 64 2HG1 THR 64 3.189 12.221 16.849 476 HG23 THR 64 2HG2 THR 64 3.516 12.089 15.104 477 H GLY 65 H GLY 65 3.050 9.485 12.977 478 HA2 GLY 65 1HA GLY 65 4.971 10.365 11.089 479 HA3 GLY 65 2HA GLY 65 3.206 10.424 10.872 480 H ASP 66 H ASP 66 5.412 12.327 10.134 481 HA ASP 66 HA ASP 66 4.056 14.774 11.060 482 HB2 ASP 66 1HB ASP 66 5.870 14.191 12.797 483 HB3 ASP 66 2HB ASP 66 7.046 14.487 11.525 484 H ALA 67 H ALA 67 4.089 13.621 8.562 485 HA ALA 67 HA ALA 67 6.046 15.217 7.011 486 HB1 ALA 67 3HB ALA 67 3.940 13.216 6.115 487 HB2 ALA 67 1HB ALA 67 5.136 14.006 5.062 488 HB3 ALA 67 2HB ALA 67 5.674 12.884 6.334 489 H GLY 68 H GLY 68 2.813 15.371 8.140 490 HA2 GLY 68 1HA GLY 68 1.580 17.425 8.058 491 HA3 GLY 68 2HA GLY 68 2.435 17.863 6.560 492 H TYR 69 H TYR 69 1.728 14.688 6.204 493 HA TYR 69 HA TYR 69 -0.508 15.280 4.383 494 HB2 TYR 69 1HB TYR 69 1.092 12.781 5.018 495 HB3 TYR 69 2HB TYR 69 -0.317 12.754 3.968 496 HD1 TYR 69 1HD TYR 69 2.902 14.622 4.406 497 HD2 TYR 69 2HD TYR 69 -0.025 13.038 1.699 498 HE1 TYR 69 1HE TYR 69 4.317 15.281 2.490 499 HE2 TYR 69 2HE TYR 69 1.389 13.697 -0.217 500 HH TYR 69 HH TYR 69 4.513 15.327 0.277 501 H THR 70 H THR 70 -1.782 16.036 6.330 502 HA THR 70 HA THR 70 -3.220 13.711 7.553 503 HB THR 70 HB THR 70 -3.149 16.666 8.306 504 HG1 THR 70 1HG THR 70 -2.266 14.293 9.635 505 HG21 THR 70 2HG3 THR 70 -4.706 14.366 9.549 506 HG22 THR 70 2HG1 THR 70 -4.601 16.022 10.190 507 HG23 THR 70 2HG2 THR 70 -5.408 15.720 8.632 508 H ILE 71 H ILE 71 -5.028 13.063 6.737 509 HA ILE 71 HA ILE 71 -6.839 15.083 5.454 510 HB ILE 71 HB ILE 71 -7.453 13.351 3.766 511 HG12 ILE 71 1HG1 ILE 71 -5.137 11.737 4.856 512 HG13 ILE 71 1HG2 ILE 71 -6.825 11.411 5.217 513 HG21 ILE 71 2HG1 ILE 71 -5.399 13.442 2.411 514 HG22 ILE 71 2HG2 ILE 71 -5.722 15.009 3.189 515 HG23 ILE 71 2HG3 ILE 71 -4.468 13.931 3.847 516 HD11 ILE 71 1HD3 ILE 71 -5.570 11.378 2.463 517 HD12 ILE 71 1HD1 ILE 71 -6.012 9.961 3.443 518 HD13 ILE 71 1HD2 ILE 71 -7.279 11.050 2.829 519 HA PRO 72 HA PRO 72 -10.035 13.204 7.810 520 HB2 PRO 72 1HB PRO 72 -12.193 13.685 6.214 521 HB3 PRO 72 2HB PRO 72 -11.364 15.042 6.986 522 HG2 PRO 72 1HG PRO 72 -11.051 13.982 4.144 523 HG3 PRO 72 2HG PRO 72 -11.291 15.652 4.666 524 HD2 PRO 72 1HD PRO 72 -8.804 14.678 4.109 525 HD3 PRO 72 2HD PRO 72 -9.073 15.900 5.415 526 H CYS 73 H CYS 73 -11.638 11.540 7.769 527 HA CYS 73 HA CYS 73 -10.591 9.131 6.475 528 HB2 CYS 73 1HB CYS 73 -13.047 9.575 8.101 529 HB3 CYS 73 2HB CYS 73 -12.466 8.029 7.499 530 HG CYS 73 HG CYS 73 -11.994 8.236 10.016 531 H GLU 74 H GLU 74 -11.263 8.132 4.670 532 HA GLU 74 HA GLU 74 -13.326 9.470 3.007 533 HB2 GLU 74 1HB GLU 74 -11.405 7.171 2.444 534 HB3 GLU 74 2HB GLU 74 -12.556 7.809 1.280 535 HG2 GLU 74 1HG GLU 74 -11.415 10.065 1.584 536 HG3 GLU 74 2HG GLU 74 -10.160 9.202 2.468 537 H THR 75 H THR 75 -13.276 7.128 5.362 538 HA THR 75 HA THR 75 -15.072 5.179 4.184 539 HB THR 75 HB THR 75 -15.378 4.380 6.492 540 HG1 THR 75 1HG THR 75 -14.688 5.567 8.210 541 HG21 THR 75 2HG3 THR 75 -12.504 5.208 5.938 542 HG22 THR 75 2HG1 THR 75 -13.023 3.923 7.053 543 HG23 THR 75 2HG2 THR 75 -13.305 3.752 5.304 544 H ASP 76 H ASP 76 -15.520 8.359 5.334 545 HA ASP 76 HA ASP 76 -18.265 8.182 6.169 546 HB2 ASP 76 1HB ASP 76 -16.611 10.438 4.972 547 HB3 ASP 76 2HB ASP 76 -18.289 10.646 5.456 548 H ASN 77 H ASN 77 -16.744 8.430 3.000 549 HA ASN 77 HA ASN 77 -19.474 8.448 1.760 550 HB2 ASN 77 1HB ASN 77 -16.763 9.203 0.634 551 HB3 ASN 77 2HB ASN 77 -18.241 9.105 -0.313 552 HD21 ASN 77 2HD2 ASN 77 -16.273 11.093 1.508 553 HD22 ASN 77 2HD1 ASN 77 -17.372 12.410 1.751 554 H ASN 78 H ASN 78 -16.529 6.621 2.124 555 HA ASN 78 HA ASN 78 -17.868 4.339 0.767 556 HB2 ASN 78 1HB ASN 78 -16.487 5.447 -0.968 557 HB3 ASN 78 2HB ASN 78 -15.071 5.269 0.059 558 HD21 ASN 78 2HD2 ASN 78 -14.124 4.055 -1.651 559 HD22 ASN 78 2HD1 ASN 78 -14.536 2.388 -1.879 560 HA PRO 79 HA PRO 79 -16.108 3.182 4.860 561 HB2 PRO 79 1HB PRO 79 -18.226 1.079 4.203 562 HB3 PRO 79 2HB PRO 79 -17.882 1.836 5.764 563 HG2 PRO 79 1HG PRO 79 -20.024 2.652 4.414 564 HG3 PRO 79 2HG PRO 79 -18.995 3.861 5.186 565 HD2 PRO 79 1HD PRO 79 -19.130 3.038 2.267 566 HD3 PRO 79 2HD PRO 79 -18.917 4.686 2.982 567 H HIS 80 H HIS 80 -14.437 1.978 5.100 568 HA HIS 80 HA HIS 80 -13.893 -0.050 2.958 569 HB2 HIS 80 1HB HIS 80 -11.938 1.561 4.657 570 HB3 HIS 80 2HB HIS 80 -11.490 0.345 3.470 571 HD2 HIS 80 2HD HIS 80 -12.236 1.116 0.721 572 HE1 HIS 80 1HE HIS 80 -12.192 5.261 1.710 573 H ARG 81 H ARG 81 -13.218 -2.051 3.429 574 HA ARG 81 HA ARG 81 -13.502 -2.843 6.302 575 HB2 ARG 81 1HB ARG 81 -13.537 -4.590 3.812 576 HB3 ARG 81 2HB ARG 81 -13.910 -5.094 5.454 577 HG2 ARG 81 1HG ARG 81 -15.528 -3.017 3.966 578 HG3 ARG 81 2HG ARG 81 -15.882 -4.762 3.932 579 HD2 ARG 81 1HD ARG 81 -15.754 -3.027 6.389 580 HD3 ARG 81 2HD ARG 81 -17.230 -3.598 5.575 581 HE ARG 81 HE ARG 81 -15.499 -5.092 7.349 582 HH11 ARG 81 1HH1 ARG 81 -17.836 -5.326 4.737 583 HH12 ARG 81 1HH2 ARG 81 -18.316 -6.958 5.144 584 HH21 ARG 81 2HH1 ARG 81 -16.129 -7.212 7.866 585 HH22 ARG 81 2HH2 ARG 81 -17.349 -8.026 6.915 586 H HIS 82 H HIS 82 -12.033 -4.096 7.346 587 HA HIS 82 HA HIS 82 -9.313 -4.058 6.088 588 HB2 HIS 82 1HB HIS 82 -10.169 -3.886 9.007 589 HB3 HIS 82 2HB HIS 82 -8.503 -4.097 8.488 590 HD2 HIS 82 2HD HIS 82 -7.149 -1.641 7.953 591 HE1 HIS 82 1HE HIS 82 -10.670 0.734 7.880 592 H VAL 83 H VAL 83 -8.816 -5.942 5.285 593 HA VAL 83 HA VAL 83 -9.247 -8.373 7.009 594 HB VAL 83 HB VAL 83 -9.725 -9.655 4.961 595 HG11 VAL 83 1HG1 VAL 83 -11.946 -8.774 4.431 596 HG12 VAL 83 1HG2 VAL 83 -11.618 -8.746 6.181 597 HG13 VAL 83 1HG3 VAL 83 -11.528 -7.241 5.233 598 HG21 VAL 83 2HG3 VAL 83 -8.422 -8.262 3.391 599 HG22 VAL 83 2HG1 VAL 83 -10.089 -8.485 2.811 600 HG23 VAL 83 2HG2 VAL 83 -9.609 -6.947 3.568 601 H THR 84 H THR 84 -8.016 -10.273 5.881 602 HA THR 84 HA THR 84 -5.256 -9.780 6.310 603 HB THR 84 HB THR 84 -6.535 -11.966 4.608 604 HG1 THR 84 1HG THR 84 -5.765 -11.979 7.359 605 HG21 THR 84 2HG3 THR 84 -3.826 -11.809 5.985 606 HG22 THR 84 2HG1 THR 84 -4.475 -13.219 5.115 607 HG23 THR 84 2HG2 THR 84 -4.106 -11.719 4.230 608 H GLY 85 H GLY 85 -3.895 -8.572 5.281 609 HA2 GLY 85 1HA GLY 85 -2.473 -8.375 3.331 610 HA3 GLY 85 2HA GLY 85 -3.877 -8.743 2.302 611 H ALA 86 H ALA 86 -5.398 -6.865 4.294 612 HA ALA 86 HA ALA 86 -5.539 -4.752 2.379 613 HB1 ALA 86 3HB ALA 86 -6.524 -4.831 5.253 614 HB2 ALA 86 1HB ALA 86 -7.018 -3.651 4.018 615 HB3 ALA 86 2HB ALA 86 -7.430 -5.372 3.820 616 H MET 87 H MET 87 -4.780 -2.709 2.297 617 HA MET 87 HA MET 87 -2.862 -1.899 4.462 618 HB2 MET 87 1HB MET 87 -2.783 -1.232 1.497 619 HB3 MET 87 2HB MET 87 -1.694 -0.581 2.712 620 HG2 MET 87 1HG MET 87 -0.748 -2.768 3.127 621 HG3 MET 87 2HG MET 87 -1.943 -3.534 2.079 622 HE1 MET 87 3HE MET 87 1.367 -1.552 2.343 623 HE2 MET 87 1HE MET 87 1.600 -0.915 0.699 624 HE3 MET 87 2HE MET 87 0.301 -0.265 1.729 625 H SER 88 H SER 88 -3.179 -0.059 5.487 626 HA SER 88 HA SER 88 -5.446 1.723 4.572 627 HB2 SER 88 1HB SER 88 -6.442 -0.027 5.832 628 HB3 SER 88 2HB SER 88 -5.375 0.313 7.185 629 HG SER 88 HG SER 88 -7.471 1.332 7.181 630 H MET 89 H MET 89 -5.224 3.805 5.205 631 HA MET 89 HA MET 89 -2.715 4.727 6.327 632 HB2 MET 89 1HB MET 89 -4.064 6.074 4.747 633 HB3 MET 89 2HB MET 89 -5.362 6.173 5.927 634 HG2 MET 89 1HG MET 89 -3.864 7.402 7.464 635 HG3 MET 89 2HG MET 89 -2.575 7.318 6.261 636 HE1 MET 89 3HE MET 89 -3.070 8.234 3.660 637 HE2 MET 89 1HE MET 89 -3.317 9.994 3.755 638 HE3 MET 89 2HE MET 89 -2.077 9.213 4.768 639 H ALA 90 H ALA 90 -2.093 5.162 8.307 640 HA ALA 90 HA ALA 90 -3.853 4.525 10.547 641 HB1 ALA 90 3HB ALA 90 -1.079 5.765 10.478 642 HB2 ALA 90 1HB ALA 90 -1.921 5.184 11.933 643 HB3 ALA 90 2HB ALA 90 -1.448 4.034 10.659 644 H HIS 91 H HIS 91 -4.536 5.910 12.191 645 HA HIS 91 HA HIS 91 -4.644 8.802 11.422 646 HB2 HIS 91 1HB HIS 91 -6.939 7.022 12.340 647 HB3 HIS 91 2HB HIS 91 -7.015 8.778 12.341 648 HD2 HIS 91 2HD HIS 91 -7.882 9.883 9.857 649 HE1 HIS 91 1HE HIS 91 -7.308 6.315 7.622 650 H ARG 92 H ARG 92 -4.654 10.289 13.025 651 HA ARG 92 HA ARG 92 -3.931 9.233 15.726 652 HB2 ARG 92 1HB ARG 92 -3.636 12.009 14.510 653 HB3 ARG 92 2HB ARG 92 -3.144 11.561 16.136 654 HG2 ARG 92 1HG ARG 92 -1.473 10.022 15.242 655 HG3 ARG 92 2HG ARG 92 -1.996 10.403 13.584 656 HD2 ARG 92 1HD ARG 92 -0.038 11.654 14.093 657 HD3 ARG 92 2HD ARG 92 -1.424 12.766 14.012 658 HE ARG 92 HE ARG 92 -0.995 11.882 16.693 659 HH11 ARG 92 1HH1 ARG 92 0.306 14.030 14.236 660 HH12 ARG 92 1HH2 ARG 92 0.998 15.141 15.396 661 HH21 ARG 92 2HH1 ARG 92 -0.091 13.332 18.189 662 HH22 ARG 92 2HH2 ARG 92 0.775 14.747 17.634 663 H GLY 93 H GLY 93 -6.676 9.880 14.239 664 HA2 GLY 93 1HA GLY 93 -8.338 10.053 16.406 665 HA3 GLY 93 2HA GLY 93 -7.882 11.751 16.135 666 H ARG 94 H ARG 94 -10.367 11.669 15.865 667 HA ARG 94 HA ARG 94 -11.553 10.517 13.537 668 HB2 ARG 94 1HB ARG 94 -12.795 11.466 15.514 669 HB3 ARG 94 2HB ARG 94 -12.355 13.079 14.971 670 HG2 ARG 94 1HG ARG 94 -13.615 12.751 12.897 671 HG3 ARG 94 2HG ARG 94 -14.039 11.101 13.413 672 HD2 ARG 94 1HD ARG 94 -14.736 13.625 14.894 673 HD3 ARG 94 2HD ARG 94 -15.824 12.716 13.822 674 HE ARG 94 HE ARG 94 -15.022 12.033 16.530 675 HH11 ARG 94 1HH1 ARG 94 -16.335 10.846 13.496 676 HH12 ARG 94 1HH2 ARG 94 -17.121 9.466 14.233 677 HH21 ARG 94 2HH1 ARG 94 -16.047 10.240 17.474 678 HH22 ARG 94 2HH2 ARG 94 -16.959 9.123 16.484 679 H ASP 95 H ASP 95 -11.232 10.855 11.500 680 HA ASP 95 HA ASP 95 -10.565 11.895 9.526 681 HB2 ASP 95 1HB ASP 95 -11.842 14.258 10.965 682 HB3 ASP 95 2HB ASP 95 -11.370 14.273 9.272 683 H THR 96 H THR 96 -8.601 11.703 11.627 684 HA THR 96 HA THR 96 -6.861 13.982 10.748 685 HB THR 96 HB THR 96 -6.797 12.646 13.489 686 HG1 THR 96 1HG THR 96 -8.650 14.016 13.169 687 HG21 THR 96 2HG3 THR 96 -5.374 15.089 12.364 688 HG22 THR 96 2HG1 THR 96 -5.255 14.489 14.034 689 HG23 THR 96 2HG2 THR 96 -4.624 13.508 12.688 690 H GLY 97 H GLY 97 -6.509 12.303 9.030 691 HA2 GLY 97 1HA GLY 97 -5.082 9.895 9.663 692 HA3 GLY 97 2HA GLY 97 -5.148 10.694 8.075 693 H SER 98 H SER 98 -2.857 9.397 9.223 694 HA SER 98 HA SER 98 -0.957 11.757 9.405 695 HB2 SER 98 1HB SER 98 0.505 10.531 10.605 696 HB3 SER 98 2HB SER 98 -1.061 10.302 11.366 697 HG SER 98 HG SER 98 -0.031 8.367 11.172 698 H CYS 99 H CYS 99 1.293 10.947 8.630 699 HA CYS 99 HA CYS 99 1.125 10.028 5.821 700 HB2 CYS 99 1HB CYS 99 3.452 10.361 5.749 701 HB3 CYS 99 2HB CYS 99 2.612 11.776 6.366 702 HG CYS 99 HG CYS 99 3.107 11.336 8.865 703 H GLN 100 H GLN 100 0.959 8.421 8.733 704 HA GLN 100 HA GLN 100 2.779 6.203 7.978 705 HB2 GLN 100 1HB GLN 100 1.007 6.674 10.412 706 HB3 GLN 100 2HB GLN 100 1.990 5.237 10.174 707 HG2 GLN 100 1HG GLN 100 4.022 6.567 10.207 708 HG3 GLN 100 2HG GLN 100 3.056 8.063 10.347 709 HE21 GLN 100 2HE2 GLN 100 4.245 5.196 11.982 710 HE22 GLN 100 2HE1 GLN 100 3.810 5.683 13.587 711 H PHE 101 H PHE 101 2.207 4.198 7.395 712 HA PHE 101 HA PHE 101 -0.724 3.600 7.232 713 HB2 PHE 101 1HB PHE 101 1.358 2.824 5.147 714 HB3 PHE 101 2HB PHE 101 -0.362 2.467 5.095 715 HD1 PHE 101 1HD PHE 101 2.177 5.107 4.769 716 HD2 PHE 101 2HD PHE 101 -1.969 4.132 4.441 717 HE1 PHE 101 1HE PHE 101 1.779 7.219 3.547 718 HE2 PHE 101 2HE PHE 101 -2.372 6.241 3.217 719 HZ PHE 101 HZ PHE 101 -0.496 7.786 2.771 720 H PHE 102 H PHE 102 -1.283 1.375 7.239 721 HA PHE 102 HA PHE 102 0.803 -0.425 8.385 722 HB2 PHE 102 1HB PHE 102 -0.663 -1.071 10.223 723 HB3 PHE 102 2HB PHE 102 -0.378 0.661 10.298 724 HD1 PHE 102 1HD PHE 102 -2.846 -1.960 9.609 725 HD2 PHE 102 2HD PHE 102 -2.153 2.248 9.860 726 HE1 PHE 102 1HE PHE 102 -5.286 -1.562 9.634 727 HE2 PHE 102 2HE PHE 102 -4.593 2.650 9.889 728 HZ PHE 102 HZ PHE 102 -6.159 0.743 9.774 729 H ILE 103 H ILE 103 0.386 -2.621 8.246 730 HA ILE 103 HA ILE 103 -1.670 -3.293 6.156 731 HB ILE 103 HB ILE 103 0.970 -4.690 6.824 732 HG12 ILE 103 1HG1 ILE 103 1.226 -3.889 4.254 733 HG13 ILE 103 1HG2 ILE 103 0.260 -2.563 4.886 734 HG21 ILE 103 2HG1 ILE 103 0.493 -6.025 4.811 735 HG22 ILE 103 2HG2 ILE 103 -0.786 -6.228 6.030 736 HG23 ILE 103 2HG3 ILE 103 -1.063 -5.184 4.616 737 HD11 ILE 103 1HD3 ILE 103 2.896 -3.526 6.019 738 HD12 ILE 103 1HD1 ILE 103 2.637 -2.067 5.036 739 HD13 ILE 103 1HD2 ILE 103 1.918 -2.185 6.660 740 H VAL 104 H VAL 104 -3.292 -4.465 6.643 741 HA VAL 104 HA VAL 104 -3.432 -5.718 9.328 742 HB VAL 104 HB VAL 104 -5.431 -5.631 7.016 743 HG11 VAL 104 1HG1 VAL 104 -7.085 -6.286 8.695 744 HG12 VAL 104 1HG2 VAL 104 -5.814 -7.515 8.498 745 HG13 VAL 104 1HG3 VAL 104 -5.793 -6.432 9.910 746 HG21 VAL 104 2HG3 VAL 104 -4.912 -3.385 7.904 747 HG22 VAL 104 2HG1 VAL 104 -6.558 -3.884 8.358 748 HG23 VAL 104 2HG2 VAL 104 -5.244 -3.959 9.556 749 H HIS 105 H HIS 105 -3.351 -7.740 9.874 750 HA HIS 105 HA HIS 105 -2.645 -9.660 7.685 751 HB2 HIS 105 1HB HIS 105 -2.009 -9.766 10.666 752 HB3 HIS 105 2HB HIS 105 -1.538 -10.974 9.478 753 HD2 HIS 105 2HD HIS 105 0.199 -8.084 11.197 754 HE1 HIS 105 1HE HIS 105 1.852 -8.269 7.287 755 H GLU 106 H GLU 106 -4.719 -9.141 10.487 756 HA GLU 106 HA GLU 106 -6.451 -11.319 9.379 757 HB2 GLU 106 1HB GLU 106 -5.894 -10.719 12.314 758 HB3 GLU 106 2HB GLU 106 -7.171 -11.783 11.745 759 HG2 GLU 106 1HG GLU 106 -5.462 -13.240 10.696 760 HG3 GLU 106 2HG GLU 106 -4.200 -12.188 11.335 761 HA PRO 107 HA PRO 107 -9.629 -8.435 8.945 762 HB2 PRO 107 1HB PRO 107 -11.296 -10.539 10.420 763 HB3 PRO 107 2HB PRO 107 -11.690 -9.684 8.923 764 HG2 PRO 107 1HG PRO 107 -10.847 -12.203 8.752 765 HG3 PRO 107 2HG PRO 107 -10.217 -11.014 7.608 766 HD2 PRO 107 1HD PRO 107 -8.905 -12.186 10.077 767 HD3 PRO 107 2HD PRO 107 -8.163 -11.739 8.489 768 H GLN 108 H GLN 108 -10.257 -6.733 9.967 769 HA GLN 108 HA GLN 108 -10.445 -6.887 12.955 770 HB2 GLN 108 1HB GLN 108 -9.247 -4.620 11.305 771 HB3 GLN 108 2HB GLN 108 -9.434 -4.634 13.053 772 HG2 GLN 108 1HG GLN 108 -7.701 -6.534 11.459 773 HG3 GLN 108 2HG GLN 108 -7.140 -5.106 12.373 774 HE21 GLN 108 2HE2 GLN 108 -6.972 -8.272 12.509 775 HE22 GLN 108 2HE1 GLN 108 -7.150 -8.568 14.207 776 HA PRO 109 HA PRO 109 -14.511 -5.372 11.482 777 HB2 PRO 109 1HB PRO 109 -14.967 -6.321 14.342 778 HB3 PRO 109 2HB PRO 109 -15.991 -6.580 12.924 779 HG2 PRO 109 1HG PRO 109 -14.530 -8.619 13.811 780 HG3 PRO 109 2HG PRO 109 -14.612 -8.325 12.070 781 HD2 PRO 109 1HD PRO 109 -12.409 -7.589 14.039 782 HD3 PRO 109 2HD PRO 109 -12.266 -8.268 12.368 783 H HIS 110 H HIS 110 -12.548 -4.830 14.345 784 HA HIS 110 HA HIS 110 -14.140 -2.587 15.283 785 HB2 HIS 110 1HB HIS 110 -11.292 -3.473 15.912 786 HB3 HIS 110 2HB HIS 110 -12.111 -2.145 16.723 787 HD2 HIS 110 2HD HIS 110 -11.588 -5.833 17.226 788 HE1 HIS 110 1HE HIS 110 -15.154 -4.883 19.357 789 H LEU 111 H LEU 111 -11.678 -2.977 12.891 790 HA LEU 111 HA LEU 111 -11.114 -0.050 12.887 791 HB2 LEU 111 1HB LEU 111 -9.851 -2.338 11.321 792 HB3 LEU 111 2HB LEU 111 -9.324 -0.652 11.283 793 HG LEU 111 HG LEU 111 -9.173 -2.537 13.662 794 HD11 LEU 111 1HD1 LEU 111 -6.753 -2.307 13.326 795 HD12 LEU 111 1HD2 LEU 111 -7.552 -3.008 11.898 796 HD13 LEU 111 1HD3 LEU 111 -7.048 -1.301 11.888 797 HD21 LEU 111 2HD3 LEU 111 -9.663 -0.211 14.342 798 HD22 LEU 111 2HD1 LEU 111 -7.993 -0.664 14.763 799 HD23 LEU 111 2HD2 LEU 111 -8.306 0.366 13.345 800 H ASP 112 H ASP 112 -13.212 -2.234 11.462 801 HA ASP 112 HA ASP 112 -13.232 -1.275 8.745 802 HB2 ASP 112 1HB ASP 112 -15.370 -2.613 10.454 803 HB3 ASP 112 2HB ASP 112 -15.578 -2.252 8.747 804 H GLY 113 H GLY 113 -13.874 0.524 7.886 805 HA2 GLY 113 1HA GLY 113 -15.154 2.437 7.535 806 HA3 GLY 113 2HA GLY 113 -16.184 1.974 8.909 807 H VAL 114 H VAL 114 -12.978 1.828 9.849 808 HA VAL 114 HA VAL 114 -13.198 4.506 11.205 809 HB VAL 114 HB VAL 114 -11.496 2.054 11.869 810 HG11 VAL 114 1HG1 VAL 114 -10.995 3.232 13.955 811 HG12 VAL 114 1HG2 VAL 114 -10.431 4.134 12.528 812 HG13 VAL 114 1HG3 VAL 114 -11.910 4.644 13.376 813 HG21 VAL 114 2HG3 VAL 114 -13.903 1.663 12.268 814 HG22 VAL 114 2HG1 VAL 114 -13.017 1.802 13.805 815 HG23 VAL 114 2HG2 VAL 114 -13.992 3.168 13.214 816 H HIS 115 H HIS 115 -10.814 2.395 9.602 817 HA HIS 115 HA HIS 115 -9.293 4.894 8.944 818 HB2 HIS 115 1HB HIS 115 -8.350 1.995 9.032 819 HB3 HIS 115 2HB HIS 115 -7.364 3.366 8.547 820 HD2 HIS 115 2HD HIS 115 -8.775 1.740 11.811 821 HE1 HIS 115 1HE HIS 115 -6.151 4.917 12.898 822 H THR 116 H THR 116 -8.193 4.937 6.870 823 HA THR 116 HA THR 116 -10.158 4.067 4.802 824 HB THR 116 HB THR 116 -7.924 6.143 4.693 825 HG1 THR 116 1HG THR 116 -9.775 6.708 5.984 826 HG21 THR 116 2HG3 THR 116 -10.109 5.448 2.693 827 HG22 THR 116 2HG1 THR 116 -8.948 6.789 2.546 828 HG23 THR 116 2HG2 THR 116 -8.375 5.104 2.496 829 H VAL 117 H VAL 117 -9.770 2.171 3.960 830 HA VAL 117 HA VAL 117 -7.036 1.198 3.431 831 HB VAL 117 HB VAL 117 -9.765 0.216 2.463 832 HG11 VAL 117 1HG1 VAL 117 -8.600 -1.873 1.947 833 HG12 VAL 117 1HG2 VAL 117 -7.962 -0.504 1.006 834 HG13 VAL 117 1HG3 VAL 117 -7.054 -1.124 2.406 835 HG21 VAL 117 2HG3 VAL 117 -9.538 0.134 4.922 836 HG22 VAL 117 2HG1 VAL 117 -9.510 -1.502 4.225 837 HG23 VAL 117 2HG2 VAL 117 -7.994 -0.734 4.753 838 H PHE 118 H PHE 118 -5.875 1.191 1.662 839 HA PHE 118 HA PHE 118 -6.960 2.803 -0.622 840 HB2 PHE 118 1HB PHE 118 -4.883 4.036 -0.742 841 HB3 PHE 118 2HB PHE 118 -5.509 4.192 0.893 842 HD1 PHE 118 2HD PHE 118 -4.443 2.999 2.762 843 HD2 PHE 118 1HD PHE 118 -2.834 2.873 -1.193 844 HE1 PHE 118 2HE PHE 118 -2.293 2.182 3.667 845 HE2 PHE 118 1HE PHE 118 -0.682 2.052 -0.292 846 HZ PHE 118 HZ PHE 118 -0.412 1.706 2.137 847 H GLY 119 H GLY 119 -5.323 0.028 0.470 848 HA2 GLY 119 1HA GLY 119 -5.146 -1.035 -2.207 849 HA3 GLY 119 2HA GLY 119 -3.540 -0.585 -1.588 850 H GLN 120 H GLN 120 -3.308 -3.003 -1.949 851 HA GLN 120 HA GLN 120 -3.292 -4.182 0.723 852 HB2 GLN 120 1HB GLN 120 -4.570 -6.160 0.242 853 HB3 GLN 120 2HB GLN 120 -5.591 -4.785 -0.156 854 HG2 GLN 120 1HG GLN 120 -5.132 -5.069 -2.522 855 HG3 GLN 120 2HG GLN 120 -4.000 -6.402 -2.157 856 HE21 GLN 120 2HE2 GLN 120 -4.772 -8.434 -1.732 857 HE22 GLN 120 2HE1 GLN 120 -6.447 -8.863 -1.842 858 H VAL 121 H VAL 121 -1.847 -5.831 0.983 859 HA VAL 121 HA VAL 121 0.209 -6.093 -1.119 860 HB VAL 121 HB VAL 121 -0.148 -7.529 1.556 861 HG11 VAL 121 1HG1 VAL 121 2.220 -8.099 1.329 862 HG12 VAL 121 1HG2 VAL 121 1.241 -8.784 0.010 863 HG13 VAL 121 1HG3 VAL 121 2.246 -7.344 -0.283 864 HG21 VAL 121 2HG3 VAL 121 0.110 -5.088 1.822 865 HG22 VAL 121 2HG1 VAL 121 1.567 -5.946 2.376 866 HG23 VAL 121 2HG2 VAL 121 1.564 -5.127 0.796 867 H THR 122 H THR 122 0.538 -7.597 -2.537 868 HA THR 122 HA THR 122 -1.582 -9.718 -2.673 869 HB THR 122 HB THR 122 -1.318 -9.605 -5.133 870 HG1 THR 122 1HG THR 122 -0.034 -7.867 -5.979 871 HG21 THR 122 2HG3 THR 122 -1.808 -6.882 -3.865 872 HG22 THR 122 2HG1 THR 122 -2.332 -7.387 -5.489 873 HG23 THR 122 2HG2 THR 122 -3.015 -8.176 -4.047 874 H SER 123 H SER 123 1.807 -9.059 -2.621 875 HA SER 123 HA SER 123 2.291 -12.050 -2.683 876 HB2 SER 123 1HB SER 123 4.190 -11.880 -3.902 877 HB3 SER 123 2HB SER 123 2.935 -11.037 -4.799 878 HG SER 123 HG SER 123 4.870 -9.897 -4.721 879 H GLY 124 H GLY 124 3.712 -12.771 -1.164 880 HA2 GLY 124 1HA GLY 124 5.228 -12.754 0.585 881 HA3 GLY 124 2HA GLY 124 5.694 -11.112 0.087 882 H MET 125 H MET 125 2.405 -12.062 0.941 883 HA MET 125 HA MET 125 2.070 -10.055 2.950 884 HB2 MET 125 1HB MET 125 0.606 -12.661 2.420 885 HB3 MET 125 2HB MET 125 0.102 -11.504 3.643 886 HG2 MET 125 1HG MET 125 -0.027 -9.775 1.773 887 HG3 MET 125 2HG MET 125 0.176 -11.117 0.645 888 HE1 MET 125 3HE MET 125 -1.389 -13.508 1.858 889 HE2 MET 125 1HE MET 125 -3.017 -13.252 1.182 890 HE3 MET 125 2HE MET 125 -1.579 -12.964 0.173 891 H ASP 126 H ASP 126 3.039 -13.462 3.190 892 HA ASP 126 HA ASP 126 3.282 -13.482 6.062 893 HB2 ASP 126 1HB ASP 126 4.614 -15.106 3.859 894 HB3 ASP 126 2HB ASP 126 4.925 -15.387 5.567 895 H VAL 127 H VAL 127 5.518 -12.589 3.461 896 HA VAL 127 HA VAL 127 7.838 -12.159 5.116 897 HB VAL 127 HB VAL 127 6.922 -10.779 2.546 898 HG11 VAL 127 1HG1 VAL 127 9.259 -10.106 2.282 899 HG12 VAL 127 1HG2 VAL 127 8.525 -9.404 3.743 900 HG13 VAL 127 1HG3 VAL 127 9.636 -10.788 3.882 901 HG21 VAL 127 2HG3 VAL 127 7.241 -13.218 2.318 902 HG22 VAL 127 2HG1 VAL 127 8.518 -12.326 1.459 903 HG23 VAL 127 2HG2 VAL 127 8.864 -13.076 3.035 904 H VAL 128 H VAL 128 5.207 -9.949 4.193 905 HA VAL 128 HA VAL 128 6.161 -7.726 5.781 906 HB VAL 128 HB VAL 128 3.321 -8.553 5.009 907 HG11 VAL 128 1HG1 VAL 128 2.735 -6.215 5.427 908 HG12 VAL 128 1HG2 VAL 128 3.330 -7.024 6.895 909 HG13 VAL 128 1HG3 VAL 128 4.388 -5.904 6.004 910 HG21 VAL 128 2HG3 VAL 128 4.794 -8.192 3.059 911 HG22 VAL 128 2HG1 VAL 128 3.592 -6.888 3.198 912 HG23 VAL 128 2HG2 VAL 128 5.273 -6.607 3.710 913 H ARG 129 H ARG 129 3.999 -10.435 6.559 914 HA ARG 129 HA ARG 129 3.389 -9.567 9.215 915 HB2 ARG 129 1HB ARG 129 2.263 -11.443 7.916 916 HB3 ARG 129 2HB ARG 129 3.675 -12.435 8.246 917 HG2 ARG 129 1HG ARG 129 3.256 -12.272 10.653 918 HG3 ARG 129 2HG ARG 129 1.846 -11.232 10.339 919 HD2 ARG 129 1HD ARG 129 2.185 -14.035 9.301 920 HD3 ARG 129 2HD ARG 129 1.274 -13.585 10.761 921 HE ARG 129 HE ARG 129 0.156 -12.009 8.854 922 HH11 ARG 129 1HH1 ARG 129 0.828 -15.453 9.020 923 HH12 ARG 129 1HH2 ARG 129 -0.530 -15.893 8.008 924 HH21 ARG 129 2HH1 ARG 129 -1.603 -12.594 7.542 925 HH22 ARG 129 2HH2 ARG 129 -1.906 -14.276 7.171 926 H THR 130 H THR 130 6.173 -11.261 7.889 927 HA THR 130 HA THR 130 7.183 -11.775 10.648 928 HB THR 130 HB THR 130 8.911 -13.155 9.493 929 HG1 THR 130 1HG THR 130 8.890 -11.977 7.495 930 HG21 THR 130 2HG3 THR 130 6.058 -13.777 8.638 931 HG22 THR 130 2HG1 THR 130 7.403 -14.939 8.712 932 HG23 THR 130 2HG2 THR 130 6.786 -14.195 10.206 933 H MET 131 H MET 131 7.134 -9.153 8.929 934 HA MET 131 HA MET 131 9.893 -8.306 8.906 935 HB2 MET 131 1HB MET 131 7.256 -6.826 9.127 936 HB3 MET 131 2HB MET 131 8.804 -5.994 9.146 937 HG2 MET 131 1HG MET 131 9.327 -6.907 6.916 938 HG3 MET 131 2HG MET 131 7.776 -7.750 6.897 939 HE1 MET 131 3HE MET 131 7.273 -6.594 4.542 940 HE2 MET 131 1HE MET 131 7.317 -4.833 4.285 941 HE3 MET 131 2HE MET 131 8.823 -5.721 4.629 942 H LYS 132 H LYS 132 10.871 -6.740 10.329 943 HA LYS 132 HA LYS 132 10.333 -7.532 13.168 944 HB2 LYS 132 1HB LYS 132 12.860 -6.459 11.851 945 HB3 LYS 132 2HB LYS 132 12.691 -6.831 13.561 946 HG2 LYS 132 1HG LYS 132 12.283 -9.204 13.006 947 HG3 LYS 132 2HG LYS 132 12.473 -8.826 11.287 948 HD2 LYS 132 1HD LYS 132 14.779 -8.055 11.698 949 HD3 LYS 132 2HD LYS 132 14.593 -8.395 13.425 950 HE2 LYS 132 1HE LYS 132 14.198 -10.789 12.898 951 HE3 LYS 132 2HE LYS 132 14.427 -10.442 11.182 952 HZ1 LYS 132 3HZ LYS 132 16.450 -10.056 13.285 953 HZ2 LYS 132 1HZ LYS 132 16.421 -11.282 12.184 954 HZ3 LYS 132 2HZ LYS 132 16.663 -9.729 11.682 955 H ASN 133 H ASN 133 10.590 -5.998 14.843 956 HA ASN 133 HA ASN 133 9.461 -3.388 14.270 957 HB2 ASN 133 1HB ASN 133 9.186 -4.602 16.429 958 HB3 ASN 133 2HB ASN 133 10.895 -4.357 16.758 959 HD21 ASN 133 2HD2 ASN 133 8.569 -3.423 18.237 960 HD22 ASN 133 2HD1 ASN 133 8.697 -1.698 18.302 961 H GLY 134 H GLY 134 10.433 -1.860 13.214 962 HA2 GLY 134 1HA GLY 134 12.075 -0.164 12.979 963 HA3 GLY 134 2HA GLY 134 13.195 -1.119 13.978 964 H ASP 135 H ASP 135 11.624 -3.040 11.675 965 HA ASP 135 HA ASP 135 13.944 -3.550 10.082 966 HB2 ASP 135 1HB ASP 135 11.783 -4.961 10.323 967 HB3 ASP 135 2HB ASP 135 11.076 -3.872 9.138 968 H VAL 136 H VAL 136 14.752 -2.757 8.247 969 HA VAL 136 HA VAL 136 13.930 0.070 7.766 970 HB VAL 136 HB VAL 136 16.358 -1.527 6.815 971 HG11 VAL 136 1HG1 VAL 136 17.310 0.660 6.268 972 HG12 VAL 136 1HG2 VAL 136 15.826 0.330 5.345 973 HG13 VAL 136 1HG3 VAL 136 15.783 1.442 6.734 974 HG21 VAL 136 2HG3 VAL 136 16.308 -1.272 9.272 975 HG22 VAL 136 2HG1 VAL 136 17.587 -0.266 8.553 976 HG23 VAL 136 2HG2 VAL 136 16.063 0.481 9.088 977 H MET 137 H MET 137 12.842 0.769 6.152 978 HA MET 137 HA MET 137 12.386 -0.962 3.798 979 HB2 MET 137 1HB MET 137 11.424 1.817 4.557 980 HB3 MET 137 2HB MET 137 11.033 1.037 3.031 981 HG2 MET 137 1HG MET 137 9.897 -0.781 4.238 982 HG3 MET 137 2HG MET 137 10.306 -0.022 5.778 983 HE1 MET 137 3HE MET 137 9.754 2.861 5.853 984 HE2 MET 137 1HE MET 137 7.993 2.971 6.085 985 HE3 MET 137 2HE MET 137 8.925 1.715 6.935 986 H LYS 138 H LYS 138 13.523 -1.000 2.037 987 HA LYS 138 HA LYS 138 15.781 0.915 1.822 988 HB2 LYS 138 1HB LYS 138 16.196 -1.537 1.631 989 HB3 LYS 138 2HB LYS 138 15.141 -1.596 0.225 990 HG2 LYS 138 1HG LYS 138 16.654 -0.202 -1.049 991 HG3 LYS 138 2HG LYS 138 17.665 0.075 0.377 992 HD2 LYS 138 1HD LYS 138 18.145 -2.365 0.487 993 HD3 LYS 138 2HD LYS 138 17.177 -2.605 -0.975 994 HE2 LYS 138 1HE LYS 138 18.697 -1.210 -2.270 995 HE3 LYS 138 2HE LYS 138 19.612 -0.794 -0.820 996 HZ1 LYS 138 3HZ LYS 138 19.364 -3.495 -1.966 997 HZ2 LYS 138 1HZ LYS 138 20.685 -2.514 -2.077 998 HZ3 LYS 138 2HZ LYS 138 20.218 -3.106 -0.609 999 H GLU 139 H GLU 139 12.949 -0.152 -0.027 1000 HA GLU 139 HA GLU 139 12.852 2.458 -1.359 1001 HB2 GLU 139 1HB GLU 139 14.481 1.227 -2.790 1002 HB3 GLU 139 2HB GLU 139 13.315 -0.071 -2.997 1003 HG2 GLU 139 1HG GLU 139 11.784 1.456 -4.143 1004 HG3 GLU 139 2HG GLU 139 12.907 2.791 -3.893 1005 H VAL 140 H VAL 140 10.854 3.056 -1.745 1006 HA VAL 140 HA VAL 140 8.801 0.913 -2.257 1007 HB VAL 140 HB VAL 140 8.416 3.515 -0.699 1008 HG11 VAL 140 1HG1 VAL 140 6.144 2.697 -0.313 1009 HG12 VAL 140 1HG2 VAL 140 6.480 2.936 -2.044 1010 HG13 VAL 140 1HG3 VAL 140 6.472 1.294 -1.357 1011 HG21 VAL 140 2HG3 VAL 140 9.624 1.807 0.616 1012 HG22 VAL 140 2HG1 VAL 140 7.970 2.033 1.231 1013 HG23 VAL 140 2HG2 VAL 140 8.360 0.615 0.230 1014 H LYS 141 H LYS 141 7.905 1.003 -4.117 1015 HA LYS 141 HA LYS 141 7.946 3.626 -5.570 1016 HB2 LYS 141 1HB LYS 141 9.820 2.162 -6.331 1017 HB3 LYS 141 2HB LYS 141 8.660 0.899 -6.719 1018 HG2 LYS 141 1HG LYS 141 7.632 2.311 -8.424 1019 HG3 LYS 141 2HG LYS 141 8.706 3.649 -7.993 1020 HD2 LYS 141 1HD LYS 141 10.668 2.279 -8.627 1021 HD3 LYS 141 2HD LYS 141 9.593 0.942 -9.059 1022 HE2 LYS 141 1HE LYS 141 8.544 2.304 -10.804 1023 HE3 LYS 141 2HE LYS 141 9.517 3.701 -10.336 1024 HZ1 LYS 141 3HZ LYS 141 10.572 1.163 -11.395 1025 HZ2 LYS 141 1HZ LYS 141 10.437 2.579 -12.230 1026 HZ3 LYS 141 2HZ LYS 141 11.481 2.468 -10.956 1027 H VAL 142 H VAL 142 6.148 4.222 -6.506 1028 HA VAL 142 HA VAL 142 4.053 2.118 -7.045 1029 HB VAL 142 HB VAL 142 3.699 5.074 -6.350 1030 HG11 VAL 142 1HG1 VAL 142 1.302 4.583 -6.371 1031 HG12 VAL 142 1HG2 VAL 142 2.052 4.310 -7.961 1032 HG13 VAL 142 1HG3 VAL 142 1.648 2.925 -6.919 1033 HG21 VAL 142 2HG3 VAL 142 4.313 3.698 -4.392 1034 HG22 VAL 142 2HG1 VAL 142 2.614 4.219 -4.297 1035 HG23 VAL 142 2HG2 VAL 142 3.008 2.553 -4.785 1036 H PHE 143 H PHE 143 3.050 2.036 -8.924 1037 HA PHE 143 HA PHE 143 3.767 4.016 -11.016 1038 HB2 PHE 143 1HB PHE 143 4.588 2.261 -12.539 1039 HB3 PHE 143 2HB PHE 143 5.614 2.383 -11.118 1040 HD1 PHE 143 2HD PHE 143 5.615 0.630 -9.414 1041 HD2 PHE 143 1HD PHE 143 3.240 0.304 -12.950 1042 HE1 PHE 143 2HE PHE 143 5.328 -1.790 -8.995 1043 HE2 PHE 143 1HE PHE 143 2.948 -2.116 -12.533 1044 HZ PHE 143 HZ PHE 143 3.993 -3.162 -10.555 1045 H ASP 144 H ASP 144 2.678 3.565 -13.082 1046 HA ASP 144 HA ASP 144 -0.074 2.548 -12.503 1047 HB2 ASP 144 1HB ASP 144 0.981 4.381 -14.700 1048 HB3 ASP 144 2HB ASP 144 -0.686 3.838 -14.565 1049 H GLU 145 H GLU 145 -1.173 1.209 -13.897 1050 HA GLU 145 HA GLU 145 0.559 -0.268 -15.853 1051 HB2 GLU 145 1HB GLU 145 0.184 -1.568 -13.728 1052 HB3 GLU 145 2HB GLU 145 -1.549 -1.473 -14.010 1053 HG2 GLU 145 1HG GLU 145 -1.192 -2.664 -16.189 1054 HG3 GLU 145 2HG GLU 145 0.500 -2.873 -15.739 1055 HA PRO 146 HA PRO 146 -2.809 0.714 -18.525 1056 HB2 PRO 146 1HB PRO 146 -1.722 -0.269 -20.817 1057 HB3 PRO 146 2HB PRO 146 -0.994 1.155 -20.060 1058 HG2 PRO 146 1HG PRO 146 -0.130 -1.761 -19.870 1059 HG3 PRO 146 2HG PRO 146 0.871 -0.344 -20.202 1060 HD2 PRO 146 1HD PRO 146 0.655 -1.422 -17.687 1061 HD3 PRO 146 2HD PRO 146 0.902 0.350 -17.961 Start of MODEL 3 1 H MET 1 1H MET 1 -3.873 2.702 -17.390 2 HA MET 1 HA MET 1 -4.411 0.102 -16.615 3 HB2 MET 1 1HB MET 1 -2.027 1.958 -16.286 4 HB3 MET 1 2HB MET 1 -1.996 0.244 -15.899 5 HG2 MET 1 1HG MET 1 -2.597 -0.250 -18.280 6 HG3 MET 1 2HG MET 1 -2.460 1.475 -18.628 7 HE1 MET 1 3HE MET 1 -0.051 2.584 -17.123 8 HE2 MET 1 1HE MET 1 1.294 2.235 -18.235 9 HE3 MET 1 2HE MET 1 -0.276 2.780 -18.878 10 H ALA 2 H ALA 2 -4.074 -0.940 -14.652 11 HA ALA 2 HA ALA 2 -5.168 0.528 -12.375 12 HB1 ALA 2 3HB ALA 2 -4.102 -2.310 -12.596 13 HB2 ALA 2 1HB ALA 2 -4.989 -1.637 -11.208 14 HB3 ALA 2 2HB ALA 2 -5.799 -1.811 -12.783 15 H LYS 3 H LYS 3 -4.213 0.967 -10.420 16 HA LYS 3 HA LYS 3 -1.293 1.453 -10.633 17 HB2 LYS 3 1HB LYS 3 -3.368 2.352 -8.595 18 HB3 LYS 3 2HB LYS 3 -1.664 2.780 -8.539 19 HG2 LYS 3 1HG LYS 3 -1.900 3.915 -10.740 20 HG3 LYS 3 2HG LYS 3 -3.627 3.536 -10.721 21 HD2 LYS 3 1HD LYS 3 -3.969 4.866 -8.727 22 HD3 LYS 3 2HD LYS 3 -2.227 5.102 -8.527 23 HE2 LYS 3 1HE LYS 3 -3.783 6.055 -10.955 24 HE3 LYS 3 2HE LYS 3 -3.464 7.062 -9.540 25 HZ1 LYS 3 3HZ LYS 3 -1.414 5.825 -11.254 26 HZ2 LYS 3 1HZ LYS 3 -1.848 7.417 -11.258 27 HZ3 LYS 3 2HZ LYS 3 -1.115 6.765 -9.932 28 H LYS 4 H LYS 4 0.252 0.555 -9.455 29 HA LYS 4 HA LYS 4 -0.461 -0.943 -7.005 30 HB2 LYS 4 1HB LYS 4 0.666 -2.977 -7.670 31 HB3 LYS 4 2HB LYS 4 -0.598 -2.633 -8.842 32 HG2 LYS 4 1HG LYS 4 1.089 -1.718 -10.396 33 HG3 LYS 4 2HG LYS 4 2.359 -2.077 -9.218 34 HD2 LYS 4 1HD LYS 4 1.764 -4.481 -9.313 35 HD3 LYS 4 2HD LYS 4 0.504 -4.117 -10.502 36 HE2 LYS 4 1HE LYS 4 2.194 -3.279 -12.074 37 HE3 LYS 4 2HE LYS 4 3.468 -3.549 -10.882 38 HZ1 LYS 4 3HZ LYS 4 1.775 -5.640 -12.077 39 HZ2 LYS 4 1HZ LYS 4 3.347 -5.329 -12.465 40 HZ3 LYS 4 2HZ LYS 4 2.964 -5.894 -10.963 41 H GLY 5 H GLY 5 1.508 -1.734 -5.868 42 HA2 GLY 5 1HA GLY 5 3.841 0.050 -6.372 43 HA3 GLY 5 2HA GLY 5 3.032 0.094 -4.788 44 H TYR 6 H TYR 6 5.710 -0.522 -4.965 45 HA TYR 6 HA TYR 6 5.693 -3.353 -4.032 46 HB2 TYR 6 1HB TYR 6 6.463 -3.538 -6.327 47 HB3 TYR 6 2HB TYR 6 7.579 -2.196 -6.114 48 HD1 TYR 6 1HD TYR 6 6.817 -5.599 -4.760 49 HD2 TYR 6 2HD TYR 6 9.787 -2.603 -5.543 50 HE1 TYR 6 1HE TYR 6 8.593 -7.182 -4.087 51 HE2 TYR 6 2HE TYR 6 11.562 -4.185 -4.870 52 HH TYR 6 HH TYR 6 10.836 -7.551 -4.117 53 H ILE 7 H ILE 7 6.381 -3.405 -2.057 54 HA ILE 7 HA ILE 7 8.332 -1.355 -1.108 55 HB ILE 7 HB ILE 7 6.739 -3.533 0.333 56 HG12 ILE 7 1HG1 ILE 7 6.512 -0.523 0.525 57 HG13 ILE 7 1HG2 ILE 7 5.476 -1.530 -0.474 58 HG21 ILE 7 2HG1 ILE 7 7.635 -2.559 2.409 59 HG22 ILE 7 2HG2 ILE 7 8.943 -3.201 1.388 60 HG23 ILE 7 2HG3 ILE 7 8.648 -1.448 1.455 61 HD11 ILE 7 1HD3 ILE 7 5.749 -1.715 2.534 62 HD12 ILE 7 1HD1 ILE 7 4.398 -0.987 1.636 63 HD13 ILE 7 1HD2 ILE 7 4.701 -2.737 1.522 64 H LEU 8 H LEU 8 10.380 -1.617 -1.115 65 HA LEU 8 HA LEU 8 11.429 -4.412 -0.843 66 HB2 LEU 8 1HB LEU 8 12.168 -3.252 -2.898 67 HB3 LEU 8 2HB LEU 8 12.752 -1.892 -1.934 68 HG LEU 8 HG LEU 8 14.422 -3.429 -0.868 69 HD11 LEU 8 1HD1 LEU 8 14.823 -5.610 -1.922 70 HD12 LEU 8 1HD2 LEU 8 13.204 -5.521 -1.189 71 HD13 LEU 8 1HD3 LEU 8 13.392 -5.375 -2.952 72 HD21 LEU 8 2HD3 LEU 8 14.995 -1.991 -2.796 73 HD22 LEU 8 2HD1 LEU 8 15.876 -3.536 -2.865 74 HD23 LEU 8 2HD2 LEU 8 14.460 -3.271 -3.911 75 H MET 9 H MET 9 12.165 -4.990 1.024 76 HA MET 9 HA MET 9 12.749 -2.904 3.057 77 HB2 MET 9 1HB MET 9 12.671 -5.929 3.337 78 HB3 MET 9 2HB MET 9 12.738 -4.754 4.643 79 HG2 MET 9 1HG MET 9 10.438 -5.082 2.696 80 HG3 MET 9 2HG MET 9 10.492 -5.703 4.347 81 HE1 MET 9 3HE MET 9 11.763 -3.499 6.095 82 HE2 MET 9 1HE MET 9 10.345 -2.520 6.541 83 HE3 MET 9 2HE MET 9 10.220 -4.295 6.492 84 H GLU 10 H GLU 10 14.616 -2.879 4.326 85 HA GLU 10 HA GLU 10 17.038 -3.056 2.812 86 HB2 GLU 10 1HB GLU 10 16.486 -2.805 5.792 87 HB3 GLU 10 2HB GLU 10 18.114 -2.807 5.130 88 HG2 GLU 10 1HG GLU 10 15.984 -0.839 4.279 89 HG3 GLU 10 2HG GLU 10 17.103 -0.552 5.610 90 H ASN 11 H ASN 11 15.344 -5.396 4.750 91 HA ASN 11 HA ASN 11 17.732 -7.172 4.834 92 HB2 ASN 11 1HB ASN 11 14.973 -7.365 6.070 93 HB3 ASN 11 2HB ASN 11 16.174 -8.647 6.156 94 HD21 ASN 11 2HD2 ASN 11 14.958 -5.937 7.658 95 HD22 ASN 11 2HD1 ASN 11 16.267 -5.620 8.748 96 H GLY 12 H GLY 12 15.906 -6.411 2.420 97 HA2 GLY 12 1HA GLY 12 15.920 -7.583 0.380 98 HA3 GLY 12 2HA GLY 12 16.275 -9.090 1.256 99 H GLY 13 H GLY 13 13.758 -7.308 2.680 100 HA2 GLY 13 1HA GLY 13 11.783 -9.314 2.144 101 HA3 GLY 13 2HA GLY 13 11.490 -7.717 2.870 102 H LYS 14 H LYS 14 10.156 -9.451 0.691 103 HA LYS 14 HA LYS 14 10.038 -7.314 -1.414 104 HB2 LYS 14 1HB LYS 14 9.909 -10.328 -1.830 105 HB3 LYS 14 2HB LYS 14 9.703 -9.109 -3.081 106 HG2 LYS 14 1HG LYS 14 12.055 -8.322 -2.576 107 HG3 LYS 14 2HG LYS 14 12.225 -9.738 -1.529 108 HD2 LYS 14 1HD LYS 14 11.700 -11.217 -3.445 109 HD3 LYS 14 2HD LYS 14 11.539 -9.798 -4.492 110 HE2 LYS 14 1HE LYS 14 13.894 -9.203 -4.066 111 HE3 LYS 14 2HE LYS 14 14.062 -10.593 -2.991 112 HZ1 LYS 14 3HZ LYS 14 13.436 -10.725 -5.865 113 HZ2 LYS 14 1HZ LYS 14 14.895 -11.063 -5.175 114 HZ3 LYS 14 2HZ LYS 14 13.591 -12.023 -4.860 115 H ILE 15 H ILE 15 8.231 -6.307 -0.775 116 HA ILE 15 HA ILE 15 5.757 -8.004 -0.520 117 HB ILE 15 HB ILE 15 6.423 -5.338 0.828 118 HG12 ILE 15 1HG1 ILE 15 6.033 -8.032 2.141 119 HG13 ILE 15 1HG2 ILE 15 7.611 -7.389 1.713 120 HG21 ILE 15 2HG1 ILE 15 4.286 -5.666 2.005 121 HG22 ILE 15 2HG2 ILE 15 4.038 -5.562 0.248 122 HG23 ILE 15 2HG3 ILE 15 3.988 -7.144 1.059 123 HD11 ILE 15 1HD3 ILE 15 5.625 -6.092 3.593 124 HD12 ILE 15 1HD1 ILE 15 7.100 -6.973 4.053 125 HD13 ILE 15 1HD2 ILE 15 7.222 -5.439 3.157 126 H GLU 16 H GLU 16 4.755 -7.976 -2.349 127 HA GLU 16 HA GLU 16 4.525 -5.359 -3.785 128 HB2 GLU 16 1HB GLU 16 5.468 -7.350 -5.028 129 HB3 GLU 16 2HB GLU 16 3.932 -8.173 -4.791 130 HG2 GLU 16 1HG GLU 16 2.780 -6.441 -6.080 131 HG3 GLU 16 2HG GLU 16 4.295 -5.565 -6.282 132 H PHE 17 H PHE 17 2.654 -4.387 -4.173 133 HA PHE 17 HA PHE 17 0.146 -5.692 -3.249 134 HB2 PHE 17 1HB PHE 17 -0.383 -3.897 -1.711 135 HB3 PHE 17 2HB PHE 17 1.167 -4.577 -1.244 136 HD1 PHE 17 2HD PHE 17 3.270 -3.349 -1.762 137 HD2 PHE 17 1HD PHE 17 -0.589 -1.633 -2.404 138 HE1 PHE 17 2HE PHE 17 4.290 -1.099 -1.857 139 HE2 PHE 17 1HE PHE 17 0.428 0.619 -2.502 140 HZ PHE 17 HZ PHE 17 2.867 0.886 -2.228 141 H GLU 18 H GLU 18 -1.771 -4.540 -3.782 142 HA GLU 18 HA GLU 18 -1.382 -2.842 -6.219 143 HB2 GLU 18 1HB GLU 18 -3.758 -4.501 -5.275 144 HB3 GLU 18 2HB GLU 18 -3.777 -3.455 -6.688 145 HG2 GLU 18 1HG GLU 18 -1.974 -4.811 -7.700 146 HG3 GLU 18 2HG GLU 18 -2.003 -5.874 -6.295 147 H LEU 19 H LEU 19 -2.784 -1.073 -6.600 148 HA LEU 19 HA LEU 19 -3.660 0.232 -4.047 149 HB2 LEU 19 1HB LEU 19 -2.749 1.398 -6.708 150 HB3 LEU 19 2HB LEU 19 -3.460 2.358 -5.407 151 HG LEU 19 HG LEU 19 -0.892 0.760 -5.129 152 HD11 LEU 19 1HD1 LEU 19 0.241 2.927 -5.338 153 HD12 LEU 19 1HD2 LEU 19 -0.648 2.504 -6.820 154 HD13 LEU 19 1HD3 LEU 19 -1.318 3.708 -5.693 155 HD21 LEU 19 2HD3 LEU 19 -2.118 1.197 -3.027 156 HD22 LEU 19 2HD1 LEU 19 -0.621 2.158 -3.109 157 HD23 LEU 19 2HD2 LEU 19 -2.193 2.929 -3.432 158 H PHE 20 H PHE 20 -5.583 1.325 -3.921 159 HA PHE 20 HA PHE 20 -7.536 0.741 -6.115 160 HB2 PHE 20 1HB PHE 20 -8.032 0.333 -3.135 161 HB3 PHE 20 2HB PHE 20 -9.206 0.102 -4.421 162 HD1 PHE 20 2HD PHE 20 -8.733 -1.698 -6.171 163 HD2 PHE 20 1HD PHE 20 -6.616 -1.404 -2.472 164 HE1 PHE 20 2HE PHE 20 -8.035 -4.060 -6.385 165 HE2 PHE 20 1HE PHE 20 -5.913 -3.765 -2.684 166 HZ PHE 20 HZ PHE 20 -6.623 -5.093 -4.642 167 HA PRO 21 HA PRO 21 -7.822 5.161 -4.945 168 HB2 PRO 21 1HB PRO 21 -8.294 5.982 -7.544 169 HB3 PRO 21 2HB PRO 21 -6.648 5.743 -6.946 170 HG2 PRO 21 1HG PRO 21 -8.396 3.830 -8.551 171 HG3 PRO 21 2HG PRO 21 -6.712 4.277 -8.842 172 HD2 PRO 21 1HD PRO 21 -7.302 1.973 -7.564 173 HD3 PRO 21 2HD PRO 21 -5.898 2.980 -7.028 174 H ASN 22 H ASN 22 -9.807 2.796 -6.455 175 HA ASN 22 HA ASN 22 -12.255 4.339 -6.475 176 HB2 ASN 22 1HB ASN 22 -11.681 1.372 -6.329 177 HB3 ASN 22 2HB ASN 22 -13.311 2.032 -6.344 178 HD21 ASN 22 2HD2 ASN 22 -12.259 0.301 -8.294 179 HD22 ASN 22 2HD1 ASN 22 -12.203 1.153 -9.800 180 H GLU 23 H GLU 23 -10.458 2.665 -3.978 181 HA GLU 23 HA GLU 23 -12.634 2.885 -2.017 182 HB2 GLU 23 1HB GLU 23 -9.672 2.218 -1.759 183 HB3 GLU 23 2HB GLU 23 -10.793 2.231 -0.407 184 HG2 GLU 23 1HG GLU 23 -12.065 0.419 -1.349 185 HG3 GLU 23 2HG GLU 23 -11.147 0.489 -2.851 186 H ALA 24 H ALA 24 -9.733 4.711 -2.881 187 HA ALA 24 HA ALA 24 -10.870 7.103 -1.707 188 HB1 ALA 24 3HB ALA 24 -8.426 5.885 -0.373 189 HB2 ALA 24 1HB ALA 24 -9.086 7.504 -0.050 190 HB3 ALA 24 2HB ALA 24 -10.040 6.056 0.356 191 HA PRO 25 HA PRO 25 -8.232 7.955 -5.327 192 HB2 PRO 25 1HB PRO 25 -9.939 10.458 -4.981 193 HB3 PRO 25 2HB PRO 25 -9.553 9.593 -6.474 194 HG2 PRO 25 1HG PRO 25 -11.987 9.297 -5.449 195 HG3 PRO 25 2HG PRO 25 -11.143 7.869 -6.055 196 HD2 PRO 25 1HD PRO 25 -11.480 8.826 -3.186 197 HD3 PRO 25 2HD PRO 25 -11.590 7.146 -3.848 198 H VAL 26 H VAL 26 -9.133 10.211 -2.711 199 HA VAL 26 HA VAL 26 -6.802 11.898 -3.084 200 HB VAL 26 HB VAL 26 -8.597 11.423 -0.655 201 HG11 VAL 26 1HG1 VAL 26 -7.712 13.540 0.193 202 HG12 VAL 26 1HG2 VAL 26 -6.440 12.308 0.020 203 HG13 VAL 26 1HG3 VAL 26 -6.581 13.617 -1.180 204 HG21 VAL 26 2HG3 VAL 26 -9.791 12.315 -2.625 205 HG22 VAL 26 2HG1 VAL 26 -9.656 13.549 -1.349 206 HG23 VAL 26 2HG2 VAL 26 -8.585 13.615 -2.769 207 H THR 27 H THR 27 -7.442 9.138 -0.945 208 HA THR 27 HA THR 27 -4.989 9.426 0.534 209 HB THR 27 HB THR 27 -6.705 6.947 0.062 210 HG1 THR 27 1HG THR 27 -6.671 8.863 2.185 211 HG21 THR 27 2HG3 THR 27 -4.616 7.566 2.185 212 HG22 THR 27 2HG1 THR 27 -5.636 6.110 2.118 213 HG23 THR 27 2HG2 THR 27 -4.425 6.409 0.847 214 H VAL 28 H VAL 28 -5.855 7.340 -2.227 215 HA VAL 28 HA VAL 28 -3.234 6.130 -2.468 216 HB VAL 28 HB VAL 28 -5.459 6.599 -4.512 217 HG11 VAL 28 1HG1 VAL 28 -4.348 4.892 -5.867 218 HG12 VAL 28 1HG2 VAL 28 -3.322 6.327 -5.629 219 HG13 VAL 28 1HG3 VAL 28 -3.004 4.841 -4.701 220 HG21 VAL 28 2HG3 VAL 28 -6.106 5.158 -2.612 221 HG22 VAL 28 2HG1 VAL 28 -5.960 4.209 -4.109 222 HG23 VAL 28 2HG2 VAL 28 -4.668 4.146 -2.887 223 H ALA 29 H ALA 29 -4.669 9.019 -3.940 224 HA ALA 29 HA ALA 29 -2.472 9.652 -5.622 225 HB1 ALA 29 3HB ALA 29 -4.371 11.523 -4.164 226 HB2 ALA 29 1HB ALA 29 -3.324 11.965 -5.531 227 HB3 ALA 29 2HB ALA 29 -4.643 10.793 -5.764 228 H ASN 30 H ASN 30 -3.125 10.642 -2.254 229 HA ASN 30 HA ASN 30 -0.718 12.171 -1.938 230 HB2 ASN 30 1HB ASN 30 -2.675 10.873 -0.066 231 HB3 ASN 30 2HB ASN 30 -1.157 11.500 0.563 232 HD21 ASN 30 2HD2 ASN 30 -4.305 12.237 -0.014 233 HD22 ASN 30 2HD1 ASN 30 -4.196 13.964 -0.078 234 H PHE 31 H PHE 31 -1.439 8.748 -1.293 235 HA PHE 31 HA PHE 31 1.078 8.034 -0.185 236 HB2 PHE 31 1HB PHE 31 -0.886 6.518 -0.233 237 HB3 PHE 31 2HB PHE 31 -0.773 6.409 -1.983 238 HD1 PHE 31 1HD PHE 31 0.865 5.508 1.198 239 HD2 PHE 31 2HD PHE 31 0.826 4.990 -3.043 240 HE1 PHE 31 1HE PHE 31 2.406 3.588 1.419 241 HE2 PHE 31 2HE PHE 31 2.365 3.068 -2.825 242 HZ PHE 31 HZ PHE 31 3.156 2.367 -0.592 243 H GLU 32 H GLU 32 0.039 7.986 -3.603 244 HA GLU 32 HA GLU 32 2.556 7.090 -4.634 245 HB2 GLU 32 1HB GLU 32 0.389 7.096 -5.906 246 HB3 GLU 32 2HB GLU 32 0.463 8.851 -5.981 247 HG2 GLU 32 1HG GLU 32 2.574 8.703 -7.252 248 HG3 GLU 32 2HG GLU 32 2.478 6.944 -7.191 249 H LYS 33 H LYS 33 1.262 10.375 -4.163 250 HA LYS 33 HA LYS 33 3.502 11.731 -5.329 251 HB2 LYS 33 1HB LYS 33 1.463 12.586 -3.243 252 HB3 LYS 33 2HB LYS 33 2.682 13.671 -3.898 253 HG2 LYS 33 1HG LYS 33 1.759 13.375 -6.156 254 HG3 LYS 33 2HG LYS 33 0.550 12.250 -5.521 255 HD2 LYS 33 1HD LYS 33 -0.346 14.046 -4.063 256 HD3 LYS 33 2HD LYS 33 0.853 15.169 -4.722 257 HE2 LYS 33 1HE LYS 33 -0.100 14.848 -6.987 258 HE3 LYS 33 2HE LYS 33 -1.306 13.743 -6.321 259 HZ1 LYS 33 3HZ LYS 33 -1.012 16.584 -5.604 260 HZ2 LYS 33 1HZ LYS 33 -2.178 15.947 -6.581 261 HZ3 LYS 33 2HZ LYS 33 -2.137 15.551 -4.981 262 H LEU 34 H LEU 34 2.823 10.783 -1.965 263 HA LEU 34 HA LEU 34 5.178 11.914 -0.822 264 HB2 LEU 34 1HB LEU 34 3.490 9.496 -0.083 265 HB3 LEU 34 2HB LEU 34 4.856 10.038 0.896 266 HG LEU 34 HG LEU 34 2.441 11.769 0.266 267 HD11 LEU 34 1HD1 LEU 34 1.707 11.236 2.547 268 HD12 LEU 34 1HD2 LEU 34 1.767 9.785 1.520 269 HD13 LEU 34 1HD3 LEU 34 3.055 10.086 2.712 270 HD21 LEU 34 2HD3 LEU 34 4.523 12.976 0.832 271 HD22 LEU 34 2HD1 LEU 34 3.326 13.112 2.142 272 HD23 LEU 34 2HD2 LEU 34 4.696 11.988 2.301 273 H ALA 35 H ALA 35 4.615 8.678 -2.202 274 HA ALA 35 HA ALA 35 7.234 7.681 -1.709 275 HB1 ALA 35 3HB ALA 35 5.316 7.023 -3.974 276 HB2 ALA 35 1HB ALA 35 6.729 6.054 -3.495 277 HB3 ALA 35 2HB ALA 35 5.357 6.242 -2.376 278 H ASN 36 H ASN 36 5.906 9.455 -4.494 279 HA ASN 36 HA ASN 36 8.354 9.433 -6.020 280 HB2 ASN 36 1HB ASN 36 5.912 11.217 -6.055 281 HB3 ASN 36 2HB ASN 36 7.274 11.445 -7.144 282 HD21 ASN 36 2HD2 ASN 36 4.647 10.873 -7.960 283 HD22 ASN 36 2HD1 ASN 36 4.646 9.325 -8.737 284 H GLU 37 H GLU 37 7.180 11.425 -3.393 285 HA GLU 37 HA GLU 37 9.327 13.416 -3.769 286 HB2 GLU 37 1HB GLU 37 7.160 13.021 -1.672 287 HB3 GLU 37 2HB GLU 37 8.398 14.262 -1.535 288 HG2 GLU 37 1HG GLU 37 7.628 15.351 -3.539 289 HG3 GLU 37 2HG GLU 37 6.512 14.033 -3.886 290 H GLY 38 H GLY 38 9.121 10.332 -2.461 291 HA2 GLY 38 1HA GLY 38 11.181 9.244 -1.923 292 HA3 GLY 38 2HA GLY 38 11.840 10.796 -1.355 293 H PHE 39 H PHE 39 8.708 10.519 -0.249 294 HA PHE 39 HA PHE 39 9.568 10.283 2.503 295 HB2 PHE 39 1HB PHE 39 6.883 10.382 1.101 296 HB3 PHE 39 2HB PHE 39 6.978 10.028 2.819 297 HD1 PHE 39 2HD PHE 39 7.877 11.712 4.394 298 HD2 PHE 39 1HD PHE 39 7.261 12.583 0.257 299 HE1 PHE 39 2HE PHE 39 7.990 14.133 4.889 300 HE2 PHE 39 1HE PHE 39 7.376 15.004 0.748 301 HZ PHE 39 HZ PHE 39 7.740 15.778 3.064 302 H TYR 40 H TYR 40 8.345 8.003 0.137 303 HA TYR 40 HA TYR 40 8.384 5.866 2.234 304 HB2 TYR 40 1HB TYR 40 7.132 6.040 -0.524 305 HB3 TYR 40 2HB TYR 40 7.339 4.507 0.311 306 HD1 TYR 40 2HD TYR 40 6.205 4.134 2.521 307 HD2 TYR 40 1HD TYR 40 5.384 7.533 0.035 308 HE1 TYR 40 2HE TYR 40 4.087 4.510 3.737 309 HE2 TYR 40 1HE TYR 40 3.265 7.909 1.251 310 HH TYR 40 HH TYR 40 2.532 6.372 4.190 311 H ASN 41 H ASN 41 10.776 7.156 1.052 312 HA ASN 41 HA ASN 41 12.019 4.595 0.091 313 HB2 ASN 41 1HB ASN 41 12.651 7.463 -0.630 314 HB3 ASN 41 2HB ASN 41 13.787 6.145 -0.889 315 HD21 ASN 41 2HD2 ASN 41 12.558 7.840 -2.862 316 HD22 ASN 41 2HD1 ASN 41 11.654 6.807 -3.919 317 H GLY 42 H GLY 42 11.664 4.827 2.736 318 HA2 GLY 42 1HA GLY 42 13.920 4.112 3.943 319 HA3 GLY 42 2HA GLY 42 14.202 5.866 3.861 320 H LEU 43 H LEU 43 11.480 3.668 4.676 321 HA LEU 43 HA LEU 43 11.109 5.255 7.194 322 HB2 LEU 43 1HB LEU 43 9.052 3.635 5.640 323 HB3 LEU 43 2HB LEU 43 8.751 4.553 7.119 324 HG LEU 43 HG LEU 43 9.554 5.768 4.450 325 HD11 LEU 43 1HD1 LEU 43 7.220 6.522 4.361 326 HD12 LEU 43 1HD2 LEU 43 7.337 4.747 4.367 327 HD13 LEU 43 1HD3 LEU 43 6.868 5.614 5.849 328 HD21 LEU 43 2HD3 LEU 43 10.274 7.069 6.426 329 HD22 LEU 43 2HD1 LEU 43 8.945 7.886 5.568 330 HD23 LEU 43 2HD2 LEU 43 8.618 6.998 7.076 331 H THR 44 H THR 44 10.311 4.112 9.044 332 HA THR 44 HA THR 44 11.333 1.289 9.093 333 HB THR 44 HB THR 44 11.227 3.300 11.385 334 HG1 THR 44 1HG THR 44 13.531 3.238 11.125 335 HG21 THR 44 2HG3 THR 44 12.441 0.519 11.175 336 HG22 THR 44 2HG1 THR 44 12.553 1.603 12.582 337 HG23 THR 44 2HG2 THR 44 10.975 0.945 12.088 338 H PHE 45 H PHE 45 10.216 -0.285 10.129 339 HA PHE 45 HA PHE 45 7.377 0.366 10.785 340 HB2 PHE 45 1HB PHE 45 8.862 -2.244 10.292 341 HB3 PHE 45 2HB PHE 45 7.222 -2.188 10.917 342 HD1 PHE 45 1HD PHE 45 9.326 -1.136 8.036 343 HD2 PHE 45 2HD PHE 45 5.394 -1.982 9.475 344 HE1 PHE 45 1HE PHE 45 8.454 -0.997 5.727 345 HE2 PHE 45 2HE PHE 45 4.518 -1.846 7.167 346 HZ PHE 45 HZ PHE 45 6.048 -1.352 5.293 347 H HIS 46 H HIS 46 7.243 1.190 12.761 348 HA HIS 46 HA HIS 46 9.148 0.426 14.833 349 HB2 HIS 46 1HB HIS 46 8.115 2.744 14.542 350 HB3 HIS 46 2HB HIS 46 6.601 2.069 15.128 351 HD2 HIS 46 2HD HIS 46 6.408 1.895 17.994 352 HE1 HIS 46 1HE HIS 46 10.450 3.008 18.681 353 H ARG 47 H ARG 47 5.735 -0.263 14.166 354 HA ARG 47 HA ARG 47 5.723 -2.025 16.598 355 HB2 ARG 47 1HB ARG 47 3.440 -0.377 15.440 356 HB3 ARG 47 2HB ARG 47 3.315 -1.478 16.804 357 HG2 ARG 47 1HG ARG 47 4.897 -0.057 18.074 358 HG3 ARG 47 2HG ARG 47 4.937 1.076 16.702 359 HD2 ARG 47 1HD ARG 47 2.530 1.392 16.913 360 HD3 ARG 47 2HD ARG 47 2.516 0.286 18.305 361 HE ARG 47 HE ARG 47 3.526 1.915 19.618 362 HH11 ARG 47 1HH1 ARG 47 3.304 2.972 16.276 363 HH12 ARG 47 1HH2 ARG 47 3.670 4.641 16.648 364 HH21 ARG 47 2HH1 ARG 47 4.002 4.085 20.089 365 HH22 ARG 47 2HH2 ARG 47 4.066 5.272 18.806 366 H VAL 48 H VAL 48 6.455 -3.709 15.176 367 HA VAL 48 HA VAL 48 4.374 -4.764 13.301 368 HB VAL 48 HB VAL 48 7.158 -5.789 14.044 369 HG11 VAL 48 1HG1 VAL 48 6.905 -7.263 12.107 370 HG12 VAL 48 1HG2 VAL 48 5.674 -7.581 13.351 371 HG13 VAL 48 1HG3 VAL 48 5.241 -6.678 11.879 372 HG21 VAL 48 2HG3 VAL 48 7.226 -3.638 12.829 373 HG22 VAL 48 2HG1 VAL 48 7.802 -4.969 11.798 374 HG23 VAL 48 2HG2 VAL 48 6.163 -4.312 11.570 375 H ILE 49 H ILE 49 2.883 -6.076 13.843 376 HA ILE 49 HA ILE 49 3.347 -7.852 16.230 377 HB ILE 49 HB ILE 49 0.703 -6.658 15.254 378 HG12 ILE 49 1HG1 ILE 49 2.245 -5.961 17.761 379 HG13 ILE 49 1HG2 ILE 49 2.263 -4.997 16.292 380 HG21 ILE 49 2HG1 ILE 49 -0.203 -7.620 17.331 381 HG22 ILE 49 2HG2 ILE 49 0.486 -8.885 16.288 382 HG23 ILE 49 2HG3 ILE 49 1.391 -8.314 17.710 383 HD11 ILE 49 1HD3 ILE 49 -0.184 -5.642 17.954 384 HD12 ILE 49 1HD1 ILE 49 0.693 -4.094 17.916 385 HD13 ILE 49 1HD2 ILE 49 -0.166 -4.667 16.465 386 HA PRO 50 HA PRO 50 3.178 -10.735 12.801 387 HB2 PRO 50 1HB PRO 50 3.876 -12.465 15.218 388 HB3 PRO 50 2HB PRO 50 4.600 -12.493 13.604 389 HG2 PRO 50 1HG PRO 50 5.969 -11.348 15.576 390 HG3 PRO 50 2HG PRO 50 5.911 -10.545 14.003 391 HD2 PRO 50 1HD PRO 50 4.335 -9.934 16.530 392 HD3 PRO 50 2HD PRO 50 5.082 -8.790 15.344 393 H GLY 51 H GLY 51 1.408 -11.526 12.094 394 HA2 GLY 51 1HA GLY 51 -0.264 -13.229 12.155 395 HA3 GLY 51 2HA GLY 51 -0.215 -13.199 13.934 396 H PHE 52 H PHE 52 -0.157 -10.058 13.277 397 HA PHE 52 HA PHE 52 -3.141 -9.811 13.061 398 HB2 PHE 52 1HB PHE 52 -1.232 -8.368 14.946 399 HB3 PHE 52 2HB PHE 52 -2.889 -7.859 14.661 400 HD1 PHE 52 1HD PHE 52 -0.756 -10.488 16.105 401 HD2 PHE 52 2HD PHE 52 -4.745 -9.041 15.612 402 HE1 PHE 52 1HE PHE 52 -1.534 -12.038 17.867 403 HE2 PHE 52 2HE PHE 52 -5.526 -10.587 17.376 404 HZ PHE 52 HZ PHE 52 -3.919 -12.088 18.502 405 H VAL 53 H VAL 53 -0.227 -7.723 13.103 406 HA VAL 53 HA VAL 53 -0.717 -6.547 10.507 407 HB VAL 53 HB VAL 53 -2.736 -5.670 11.792 408 HG11 VAL 53 1HG1 VAL 53 -2.356 -3.987 13.528 409 HG12 VAL 53 1HG2 VAL 53 -1.735 -5.586 14.002 410 HG13 VAL 53 1HG3 VAL 53 -0.609 -4.317 13.464 411 HG21 VAL 53 2HG3 VAL 53 -1.758 -4.429 9.893 412 HG22 VAL 53 2HG1 VAL 53 -2.362 -3.313 11.139 413 HG23 VAL 53 2HG2 VAL 53 -0.616 -3.631 11.000 414 H SER 54 H SER 54 0.941 -5.456 9.805 415 HA SER 54 HA SER 54 3.144 -4.733 11.724 416 HB2 SER 54 1HB SER 54 3.085 -4.830 8.756 417 HB3 SER 54 2HB SER 54 4.438 -4.341 9.764 418 HG SER 54 HG SER 54 4.783 -6.398 9.526 419 H GLN 55 H GLN 55 2.608 -2.807 12.690 420 HA GLN 55 HA GLN 55 1.680 -0.556 10.988 421 HB2 GLN 55 1HB GLN 55 0.617 -0.866 13.204 422 HB3 GLN 55 2HB GLN 55 2.187 -0.755 13.988 423 HG2 GLN 55 1HG GLN 55 2.425 1.560 13.203 424 HG3 GLN 55 2HG GLN 55 0.822 1.445 12.422 425 HE21 GLN 55 2HE2 GLN 55 0.965 3.461 14.071 426 HE22 GLN 55 2HE1 GLN 55 0.209 3.140 15.596 427 H GLY 56 H GLY 56 2.974 0.789 10.041 428 HA2 GLY 56 1HA GLY 56 5.469 1.687 11.194 429 HA3 GLY 56 2HA GLY 56 5.735 0.461 9.935 430 H GLY 57 H GLY 57 6.869 2.694 9.295 431 HA2 GLY 57 1HA GLY 57 6.594 3.791 7.065 432 HA3 GLY 57 2HA GLY 57 4.930 4.181 7.561 433 H CYS 58 H CYS 58 7.517 4.308 9.895 434 HA CYS 58 HA CYS 58 7.151 7.284 10.166 435 HB2 CYS 58 1HB CYS 58 6.728 5.950 12.105 436 HB3 CYS 58 2HB CYS 58 8.366 5.314 12.041 437 HG CYS 58 HG CYS 58 8.017 7.084 13.944 438 HA PRO 59 HA PRO 59 11.231 7.651 8.349 439 HB2 PRO 59 1HB PRO 59 11.347 10.380 8.380 440 HB3 PRO 59 2HB PRO 59 10.250 9.565 7.259 441 HG2 PRO 59 1HG PRO 59 9.634 10.797 9.978 442 HG3 PRO 59 2HG PRO 59 8.764 11.014 8.458 443 HD2 PRO 59 1HD PRO 59 7.927 9.219 10.337 444 HD3 PRO 59 2HD PRO 59 7.732 8.901 8.567 445 H ARG 60 H ARG 60 10.184 8.565 11.480 446 HA ARG 60 HA ARG 60 12.986 9.188 12.302 447 HB2 ARG 60 1HB ARG 60 10.417 9.335 13.923 448 HB3 ARG 60 2HB ARG 60 11.996 9.940 14.401 449 HG2 ARG 60 1HG ARG 60 11.916 11.647 12.672 450 HG3 ARG 60 2HG ARG 60 10.369 10.997 12.075 451 HD2 ARG 60 1HD ARG 60 9.512 11.385 14.440 452 HD3 ARG 60 2HD ARG 60 10.965 12.388 14.658 453 HE ARG 60 HE ARG 60 9.616 13.131 12.264 454 HH11 ARG 60 1HH1 ARG 60 9.336 13.345 15.760 455 HH12 ARG 60 1HH2 ARG 60 8.409 14.828 15.720 456 HH21 ARG 60 2HH1 ARG 60 8.413 15.056 12.226 457 HH22 ARG 60 2HH2 ARG 60 7.886 15.797 13.720 458 H GLY 61 H GLY 61 10.577 6.709 12.423 459 HA2 GLY 61 1HA GLY 61 10.787 4.512 13.160 460 HA3 GLY 61 2HA GLY 61 12.468 4.860 13.630 461 H ASN 62 H ASN 62 10.103 7.050 14.824 462 HA ASN 62 HA ASN 62 10.582 5.962 17.567 463 HB2 ASN 62 1HB ASN 62 9.774 8.707 16.571 464 HB3 ASN 62 2HB ASN 62 9.794 8.249 18.269 465 HD21 ASN 62 2HD2 ASN 62 11.344 10.287 16.920 466 HD22 ASN 62 2HD1 ASN 62 13.010 9.884 17.165 467 H GLY 63 H GLY 63 8.300 5.748 15.213 468 HA2 GLY 63 1HA GLY 63 6.312 4.471 15.589 469 HA3 GLY 63 2HA GLY 63 6.270 5.054 17.269 470 H THR 64 H THR 64 7.032 7.733 15.616 471 HA THR 64 HA THR 64 4.163 8.463 15.113 472 HB THR 64 HB THR 64 6.436 10.249 16.092 473 HG1 THR 64 1HG THR 64 5.116 10.304 18.000 474 HG21 THR 64 2HG3 THR 64 3.485 10.821 15.622 475 HG22 THR 64 2HG1 THR 64 4.670 11.952 16.317 476 HG23 THR 64 2HG2 THR 64 4.830 11.421 14.625 477 H GLY 65 H GLY 65 3.849 8.333 13.021 478 HA2 GLY 65 1HA GLY 65 5.930 8.786 11.078 479 HA3 GLY 65 2HA GLY 65 4.193 8.589 10.745 480 H ASP 66 H ASP 66 6.005 10.422 9.453 481 HA ASP 66 HA ASP 66 4.539 12.944 10.001 482 HB2 ASP 66 1HB ASP 66 6.648 13.033 11.375 483 HB3 ASP 66 2HB ASP 66 7.583 12.804 9.904 484 H ALA 67 H ALA 67 3.503 12.937 8.113 485 HA ALA 67 HA ALA 67 4.955 12.492 5.610 486 HB1 ALA 67 3HB ALA 67 2.130 13.482 6.132 487 HB2 ALA 67 1HB ALA 67 2.793 13.022 4.548 488 HB3 ALA 67 2HB ALA 67 2.608 11.796 5.825 489 H GLY 68 H GLY 68 4.604 15.086 7.729 490 HA2 GLY 68 1HA GLY 68 5.479 17.270 7.395 491 HA3 GLY 68 2HA GLY 68 5.420 17.017 5.635 492 H TYR 69 H TYR 69 2.569 15.833 6.505 493 HA TYR 69 HA TYR 69 1.048 18.237 7.132 494 HB2 TYR 69 1HB TYR 69 -0.121 18.463 5.012 495 HB3 TYR 69 2HB TYR 69 1.602 18.698 4.756 496 HD1 TYR 69 2HD TYR 69 2.952 17.000 3.603 497 HD2 TYR 69 1HD TYR 69 -1.292 16.582 4.073 498 HE1 TYR 69 2HE TYR 69 2.927 15.263 1.844 499 HE2 TYR 69 1HE TYR 69 -1.316 14.845 2.315 500 HH TYR 69 HH TYR 69 -0.058 13.988 0.558 501 H THR 70 H THR 70 -1.312 17.864 6.959 502 HA THR 70 HA THR 70 -1.874 15.116 7.930 503 HB THR 70 HB THR 70 -4.087 16.066 8.566 504 HG1 THR 70 1HG THR 70 -4.351 17.660 7.013 505 HG21 THR 70 2HG3 THR 70 -1.722 17.766 9.445 506 HG22 THR 70 2HG1 THR 70 -3.274 17.613 10.302 507 HG23 THR 70 2HG2 THR 70 -2.198 16.204 10.151 508 H ILE 71 H ILE 71 -2.990 13.613 6.935 509 HA ILE 71 HA ILE 71 -3.825 14.209 4.121 510 HB ILE 71 HB ILE 71 -3.329 11.559 5.570 511 HG12 ILE 71 1HG1 ILE 71 -1.667 12.870 3.409 512 HG13 ILE 71 1HG2 ILE 71 -1.302 12.970 5.125 513 HG21 ILE 71 2HG1 ILE 71 -3.539 10.554 3.331 514 HG22 ILE 71 2HG2 ILE 71 -5.043 11.377 3.806 515 HG23 ILE 71 2HG3 ILE 71 -3.935 12.149 2.648 516 HD11 ILE 71 1HD3 ILE 71 -1.466 10.422 3.499 517 HD12 ILE 71 1HD1 ILE 71 0.018 11.237 4.047 518 HD13 ILE 71 1HD2 ILE 71 -1.098 10.525 5.238 519 HA PRO 72 HA PRO 72 -8.066 14.229 5.298 520 HB2 PRO 72 1HB PRO 72 -8.264 13.700 2.309 521 HB3 PRO 72 2HB PRO 72 -9.097 14.935 3.262 522 HG2 PRO 72 1HG PRO 72 -7.080 15.697 1.705 523 HG3 PRO 72 2HG PRO 72 -7.194 16.364 3.337 524 HD2 PRO 72 1HD PRO 72 -5.436 14.095 2.312 525 HD3 PRO 72 2HD PRO 72 -5.000 15.466 3.409 526 H CYS 73 H CYS 73 -9.538 12.762 5.739 527 HA CYS 73 HA CYS 73 -8.943 9.901 5.056 528 HB2 CYS 73 1HB CYS 73 -9.309 10.385 7.337 529 HB3 CYS 73 2HB CYS 73 -10.872 11.106 6.978 530 HG CYS 73 HG CYS 73 -11.318 8.878 8.068 531 H GLU 74 H GLU 74 -9.615 9.687 2.902 532 HA GLU 74 HA GLU 74 -12.359 10.554 2.177 533 HB2 GLU 74 1HB GLU 74 -10.366 10.806 0.610 534 HB3 GLU 74 2HB GLU 74 -10.309 9.053 0.500 535 HG2 GLU 74 1HG GLU 74 -11.458 9.876 -1.410 536 HG3 GLU 74 2HG GLU 74 -12.638 9.070 -0.377 537 H THR 75 H THR 75 -14.067 9.368 2.412 538 HA THR 75 HA THR 75 -13.679 6.468 3.020 539 HB THR 75 HB THR 75 -15.936 6.578 4.007 540 HG1 THR 75 1HG THR 75 -16.963 8.655 4.105 541 HG21 THR 75 2HG3 THR 75 -14.161 8.870 4.927 542 HG22 THR 75 2HG1 THR 75 -15.450 8.102 5.881 543 HG23 THR 75 2HG2 THR 75 -14.004 7.171 5.427 544 H ASP 76 H ASP 76 -14.416 8.400 0.435 545 HA ASP 76 HA ASP 76 -16.264 6.349 -0.736 546 HB2 ASP 76 1HB ASP 76 -15.755 9.253 -1.507 547 HB3 ASP 76 2HB ASP 76 -16.768 8.148 -2.424 548 H ASN 77 H ASN 77 -14.299 5.443 -3.436 549 HA ASN 77 HA ASN 77 -17.001 6.108 -2.345 550 HB2 ASN 77 1HB ASN 77 -16.118 4.632 -4.838 551 HB3 ASN 77 2HB ASN 77 -17.790 4.753 -4.307 552 HD21 ASN 77 2HD2 ASN 77 -15.483 6.091 -6.253 553 HD22 ASN 77 2HD1 ASN 77 -16.175 7.662 -6.478 554 H ASN 78 H ASN 78 -14.724 3.438 -2.765 555 HA ASN 78 HA ASN 78 -16.627 1.482 -1.670 556 HB2 ASN 78 1HB ASN 78 -13.706 1.334 -2.449 557 HB3 ASN 78 2HB ASN 78 -14.587 -0.015 -1.743 558 HD21 ASN 78 2HD2 ASN 78 -13.376 0.004 -4.298 559 HD22 ASN 78 2HD1 ASN 78 -14.626 -0.185 -5.481 560 HA PRO 79 HA PRO 79 -15.655 1.955 2.541 561 HB2 PRO 79 1HB PRO 79 -16.237 -0.561 3.470 562 HB3 PRO 79 2HB PRO 79 -17.527 0.481 2.856 563 HG2 PRO 79 1HG PRO 79 -16.021 -1.746 1.415 564 HG3 PRO 79 2HG PRO 79 -17.766 -1.482 1.497 565 HD2 PRO 79 1HD PRO 79 -16.327 -0.642 -0.649 566 HD3 PRO 79 2HD PRO 79 -17.718 0.329 -0.020 567 H HIS 80 H HIS 80 -14.454 0.926 4.370 568 HA HIS 80 HA HIS 80 -11.809 0.047 3.260 569 HB2 HIS 80 1HB HIS 80 -12.355 1.982 5.553 570 HB3 HIS 80 2HB HIS 80 -10.766 1.414 5.062 571 HD2 HIS 80 2HD HIS 80 -13.000 4.360 4.410 572 HE1 HIS 80 1HE HIS 80 -10.429 4.108 1.021 573 H ARG 81 H ARG 81 -13.038 -2.059 3.762 574 HA ARG 81 HA ARG 81 -12.750 -2.892 6.573 575 HB2 ARG 81 1HB ARG 81 -13.357 -4.386 3.997 576 HB3 ARG 81 2HB ARG 81 -13.183 -5.186 5.552 577 HG2 ARG 81 1HG ARG 81 -15.064 -3.778 6.422 578 HG3 ARG 81 2HG ARG 81 -15.287 -3.159 4.766 579 HD2 ARG 81 1HD ARG 81 -15.649 -5.429 3.974 580 HD3 ARG 81 2HD ARG 81 -15.443 -6.037 5.633 581 HE ARG 81 HE ARG 81 -17.764 -4.703 4.507 582 HH11 ARG 81 1HH1 ARG 81 -16.045 -5.542 7.453 583 HH12 ARG 81 1HH2 ARG 81 -17.467 -5.432 8.464 584 HH21 ARG 81 2HH1 ARG 81 -19.605 -4.563 5.829 585 HH22 ARG 81 2HH2 ARG 81 -19.483 -4.877 7.546 586 H HIS 82 H HIS 82 -11.249 -4.219 7.450 587 HA HIS 82 HA HIS 82 -8.663 -4.271 5.952 588 HB2 HIS 82 1HB HIS 82 -9.328 -4.428 8.919 589 HB3 HIS 82 2HB HIS 82 -7.723 -4.750 8.280 590 HD2 HIS 82 2HD HIS 82 -6.119 -2.416 8.297 591 HE1 HIS 82 1HE HIS 82 -9.354 0.333 8.131 592 H VAL 83 H VAL 83 -8.817 -6.048 4.699 593 HA VAL 83 HA VAL 83 -9.259 -8.674 6.104 594 HB VAL 83 HB VAL 83 -9.610 -9.583 3.850 595 HG11 VAL 83 1HG1 VAL 83 -11.671 -8.419 3.231 596 HG12 VAL 83 1HG2 VAL 83 -11.551 -8.671 4.988 597 HG13 VAL 83 1HG3 VAL 83 -11.225 -7.064 4.295 598 HG21 VAL 83 2HG3 VAL 83 -8.019 -8.119 2.655 599 HG22 VAL 83 2HG1 VAL 83 -9.618 -8.091 1.877 600 HG23 VAL 83 2HG2 VAL 83 -9.104 -6.731 2.904 601 H THR 84 H THR 84 -8.048 -10.402 4.515 602 HA THR 84 HA THR 84 -5.411 -10.393 5.565 603 HB THR 84 HB THR 84 -6.419 -11.876 3.096 604 HG1 THR 84 1HG THR 84 -6.840 -13.537 4.659 605 HG21 THR 84 2HG3 THR 84 -4.143 -12.457 5.030 606 HG22 THR 84 2HG1 THR 84 -4.652 -13.493 3.677 607 HG23 THR 84 2HG2 THR 84 -3.961 -11.884 3.356 608 H GLY 85 H GLY 85 -4.006 -8.833 5.228 609 HA2 GLY 85 1HA GLY 85 -2.081 -8.266 3.951 610 HA3 GLY 85 2HA GLY 85 -2.943 -8.721 2.464 611 H ALA 86 H ALA 86 -5.128 -7.005 4.202 612 HA ALA 86 HA ALA 86 -5.186 -4.865 2.349 613 HB1 ALA 86 3HB ALA 86 -6.345 -4.992 5.157 614 HB2 ALA 86 1HB ALA 86 -6.802 -3.823 3.896 615 HB3 ALA 86 2HB ALA 86 -7.141 -5.556 3.669 616 H MET 87 H MET 87 -4.469 -2.818 2.301 617 HA MET 87 HA MET 87 -2.613 -1.998 4.516 618 HB2 MET 87 1HB MET 87 -2.380 -1.522 1.524 619 HB3 MET 87 2HB MET 87 -1.375 -0.732 2.731 620 HG2 MET 87 1HG MET 87 -0.506 -2.931 3.445 621 HG3 MET 87 2HG MET 87 -1.511 -3.720 2.228 622 HE1 MET 87 3HE MET 87 1.595 -1.464 2.936 623 HE2 MET 87 1HE MET 87 2.059 -0.925 1.304 624 HE3 MET 87 2HE MET 87 0.550 -0.334 2.042 625 H SER 88 H SER 88 -2.958 -0.156 5.493 626 HA SER 88 HA SER 88 -4.990 1.764 4.323 627 HB2 SER 88 1HB SER 88 -6.197 1.856 6.289 628 HB3 SER 88 2HB SER 88 -6.172 0.207 5.684 629 HG SER 88 HG SER 88 -5.794 0.200 7.845 630 H MET 89 H MET 89 -4.836 3.865 5.122 631 HA MET 89 HA MET 89 -2.196 4.585 6.262 632 HB2 MET 89 1HB MET 89 -4.495 6.314 5.279 633 HB3 MET 89 2HB MET 89 -2.919 6.902 5.787 634 HG2 MET 89 1HG MET 89 -3.420 5.059 3.432 635 HG3 MET 89 2HG MET 89 -3.154 6.802 3.339 636 HE1 MET 89 3HE MET 89 -0.891 7.536 5.254 637 HE2 MET 89 1HE MET 89 0.560 7.248 4.263 638 HE3 MET 89 2HE MET 89 -0.888 7.981 3.530 639 H ALA 90 H ALA 90 -1.791 5.406 8.197 640 HA ALA 90 HA ALA 90 -3.826 5.063 10.255 641 HB1 ALA 90 3HB ALA 90 -1.030 6.248 10.394 642 HB2 ALA 90 1HB ALA 90 -2.054 5.837 11.789 643 HB3 ALA 90 2HB ALA 90 -1.465 4.553 10.708 644 H HIS 91 H HIS 91 -5.168 6.474 11.096 645 HA HIS 91 HA HIS 91 -4.552 9.340 11.127 646 HB2 HIS 91 1HB HIS 91 -6.433 10.087 9.824 647 HB3 HIS 91 2HB HIS 91 -5.526 8.965 8.820 648 HD2 HIS 91 2HD HIS 91 -6.943 6.749 7.955 649 HE1 HIS 91 1HE HIS 91 -10.498 7.544 10.169 650 H ARG 92 H ARG 92 -6.556 10.574 11.970 651 HA ARG 92 HA ARG 92 -8.081 8.864 13.891 652 HB2 ARG 92 1HB ARG 92 -6.683 11.487 14.552 653 HB3 ARG 92 2HB ARG 92 -7.771 10.617 15.623 654 HG2 ARG 92 1HG ARG 92 -5.177 9.462 14.576 655 HG3 ARG 92 2HG ARG 92 -5.347 10.323 16.126 656 HD2 ARG 92 1HD ARG 92 -7.056 8.676 16.790 657 HD3 ARG 92 2HD ARG 92 -6.727 7.786 15.286 658 HE ARG 92 HE ARG 92 -5.046 7.944 17.668 659 HH11 ARG 92 1HH1 ARG 92 -5.264 7.085 14.268 660 HH12 ARG 92 1HH2 ARG 92 -3.891 6.003 14.324 661 HH21 ARG 92 2HH1 ARG 92 -3.264 6.538 17.727 662 HH22 ARG 92 2HH2 ARG 92 -2.758 5.692 16.282 663 H GLY 93 H GLY 93 -8.852 9.947 11.346 664 HA2 GLY 93 1HA GLY 93 -11.316 10.666 11.293 665 HA3 GLY 93 2HA GLY 93 -10.752 12.094 12.192 666 H ARG 94 H ARG 94 -11.827 13.114 10.247 667 HA ARG 94 HA ARG 94 -10.528 12.921 7.658 668 HB2 ARG 94 1HB ARG 94 -12.884 13.652 7.925 669 HB3 ARG 94 2HB ARG 94 -12.350 15.067 8.818 670 HG2 ARG 94 1HG ARG 94 -12.735 15.918 6.710 671 HG3 ARG 94 2HG ARG 94 -10.981 15.613 6.667 672 HD2 ARG 94 1HD ARG 94 -11.355 13.521 5.525 673 HD3 ARG 94 2HD ARG 94 -13.114 13.771 5.610 674 HE ARG 94 HE ARG 94 -11.973 16.022 4.365 675 HH11 ARG 94 1HH1 ARG 94 -12.419 12.588 3.767 676 HH12 ARG 94 1HH2 ARG 94 -12.460 12.770 2.027 677 HH21 ARG 94 2HH1 ARG 94 -12.029 16.243 2.105 678 HH22 ARG 94 2HH2 ARG 94 -12.240 14.838 1.086 679 H ASP 95 H ASP 95 -8.659 13.654 7.072 680 HA ASP 95 HA ASP 95 -6.910 15.155 6.753 681 HB2 ASP 95 1HB ASP 95 -8.956 16.820 6.803 682 HB3 ASP 95 2HB ASP 95 -8.368 17.224 8.410 683 H THR 96 H THR 96 -6.651 13.301 8.719 684 HA THR 96 HA THR 96 -4.855 14.793 10.576 685 HB THR 96 HB THR 96 -5.553 13.345 12.464 686 HG1 THR 96 1HG THR 96 -7.443 12.408 10.547 687 HG21 THR 96 2HG3 THR 96 -7.870 14.840 11.180 688 HG22 THR 96 2HG1 THR 96 -7.743 14.387 12.896 689 HG23 THR 96 2HG2 THR 96 -6.604 15.564 12.199 690 H GLY 97 H GLY 97 -5.094 12.618 8.194 691 HA2 GLY 97 1HA GLY 97 -3.775 10.312 9.338 692 HA3 GLY 97 2HA GLY 97 -4.039 10.637 7.609 693 H SER 98 H SER 98 -1.665 9.570 9.012 694 HA SER 98 HA SER 98 0.366 11.643 8.122 695 HB2 SER 98 1HB SER 98 1.855 10.900 9.627 696 HB3 SER 98 2HB SER 98 0.348 11.067 10.512 697 HG SER 98 HG SER 98 0.027 8.850 10.245 698 H CYS 99 H CYS 99 2.497 10.374 7.633 699 HA CYS 99 HA CYS 99 2.119 8.741 5.253 700 HB2 CYS 99 1HB CYS 99 4.428 8.553 5.163 701 HB3 CYS 99 2HB CYS 99 3.986 10.212 5.539 702 HG CYS 99 HG CYS 99 6.187 9.603 6.711 703 H GLN 100 H GLN 100 2.354 8.066 8.681 704 HA GLN 100 HA GLN 100 3.248 5.340 8.525 705 HB2 GLN 100 1HB GLN 100 3.066 6.828 10.614 706 HB3 GLN 100 2HB GLN 100 1.340 6.496 10.592 707 HG2 GLN 100 1HG GLN 100 1.766 4.105 10.836 708 HG3 GLN 100 2HG GLN 100 3.525 4.415 10.814 709 HE21 GLN 100 2HE2 GLN 100 4.547 5.189 12.631 710 HE22 GLN 100 2HE1 GLN 100 3.757 5.366 14.163 711 H PHE 101 H PHE 101 2.205 3.409 8.479 712 HA PHE 101 HA PHE 101 -0.680 3.383 7.796 713 HB2 PHE 101 1HB PHE 101 -0.313 2.271 5.649 714 HB3 PHE 101 2HB PHE 101 0.452 3.852 5.631 715 HD1 PHE 101 2HD PHE 101 2.945 4.013 5.953 716 HD2 PHE 101 1HD PHE 101 0.934 0.299 5.306 717 HE1 PHE 101 2HE PHE 101 5.087 2.972 5.289 718 HE2 PHE 101 1HE PHE 101 3.074 -0.746 4.644 719 HZ PHE 101 HZ PHE 101 5.150 0.590 4.635 720 H PHE 102 H PHE 102 -1.392 1.110 7.261 721 HA PHE 102 HA PHE 102 0.098 -0.802 9.036 722 HB2 PHE 102 1HB PHE 102 -2.900 -0.610 8.519 723 HB3 PHE 102 2HB PHE 102 -2.114 -1.836 9.499 724 HD1 PHE 102 1HD PHE 102 -2.923 1.760 9.269 725 HD2 PHE 102 2HD PHE 102 -1.443 -1.396 11.739 726 HE1 PHE 102 1HE PHE 102 -3.125 3.221 11.254 727 HE2 PHE 102 2HE PHE 102 -1.645 0.062 13.726 728 HZ PHE 102 HZ PHE 102 -2.485 2.372 13.482 729 H ILE 103 H ILE 103 0.717 -2.687 8.242 730 HA ILE 103 HA ILE 103 -0.698 -3.690 5.783 731 HB ILE 103 HB ILE 103 2.000 -4.523 6.965 732 HG12 ILE 103 1HG1 ILE 103 1.417 -2.939 4.452 733 HG13 ILE 103 1HG2 ILE 103 2.032 -2.268 5.953 734 HG21 ILE 103 2HG1 ILE 103 2.226 -5.842 4.898 735 HG22 ILE 103 2HG2 ILE 103 0.807 -6.362 5.837 736 HG23 ILE 103 2HG3 ILE 103 0.593 -5.341 4.396 737 HD11 ILE 103 1HD3 ILE 103 3.424 -4.342 4.245 738 HD12 ILE 103 1HD1 ILE 103 3.825 -2.612 4.347 739 HD13 ILE 103 1HD2 ILE 103 4.046 -3.662 5.768 740 H VAL 104 H VAL 104 -2.354 -4.850 6.256 741 HA VAL 104 HA VAL 104 -2.575 -6.205 8.855 742 HB VAL 104 HB VAL 104 -4.334 -6.279 6.355 743 HG11 VAL 104 1HG1 VAL 104 -6.064 -7.181 7.831 744 HG12 VAL 104 1HG2 VAL 104 -4.649 -8.256 7.728 745 HG13 VAL 104 1HG3 VAL 104 -4.891 -7.239 9.169 746 HG21 VAL 104 2HG3 VAL 104 -4.161 -4.030 7.365 747 HG22 VAL 104 2HG1 VAL 104 -5.779 -4.724 7.628 748 HG23 VAL 104 2HG2 VAL 104 -4.590 -4.708 8.953 749 H HIS 105 H HIS 105 -2.368 -8.218 9.421 750 HA HIS 105 HA HIS 105 -1.205 -10.079 7.423 751 HB2 HIS 105 1HB HIS 105 -1.648 -10.381 10.425 752 HB3 HIS 105 2HB HIS 105 -0.825 -11.545 9.397 753 HD2 HIS 105 2HD HIS 105 0.343 -8.094 8.358 754 HE1 HIS 105 1HE HIS 105 3.094 -9.436 11.323 755 H GLU 106 H GLU 106 -2.993 -11.474 10.015 756 HA GLU 106 HA GLU 106 -5.065 -12.559 8.274 757 HB2 GLU 106 1HB GLU 106 -4.870 -12.367 11.310 758 HB3 GLU 106 2HB GLU 106 -6.107 -13.263 10.439 759 HG2 GLU 106 1HG GLU 106 -4.327 -14.683 9.440 760 HG3 GLU 106 2HG GLU 106 -3.135 -13.821 10.409 761 HA PRO 107 HA PRO 107 -8.048 -9.420 8.036 762 HB2 PRO 107 1HB PRO 107 -9.985 -11.527 9.097 763 HB3 PRO 107 2HB PRO 107 -10.147 -10.516 7.655 764 HG2 PRO 107 1HG PRO 107 -9.484 -13.072 7.330 765 HG3 PRO 107 2HG PRO 107 -8.639 -11.846 6.379 766 HD2 PRO 107 1HD PRO 107 -7.720 -13.298 8.888 767 HD3 PRO 107 2HD PRO 107 -6.778 -12.877 7.402 768 H GLN 108 H GLN 108 -8.873 -7.867 9.211 769 HA GLN 108 HA GLN 108 -9.160 -8.383 12.148 770 HB2 GLN 108 1HB GLN 108 -7.968 -5.884 10.874 771 HB3 GLN 108 2HB GLN 108 -8.159 -6.191 12.595 772 HG2 GLN 108 1HG GLN 108 -6.400 -7.808 10.739 773 HG3 GLN 108 2HG GLN 108 -5.848 -6.490 11.809 774 HE21 GLN 108 2HE2 GLN 108 -5.634 -9.649 11.558 775 HE22 GLN 108 2HE1 GLN 108 -5.772 -10.148 13.212 776 HA PRO 109 HA PRO 109 -13.124 -6.828 10.532 777 HB2 PRO 109 1HB PRO 109 -13.855 -8.064 13.223 778 HB3 PRO 109 2HB PRO 109 -14.704 -8.219 11.678 779 HG2 PRO 109 1HG PRO 109 -13.251 -10.279 12.527 780 HG3 PRO 109 2HG PRO 109 -13.155 -9.815 10.825 781 HD2 PRO 109 1HD PRO 109 -11.217 -9.212 13.092 782 HD3 PRO 109 2HD PRO 109 -10.862 -9.689 11.383 783 H HIS 110 H HIS 110 -11.518 -6.437 13.623 784 HA HIS 110 HA HIS 110 -13.405 -4.399 14.541 785 HB2 HIS 110 1HB HIS 110 -11.863 -4.149 16.434 786 HB3 HIS 110 2HB HIS 110 -12.199 -5.851 16.148 787 HD2 HIS 110 2HD HIS 110 -9.996 -7.294 14.929 788 HE1 HIS 110 1HE HIS 110 -7.139 -4.319 15.999 789 H LEU 111 H LEU 111 -10.864 -4.402 12.336 790 HA LEU 111 HA LEU 111 -10.315 -1.501 12.783 791 HB2 LEU 111 1HB LEU 111 -8.999 -3.567 10.971 792 HB3 LEU 111 2HB LEU 111 -8.534 -1.865 11.057 793 HG LEU 111 HG LEU 111 -8.293 -3.903 13.300 794 HD11 LEU 111 1HD1 LEU 111 -5.884 -3.608 12.933 795 HD12 LEU 111 1HD2 LEU 111 -6.698 -4.238 11.482 796 HD13 LEU 111 1HD3 LEU 111 -6.224 -2.524 11.565 797 HD21 LEU 111 2HD3 LEU 111 -8.810 -1.630 14.127 798 HD22 LEU 111 2HD1 LEU 111 -7.125 -2.077 14.488 799 HD23 LEU 111 2HD2 LEU 111 -7.483 -0.970 13.141 800 H ASP 112 H ASP 112 -12.467 -3.399 11.149 801 HA ASP 112 HA ASP 112 -12.476 -2.248 8.526 802 HB2 ASP 112 1HB ASP 112 -14.722 -3.442 10.204 803 HB3 ASP 112 2HB ASP 112 -14.896 -2.990 8.513 804 H GLY 113 H GLY 113 -12.417 -0.150 8.213 805 HA2 GLY 113 1HA GLY 113 -13.702 1.813 7.790 806 HA3 GLY 113 2HA GLY 113 -14.802 1.367 9.115 807 H VAL 114 H VAL 114 -11.865 0.766 10.365 808 HA VAL 114 HA VAL 114 -11.877 3.240 11.973 809 HB VAL 114 HB VAL 114 -9.998 0.828 11.917 810 HG11 VAL 114 1HG1 VAL 114 -9.188 1.643 14.077 811 HG12 VAL 114 1HG2 VAL 114 -8.874 2.805 12.767 812 HG13 VAL 114 1HG3 VAL 114 -10.206 3.093 13.911 813 HG21 VAL 114 2HG3 VAL 114 -12.304 0.269 12.605 814 HG22 VAL 114 2HG1 VAL 114 -11.187 0.174 13.986 815 HG23 VAL 114 2HG2 VAL 114 -12.265 1.579 13.809 816 H HIS 115 H HIS 115 -9.605 1.721 9.686 817 HA HIS 115 HA HIS 115 -8.423 4.456 9.329 818 HB2 HIS 115 1HB HIS 115 -7.103 1.720 9.077 819 HB3 HIS 115 2HB HIS 115 -6.354 3.229 8.573 820 HD2 HIS 115 2HD HIS 115 -6.607 1.062 11.679 821 HE1 HIS 115 1HE HIS 115 -5.309 4.901 12.998 822 H THR 116 H THR 116 -7.265 4.632 7.157 823 HA THR 116 HA THR 116 -9.457 4.109 5.204 824 HB THR 116 HB THR 116 -7.111 6.056 5.070 825 HG1 THR 116 1HG THR 116 -9.881 6.471 5.643 826 HG21 THR 116 2HG3 THR 116 -9.593 5.762 3.336 827 HG22 THR 116 2HG1 THR 116 -8.360 7.036 3.187 828 HG23 THR 116 2HG2 THR 116 -7.933 5.342 2.853 829 H VAL 117 H VAL 117 -9.208 2.190 4.298 830 HA VAL 117 HA VAL 117 -6.603 1.094 3.544 831 HB VAL 117 HB VAL 117 -9.428 0.353 2.639 832 HG11 VAL 117 1HG1 VAL 117 -8.441 -1.800 2.026 833 HG12 VAL 117 1HG2 VAL 117 -7.726 -0.453 1.108 834 HG13 VAL 117 1HG3 VAL 117 -6.829 -1.185 2.462 835 HG21 VAL 117 2HG3 VAL 117 -9.141 0.175 5.087 836 HG22 VAL 117 2HG1 VAL 117 -9.257 -1.435 4.340 837 HG23 VAL 117 2HG2 VAL 117 -7.674 -0.801 4.846 838 H PHE 118 H PHE 118 -5.445 1.237 1.815 839 HA PHE 118 HA PHE 118 -6.585 2.814 -0.470 840 HB2 PHE 118 1HB PHE 118 -4.535 4.067 -0.638 841 HB3 PHE 118 2HB PHE 118 -5.086 4.201 1.024 842 HD1 PHE 118 2HD PHE 118 -3.908 3.057 2.834 843 HD2 PHE 118 1HD PHE 118 -2.524 2.858 -1.202 844 HE1 PHE 118 2HE PHE 118 -1.712 2.242 3.629 845 HE2 PHE 118 1HE PHE 118 -0.329 2.041 -0.413 846 HZ PHE 118 HZ PHE 118 0.076 1.733 2.004 847 H GLY 119 H GLY 119 -4.863 0.075 0.627 848 HA2 GLY 119 1HA GLY 119 -4.600 -0.894 -2.127 849 HA3 GLY 119 2HA GLY 119 -3.055 -0.612 -1.292 850 H GLN 120 H GLN 120 -3.097 -3.050 -1.896 851 HA GLN 120 HA GLN 120 -3.458 -4.468 0.631 852 HB2 GLN 120 1HB GLN 120 -5.751 -4.638 -0.358 853 HB3 GLN 120 2HB GLN 120 -5.061 -5.361 -1.804 854 HG2 GLN 120 1HG GLN 120 -4.201 -7.235 -0.413 855 HG3 GLN 120 2HG GLN 120 -5.042 -6.519 0.989 856 HE21 GLN 120 2HE2 GLN 120 -5.963 -8.817 0.836 857 HE22 GLN 120 2HE1 GLN 120 -7.419 -8.991 -0.087 858 H VAL 121 H VAL 121 -1.892 -5.844 0.911 859 HA VAL 121 HA VAL 121 0.070 -6.389 -1.163 860 HB VAL 121 HB VAL 121 -0.463 -7.794 1.500 861 HG11 VAL 121 1HG1 VAL 121 1.850 -8.573 1.320 862 HG12 VAL 121 1HG2 VAL 121 0.838 -9.172 -0.016 863 HG13 VAL 121 1HG3 VAL 121 1.973 -7.830 -0.292 864 HG21 VAL 121 2HG3 VAL 121 0.008 -5.383 1.767 865 HG22 VAL 121 2HG1 VAL 121 1.371 -6.367 2.350 866 HG23 VAL 121 2HG2 VAL 121 1.472 -5.557 0.769 867 H THR 122 H THR 122 0.261 -7.849 -2.628 868 HA THR 122 HA THR 122 -1.789 -10.042 -2.647 869 HB THR 122 HB THR 122 -1.644 -9.989 -5.107 870 HG1 THR 122 1HG THR 122 -0.433 -8.261 -6.071 871 HG21 THR 122 2HG3 THR 122 -2.132 -7.231 -3.920 872 HG22 THR 122 2HG1 THR 122 -2.717 -7.806 -5.498 873 HG23 THR 122 2HG2 THR 122 -3.320 -8.552 -3.999 874 H SER 123 H SER 123 1.559 -9.228 -2.715 875 HA SER 123 HA SER 123 2.245 -12.164 -2.757 876 HB2 SER 123 1HB SER 123 2.428 -11.508 -5.020 877 HB3 SER 123 2HB SER 123 3.489 -10.178 -4.582 878 HG SER 123 HG SER 123 4.608 -12.028 -5.200 879 H GLY 124 H GLY 124 3.890 -12.650 -1.405 880 HA2 GLY 124 1HA GLY 124 5.858 -12.234 -0.140 881 HA3 GLY 124 2HA GLY 124 5.614 -10.485 -0.349 882 H MET 125 H MET 125 2.865 -12.400 0.519 883 HA MET 125 HA MET 125 2.386 -11.038 2.986 884 HB2 MET 125 1HB MET 125 1.366 -13.657 1.849 885 HB3 MET 125 2HB MET 125 0.828 -13.031 3.400 886 HG2 MET 125 1HG MET 125 0.528 -11.624 0.731 887 HG3 MET 125 2HG MET 125 -0.740 -12.494 1.596 888 HE1 MET 125 3HE MET 125 -0.082 -11.685 4.633 889 HE2 MET 125 1HE MET 125 -1.162 -10.282 4.827 890 HE3 MET 125 2HE MET 125 -1.726 -11.726 3.951 891 H ASP 126 H ASP 126 4.175 -13.982 2.250 892 HA ASP 126 HA ASP 126 4.621 -14.846 4.939 893 HB2 ASP 126 1HB ASP 126 6.310 -15.059 2.416 894 HB3 ASP 126 2HB ASP 126 6.780 -15.795 3.943 895 H VAL 127 H VAL 127 6.524 -12.625 2.891 896 HA VAL 127 HA VAL 127 8.456 -11.934 4.919 897 HB VAL 127 HB VAL 127 7.357 -10.332 2.558 898 HG11 VAL 127 1HG1 VAL 127 9.372 -8.961 2.776 899 HG12 VAL 127 1HG2 VAL 127 8.338 -8.860 4.221 900 HG13 VAL 127 1HG3 VAL 127 9.817 -9.851 4.252 901 HG21 VAL 127 2HG3 VAL 127 8.453 -12.450 1.912 902 HG22 VAL 127 2HG1 VAL 127 9.444 -11.049 1.439 903 HG23 VAL 127 2HG2 VAL 127 9.883 -12.005 2.875 904 H VAL 128 H VAL 128 5.303 -10.521 4.111 905 HA VAL 128 HA VAL 128 5.368 -8.394 6.033 906 HB VAL 128 HB VAL 128 3.059 -10.112 5.004 907 HG11 VAL 128 1HG1 VAL 128 1.582 -8.342 5.822 908 HG12 VAL 128 1HG2 VAL 128 2.476 -9.128 7.145 909 HG13 VAL 128 1HG3 VAL 128 2.976 -7.521 6.563 910 HG21 VAL 128 2HG3 VAL 128 4.231 -8.802 3.267 911 HG22 VAL 128 2HG1 VAL 128 2.605 -8.147 3.571 912 HG23 VAL 128 2HG2 VAL 128 4.035 -7.328 4.243 913 H ARG 129 H ARG 129 4.205 -11.743 6.416 914 HA ARG 129 HA ARG 129 3.402 -11.267 9.164 915 HB2 ARG 129 1HB ARG 129 3.850 -13.800 7.543 916 HB3 ARG 129 2HB ARG 129 3.293 -13.813 9.209 917 HG2 ARG 129 1HG ARG 129 1.274 -12.605 8.588 918 HG3 ARG 129 2HG ARG 129 1.846 -12.478 6.908 919 HD2 ARG 129 1HD ARG 129 1.840 -14.898 6.723 920 HD3 ARG 129 2HD ARG 129 1.267 -15.024 8.402 921 HE ARG 129 HE ARG 129 -0.528 -13.356 7.066 922 HH11 ARG 129 1HH1 ARG 129 0.580 -16.684 6.862 923 HH12 ARG 129 1HH2 ARG 129 -0.936 -17.281 6.225 924 HH21 ARG 129 2HH1 ARG 129 -2.491 -14.143 6.238 925 HH22 ARG 129 2HH2 ARG 129 -2.675 -15.844 5.872 926 H THR 130 H THR 130 6.360 -12.320 7.621 927 HA THR 130 HA THR 130 7.529 -13.009 10.276 928 HB THR 130 HB THR 130 9.465 -13.824 8.959 929 HG1 THR 130 1HG THR 130 9.217 -12.350 7.186 930 HG21 THR 130 2HG3 THR 130 6.795 -14.835 7.908 931 HG22 THR 130 2HG1 THR 130 8.343 -15.709 7.836 932 HG23 THR 130 2HG2 THR 130 7.587 -15.364 9.411 933 H MET 131 H MET 131 6.886 -10.241 8.922 934 HA MET 131 HA MET 131 9.384 -8.837 8.817 935 HB2 MET 131 1HB MET 131 7.136 -7.982 8.037 936 HB3 MET 131 2HB MET 131 6.689 -7.764 9.722 937 HG2 MET 131 1HG MET 131 8.551 -6.170 10.012 938 HG3 MET 131 2HG MET 131 8.998 -6.389 8.318 939 HE1 MET 131 3HE MET 131 6.436 -6.453 6.652 940 HE2 MET 131 1HE MET 131 6.130 -4.725 6.354 941 HE3 MET 131 2HE MET 131 7.795 -5.355 6.305 942 H LYS 132 H LYS 132 10.545 -7.684 10.267 943 HA LYS 132 HA LYS 132 10.213 -8.611 13.085 944 HB2 LYS 132 1HB LYS 132 12.560 -7.312 11.645 945 HB3 LYS 132 2HB LYS 132 12.550 -7.756 13.346 946 HG2 LYS 132 1HG LYS 132 12.282 -10.122 12.752 947 HG3 LYS 132 2HG LYS 132 12.234 -9.694 11.035 948 HD2 LYS 132 1HD LYS 132 14.515 -8.760 11.197 949 HD3 LYS 132 2HD LYS 132 14.564 -9.168 12.918 950 HE2 LYS 132 1HE LYS 132 14.278 -11.565 12.349 951 HE3 LYS 132 2HE LYS 132 14.262 -11.151 10.633 952 HZ1 LYS 132 3HZ LYS 132 16.504 -10.679 12.483 953 HZ2 LYS 132 1HZ LYS 132 16.421 -11.871 11.346 954 HZ3 LYS 132 2HZ LYS 132 16.488 -10.290 10.879 955 H ASN 133 H ASN 133 10.245 -7.255 14.835 956 HA ASN 133 HA ASN 133 8.980 -4.671 14.444 957 HB2 ASN 133 1HB ASN 133 8.583 -6.101 16.428 958 HB3 ASN 133 2HB ASN 133 10.255 -5.863 16.922 959 HD21 ASN 133 2HD2 ASN 133 7.158 -4.813 17.343 960 HD22 ASN 133 2HD1 ASN 133 7.474 -3.238 17.989 961 H GLY 134 H GLY 134 9.934 -2.987 13.638 962 HA2 GLY 134 1HA GLY 134 11.501 -1.176 13.847 963 HA3 GLY 134 2HA GLY 134 12.648 -2.282 14.638 964 H ASP 135 H ASP 135 11.197 -3.847 12.056 965 HA ASP 135 HA ASP 135 13.559 -3.977 10.455 966 HB2 ASP 135 1HB ASP 135 11.547 -5.568 10.431 967 HB3 ASP 135 2HB ASP 135 10.705 -4.359 9.473 968 H VAL 136 H VAL 136 14.409 -2.805 8.906 969 HA VAL 136 HA VAL 136 13.132 -0.137 8.424 970 HB VAL 136 HB VAL 136 15.954 -1.158 7.841 971 HG11 VAL 136 1HG1 VAL 136 16.504 1.201 7.499 972 HG12 VAL 136 1HG2 VAL 136 15.275 0.629 6.346 973 HG13 VAL 136 1HG3 VAL 136 14.793 1.633 7.735 974 HG21 VAL 136 2HG3 VAL 136 15.485 -1.052 10.265 975 HG22 VAL 136 2HG1 VAL 136 16.620 0.229 9.779 976 HG23 VAL 136 2HG2 VAL 136 14.911 0.623 10.082 977 H MET 137 H MET 137 12.354 0.536 6.617 978 HA MET 137 HA MET 137 12.349 -1.337 4.318 979 HB2 MET 137 1HB MET 137 10.248 -0.219 5.082 980 HB3 MET 137 2HB MET 137 10.958 1.342 4.692 981 HG2 MET 137 1HG MET 137 11.141 0.646 2.317 982 HG3 MET 137 2HG MET 137 10.373 -0.891 2.726 983 HE1 MET 137 3HE MET 137 9.942 2.925 2.150 984 HE2 MET 137 1HE MET 137 8.323 3.250 2.814 985 HE3 MET 137 2HE MET 137 9.667 2.840 3.908 986 H LYS 138 H LYS 138 13.297 -1.066 2.415 987 HA LYS 138 HA LYS 138 15.548 0.845 2.410 988 HB2 LYS 138 1HB LYS 138 15.861 -1.540 1.735 989 HB3 LYS 138 2HB LYS 138 14.752 -1.294 0.393 990 HG2 LYS 138 1HG LYS 138 16.263 0.246 -0.675 991 HG3 LYS 138 2HG LYS 138 17.322 0.273 0.742 992 HD2 LYS 138 1HD LYS 138 17.748 -2.169 0.428 993 HD3 LYS 138 2HD LYS 138 16.757 -2.128 -1.038 994 HE2 LYS 138 1HE LYS 138 18.292 -0.499 -2.055 995 HE3 LYS 138 2HE LYS 138 19.263 -0.466 -0.580 996 HZ1 LYS 138 3HZ LYS 138 18.838 -2.823 -2.293 997 HZ2 LYS 138 1HZ LYS 138 20.209 -1.908 -2.228 998 HZ3 LYS 138 2HZ LYS 138 19.745 -2.793 -0.915 999 H GLU 139 H GLU 139 12.794 0.075 0.267 1000 HA GLU 139 HA GLU 139 12.407 2.859 -0.432 1001 HB2 GLU 139 1HB GLU 139 13.077 2.757 -2.772 1002 HB3 GLU 139 2HB GLU 139 14.470 2.406 -1.760 1003 HG2 GLU 139 1HG GLU 139 14.105 -0.024 -2.169 1004 HG3 GLU 139 2HG GLU 139 12.789 0.392 -3.264 1005 H VAL 140 H VAL 140 10.719 3.193 -1.993 1006 HA VAL 140 HA VAL 140 9.067 0.744 -2.571 1007 HB VAL 140 HB VAL 140 8.084 3.469 -1.595 1008 HG11 VAL 140 1HG1 VAL 140 5.843 2.496 -1.728 1009 HG12 VAL 140 1HG2 VAL 140 6.635 2.564 -3.320 1010 HG13 VAL 140 1HG3 VAL 140 6.528 1.018 -2.443 1011 HG21 VAL 140 2HG3 VAL 140 8.971 2.043 0.215 1012 HG22 VAL 140 2HG1 VAL 140 7.200 2.185 0.326 1013 HG23 VAL 140 2HG2 VAL 140 7.934 0.703 -0.331 1014 H LYS 141 H LYS 141 8.419 0.482 -4.529 1015 HA LYS 141 HA LYS 141 8.734 2.803 -6.405 1016 HB2 LYS 141 1HB LYS 141 8.892 -0.188 -6.948 1017 HB3 LYS 141 2HB LYS 141 8.960 1.063 -8.180 1018 HG2 LYS 141 1HG LYS 141 11.037 1.941 -7.196 1019 HG3 LYS 141 2HG LYS 141 10.964 0.706 -5.932 1020 HD2 LYS 141 1HD LYS 141 11.096 -1.067 -7.653 1021 HD3 LYS 141 2HD LYS 141 11.167 0.168 -8.919 1022 HE2 LYS 141 1HE LYS 141 13.261 1.052 -7.924 1023 HE3 LYS 141 2HE LYS 141 13.195 -0.201 -6.682 1024 HZ1 LYS 141 3HZ LYS 141 13.423 -0.678 -9.579 1025 HZ2 LYS 141 1HZ LYS 141 14.642 -0.812 -8.477 1026 HZ3 LYS 141 2HZ LYS 141 13.360 -1.849 -8.420 1027 H VAL 142 H VAL 142 7.243 3.075 -8.086 1028 HA VAL 142 HA VAL 142 4.547 1.833 -7.548 1029 HB VAL 142 HB VAL 142 5.173 4.680 -8.467 1030 HG11 VAL 142 1HG1 VAL 142 2.764 5.046 -8.247 1031 HG12 VAL 142 1HG2 VAL 142 3.140 3.795 -9.455 1032 HG13 VAL 142 1HG3 VAL 142 2.540 3.327 -7.846 1033 HG21 VAL 142 2HG3 VAL 142 5.688 4.345 -6.074 1034 HG22 VAL 142 2HG1 VAL 142 4.241 5.361 -6.278 1035 HG23 VAL 142 2HG2 VAL 142 4.070 3.649 -5.821 1036 H PHE 143 H PHE 143 3.505 0.944 -9.121 1037 HA PHE 143 HA PHE 143 4.578 1.332 -11.892 1038 HB2 PHE 143 1HB PHE 143 3.851 -1.330 -10.598 1039 HB3 PHE 143 2HB PHE 143 4.361 -1.099 -12.263 1040 HD1 PHE 143 2HD PHE 143 6.695 -0.366 -12.756 1041 HD2 PHE 143 1HD PHE 143 5.423 -1.459 -8.826 1042 HE1 PHE 143 2HE PHE 143 9.053 -0.660 -12.077 1043 HE2 PHE 143 1HE PHE 143 7.782 -1.750 -8.142 1044 HZ PHE 143 HZ PHE 143 9.597 -1.350 -9.768 1045 H ASP 144 H ASP 144 3.154 0.776 -13.598 1046 HA ASP 144 HA ASP 144 0.281 0.529 -12.763 1047 HB2 ASP 144 1HB ASP 144 1.449 1.998 -15.166 1048 HB3 ASP 144 2HB ASP 144 -0.267 1.713 -14.906 1049 H GLU 145 H GLU 145 -0.946 -0.979 -13.668 1050 HA GLU 145 HA GLU 145 0.299 -2.669 -15.804 1051 HB2 GLU 145 1HB GLU 145 0.643 -3.762 -13.591 1052 HB3 GLU 145 2HB GLU 145 -1.085 -3.671 -13.278 1053 HG2 GLU 145 1HG GLU 145 -1.548 -5.174 -15.126 1054 HG3 GLU 145 2HG GLU 145 0.153 -5.191 -15.582 1055 HA PRO 146 HA PRO 146 -3.575 -2.058 -17.866 1056 HB2 PRO 146 1HB PRO 146 -2.667 -4.740 -19.004 1057 HB3 PRO 146 2HB PRO 146 -3.261 -3.324 -19.879 1058 HG2 PRO 146 1HG PRO 146 -0.649 -3.819 -19.919 1059 HG3 PRO 146 2HG PRO 146 -1.193 -2.156 -19.676 1060 HD2 PRO 146 1HD PRO 146 -0.203 -4.169 -17.624 1061 HD3 PRO 146 2HD PRO 146 0.144 -2.398 -17.745 Start of MODEL 4 1 H MET 1 1H MET 1 -9.052 3.412 -13.785 2 HA MET 1 HA MET 1 -7.317 4.512 -11.932 3 HB2 MET 1 1HB MET 1 -10.056 3.215 -11.689 4 HB3 MET 1 2HB MET 1 -9.285 4.181 -10.439 5 HG2 MET 1 1HG MET 1 -10.146 5.144 -13.180 6 HG3 MET 1 2HG MET 1 -10.926 5.501 -11.637 7 HE1 MET 1 3HE MET 1 -8.668 6.125 -9.622 8 HE2 MET 1 1HE MET 1 -8.427 7.871 -9.868 9 HE3 MET 1 2HE MET 1 -10.073 7.188 -9.878 10 H ALA 2 H ALA 2 -5.610 2.788 -12.215 11 HA ALA 2 HA ALA 2 -5.798 1.104 -9.816 12 HB1 ALA 2 3HB ALA 2 -5.276 -0.115 -12.550 13 HB2 ALA 2 1HB ALA 2 -5.116 -0.955 -10.991 14 HB3 ALA 2 2HB ALA 2 -6.712 -0.390 -11.539 15 H LYS 3 H LYS 3 -3.874 0.663 -8.875 16 HA LYS 3 HA LYS 3 -1.396 1.441 -10.349 17 HB2 LYS 3 1HB LYS 3 -2.130 2.398 -7.553 18 HB3 LYS 3 2HB LYS 3 -0.587 2.658 -8.354 19 HG2 LYS 3 1HG LYS 3 -1.742 3.987 -10.108 20 HG3 LYS 3 2HG LYS 3 -3.266 3.767 -9.238 21 HD2 LYS 3 1HD LYS 3 -2.201 4.833 -7.223 22 HD3 LYS 3 2HD LYS 3 -0.772 5.168 -8.211 23 HE2 LYS 3 1HE LYS 3 -3.565 6.117 -8.930 24 HE3 LYS 3 2HE LYS 3 -2.414 7.085 -8.005 25 HZ1 LYS 3 3HZ LYS 3 -1.981 6.056 -10.731 26 HZ2 LYS 3 1HZ LYS 3 -2.344 7.614 -10.330 27 HZ3 LYS 3 2HZ LYS 3 -0.904 6.957 -9.866 28 H LYS 4 H LYS 4 0.489 0.475 -9.690 29 HA LYS 4 HA LYS 4 0.241 -1.615 -7.565 30 HB2 LYS 4 1HB LYS 4 -0.051 -2.662 -9.837 31 HB3 LYS 4 2HB LYS 4 1.535 -2.053 -10.284 32 HG2 LYS 4 1HG LYS 4 2.591 -3.416 -8.555 33 HG3 LYS 4 2HG LYS 4 1.007 -3.972 -7.997 34 HD2 LYS 4 1HD LYS 4 0.585 -5.007 -10.200 35 HD3 LYS 4 2HD LYS 4 2.160 -4.440 -10.772 36 HE2 LYS 4 1HE LYS 4 3.285 -5.788 -9.040 37 HE3 LYS 4 2HE LYS 4 1.721 -6.336 -8.435 38 HZ1 LYS 4 3HZ LYS 4 2.785 -6.852 -11.131 39 HZ2 LYS 4 1HZ LYS 4 2.714 -7.941 -9.894 40 HZ3 LYS 4 2HZ LYS 4 1.322 -7.364 -10.566 41 H GLY 5 H GLY 5 1.853 -1.736 -6.198 42 HA2 GLY 5 1HA GLY 5 4.431 -0.430 -6.906 43 HA3 GLY 5 2HA GLY 5 3.543 0.139 -5.473 44 H TYR 6 H TYR 6 5.817 -0.582 -4.672 45 HA TYR 6 HA TYR 6 5.404 -3.145 -3.284 46 HB2 TYR 6 1HB TYR 6 7.593 -4.068 -3.957 47 HB3 TYR 6 2HB TYR 6 6.490 -3.942 -5.320 48 HD1 TYR 6 1HD TYR 6 9.483 -2.485 -3.720 49 HD2 TYR 6 2HD TYR 6 6.940 -2.504 -7.176 50 HE1 TYR 6 1HE TYR 6 11.177 -1.194 -4.974 51 HE2 TYR 6 2HE TYR 6 8.635 -1.214 -8.430 52 HH TYR 6 HH TYR 6 11.663 -0.168 -6.888 53 H ILE 7 H ILE 7 6.377 -3.259 -1.339 54 HA ILE 7 HA ILE 7 8.411 -1.138 -0.700 55 HB ILE 7 HB ILE 7 6.741 -2.942 1.124 56 HG12 ILE 7 1HG1 ILE 7 6.657 0.062 0.766 57 HG13 ILE 7 1HG2 ILE 7 5.511 -1.065 0.058 58 HG21 ILE 7 2HG1 ILE 7 7.773 -1.680 2.969 59 HG22 ILE 7 2HG2 ILE 7 9.003 -2.553 2.026 60 HG23 ILE 7 2HG3 ILE 7 8.791 -0.800 1.805 61 HD11 ILE 7 1HD3 ILE 7 5.997 -0.667 3.019 62 HD12 ILE 7 1HD1 ILE 7 4.614 -0.057 2.080 63 HD13 ILE 7 1HD2 ILE 7 4.837 -1.810 2.299 64 H LEU 8 H LEU 8 10.253 -1.843 -1.492 65 HA LEU 8 HA LEU 8 11.195 -4.559 -0.869 66 HB2 LEU 8 1HB LEU 8 11.899 -3.465 -2.956 67 HB3 LEU 8 2HB LEU 8 12.576 -2.111 -2.046 68 HG LEU 8 HG LEU 8 14.238 -3.700 -1.032 69 HD11 LEU 8 1HD1 LEU 8 14.520 -5.895 -2.094 70 HD12 LEU 8 1HD2 LEU 8 12.937 -5.751 -1.293 71 HD13 LEU 8 1HD3 LEU 8 13.055 -5.615 -3.064 72 HD21 LEU 8 2HD3 LEU 8 14.775 -2.285 -2.987 73 HD22 LEU 8 2HD1 LEU 8 15.600 -3.859 -3.088 74 HD23 LEU 8 2HD2 LEU 8 14.150 -3.550 -4.073 75 H MET 9 H MET 9 12.060 -5.208 0.918 76 HA MET 9 HA MET 9 12.951 -3.169 2.902 77 HB2 MET 9 1HB MET 9 12.387 -6.147 3.142 78 HB3 MET 9 2HB MET 9 12.975 -5.140 4.458 79 HG2 MET 9 1HG MET 9 10.941 -3.823 4.436 80 HG3 MET 9 2HG MET 9 10.364 -4.662 2.994 81 HE1 MET 9 3HE MET 9 8.088 -4.933 4.506 82 HE2 MET 9 1HE MET 9 8.062 -5.821 6.049 83 HE3 MET 9 2HE MET 9 8.905 -4.256 5.937 84 H GLU 10 H GLU 10 14.901 -3.294 4.000 85 HA GLU 10 HA GLU 10 17.166 -3.911 2.326 86 HB2 GLU 10 1HB GLU 10 16.873 -3.219 5.271 87 HB3 GLU 10 2HB GLU 10 18.437 -3.545 4.537 88 HG2 GLU 10 1HG GLU 10 17.998 -1.695 2.912 89 HG3 GLU 10 2HG GLU 10 16.517 -1.330 3.794 90 H ASN 11 H ASN 11 15.273 -5.820 4.477 91 HA ASN 11 HA ASN 11 17.394 -7.880 4.735 92 HB2 ASN 11 1HB ASN 11 14.554 -7.717 5.778 93 HB3 ASN 11 2HB ASN 11 15.617 -9.097 6.018 94 HD21 ASN 11 2HD2 ASN 11 14.442 -6.475 7.495 95 HD22 ASN 11 2HD1 ASN 11 15.741 -6.113 8.584 96 H GLY 12 H GLY 12 15.375 -6.964 2.339 97 HA2 GLY 12 1HA GLY 12 15.176 -8.114 0.288 98 HA3 GLY 12 2HA GLY 12 15.597 -9.636 1.107 99 H GLY 13 H GLY 13 13.315 -7.920 2.892 100 HA2 GLY 13 1HA GLY 13 11.249 -9.893 2.221 101 HA3 GLY 13 2HA GLY 13 11.183 -8.670 3.512 102 H LYS 14 H LYS 14 11.321 -8.831 -0.071 103 HA LYS 14 HA LYS 14 10.001 -6.277 -0.419 104 HB2 LYS 14 1HB LYS 14 11.522 -7.370 -2.107 105 HB3 LYS 14 2HB LYS 14 10.271 -8.569 -2.402 106 HG2 LYS 14 1HG LYS 14 8.749 -6.841 -3.213 107 HG3 LYS 14 2HG LYS 14 9.938 -5.586 -2.834 108 HD2 LYS 14 1HD LYS 14 11.529 -6.633 -4.432 109 HD3 LYS 14 2HD LYS 14 10.310 -7.852 -4.829 110 HE2 LYS 14 1HE LYS 14 8.782 -6.053 -5.601 111 HE3 LYS 14 2HE LYS 14 10.021 -4.852 -5.233 112 HZ1 LYS 14 3HZ LYS 14 10.289 -7.037 -7.188 113 HZ2 LYS 14 1HZ LYS 14 10.029 -5.448 -7.543 114 HZ3 LYS 14 2HZ LYS 14 11.447 -5.915 -6.844 115 H ILE 15 H ILE 15 7.983 -5.730 -0.286 116 HA ILE 15 HA ILE 15 5.898 -7.883 -0.570 117 HB ILE 15 HB ILE 15 5.820 -5.317 1.098 118 HG12 ILE 15 1HG1 ILE 15 5.810 -8.185 2.055 119 HG13 ILE 15 1HG2 ILE 15 7.246 -7.175 2.003 120 HG21 ILE 15 2HG1 ILE 15 3.640 -6.158 1.873 121 HG22 ILE 15 2HG2 ILE 15 3.633 -5.891 0.114 122 HG23 ILE 15 2HG3 ILE 15 3.774 -7.542 0.762 123 HD11 ILE 15 1HD3 ILE 15 4.736 -6.598 3.592 124 HD12 ILE 15 1HD1 ILE 15 6.279 -7.210 4.233 125 HD13 ILE 15 1HD2 ILE 15 6.191 -5.573 3.538 126 H GLU 16 H GLU 16 4.823 -7.834 -2.323 127 HA GLU 16 HA GLU 16 4.625 -5.236 -3.790 128 HB2 GLU 16 1HB GLU 16 4.222 -8.112 -4.716 129 HB3 GLU 16 2HB GLU 16 4.006 -6.693 -5.731 130 HG2 GLU 16 1HG GLU 16 6.378 -6.116 -5.442 131 HG3 GLU 16 2HG GLU 16 6.598 -7.529 -4.413 132 H PHE 17 H PHE 17 2.756 -4.311 -4.363 133 HA PHE 17 HA PHE 17 0.227 -5.544 -3.407 134 HB2 PHE 17 1HB PHE 17 -0.295 -3.607 -1.988 135 HB3 PHE 17 2HB PHE 17 1.155 -4.413 -1.409 136 HD1 PHE 17 1HD PHE 17 -0.143 -1.435 -3.146 137 HD2 PHE 17 2HD PHE 17 3.288 -3.325 -1.441 138 HE1 PHE 17 1HE PHE 17 1.084 0.708 -3.244 139 HE2 PHE 17 2HE PHE 17 4.518 -1.183 -1.535 140 HZ PHE 17 HZ PHE 17 3.415 0.835 -2.438 141 H GLU 18 H GLU 18 -1.671 -4.391 -4.010 142 HA GLU 18 HA GLU 18 -1.210 -2.397 -6.207 143 HB2 GLU 18 1HB GLU 18 -3.401 -4.497 -5.933 144 HB3 GLU 18 2HB GLU 18 -3.406 -3.212 -7.132 145 HG2 GLU 18 1HG GLU 18 -1.281 -4.105 -8.057 146 HG3 GLU 18 2HG GLU 18 -1.359 -5.427 -6.894 147 H LEU 19 H LEU 19 -2.361 -0.570 -6.253 148 HA LEU 19 HA LEU 19 -3.989 -0.028 -3.798 149 HB2 LEU 19 1HB LEU 19 -2.644 1.938 -5.694 150 HB3 LEU 19 2HB LEU 19 -3.460 2.330 -4.178 151 HG LEU 19 HG LEU 19 -0.868 0.770 -4.466 152 HD11 LEU 19 1HD1 LEU 19 0.115 2.746 -3.392 153 HD12 LEU 19 1HD2 LEU 19 -0.650 3.154 -4.945 154 HD13 LEU 19 1HD3 LEU 19 -1.472 3.550 -3.417 155 HD21 LEU 19 2HD3 LEU 19 -2.247 -0.019 -2.571 156 HD22 LEU 19 2HD1 LEU 19 -0.822 0.881 -1.997 157 HD23 LEU 19 2HD2 LEU 19 -2.423 1.659 -2.002 158 H PHE 20 H PHE 20 -5.846 1.287 -3.941 159 HA PHE 20 HA PHE 20 -7.227 0.968 -6.588 160 HB2 PHE 20 1HB PHE 20 -8.444 0.722 -3.805 161 HB3 PHE 20 2HB PHE 20 -9.299 0.544 -5.329 162 HD1 PHE 20 2HD PHE 20 -8.739 -1.389 -6.834 163 HD2 PHE 20 1HD PHE 20 -7.260 -1.077 -2.839 164 HE1 PHE 20 2HE PHE 20 -8.239 -3.810 -6.833 165 HE2 PHE 20 1HE PHE 20 -6.757 -3.497 -2.834 166 HZ PHE 20 HZ PHE 20 -7.245 -4.864 -4.832 167 HA PRO 21 HA PRO 21 -7.378 5.435 -5.543 168 HB2 PRO 21 1HB PRO 21 -6.970 6.247 -8.146 169 HB3 PRO 21 2HB PRO 21 -5.603 5.842 -7.101 170 HG2 PRO 21 1HG PRO 21 -7.005 4.099 -9.172 171 HG3 PRO 21 2HG PRO 21 -5.273 4.368 -8.963 172 HD2 PRO 21 1HD PRO 21 -6.449 2.157 -7.938 173 HD3 PRO 21 2HD PRO 21 -5.142 3.012 -7.024 174 H ASN 22 H ASN 22 -9.020 3.219 -7.603 175 HA ASN 22 HA ASN 22 -11.227 4.982 -8.278 176 HB2 ASN 22 1HB ASN 22 -10.687 2.805 -9.419 177 HB3 ASN 22 2HB ASN 22 -11.249 1.968 -7.977 178 HD21 ASN 22 2HD2 ASN 22 -13.268 1.307 -8.047 179 HD22 ASN 22 2HD1 ASN 22 -14.548 2.027 -8.967 180 H GLU 23 H GLU 23 -10.335 3.148 -5.443 181 HA GLU 23 HA GLU 23 -13.039 3.594 -4.262 182 HB2 GLU 23 1HB GLU 23 -10.645 2.005 -3.242 183 HB3 GLU 23 2HB GLU 23 -12.212 2.107 -2.451 184 HG2 GLU 23 1HG GLU 23 -13.272 1.005 -4.363 185 HG3 GLU 23 2HG GLU 23 -11.722 0.938 -5.199 186 H ALA 24 H ALA 24 -9.644 4.476 -3.855 187 HA ALA 24 HA ALA 24 -10.574 6.726 -2.154 188 HB1 ALA 24 3HB ALA 24 -8.258 4.891 -1.448 189 HB2 ALA 24 1HB ALA 24 -8.694 6.387 -0.592 190 HB3 ALA 24 2HB ALA 24 -9.808 4.999 -0.583 191 HA PRO 25 HA PRO 25 -7.876 8.065 -5.668 192 HB2 PRO 25 1HB PRO 25 -9.613 10.485 -4.992 193 HB3 PRO 25 2HB PRO 25 -9.135 9.891 -6.588 194 HG2 PRO 25 1HG PRO 25 -11.618 9.416 -5.767 195 HG3 PRO 25 2HG PRO 25 -10.724 8.116 -6.561 196 HD2 PRO 25 1HD PRO 25 -11.248 8.556 -3.599 197 HD3 PRO 25 2HD PRO 25 -11.264 7.014 -4.546 198 H VAL 26 H VAL 26 -8.878 9.899 -2.771 199 HA VAL 26 HA VAL 26 -6.560 11.663 -2.914 200 HB VAL 26 HB VAL 26 -8.481 11.002 -0.630 201 HG11 VAL 26 1HG1 VAL 26 -7.675 13.066 0.407 202 HG12 VAL 26 1HG2 VAL 26 -6.377 11.862 0.220 203 HG13 VAL 26 1HG3 VAL 26 -6.474 13.248 -0.893 204 HG21 VAL 26 2HG3 VAL 26 -9.582 12.015 -2.597 205 HG22 VAL 26 2HG1 VAL 26 -9.532 13.159 -1.236 206 HG23 VAL 26 2HG2 VAL 26 -8.388 13.335 -2.587 207 H THR 27 H THR 27 -7.333 8.869 -0.839 208 HA THR 27 HA THR 27 -4.904 9.088 0.684 209 HB THR 27 HB THR 27 -6.650 6.633 0.189 210 HG1 THR 27 1HG THR 27 -7.773 8.430 1.124 211 HG21 THR 27 2HG3 THR 27 -4.665 7.290 2.399 212 HG22 THR 27 2HG1 THR 27 -5.693 5.841 2.317 213 HG23 THR 27 2HG2 THR 27 -4.417 6.099 1.102 214 H VAL 28 H VAL 28 -5.758 7.123 -2.157 215 HA VAL 28 HA VAL 28 -3.210 5.746 -2.306 216 HB VAL 28 HB VAL 28 -5.313 6.403 -4.424 217 HG11 VAL 28 1HG1 VAL 28 -4.235 4.691 -5.800 218 HG12 VAL 28 1HG2 VAL 28 -3.149 6.062 -5.471 219 HG13 VAL 28 1HG3 VAL 28 -2.944 4.530 -4.587 220 HG21 VAL 28 2HG3 VAL 28 -6.106 4.931 -2.605 221 HG22 VAL 28 2HG1 VAL 28 -5.948 4.030 -4.131 222 HG23 VAL 28 2HG2 VAL 28 -4.710 3.856 -2.864 223 H ALA 29 H ALA 29 -4.403 8.728 -3.818 224 HA ALA 29 HA ALA 29 -2.093 9.216 -5.396 225 HB1 ALA 29 3HB ALA 29 -3.967 11.208 -4.071 226 HB2 ALA 29 1HB ALA 29 -2.830 11.571 -5.389 227 HB3 ALA 29 2HB ALA 29 -4.193 10.461 -5.670 228 H ASN 30 H ASN 30 -2.852 10.211 -2.058 229 HA ASN 30 HA ASN 30 -0.474 11.754 -1.649 230 HB2 ASN 30 1HB ASN 30 -2.313 10.291 0.256 231 HB3 ASN 30 2HB ASN 30 -0.938 11.243 0.799 232 HD21 ASN 30 2HD2 ASN 30 -3.619 11.765 1.469 233 HD22 ASN 30 2HD1 ASN 30 -4.055 13.299 0.794 234 H PHE 31 H PHE 31 -1.174 8.339 -0.872 235 HA PHE 31 HA PHE 31 1.422 7.761 0.194 236 HB2 PHE 31 1HB PHE 31 -0.608 6.302 0.452 237 HB3 PHE 31 2HB PHE 31 -0.502 5.892 -1.253 238 HD1 PHE 31 1HD PHE 31 1.084 5.504 2.041 239 HD2 PHE 31 2HD PHE 31 1.160 4.364 -2.074 240 HE1 PHE 31 1HE PHE 31 2.630 3.652 2.585 241 HE2 PHE 31 2HE PHE 31 2.703 2.508 -1.535 242 HZ PHE 31 HZ PHE 31 3.438 2.155 0.796 243 H GLU 32 H GLU 32 0.123 7.414 -3.107 244 HA GLU 32 HA GLU 32 2.442 6.286 -4.294 245 HB2 GLU 32 1HB GLU 32 0.339 6.413 -5.518 246 HB3 GLU 32 2HB GLU 32 0.330 8.169 -5.421 247 HG2 GLU 32 1HG GLU 32 2.485 8.132 -6.769 248 HG3 GLU 32 2HG GLU 32 2.182 6.416 -7.034 249 H LYS 33 H LYS 33 1.563 9.722 -3.902 250 HA LYS 33 HA LYS 33 3.855 10.740 -5.283 251 HB2 LYS 33 1HB LYS 33 2.065 11.948 -3.142 252 HB3 LYS 33 2HB LYS 33 3.351 12.845 -3.938 253 HG2 LYS 33 1HG LYS 33 2.256 12.519 -6.115 254 HG3 LYS 33 2HG LYS 33 0.974 11.582 -5.334 255 HD2 LYS 33 1HD LYS 33 0.384 13.557 -3.953 256 HD3 LYS 33 2HD LYS 33 1.653 14.491 -4.758 257 HE2 LYS 33 1HE LYS 33 0.520 14.148 -6.934 258 HE3 LYS 33 2HE LYS 33 -0.750 13.224 -6.126 259 HZ1 LYS 33 3HZ LYS 33 -0.108 16.052 -5.615 260 HZ2 LYS 33 1HZ LYS 33 -1.397 15.492 -6.479 261 HZ3 LYS 33 2HZ LYS 33 -1.293 15.189 -4.860 262 H LEU 34 H LEU 34 3.291 10.257 -1.790 263 HA LEU 34 HA LEU 34 5.839 11.163 -0.919 264 HB2 LEU 34 1HB LEU 34 3.933 9.069 0.191 265 HB3 LEU 34 2HB LEU 34 5.407 9.562 1.029 266 HG LEU 34 HG LEU 34 3.123 11.437 0.321 267 HD11 LEU 34 1HD1 LEU 34 2.577 11.318 2.710 268 HD12 LEU 34 1HD2 LEU 34 2.418 9.731 1.920 269 HD13 LEU 34 1HD3 LEU 34 3.836 10.082 2.937 270 HD21 LEU 34 2HD3 LEU 34 5.340 12.514 0.514 271 HD22 LEU 34 2HD1 LEU 34 4.292 12.953 1.884 272 HD23 LEU 34 2HD2 LEU 34 5.577 11.741 2.100 273 H ALA 35 H ALA 35 4.798 7.861 -1.782 274 HA ALA 35 HA ALA 35 7.272 6.598 -1.239 275 HB1 ALA 35 3HB ALA 35 5.203 5.910 -3.357 276 HB2 ALA 35 1HB ALA 35 6.486 4.827 -2.768 277 HB3 ALA 35 2HB ALA 35 5.193 5.359 -1.666 278 H ASN 36 H ASN 36 6.083 8.042 -4.281 279 HA ASN 36 HA ASN 36 8.476 7.248 -5.746 280 HB2 ASN 36 1HB ASN 36 6.165 9.093 -6.393 281 HB3 ASN 36 2HB ASN 36 7.501 8.795 -7.497 282 HD21 ASN 36 2HD2 ASN 36 4.840 8.211 -8.093 283 HD22 ASN 36 2HD1 ASN 36 4.670 6.493 -8.246 284 H GLU 37 H GLU 37 7.561 9.988 -3.818 285 HA GLU 37 HA GLU 37 9.824 11.618 -4.785 286 HB2 GLU 37 1HB GLU 37 7.834 11.949 -2.503 287 HB3 GLU 37 2HB GLU 37 9.137 13.085 -2.823 288 HG2 GLU 37 1HG GLU 37 8.213 13.630 -4.989 289 HG3 GLU 37 2HG GLU 37 6.983 12.378 -4.824 290 H GLY 38 H GLY 38 9.629 8.895 -2.956 291 HA2 GLY 38 1HA GLY 38 11.470 7.812 -2.010 292 HA3 GLY 38 2HA GLY 38 12.405 9.319 -2.143 293 H PHE 39 H PHE 39 9.276 9.480 -0.667 294 HA PHE 39 HA PHE 39 10.373 10.354 1.874 295 HB2 PHE 39 1HB PHE 39 8.212 11.201 1.062 296 HB3 PHE 39 2HB PHE 39 7.548 9.576 1.034 297 HD1 PHE 39 1HD PHE 39 8.940 12.164 3.313 298 HD2 PHE 39 2HD PHE 39 6.525 8.660 2.927 299 HE1 PHE 39 1HE PHE 39 8.170 12.439 5.647 300 HE2 PHE 39 2HE PHE 39 5.752 8.934 5.259 301 HZ PHE 39 HZ PHE 39 6.577 10.823 6.619 302 H TYR 40 H TYR 40 8.440 7.470 1.000 303 HA TYR 40 HA TYR 40 8.839 6.268 3.613 304 HB2 TYR 40 1HB TYR 40 7.834 5.147 0.972 305 HB3 TYR 40 2HB TYR 40 7.882 4.226 2.469 306 HD1 TYR 40 2HD TYR 40 6.760 5.519 4.550 307 HD2 TYR 40 1HD TYR 40 5.851 6.153 0.405 308 HE1 TYR 40 2HE TYR 40 4.543 6.416 5.173 309 HE2 TYR 40 1HE TYR 40 3.634 7.051 1.029 310 HH TYR 40 HH TYR 40 2.725 7.515 4.423 311 H ASN 41 H ASN 41 10.573 6.173 0.576 312 HA ASN 41 HA ASN 41 12.285 3.950 1.173 313 HB2 ASN 41 1HB ASN 41 12.121 5.028 -1.049 314 HB3 ASN 41 2HB ASN 41 12.895 6.468 -0.400 315 HD21 ASN 41 2HD2 ASN 41 13.801 4.786 -2.551 316 HD22 ASN 41 2HD1 ASN 41 15.349 4.163 -2.085 317 H GLY 42 H GLY 42 13.344 3.679 2.969 318 HA2 GLY 42 1HA GLY 42 15.437 4.236 4.111 319 HA3 GLY 42 2HA GLY 42 15.030 5.958 3.920 320 H LEU 43 H LEU 43 12.126 4.997 4.565 321 HA LEU 43 HA LEU 43 12.391 5.328 7.496 322 HB2 LEU 43 1HB LEU 43 9.926 5.103 5.720 323 HB3 LEU 43 2HB LEU 43 9.929 5.521 7.437 324 HG LEU 43 HG LEU 43 11.023 7.193 5.150 325 HD11 LEU 43 1HD1 LEU 43 9.256 8.748 5.847 326 HD12 LEU 43 1HD2 LEU 43 8.590 7.173 5.355 327 HD13 LEU 43 1HD3 LEU 43 8.719 7.585 7.081 328 HD21 LEU 43 2HD3 LEU 43 12.460 7.364 7.156 329 HD22 LEU 43 2HD1 LEU 43 11.530 8.861 6.903 330 HD23 LEU 43 2HD2 LEU 43 11.025 7.700 8.154 331 H THR 44 H THR 44 10.754 4.032 8.830 332 HA THR 44 HA THR 44 11.254 1.152 8.151 333 HB THR 44 HB THR 44 11.973 0.725 10.416 334 HG1 THR 44 1HG THR 44 12.060 2.480 11.930 335 HG21 THR 44 2HG3 THR 44 13.322 3.258 9.404 336 HG22 THR 44 2HG1 THR 44 14.004 2.109 10.577 337 HG23 THR 44 2HG2 THR 44 13.716 1.598 8.898 338 H PHE 45 H PHE 45 10.044 -0.349 9.628 339 HA PHE 45 HA PHE 45 7.342 0.751 10.268 340 HB2 PHE 45 1HB PHE 45 8.427 -2.093 10.130 341 HB3 PHE 45 2HB PHE 45 6.808 -1.692 10.681 342 HD1 PHE 45 2HD PHE 45 5.134 -0.803 9.117 343 HD2 PHE 45 1HD PHE 45 9.015 -2.013 7.803 344 HE1 PHE 45 2HE PHE 45 4.322 -0.864 6.783 345 HE2 PHE 45 1HE PHE 45 8.208 -2.072 5.467 346 HZ PHE 45 HZ PHE 45 5.861 -1.497 4.957 347 H HIS 46 H HIS 46 7.382 1.801 12.146 348 HA HIS 46 HA HIS 46 9.444 1.182 14.100 349 HB2 HIS 46 1HB HIS 46 8.517 3.056 15.361 350 HB3 HIS 46 2HB HIS 46 8.652 3.506 13.668 351 HD2 HIS 46 2HD HIS 46 6.074 3.932 12.304 352 HE1 HIS 46 1HE HIS 46 3.860 3.550 15.910 353 H ARG 47 H ARG 47 6.177 0.179 13.636 354 HA ARG 47 HA ARG 47 6.308 -1.312 16.214 355 HB2 ARG 47 1HB ARG 47 5.006 0.819 16.577 356 HB3 ARG 47 2HB ARG 47 3.892 0.308 15.318 357 HG2 ARG 47 1HG ARG 47 3.260 -1.653 16.646 358 HG3 ARG 47 2HG ARG 47 4.406 -1.162 17.916 359 HD2 ARG 47 1HD ARG 47 3.185 0.879 18.269 360 HD3 ARG 47 2HD ARG 47 2.075 0.471 16.940 361 HE ARG 47 HE ARG 47 2.103 -1.638 18.841 362 HH11 ARG 47 1HH1 ARG 47 0.984 1.668 18.444 363 HH12 ARG 47 1HH2 ARG 47 -0.359 1.480 19.550 364 HH21 ARG 47 2HH1 ARG 47 0.357 -1.870 20.275 365 HH22 ARG 47 2HH2 ARG 47 -0.714 -0.522 20.587 366 H VAL 48 H VAL 48 6.712 -3.154 15.019 367 HA VAL 48 HA VAL 48 4.412 -4.139 13.349 368 HB VAL 48 HB VAL 48 7.215 -5.280 13.782 369 HG11 VAL 48 1HG1 VAL 48 6.659 -6.780 11.932 370 HG12 VAL 48 1HG2 VAL 48 5.568 -7.002 13.321 371 HG13 VAL 48 1HG3 VAL 48 5.010 -6.110 11.886 372 HG21 VAL 48 2HG3 VAL 48 7.249 -3.163 12.508 373 HG22 VAL 48 2HG1 VAL 48 7.628 -4.547 11.456 374 HG23 VAL 48 2HG2 VAL 48 6.011 -3.806 11.403 375 H ILE 49 H ILE 49 3.020 -5.521 14.011 376 HA ILE 49 HA ILE 49 3.685 -7.144 16.455 377 HB ILE 49 HB ILE 49 0.951 -6.022 15.666 378 HG12 ILE 49 1HG1 ILE 49 2.734 -5.129 17.941 379 HG13 ILE 49 1HG2 ILE 49 2.570 -4.272 16.417 380 HG21 ILE 49 2HG1 ILE 49 0.272 -6.836 17.888 381 HG22 ILE 49 2HG2 ILE 49 0.874 -8.169 16.876 382 HG23 ILE 49 2HG3 ILE 49 1.907 -7.487 18.154 383 HD11 ILE 49 1HD3 ILE 49 0.334 -4.829 18.379 384 HD12 ILE 49 1HD1 ILE 49 1.169 -3.277 18.136 385 HD13 ILE 49 1HD2 ILE 49 0.169 -3.963 16.833 386 HA PRO 50 HA PRO 50 3.166 -10.188 13.173 387 HB2 PRO 50 1HB PRO 50 4.243 -11.766 15.552 388 HB3 PRO 50 2HB PRO 50 4.734 -11.870 13.856 389 HG2 PRO 50 1HG PRO 50 6.336 -10.593 15.554 390 HG3 PRO 50 2HG PRO 50 6.039 -9.879 13.966 391 HD2 PRO 50 1HD PRO 50 4.812 -9.162 16.654 392 HD3 PRO 50 2HD PRO 50 5.362 -8.069 15.322 393 H GLY 51 H GLY 51 1.371 -11.118 12.765 394 HA2 GLY 51 1HA GLY 51 -0.287 -12.778 13.201 395 HA3 GLY 51 2HA GLY 51 -0.016 -12.575 14.947 396 H PHE 52 H PHE 52 -0.027 -9.515 13.987 397 HA PHE 52 HA PHE 52 -3.011 -9.231 13.944 398 HB2 PHE 52 1HB PHE 52 -1.016 -7.722 15.683 399 HB3 PHE 52 2HB PHE 52 -2.678 -7.210 15.434 400 HD1 PHE 52 2HD PHE 52 -4.538 -8.480 16.380 401 HD2 PHE 52 1HD PHE 52 -0.480 -9.630 17.062 402 HE1 PHE 52 2HE PHE 52 -5.266 -9.927 18.248 403 HE2 PHE 52 1HE PHE 52 -1.204 -11.080 18.930 404 HZ PHE 52 HZ PHE 52 -3.597 -11.228 19.522 405 H VAL 53 H VAL 53 -0.873 -6.523 14.281 406 HA VAL 53 HA VAL 53 -1.061 -5.910 11.353 407 HB VAL 53 HB VAL 53 -1.856 -3.637 11.866 408 HG11 VAL 53 1HG1 VAL 53 -4.158 -4.141 12.524 409 HG12 VAL 53 1HG2 VAL 53 -3.530 -5.316 11.344 410 HG13 VAL 53 1HG3 VAL 53 -3.649 -5.758 13.065 411 HG21 VAL 53 2HG3 VAL 53 -0.886 -3.453 14.131 412 HG22 VAL 53 2HG1 VAL 53 -2.622 -3.064 14.149 413 HG23 VAL 53 2HG2 VAL 53 -2.059 -4.649 14.733 414 H SER 54 H SER 54 0.081 -3.785 10.902 415 HA SER 54 HA SER 54 2.450 -3.340 12.714 416 HB2 SER 54 1HB SER 54 4.014 -3.528 11.023 417 HB3 SER 54 2HB SER 54 3.146 -5.045 11.207 418 HG SER 54 HG SER 54 1.804 -4.309 9.467 419 H GLN 55 H GLN 55 3.225 -1.278 12.629 420 HA GLN 55 HA GLN 55 1.969 0.583 10.643 421 HB2 GLN 55 1HB GLN 55 1.019 0.863 12.959 422 HB3 GLN 55 2HB GLN 55 2.640 1.201 13.550 423 HG2 GLN 55 1HG GLN 55 2.777 3.184 12.138 424 HG3 GLN 55 2HG GLN 55 1.156 2.830 11.477 425 HE21 GLN 55 2HE2 GLN 55 1.005 5.166 12.335 426 HE22 GLN 55 2HE1 GLN 55 0.413 5.334 13.954 427 H GLY 56 H GLY 56 3.230 1.920 9.571 428 HA2 GLY 56 1HA GLY 56 5.959 2.487 10.503 429 HA3 GLY 56 2HA GLY 56 5.853 1.476 9.044 430 H GLY 57 H GLY 57 7.126 3.500 8.340 431 HA2 GLY 57 1HA GLY 57 6.992 5.132 6.641 432 HA3 GLY 57 2HA GLY 57 5.234 5.243 6.897 433 H CYS 58 H CYS 58 7.221 5.310 9.716 434 HA CYS 58 HA CYS 58 6.323 8.067 10.370 435 HB2 CYS 58 1HB CYS 58 6.161 6.325 12.003 436 HB3 CYS 58 2HB CYS 58 7.906 6.117 11.970 437 HG CYS 58 HG CYS 58 7.092 7.356 14.116 438 HA PRO 59 HA PRO 59 10.274 9.551 8.851 439 HB2 PRO 59 1HB PRO 59 9.647 12.209 8.892 440 HB3 PRO 59 2HB PRO 59 8.892 11.152 7.692 441 HG2 PRO 59 1HG PRO 59 7.776 12.120 10.359 442 HG3 PRO 59 2HG PRO 59 6.988 12.122 8.778 443 HD2 PRO 59 1HD PRO 59 6.544 10.132 10.598 444 HD3 PRO 59 2HD PRO 59 6.558 9.808 8.819 445 H ARG 60 H ARG 60 8.751 10.239 11.878 446 HA ARG 60 HA ARG 60 11.095 11.727 12.891 447 HB2 ARG 60 1HB ARG 60 8.556 10.755 14.261 448 HB3 ARG 60 2HB ARG 60 9.796 11.739 15.023 449 HG2 ARG 60 1HG ARG 60 9.346 13.524 13.329 450 HG3 ARG 60 2HG ARG 60 7.993 12.536 12.728 451 HD2 ARG 60 1HD ARG 60 7.071 12.550 15.035 452 HD3 ARG 60 2HD ARG 60 8.338 13.723 15.467 453 HE ARG 60 HE ARG 60 5.976 14.178 13.802 454 HH11 ARG 60 1HH1 ARG 60 9.090 15.368 14.911 455 HH12 ARG 60 1HH2 ARG 60 8.736 17.035 14.513 456 HH21 ARG 60 2HH1 ARG 60 5.527 16.344 13.290 457 HH22 ARG 60 2HH2 ARG 60 6.720 17.588 13.596 458 H GLY 61 H GLY 61 9.727 8.496 13.055 459 HA2 GLY 61 1HA GLY 61 10.843 6.527 13.643 460 HA3 GLY 61 2HA GLY 61 12.267 7.489 14.104 461 H ASN 62 H ASN 62 9.492 8.792 15.483 462 HA ASN 62 HA ASN 62 10.116 7.433 18.085 463 HB2 ASN 62 1HB ASN 62 9.088 10.227 17.514 464 HB3 ASN 62 2HB ASN 62 9.209 9.516 19.118 465 HD21 ASN 62 2HD2 ASN 62 10.732 11.440 16.915 466 HD22 ASN 62 2HD1 ASN 62 12.357 11.318 17.503 467 H GLY 63 H GLY 63 8.007 7.137 15.702 468 HA2 GLY 63 1HA GLY 63 6.032 5.816 15.884 469 HA3 GLY 63 2HA GLY 63 5.849 6.337 17.575 470 H THR 64 H THR 64 6.591 9.139 16.281 471 HA THR 64 HA THR 64 3.718 9.828 15.790 472 HB THR 64 HB THR 64 6.044 11.588 16.689 473 HG1 THR 64 1HG THR 64 4.813 11.606 18.656 474 HG21 THR 64 2HG3 THR 64 3.079 12.192 16.370 475 HG22 THR 64 2HG1 THR 64 4.304 13.297 17.036 476 HG23 THR 64 2HG2 THR 64 4.381 12.806 15.326 477 H GLY 65 H GLY 65 3.025 10.733 13.996 478 HA2 GLY 65 1HA GLY 65 4.805 10.637 11.689 479 HA3 GLY 65 2HA GLY 65 3.080 11.072 11.692 480 H ASP 66 H ASP 66 4.800 12.464 10.090 481 HA ASP 66 HA ASP 66 4.695 15.152 11.400 482 HB2 ASP 66 1HB ASP 66 7.080 14.275 11.294 483 HB3 ASP 66 2HB ASP 66 6.926 14.224 9.544 484 H ALA 67 H ALA 67 2.560 14.610 10.145 485 HA ALA 67 HA ALA 67 2.672 16.258 7.744 486 HB1 ALA 67 3HB ALA 67 1.874 13.335 7.505 487 HB2 ALA 67 1HB ALA 67 1.690 14.568 6.237 488 HB3 ALA 67 2HB ALA 67 3.315 14.090 6.784 489 H GLY 68 H GLY 68 0.481 16.499 6.743 490 HA2 GLY 68 1HA GLY 68 -1.768 15.862 8.544 491 HA3 GLY 68 2HA GLY 68 -1.379 17.587 8.351 492 H TYR 69 H TYR 69 -2.674 14.712 6.850 493 HA TYR 69 HA TYR 69 -3.244 16.240 4.336 494 HB2 TYR 69 1HB TYR 69 -3.216 13.249 4.890 495 HB3 TYR 69 2HB TYR 69 -3.693 13.979 3.364 496 HD1 TYR 69 2HD TYR 69 -1.984 15.390 2.103 497 HD2 TYR 69 1HD TYR 69 -0.964 12.811 5.377 498 HE1 TYR 69 2HE TYR 69 0.372 15.374 1.357 499 HE2 TYR 69 1HE TYR 69 1.391 12.796 4.631 500 HH TYR 69 HH TYR 69 2.419 14.622 1.743 501 H THR 70 H THR 70 -5.260 16.362 3.463 502 HA THR 70 HA THR 70 -7.515 15.856 5.317 503 HB THR 70 HB THR 70 -7.456 17.063 2.514 504 HG1 THR 70 1HG THR 70 -7.777 19.015 3.725 505 HG21 THR 70 2HG3 THR 70 -9.662 16.953 4.607 506 HG22 THR 70 2HG1 THR 70 -9.740 17.813 3.051 507 HG23 THR 70 2HG2 THR 70 -9.631 16.037 3.083 508 H ILE 71 H ILE 71 -8.050 13.808 5.510 509 HA ILE 71 HA ILE 71 -8.490 12.242 2.977 510 HB ILE 71 HB ILE 71 -7.957 11.194 5.802 511 HG12 ILE 71 1HG1 ILE 71 -5.965 12.296 4.954 512 HG13 ILE 71 1HG2 ILE 71 -5.745 10.554 5.014 513 HG21 ILE 71 2HG1 ILE 71 -7.689 9.030 4.660 514 HG22 ILE 71 2HG2 ILE 71 -9.313 9.701 4.384 515 HG23 ILE 71 2HG3 ILE 71 -8.082 9.798 3.103 516 HD11 ILE 71 1HD3 ILE 71 -6.375 12.171 2.535 517 HD12 ILE 71 1HD1 ILE 71 -4.793 11.489 2.981 518 HD13 ILE 71 1HD2 ILE 71 -6.154 10.407 2.596 519 HA PRO 72 HA PRO 72 -12.779 12.800 4.199 520 HB2 PRO 72 1HB PRO 72 -12.930 11.448 1.483 521 HB3 PRO 72 2HB PRO 72 -13.820 12.866 2.054 522 HG2 PRO 72 1HG PRO 72 -11.831 13.235 0.323 523 HG3 PRO 72 2HG PRO 72 -11.988 14.340 1.692 524 HD2 PRO 72 1HD PRO 72 -10.124 11.950 1.363 525 HD3 PRO 72 2HD PRO 72 -9.753 13.603 1.998 526 H CYS 73 H CYS 73 -14.159 11.426 5.039 527 HA CYS 73 HA CYS 73 -13.257 8.648 5.518 528 HB2 CYS 73 1HB CYS 73 -14.258 10.058 7.242 529 HB3 CYS 73 2HB CYS 73 -15.787 9.954 6.381 530 HG CYS 73 HG CYS 73 -15.824 8.403 8.426 531 H GLU 74 H GLU 74 -13.431 8.472 2.923 532 HA GLU 74 HA GLU 74 -16.150 8.090 1.909 533 HB2 GLU 74 1HB GLU 74 -14.223 8.835 0.475 534 HB3 GLU 74 2HB GLU 74 -13.471 7.264 0.712 535 HG2 GLU 74 1HG GLU 74 -15.342 6.166 -0.408 536 HG3 GLU 74 2HG GLU 74 -16.167 7.712 -0.587 537 H THR 75 H THR 75 -17.402 6.444 2.222 538 HA THR 75 HA THR 75 -16.124 3.742 2.517 539 HB THR 75 HB THR 75 -18.092 3.061 3.831 540 HG1 THR 75 1HG THR 75 -19.599 4.715 4.448 541 HG21 THR 75 2HG3 THR 75 -16.852 5.634 4.878 542 HG22 THR 75 2HG1 THR 75 -17.683 4.405 5.856 543 HG23 THR 75 2HG2 THR 75 -16.154 4.007 5.037 544 H ASP 76 H ASP 76 -18.346 5.746 0.795 545 HA ASP 76 HA ASP 76 -19.923 3.706 -0.459 546 HB2 ASP 76 1HB ASP 76 -20.414 6.173 -0.533 547 HB3 ASP 76 2HB ASP 76 -19.033 6.391 -1.599 548 H ASN 77 H ASN 77 -19.198 2.020 -1.484 549 HA ASN 77 HA ASN 77 -17.832 0.665 -2.790 550 HB2 ASN 77 1HB ASN 77 -18.739 2.399 -4.478 551 HB3 ASN 77 2HB ASN 77 -17.143 3.130 -4.384 552 HD21 ASN 77 2HD2 ASN 77 -16.699 2.660 -6.535 553 HD22 ASN 77 2HD1 ASN 77 -16.341 1.051 -7.072 554 H ASN 78 H ASN 78 -16.692 1.629 -0.436 555 HA ASN 78 HA ASN 78 -13.842 1.341 -1.199 556 HB2 ASN 78 1HB ASN 78 -14.276 3.798 -1.084 557 HB3 ASN 78 2HB ASN 78 -14.788 3.598 0.587 558 HD21 ASN 78 2HD2 ASN 78 -13.088 5.055 1.142 559 HD22 ASN 78 2HD1 ASN 78 -11.456 4.486 1.271 560 HA PRO 79 HA PRO 79 -15.219 -1.268 2.376 561 HB2 PRO 79 1HB PRO 79 -13.187 -2.992 0.899 562 HB3 PRO 79 2HB PRO 79 -14.725 -3.484 1.621 563 HG2 PRO 79 1HG PRO 79 -14.591 -3.268 -1.028 564 HG3 PRO 79 2HG PRO 79 -16.012 -2.633 -0.193 565 HD2 PRO 79 1HD PRO 79 -13.580 -1.136 -1.251 566 HD3 PRO 79 2HD PRO 79 -15.330 -0.687 -1.355 567 H HIS 80 H HIS 80 -14.244 -1.408 4.236 568 HA HIS 80 HA HIS 80 -11.311 -0.771 4.288 569 HB2 HIS 80 1HB HIS 80 -13.465 0.003 6.304 570 HB3 HIS 80 2HB HIS 80 -11.741 0.281 6.510 571 HD2 HIS 80 2HD HIS 80 -14.758 2.120 5.186 572 HE1 HIS 80 1HE HIS 80 -11.373 3.992 3.395 573 H ARG 81 H ARG 81 -11.890 -3.338 3.955 574 HA ARG 81 HA ARG 81 -12.145 -4.698 6.546 575 HB2 ARG 81 1HB ARG 81 -11.401 -5.713 3.774 576 HB3 ARG 81 2HB ARG 81 -11.636 -6.737 5.183 577 HG2 ARG 81 1HG ARG 81 -13.974 -6.162 5.295 578 HG3 ARG 81 2HG ARG 81 -13.778 -4.950 4.006 579 HD2 ARG 81 1HD ARG 81 -13.191 -7.876 3.660 580 HD3 ARG 81 2HD ARG 81 -14.758 -7.119 3.292 581 HE ARG 81 HE ARG 81 -12.892 -5.604 1.932 582 HH11 ARG 81 1HH1 ARG 81 -13.831 -8.989 1.993 583 HH12 ARG 81 1HH2 ARG 81 -13.410 -9.266 0.318 584 HH21 ARG 81 2HH1 ARG 81 -12.348 -5.975 -0.241 585 HH22 ARG 81 2HH2 ARG 81 -12.570 -7.560 -0.948 586 H HIS 82 H HIS 82 -10.644 -5.322 7.891 587 HA HIS 82 HA HIS 82 -7.802 -4.825 7.117 588 HB2 HIS 82 1HB HIS 82 -9.191 -5.127 9.810 589 HB3 HIS 82 2HB HIS 82 -7.442 -5.115 9.637 590 HD2 HIS 82 2HD HIS 82 -6.509 -2.631 10.177 591 HE1 HIS 82 1HE HIS 82 -9.795 -0.396 8.636 592 H VAL 83 H VAL 83 -7.849 -6.748 5.770 593 HA VAL 83 HA VAL 83 -7.422 -9.240 7.418 594 HB VAL 83 HB VAL 83 -7.919 -10.485 5.361 595 HG11 VAL 83 1HG1 VAL 83 -10.296 -9.966 5.106 596 HG12 VAL 83 1HG2 VAL 83 -9.792 -9.956 6.812 597 HG13 VAL 83 1HG3 VAL 83 -10.049 -8.420 5.949 598 HG21 VAL 83 2HG3 VAL 83 -7.033 -8.831 3.753 599 HG22 VAL 83 2HG1 VAL 83 -8.695 -9.306 3.329 600 HG23 VAL 83 2HG2 VAL 83 -8.390 -7.742 4.123 601 H THR 84 H THR 84 -6.034 -10.821 5.976 602 HA THR 84 HA THR 84 -3.376 -9.911 6.311 603 HB THR 84 HB THR 84 -4.361 -12.093 4.419 604 HG1 THR 84 1HG THR 84 -3.506 -12.273 7.140 605 HG21 THR 84 2HG3 THR 84 -1.670 -11.637 5.765 606 HG22 THR 84 2HG1 THR 84 -2.109 -13.035 4.755 607 HG23 THR 84 2HG2 THR 84 -2.017 -11.411 4.035 608 H GLY 85 H GLY 85 -2.325 -8.367 5.365 609 HA2 GLY 85 1HA GLY 85 -1.059 -7.648 3.476 610 HA3 GLY 85 2HA GLY 85 -2.275 -8.372 2.397 611 H ALA 86 H ALA 86 -4.144 -6.940 4.593 612 HA ALA 86 HA ALA 86 -4.946 -4.818 2.861 613 HB1 ALA 86 3HB ALA 86 -5.491 -5.210 5.825 614 HB2 ALA 86 1HB ALA 86 -6.368 -4.101 4.746 615 HB3 ALA 86 2HB ALA 86 -6.467 -5.860 4.487 616 H MET 87 H MET 87 -4.314 -2.813 2.581 617 HA MET 87 HA MET 87 -2.389 -1.662 4.582 618 HB2 MET 87 1HB MET 87 -1.360 -2.215 2.375 619 HB3 MET 87 2HB MET 87 -2.526 -1.163 1.585 620 HG2 MET 87 1HG MET 87 -1.627 0.771 2.821 621 HG3 MET 87 2HG MET 87 -0.460 -0.283 3.622 622 HE1 MET 87 3HE MET 87 0.761 -2.193 1.642 623 HE2 MET 87 1HE MET 87 2.052 -1.226 0.888 624 HE3 MET 87 2HE MET 87 1.737 -1.082 2.635 625 H SER 88 H SER 88 -2.967 0.071 5.611 626 HA SER 88 HA SER 88 -5.248 1.747 4.514 627 HB2 SER 88 1HB SER 88 -6.265 1.840 6.581 628 HB3 SER 88 2HB SER 88 -6.111 0.165 6.074 629 HG SER 88 HG SER 88 -4.417 1.543 7.851 630 H MET 89 H MET 89 -5.276 3.894 5.246 631 HA MET 89 HA MET 89 -2.611 4.929 6.088 632 HB2 MET 89 1HB MET 89 -3.728 5.888 4.072 633 HB3 MET 89 2HB MET 89 -5.076 6.398 5.079 634 HG2 MET 89 1HG MET 89 -3.638 8.279 4.682 635 HG3 MET 89 2HG MET 89 -3.521 7.834 6.387 636 HE1 MET 89 3HE MET 89 -1.732 8.146 2.968 637 HE2 MET 89 1HE MET 89 -0.264 7.163 3.182 638 HE3 MET 89 2HE MET 89 -1.858 6.374 3.080 639 H ALA 90 H ALA 90 -2.168 5.793 7.967 640 HA ALA 90 HA ALA 90 -4.067 5.550 10.131 641 HB1 ALA 90 3HB ALA 90 -1.398 6.998 10.000 642 HB2 ALA 90 1HB ALA 90 -2.306 6.627 11.484 643 HB3 ALA 90 2HB ALA 90 -1.648 5.306 10.488 644 H HIS 91 H HIS 91 -5.142 7.072 11.309 645 HA HIS 91 HA HIS 91 -5.017 9.907 10.556 646 HB2 HIS 91 1HB HIS 91 -7.297 10.124 9.812 647 HB3 HIS 91 2HB HIS 91 -6.544 8.885 8.817 648 HD2 HIS 91 2HD HIS 91 -7.628 6.315 9.072 649 HE1 HIS 91 1HE HIS 91 -10.675 7.409 11.843 650 H ARG 92 H ARG 92 -6.462 11.252 11.840 651 HA ARG 92 HA ARG 92 -7.200 9.924 14.430 652 HB2 ARG 92 1HB ARG 92 -6.171 12.749 13.955 653 HB3 ARG 92 2HB ARG 92 -6.747 12.131 15.496 654 HG2 ARG 92 1HG ARG 92 -4.915 10.474 15.510 655 HG3 ARG 92 2HG ARG 92 -4.322 11.145 13.971 656 HD2 ARG 92 1HD ARG 92 -4.020 13.309 15.036 657 HD3 ARG 92 2HD ARG 92 -4.599 12.629 16.574 658 HE ARG 92 HE ARG 92 -2.440 11.071 15.565 659 HH11 ARG 92 1HH1 ARG 92 -3.135 14.171 17.063 660 HH12 ARG 92 1HH2 ARG 92 -1.557 14.306 17.807 661 HH21 ARG 92 2HH1 ARG 92 -0.396 11.258 16.535 662 HH22 ARG 92 2HH2 ARG 92 -0.006 12.658 17.508 663 H GLY 93 H GLY 93 -8.941 10.023 12.245 664 HA2 GLY 93 1HA GLY 93 -11.371 10.512 12.767 665 HA3 GLY 93 2HA GLY 93 -10.844 12.183 13.070 666 H ARG 94 H ARG 94 -12.719 12.233 11.351 667 HA ARG 94 HA ARG 94 -12.015 11.613 8.607 668 HB2 ARG 94 1HB ARG 94 -14.366 11.857 9.436 669 HB3 ARG 94 2HB ARG 94 -14.077 13.570 9.697 670 HG2 ARG 94 1HG ARG 94 -13.737 13.915 7.308 671 HG3 ARG 94 2HG ARG 94 -13.939 12.171 7.014 672 HD2 ARG 94 1HD ARG 94 -16.199 12.266 7.833 673 HD3 ARG 94 2HD ARG 94 -16.006 13.991 8.227 674 HE ARG 94 HE ARG 94 -15.382 13.634 5.504 675 HH11 ARG 94 1HH1 ARG 94 -18.146 13.416 7.660 676 HH12 ARG 94 1HH2 ARG 94 -19.307 13.822 6.416 677 HH21 ARG 94 2HH1 ARG 94 -16.898 14.160 3.897 678 HH22 ARG 94 2HH2 ARG 94 -18.602 14.242 4.286 679 H ASP 95 H ASP 95 -11.180 12.785 7.012 680 HA ASP 95 HA ASP 95 -9.887 14.445 6.023 681 HB2 ASP 95 1HB ASP 95 -11.561 16.207 7.865 682 HB3 ASP 95 2HB ASP 95 -10.525 16.811 6.579 683 H THR 96 H THR 96 -8.779 13.062 8.248 684 HA THR 96 HA THR 96 -6.716 15.032 9.030 685 HB THR 96 HB THR 96 -8.223 13.458 11.161 686 HG1 THR 96 1HG THR 96 -9.574 15.102 10.463 687 HG21 THR 96 2HG3 THR 96 -6.140 15.671 11.315 688 HG22 THR 96 2HG1 THR 96 -6.942 14.894 12.700 689 HG23 THR 96 2HG2 THR 96 -5.853 13.950 11.658 690 H GLY 97 H GLY 97 -5.766 13.517 7.416 691 HA2 GLY 97 1HA GLY 97 -5.040 10.898 8.649 692 HA3 GLY 97 2HA GLY 97 -4.970 11.287 6.915 693 H SER 98 H SER 98 -2.832 10.119 8.309 694 HA SER 98 HA SER 98 -0.795 12.362 8.487 695 HB2 SER 98 1HB SER 98 0.387 11.211 10.014 696 HB3 SER 98 2HB SER 98 -1.282 11.135 10.556 697 HG SER 98 HG SER 98 -1.416 9.085 9.619 698 H CYS 99 H CYS 99 1.475 11.167 8.230 699 HA CYS 99 HA CYS 99 1.569 9.988 5.488 700 HB2 CYS 99 1HB CYS 99 3.897 10.244 5.628 701 HB3 CYS 99 2HB CYS 99 3.065 11.751 5.985 702 HG CYS 99 HG CYS 99 3.267 11.559 8.570 703 H GLN 100 H GLN 100 1.119 8.830 8.613 704 HA GLN 100 HA GLN 100 2.798 6.411 8.261 705 HB2 GLN 100 1HB GLN 100 0.907 7.257 10.498 706 HB3 GLN 100 2HB GLN 100 1.893 5.801 10.510 707 HG2 GLN 100 1HG GLN 100 3.923 7.090 10.552 708 HG3 GLN 100 2HG GLN 100 3.006 8.607 10.336 709 HE21 GLN 100 2HE2 GLN 100 4.305 6.362 12.561 710 HE22 GLN 100 2HE1 GLN 100 3.605 7.017 14.004 711 H PHE 101 H PHE 101 2.016 4.308 8.248 712 HA PHE 101 HA PHE 101 -0.847 3.964 7.515 713 HB2 PHE 101 1HB PHE 101 -0.320 2.841 5.433 714 HB3 PHE 101 2HB PHE 101 0.400 4.442 5.386 715 HD1 PHE 101 2HD PHE 101 2.848 4.716 5.678 716 HD2 PHE 101 1HD PHE 101 1.017 0.868 5.377 717 HE1 PHE 101 2HE PHE 101 5.047 3.713 5.162 718 HE2 PHE 101 1HE PHE 101 3.214 -0.140 4.864 719 HZ PHE 101 HZ PHE 101 5.231 1.282 4.756 720 H PHE 102 H PHE 102 -1.530 1.760 7.405 721 HA PHE 102 HA PHE 102 0.150 0.016 9.178 722 HB2 PHE 102 1HB PHE 102 -2.873 0.146 8.814 723 HB3 PHE 102 2HB PHE 102 -2.039 -1.072 9.765 724 HD1 PHE 102 1HD PHE 102 -2.918 2.496 9.550 725 HD2 PHE 102 2HD PHE 102 -1.154 -0.575 11.937 726 HE1 PHE 102 1HE PHE 102 -2.993 3.987 11.519 727 HE2 PHE 102 2HE PHE 102 -1.229 0.912 13.911 728 HZ PHE 102 HZ PHE 102 -2.148 3.195 13.701 729 H ILE 103 H ILE 103 0.636 -2.016 8.616 730 HA ILE 103 HA ILE 103 -0.861 -3.183 6.281 731 HB ILE 103 HB ILE 103 2.005 -3.737 7.203 732 HG12 ILE 103 1HG1 ILE 103 0.960 -2.461 4.664 733 HG13 ILE 103 1HG2 ILE 103 1.787 -1.632 5.972 734 HG21 ILE 103 2HG1 ILE 103 2.099 -5.270 5.280 735 HG22 ILE 103 2HG2 ILE 103 0.853 -5.779 6.443 736 HG23 ILE 103 2HG3 ILE 103 0.381 -4.955 4.939 737 HD11 ILE 103 1HD3 ILE 103 2.969 -3.809 4.234 738 HD12 ILE 103 1HD1 ILE 103 3.296 -2.064 4.116 739 HD13 ILE 103 1HD2 ILE 103 3.806 -2.971 5.561 740 H VAL 104 H VAL 104 -2.266 -4.595 6.800 741 HA VAL 104 HA VAL 104 -2.207 -5.799 9.508 742 HB VAL 104 HB VAL 104 -4.168 -6.138 7.187 743 HG11 VAL 104 1HG1 VAL 104 -5.699 -6.998 8.891 744 HG12 VAL 104 1HG2 VAL 104 -4.233 -7.995 8.749 745 HG13 VAL 104 1HG3 VAL 104 -4.412 -6.866 10.113 746 HG21 VAL 104 2HG3 VAL 104 -4.053 -3.800 7.978 747 HG22 VAL 104 2HG1 VAL 104 -5.592 -4.558 8.450 748 HG23 VAL 104 2HG2 VAL 104 -4.296 -4.352 9.652 749 H HIS 105 H HIS 105 -1.938 -7.825 10.089 750 HA HIS 105 HA HIS 105 -0.594 -9.529 8.041 751 HB2 HIS 105 1HB HIS 105 -0.639 -9.772 11.081 752 HB3 HIS 105 2HB HIS 105 0.302 -10.769 9.980 753 HD2 HIS 105 2HD HIS 105 0.967 -7.403 8.449 754 HE1 HIS 105 1HE HIS 105 3.612 -7.666 11.763 755 H GLU 106 H GLU 106 -3.192 -9.588 10.451 756 HA GLU 106 HA GLU 106 -4.341 -11.923 8.982 757 HB2 GLU 106 1HB GLU 106 -4.037 -11.690 12.005 758 HB3 GLU 106 2HB GLU 106 -5.006 -12.909 11.188 759 HG2 GLU 106 1HG GLU 106 -2.959 -13.752 10.070 760 HG3 GLU 106 2HG GLU 106 -2.008 -12.565 10.960 761 HA PRO 107 HA PRO 107 -8.173 -9.805 9.037 762 HB2 PRO 107 1HB PRO 107 -9.255 -12.471 10.047 763 HB3 PRO 107 2HB PRO 107 -9.838 -11.494 8.693 764 HG2 PRO 107 1HG PRO 107 -8.433 -13.684 8.147 765 HG3 PRO 107 2HG PRO 107 -8.087 -12.207 7.242 766 HD2 PRO 107 1HD PRO 107 -6.578 -13.415 9.592 767 HD3 PRO 107 2HD PRO 107 -5.925 -12.654 8.085 768 H GLN 108 H GLN 108 -8.631 -8.382 10.459 769 HA GLN 108 HA GLN 108 -9.325 -9.353 13.208 770 HB2 GLN 108 1HB GLN 108 -7.971 -6.722 12.471 771 HB3 GLN 108 2HB GLN 108 -8.500 -7.181 14.083 772 HG2 GLN 108 1HG GLN 108 -6.383 -8.607 12.459 773 HG3 GLN 108 2HG GLN 108 -6.096 -7.460 13.798 774 HE21 GLN 108 2HE2 GLN 108 -5.605 -10.478 13.268 775 HE22 GLN 108 2HE1 GLN 108 -6.170 -11.230 14.723 776 HA PRO 109 HA PRO 109 -13.121 -7.703 11.386 777 HB2 PRO 109 1HB PRO 109 -14.048 -9.026 13.977 778 HB3 PRO 109 2HB PRO 109 -14.788 -9.122 12.374 779 HG2 PRO 109 1HG PRO 109 -13.392 -11.213 13.240 780 HG3 PRO 109 2HG PRO 109 -13.179 -10.682 11.569 781 HD2 PRO 109 1HD PRO 109 -11.400 -10.190 13.982 782 HD3 PRO 109 2HD PRO 109 -10.932 -10.564 12.274 783 H HIS 110 H HIS 110 -11.843 -7.408 14.647 784 HA HIS 110 HA HIS 110 -13.780 -5.323 15.359 785 HB2 HIS 110 1HB HIS 110 -12.491 -5.182 17.457 786 HB3 HIS 110 2HB HIS 110 -12.914 -6.848 17.095 787 HD2 HIS 110 2HD HIS 110 -10.680 -8.447 16.149 788 HE1 HIS 110 1HE HIS 110 -7.780 -5.723 17.678 789 H LEU 111 H LEU 111 -10.939 -5.402 13.556 790 HA LEU 111 HA LEU 111 -10.404 -2.514 14.109 791 HB2 LEU 111 1HB LEU 111 -8.810 -4.602 12.566 792 HB3 LEU 111 2HB LEU 111 -8.341 -2.909 12.756 793 HG LEU 111 HG LEU 111 -8.546 -4.977 14.973 794 HD11 LEU 111 1HD1 LEU 111 -6.111 -4.692 15.077 795 HD12 LEU 111 1HD2 LEU 111 -6.635 -5.291 13.486 796 HD13 LEU 111 1HD3 LEU 111 -6.182 -3.581 13.689 797 HD21 LEU 111 2HD3 LEU 111 -9.203 -2.717 15.730 798 HD22 LEU 111 2HD1 LEU 111 -7.620 -3.181 16.396 799 HD23 LEU 111 2HD2 LEU 111 -7.711 -2.048 15.026 800 H ASP 112 H ASP 112 -12.287 -4.363 12.149 801 HA ASP 112 HA ASP 112 -11.820 -3.162 9.568 802 HB2 ASP 112 1HB ASP 112 -14.246 -4.517 10.810 803 HB3 ASP 112 2HB ASP 112 -14.227 -3.930 9.153 804 H GLY 113 H GLY 113 -12.374 -1.320 8.694 805 HA2 GLY 113 1HA GLY 113 -13.686 0.562 8.258 806 HA3 GLY 113 2HA GLY 113 -14.763 0.102 9.597 807 H VAL 114 H VAL 114 -11.594 -0.011 10.658 808 HA VAL 114 HA VAL 114 -11.962 2.457 12.260 809 HB VAL 114 HB VAL 114 -9.745 0.355 12.164 810 HG11 VAL 114 1HG1 VAL 114 -8.939 1.365 14.241 811 HG12 VAL 114 1HG2 VAL 114 -8.872 2.504 12.876 812 HG13 VAL 114 1HG3 VAL 114 -10.164 2.647 14.092 813 HG21 VAL 114 2HG3 VAL 114 -11.902 -0.500 13.015 814 HG22 VAL 114 2HG1 VAL 114 -10.704 -0.376 14.325 815 HG23 VAL 114 2HG2 VAL 114 -11.984 0.852 14.170 816 H HIS 115 H HIS 115 -9.568 1.241 9.917 817 HA HIS 115 HA HIS 115 -8.676 4.087 9.599 818 HB2 HIS 115 1HB HIS 115 -7.180 1.494 9.013 819 HB3 HIS 115 2HB HIS 115 -6.564 3.111 8.703 820 HD2 HIS 115 2HD HIS 115 -6.510 0.529 11.475 821 HE1 HIS 115 1HE HIS 115 -5.512 4.250 13.297 822 H THR 116 H THR 116 -7.707 4.515 7.396 823 HA THR 116 HA THR 116 -9.857 3.864 5.457 824 HB THR 116 HB THR 116 -7.544 5.848 5.280 825 HG1 THR 116 1HG THR 116 -9.263 7.361 5.656 826 HG21 THR 116 2HG3 THR 116 -10.016 5.477 3.545 827 HG22 THR 116 2HG1 THR 116 -8.808 6.772 3.377 828 HG23 THR 116 2HG2 THR 116 -8.347 5.079 3.074 829 H VAL 117 H VAL 117 -9.579 1.915 4.609 830 HA VAL 117 HA VAL 117 -6.908 0.953 3.792 831 HB VAL 117 HB VAL 117 -9.711 -0.160 3.281 832 HG11 VAL 117 1HG1 VAL 117 -8.559 -2.260 2.781 833 HG12 VAL 117 1HG2 VAL 117 -8.089 -0.960 1.661 834 HG13 VAL 117 1HG3 VAL 117 -6.989 -1.444 2.974 835 HG21 VAL 117 2HG3 VAL 117 -9.166 -0.034 5.687 836 HG22 VAL 117 2HG1 VAL 117 -9.177 -1.722 5.124 837 HG23 VAL 117 2HG2 VAL 117 -7.630 -0.883 5.385 838 H PHE 118 H PHE 118 -5.948 1.010 1.937 839 HA PHE 118 HA PHE 118 -7.452 2.074 -0.410 840 HB2 PHE 118 1HB PHE 118 -5.865 3.842 -0.780 841 HB3 PHE 118 2HB PHE 118 -6.428 4.002 0.876 842 HD1 PHE 118 2HD PHE 118 -4.966 3.382 2.762 843 HD2 PHE 118 1HD PHE 118 -3.586 3.298 -1.281 844 HE1 PHE 118 2HE PHE 118 -2.628 3.338 3.563 845 HE2 PHE 118 1HE PHE 118 -1.247 3.252 -0.483 846 HZ PHE 118 HZ PHE 118 -0.768 3.272 1.939 847 H GLY 119 H GLY 119 -5.158 -0.010 0.930 848 HA2 GLY 119 1HA GLY 119 -4.199 -0.727 -1.803 849 HA3 GLY 119 2HA GLY 119 -3.036 -0.498 -0.478 850 H GLN 120 H GLN 120 -3.548 -2.902 -2.058 851 HA GLN 120 HA GLN 120 -3.876 -4.701 0.292 852 HB2 GLN 120 1HB GLN 120 -6.035 -4.872 -0.804 853 HB3 GLN 120 2HB GLN 120 -5.285 -5.005 -2.389 854 HG2 GLN 120 1HG GLN 120 -6.044 -7.163 -1.739 855 HG3 GLN 120 2HG GLN 120 -4.260 -7.168 -1.656 856 HE21 GLN 120 2HE2 GLN 120 -3.667 -8.473 -0.053 857 HE22 GLN 120 2HE1 GLN 120 -4.338 -8.481 1.545 858 H VAL 121 H VAL 121 -2.107 -5.783 0.564 859 HA VAL 121 HA VAL 121 -0.084 -6.205 -1.463 860 HB VAL 121 HB VAL 121 -0.696 -7.720 1.121 861 HG11 VAL 121 1HG1 VAL 121 1.600 -8.549 0.968 862 HG12 VAL 121 1HG2 VAL 121 0.605 -9.087 -0.405 863 HG13 VAL 121 1HG3 VAL 121 1.777 -7.765 -0.619 864 HG21 VAL 121 2HG3 VAL 121 -0.174 -5.330 1.465 865 HG22 VAL 121 2HG1 VAL 121 1.151 -6.362 2.050 866 HG23 VAL 121 2HG2 VAL 121 1.306 -5.512 0.494 867 H THR 122 H THR 122 0.297 -7.668 -2.914 868 HA THR 122 HA THR 122 -1.790 -9.805 -3.225 869 HB THR 122 HB THR 122 -1.453 -9.631 -5.654 870 HG1 THR 122 1HG THR 122 -0.115 -7.905 -6.439 871 HG21 THR 122 2HG3 THR 122 -1.947 -6.913 -4.379 872 HG22 THR 122 2HG1 THR 122 -2.422 -7.396 -6.024 873 HG23 THR 122 2HG2 THR 122 -3.166 -8.187 -4.614 874 H SER 123 H SER 123 1.570 -9.047 -3.003 875 HA SER 123 HA SER 123 2.219 -11.987 -3.101 876 HB2 SER 123 1HB SER 123 2.530 -11.288 -5.334 877 HB3 SER 123 2HB SER 123 3.579 -9.979 -4.815 878 HG SER 123 HG SER 123 4.712 -11.827 -5.414 879 H GLY 124 H GLY 124 3.857 -12.533 -1.736 880 HA2 GLY 124 1HA GLY 124 5.602 -12.164 -0.178 881 HA3 GLY 124 2HA GLY 124 5.380 -10.408 -0.354 882 H MET 125 H MET 125 2.563 -12.381 0.072 883 HA MET 125 HA MET 125 1.764 -10.986 2.463 884 HB2 MET 125 1HB MET 125 0.742 -13.543 1.179 885 HB3 MET 125 2HB MET 125 -0.032 -12.747 2.541 886 HG2 MET 125 1HG MET 125 -0.526 -10.796 1.208 887 HG3 MET 125 2HG MET 125 0.425 -11.417 -0.142 888 HE1 MET 125 3HE MET 125 -2.905 -11.555 1.842 889 HE2 MET 125 1HE MET 125 -3.659 -13.061 1.263 890 HE3 MET 125 2HE MET 125 -2.209 -13.130 2.296 891 H ASP 126 H ASP 126 3.560 -13.938 1.912 892 HA ASP 126 HA ASP 126 3.488 -14.898 4.629 893 HB2 ASP 126 1HB ASP 126 5.508 -15.204 2.375 894 HB3 ASP 126 2HB ASP 126 5.720 -15.964 3.946 895 H VAL 127 H VAL 127 5.648 -12.635 2.936 896 HA VAL 127 HA VAL 127 7.313 -12.060 5.244 897 HB VAL 127 HB VAL 127 6.584 -10.368 2.803 898 HG11 VAL 127 1HG1 VAL 127 8.575 -9.055 3.347 899 HG12 VAL 127 1HG2 VAL 127 7.353 -8.979 4.639 900 HG13 VAL 127 1HG3 VAL 127 8.794 -10.004 4.836 901 HG21 VAL 127 2HG3 VAL 127 7.717 -12.489 2.237 902 HG22 VAL 127 2HG1 VAL 127 8.791 -11.098 1.957 903 HG23 VAL 127 2HG2 VAL 127 9.008 -12.113 3.404 904 H VAL 128 H VAL 128 4.324 -10.587 4.018 905 HA VAL 128 HA VAL 128 4.055 -8.547 5.997 906 HB VAL 128 HB VAL 128 1.952 -10.315 4.658 907 HG11 VAL 128 1HG1 VAL 128 0.329 -8.607 5.314 908 HG12 VAL 128 1HG2 VAL 128 1.079 -9.390 6.725 909 HG13 VAL 128 1HG3 VAL 128 1.593 -7.758 6.233 910 HG21 VAL 128 2HG3 VAL 128 3.285 -8.938 3.097 911 HG22 VAL 128 2HG1 VAL 128 1.613 -8.339 3.208 912 HG23 VAL 128 2HG2 VAL 128 2.922 -7.488 4.064 913 H ARG 129 H ARG 129 2.901 -11.919 6.146 914 HA ARG 129 HA ARG 129 1.825 -11.832 8.744 915 HB2 ARG 129 1HB ARG 129 1.730 -13.795 7.182 916 HB3 ARG 129 2HB ARG 129 3.428 -14.105 7.507 917 HG2 ARG 129 1HG ARG 129 2.903 -14.501 9.883 918 HG3 ARG 129 2HG ARG 129 1.180 -14.213 9.534 919 HD2 ARG 129 1HD ARG 129 2.891 -16.346 8.275 920 HD3 ARG 129 2HD ARG 129 1.742 -16.583 9.612 921 HE ARG 129 HE ARG 129 -0.059 -16.060 8.103 922 HH11 ARG 129 1HH1 ARG 129 3.080 -16.517 6.595 923 HH12 ARG 129 1HH2 ARG 129 2.412 -16.857 5.015 924 HH21 ARG 129 2HH1 ARG 129 -0.915 -16.502 6.046 925 HH22 ARG 129 2HH2 ARG 129 0.150 -16.849 4.703 926 H THR 130 H THR 130 5.212 -12.438 7.801 927 HA THR 130 HA THR 130 5.922 -12.244 10.711 928 HB THR 130 HB THR 130 7.927 -13.602 10.129 929 HG1 THR 130 1HG THR 130 7.935 -14.590 8.030 930 HG21 THR 130 2HG3 THR 130 5.297 -14.866 9.269 931 HG22 THR 130 2HG1 THR 130 6.761 -15.743 9.773 932 HG23 THR 130 2HG2 THR 130 5.883 -14.728 10.943 933 H MET 131 H MET 131 5.573 -9.877 9.473 934 HA MET 131 HA MET 131 8.027 -8.760 8.449 935 HB2 MET 131 1HB MET 131 5.625 -7.559 9.858 936 HB3 MET 131 2HB MET 131 6.986 -6.588 9.314 937 HG2 MET 131 1HG MET 131 6.575 -7.186 7.009 938 HG3 MET 131 2HG MET 131 5.337 -8.352 7.482 939 HE1 MET 131 3HE MET 131 6.288 -4.601 7.023 940 HE2 MET 131 1HE MET 131 4.923 -3.757 7.794 941 HE3 MET 131 2HE MET 131 6.078 -4.676 8.790 942 H LYS 132 H LYS 132 9.669 -7.656 9.386 943 HA LYS 132 HA LYS 132 10.167 -8.339 12.236 944 HB2 LYS 132 1HB LYS 132 11.987 -8.795 10.681 945 HB3 LYS 132 2HB LYS 132 11.926 -7.153 10.056 946 HG2 LYS 132 1HG LYS 132 12.649 -6.286 12.252 947 HG3 LYS 132 2HG LYS 132 12.713 -7.940 12.877 948 HD2 LYS 132 1HD LYS 132 14.421 -8.528 11.206 949 HD3 LYS 132 2HD LYS 132 14.332 -6.897 10.523 950 HE2 LYS 132 1HE LYS 132 15.092 -5.947 12.670 951 HE3 LYS 132 2HE LYS 132 15.160 -7.566 13.372 952 HZ1 LYS 132 3HZ LYS 132 16.767 -6.625 11.092 953 HZ2 LYS 132 1HZ LYS 132 17.308 -6.833 12.635 954 HZ3 LYS 132 2HZ LYS 132 16.830 -8.138 11.746 955 H ASN 133 H ASN 133 10.120 -7.001 13.873 956 HA ASN 133 HA ASN 133 8.988 -4.360 13.582 957 HB2 ASN 133 1HB ASN 133 8.851 -5.889 15.612 958 HB3 ASN 133 2HB ASN 133 10.510 -5.425 15.967 959 HD21 ASN 133 2HD2 ASN 133 9.769 -4.525 17.934 960 HD22 ASN 133 2HD1 ASN 133 8.996 -2.974 17.968 961 H GLY 134 H GLY 134 9.853 -2.558 12.979 962 HA2 GLY 134 1HA GLY 134 11.439 -0.825 12.951 963 HA3 GLY 134 2HA GLY 134 12.605 -1.891 13.770 964 H ASP 135 H ASP 135 11.121 -3.465 11.178 965 HA ASP 135 HA ASP 135 13.498 -3.698 9.619 966 HB2 ASP 135 1HB ASP 135 11.470 -5.225 9.534 967 HB3 ASP 135 2HB ASP 135 10.627 -3.969 8.639 968 H VAL 136 H VAL 136 14.365 -2.655 7.963 969 HA VAL 136 HA VAL 136 13.344 0.116 7.508 970 HB VAL 136 HB VAL 136 15.932 -1.225 6.593 971 HG11 VAL 136 1HG1 VAL 136 16.717 1.066 6.248 972 HG12 VAL 136 1HG2 VAL 136 15.294 0.691 5.247 973 HG13 VAL 136 1HG3 VAL 136 15.115 1.684 6.713 974 HG21 VAL 136 2HG3 VAL 136 15.783 -1.168 9.059 975 HG22 VAL 136 2HG1 VAL 136 16.997 -0.009 8.467 976 HG23 VAL 136 2HG2 VAL 136 15.400 0.569 8.998 977 H MET 137 H MET 137 12.332 0.785 5.834 978 HA MET 137 HA MET 137 11.875 -1.037 3.568 979 HB2 MET 137 1HB MET 137 11.004 1.833 4.068 980 HB3 MET 137 2HB MET 137 10.490 0.846 2.709 981 HG2 MET 137 1HG MET 137 9.481 -0.772 4.334 982 HG3 MET 137 2HG MET 137 9.896 0.345 5.637 983 HE1 MET 137 3HE MET 137 9.289 3.168 4.909 984 HE2 MET 137 1HE MET 137 7.538 3.312 5.198 985 HE3 MET 137 2HE MET 137 8.551 2.366 6.317 986 H LYS 138 H LYS 138 13.582 -1.390 2.331 987 HA LYS 138 HA LYS 138 15.667 0.529 1.876 988 HB2 LYS 138 1HB LYS 138 15.946 -1.939 1.630 989 HB3 LYS 138 2HB LYS 138 14.897 -1.907 0.219 990 HG2 LYS 138 1HG LYS 138 16.495 -0.534 -1.000 991 HG3 LYS 138 2HG LYS 138 17.527 -0.413 0.433 992 HD2 LYS 138 1HD LYS 138 17.857 -2.862 0.408 993 HD3 LYS 138 2HD LYS 138 16.813 -2.992 -1.014 994 HE2 LYS 138 1HE LYS 138 18.380 -1.558 -2.289 995 HE3 LYS 138 2HE LYS 138 19.426 -1.441 -0.872 996 HZ1 LYS 138 3HZ LYS 138 18.751 -3.929 -2.294 997 HZ2 LYS 138 1HZ LYS 138 20.183 -3.117 -2.390 998 HZ3 LYS 138 2HZ LYS 138 19.726 -3.820 -0.969 999 H GLU 139 H GLU 139 12.853 -0.409 -0.089 1000 HA GLU 139 HA GLU 139 13.003 2.171 -1.513 1001 HB2 GLU 139 1HB GLU 139 14.556 0.786 -2.836 1002 HB3 GLU 139 2HB GLU 139 13.355 -0.493 -2.953 1003 HG2 GLU 139 1HG GLU 139 11.887 0.982 -4.250 1004 HG3 GLU 139 2HG GLU 139 13.063 2.288 -4.109 1005 H VAL 140 H VAL 140 11.047 2.901 -1.314 1006 HA VAL 140 HA VAL 140 8.753 1.021 -1.868 1007 HB VAL 140 HB VAL 140 8.752 3.696 -0.392 1008 HG11 VAL 140 1HG1 VAL 140 6.481 3.062 0.264 1009 HG12 VAL 140 1HG2 VAL 140 6.653 3.191 -1.502 1010 HG13 VAL 140 1HG3 VAL 140 6.607 1.590 -0.728 1011 HG21 VAL 140 2HG3 VAL 140 9.972 1.972 0.890 1012 HG22 VAL 140 2HG1 VAL 140 8.409 2.346 1.653 1013 HG23 VAL 140 2HG2 VAL 140 8.599 0.855 0.699 1014 H LYS 141 H LYS 141 7.943 1.116 -3.761 1015 HA LYS 141 HA LYS 141 7.797 3.788 -5.107 1016 HB2 LYS 141 1HB LYS 141 8.615 1.155 -6.397 1017 HB3 LYS 141 2HB LYS 141 8.341 2.667 -7.251 1018 HG2 LYS 141 1HG LYS 141 10.450 2.323 -5.101 1019 HG3 LYS 141 2HG LYS 141 10.747 2.089 -6.829 1020 HD2 LYS 141 1HD LYS 141 10.123 4.402 -7.298 1021 HD3 LYS 141 2HD LYS 141 9.664 4.654 -5.607 1022 HE2 LYS 141 1HE LYS 141 11.879 5.593 -6.024 1023 HE3 LYS 141 2HE LYS 141 12.002 4.228 -4.912 1024 HZ1 LYS 141 3HZ LYS 141 12.567 4.133 -7.800 1025 HZ2 LYS 141 1HZ LYS 141 13.691 4.150 -6.594 1026 HZ3 LYS 141 2HZ LYS 141 12.680 2.857 -6.761 1027 H VAL 142 H VAL 142 6.079 4.170 -6.433 1028 HA VAL 142 HA VAL 142 4.086 1.954 -6.801 1029 HB VAL 142 HB VAL 142 3.431 4.824 -5.977 1030 HG11 VAL 142 1HG1 VAL 142 1.117 4.035 -5.888 1031 HG12 VAL 142 1HG2 VAL 142 1.809 3.889 -7.520 1032 HG13 VAL 142 1HG3 VAL 142 1.637 2.445 -6.493 1033 HG21 VAL 142 2HG3 VAL 142 4.317 3.500 -4.088 1034 HG22 VAL 142 2HG1 VAL 142 2.574 3.801 -3.893 1035 HG23 VAL 142 2HG2 VAL 142 3.145 2.207 -4.442 1036 H PHE 143 H PHE 143 3.450 1.666 -8.749 1037 HA PHE 143 HA PHE 143 3.891 3.904 -10.703 1038 HB2 PHE 143 1HB PHE 143 4.234 0.907 -11.144 1039 HB3 PHE 143 2HB PHE 143 4.375 2.139 -12.389 1040 HD1 PHE 143 2HD PHE 143 6.284 3.671 -12.429 1041 HD2 PHE 143 1HD PHE 143 5.981 0.555 -9.523 1042 HE1 PHE 143 2HE PHE 143 8.689 3.924 -11.912 1043 HE2 PHE 143 1HE PHE 143 8.385 0.805 -9.001 1044 HZ PHE 143 HZ PHE 143 9.738 2.491 -10.195 1045 H ASP 144 H ASP 144 2.284 4.499 -11.941 1046 HA ASP 144 HA ASP 144 -0.366 3.409 -11.448 1047 HB2 ASP 144 1HB ASP 144 0.095 5.824 -11.988 1048 HB3 ASP 144 2HB ASP 144 0.570 5.343 -13.611 1049 H GLU 145 H GLU 145 -1.549 1.999 -12.501 1050 HA GLU 145 HA GLU 145 -0.201 0.432 -14.620 1051 HB2 GLU 145 1HB GLU 145 -2.828 0.055 -13.120 1052 HB3 GLU 145 2HB GLU 145 -2.239 -1.040 -14.363 1053 HG2 GLU 145 1HG GLU 145 -0.823 -0.419 -11.761 1054 HG3 GLU 145 2HG GLU 145 -1.805 -1.846 -12.082 1055 HA PRO 146 HA PRO 146 -2.146 2.140 -18.157 1056 HB2 PRO 146 1HB PRO 146 -2.700 -0.796 -18.782 1057 HB3 PRO 146 2HB PRO 146 -1.982 0.432 -19.833 1058 HG2 PRO 146 1HG PRO 146 -0.372 -1.378 -18.739 1059 HG3 PRO 146 2HG PRO 146 0.143 0.310 -18.763 1060 HD2 PRO 146 1HD PRO 146 -1.046 -1.302 -16.475 1061 HD3 PRO 146 2HD PRO 146 0.301 -0.094 -16.442 Start of MODEL 5 1 H MET 1 1H MET 1 -8.763 4.201 -14.079 2 HA MET 1 HA MET 1 -6.957 5.067 -12.172 3 HB2 MET 1 1HB MET 1 -9.764 3.914 -12.009 4 HB3 MET 1 2HB MET 1 -8.933 4.712 -10.682 5 HG2 MET 1 1HG MET 1 -9.716 5.981 -13.322 6 HG3 MET 1 2HG MET 1 -10.503 6.223 -11.760 7 HE1 MET 1 3HE MET 1 -8.212 6.491 -9.679 8 HE2 MET 1 1HE MET 1 -7.885 8.240 -9.727 9 HE3 MET 1 2HE MET 1 -9.562 7.646 -9.808 10 H ALA 2 H ALA 2 -5.289 3.403 -12.422 11 HA ALA 2 HA ALA 2 -5.665 1.451 -10.256 12 HB1 ALA 2 3HB ALA 2 -4.892 0.568 -13.059 13 HB2 ALA 2 1HB ALA 2 -4.859 -0.453 -11.603 14 HB3 ALA 2 2HB ALA 2 -6.408 0.172 -12.218 15 H LYS 3 H LYS 3 -3.847 0.976 -9.168 16 HA LYS 3 HA LYS 3 -1.240 1.863 -10.308 17 HB2 LYS 3 1HB LYS 3 -2.347 2.761 -7.617 18 HB3 LYS 3 2HB LYS 3 -0.694 3.009 -8.161 19 HG2 LYS 3 1HG LYS 3 -1.427 4.477 -9.937 20 HG3 LYS 3 2HG LYS 3 -3.124 4.119 -9.590 21 HD2 LYS 3 1HD LYS 3 -2.720 5.035 -7.245 22 HD3 LYS 3 2HD LYS 3 -1.146 5.599 -7.827 23 HE2 LYS 3 1HE LYS 3 -3.796 6.340 -9.116 24 HE3 LYS 3 2HE LYS 3 -2.975 7.331 -7.908 25 HZ1 LYS 3 3HZ LYS 3 -1.867 6.561 -10.525 26 HZ2 LYS 3 1HZ LYS 3 -2.468 8.044 -10.127 27 HZ3 LYS 3 2HZ LYS 3 -1.099 7.487 -9.396 28 H LYS 4 H LYS 4 0.574 0.917 -9.440 29 HA LYS 4 HA LYS 4 0.187 -1.184 -7.378 30 HB2 LYS 4 1HB LYS 4 -0.227 -2.257 -9.624 31 HB3 LYS 4 2HB LYS 4 1.400 -1.791 -10.101 32 HG2 LYS 4 1HG LYS 4 2.364 -3.193 -8.359 33 HG3 LYS 4 2HG LYS 4 0.751 -3.594 -7.752 34 HD2 LYS 4 1HD LYS 4 0.196 -4.639 -9.930 35 HD3 LYS 4 2HD LYS 4 1.819 -4.253 -10.522 36 HE2 LYS 4 1HE LYS 4 2.805 -5.646 -8.731 37 HE3 LYS 4 2HE LYS 4 1.188 -6.032 -8.137 38 HZ1 LYS 4 3HZ LYS 4 2.234 -6.710 -10.804 39 HZ2 LYS 4 1HZ LYS 4 2.045 -7.757 -9.544 40 HZ3 LYS 4 2HZ LYS 4 0.722 -7.069 -10.251 41 H GLY 5 H GLY 5 1.905 -1.584 -6.141 42 HA2 GLY 5 1HA GLY 5 4.482 -0.295 -6.861 43 HA3 GLY 5 2HA GLY 5 3.658 0.236 -5.376 44 H TYR 6 H TYR 6 5.965 -0.602 -4.732 45 HA TYR 6 HA TYR 6 5.487 -3.159 -3.361 46 HB2 TYR 6 1HB TYR 6 7.482 -4.269 -4.187 47 HB3 TYR 6 2HB TYR 6 6.422 -3.901 -5.541 48 HD1 TYR 6 1HD TYR 6 9.556 -2.977 -3.825 49 HD2 TYR 6 2HD TYR 6 7.067 -2.370 -7.266 50 HE1 TYR 6 1HE TYR 6 11.415 -1.814 -4.966 51 HE2 TYR 6 2HE TYR 6 8.925 -1.208 -8.407 52 HH TYR 6 HH TYR 6 12.002 -0.598 -6.756 53 H ILE 7 H ILE 7 6.726 -3.477 -1.559 54 HA ILE 7 HA ILE 7 8.742 -1.327 -0.947 55 HB ILE 7 HB ILE 7 7.130 -3.122 0.937 56 HG12 ILE 7 1HG1 ILE 7 7.009 -0.122 0.552 57 HG13 ILE 7 1HG2 ILE 7 5.848 -1.266 -0.103 58 HG21 ILE 7 2HG1 ILE 7 8.209 -1.836 2.737 59 HG22 ILE 7 2HG2 ILE 7 9.416 -2.708 1.763 60 HG23 ILE 7 2HG3 ILE 7 9.182 -0.959 1.533 61 HD11 ILE 7 1HD3 ILE 7 6.435 -0.829 2.834 62 HD12 ILE 7 1HD1 ILE 7 5.014 -0.241 1.938 63 HD13 ILE 7 1HD2 ILE 7 5.259 -1.989 2.170 64 H LEU 8 H LEU 8 10.656 -1.921 -1.507 65 HA LEU 8 HA LEU 8 11.548 -4.697 -0.974 66 HB2 LEU 8 1HB LEU 8 12.281 -3.605 -3.053 67 HB3 LEU 8 2HB LEU 8 12.963 -2.260 -2.133 68 HG LEU 8 HG LEU 8 14.588 -3.886 -1.098 69 HD11 LEU 8 1HD1 LEU 8 14.867 -6.064 -2.194 70 HD12 LEU 8 1HD2 LEU 8 13.271 -5.917 -1.420 71 HD13 LEU 8 1HD3 LEU 8 13.423 -5.750 -3.186 72 HD21 LEU 8 2HD3 LEU 8 15.178 -2.442 -3.017 73 HD22 LEU 8 2HD1 LEU 8 15.987 -4.023 -3.130 74 HD23 LEU 8 2HD2 LEU 8 14.560 -3.680 -4.137 75 H MET 9 H MET 9 12.483 -5.363 0.778 76 HA MET 9 HA MET 9 13.185 -3.381 2.868 77 HB2 MET 9 1HB MET 9 13.198 -6.420 2.930 78 HB3 MET 9 2HB MET 9 13.429 -5.357 4.310 79 HG2 MET 9 1HG MET 9 10.902 -5.564 2.649 80 HG3 MET 9 2HG MET 9 11.165 -6.289 4.237 81 HE1 MET 9 3HE MET 9 8.849 -5.094 4.946 82 HE2 MET 9 1HE MET 9 8.588 -3.336 4.835 83 HE3 MET 9 2HE MET 9 8.736 -4.310 3.351 84 H GLU 10 H GLU 10 15.153 -3.482 4.055 85 HA GLU 10 HA GLU 10 17.502 -3.583 2.383 86 HB2 GLU 10 1HB GLU 10 17.100 -3.458 5.397 87 HB3 GLU 10 2HB GLU 10 18.692 -3.458 4.652 88 HG2 GLU 10 1HG GLU 10 16.564 -1.416 3.996 89 HG3 GLU 10 2HG GLU 10 17.744 -1.211 5.289 90 H ASN 11 H ASN 11 15.724 -6.020 3.990 91 HA ASN 11 HA ASN 11 18.026 -7.890 4.061 92 HB2 ASN 11 1HB ASN 11 15.098 -8.231 4.765 93 HB3 ASN 11 2HB ASN 11 16.308 -9.501 4.885 94 HD21 ASN 11 2HD2 ASN 11 14.669 -7.271 6.610 95 HD22 ASN 11 2HD1 ASN 11 15.777 -7.021 7.917 96 H GLY 12 H GLY 12 16.120 -6.688 1.687 97 HA2 GLY 12 1HA GLY 12 16.247 -7.400 -0.564 98 HA3 GLY 12 2HA GLY 12 16.748 -9.017 -0.018 99 H GLY 13 H GLY 13 14.184 -8.027 1.866 100 HA2 GLY 13 1HA GLY 13 12.359 -9.890 0.560 101 HA3 GLY 13 2HA GLY 13 12.048 -8.947 2.035 102 H LYS 14 H LYS 14 11.522 -9.228 -1.337 103 HA LYS 14 HA LYS 14 10.455 -6.455 -1.563 104 HB2 LYS 14 1HB LYS 14 11.883 -7.400 -3.398 105 HB3 LYS 14 2HB LYS 14 10.676 -8.651 -3.659 106 HG2 LYS 14 1HG LYS 14 9.006 -6.907 -4.227 107 HG3 LYS 14 2HG LYS 14 10.251 -5.669 -4.006 108 HD2 LYS 14 1HD LYS 14 11.616 -6.743 -5.783 109 HD3 LYS 14 2HD LYS 14 10.343 -7.949 -6.017 110 HE2 LYS 14 1HE LYS 14 8.750 -6.117 -6.586 111 HE3 LYS 14 2HE LYS 14 10.064 -4.948 -6.420 112 HZ1 LYS 14 3HZ LYS 14 9.989 -7.172 -8.349 113 HZ2 LYS 14 1HZ LYS 14 9.727 -5.582 -8.695 114 HZ3 LYS 14 2HZ LYS 14 11.217 -6.082 -8.193 115 H ILE 15 H ILE 15 8.502 -6.070 -0.914 116 HA ILE 15 HA ILE 15 6.411 -8.194 -1.329 117 HB ILE 15 HB ILE 15 6.511 -5.865 0.653 118 HG12 ILE 15 1HG1 ILE 15 6.223 -8.099 2.154 119 HG13 ILE 15 1HG2 ILE 15 7.203 -8.737 0.844 120 HG21 ILE 15 2HG1 ILE 15 4.404 -6.793 1.522 121 HG22 ILE 15 2HG2 ILE 15 4.229 -6.292 -0.175 122 HG23 ILE 15 2HG3 ILE 15 4.405 -8.015 0.229 123 HD11 ILE 15 1HD3 ILE 15 7.887 -6.334 2.551 124 HD12 ILE 15 1HD1 ILE 15 8.593 -7.961 2.681 125 HD13 ILE 15 1HD2 ILE 15 8.879 -6.980 1.223 126 H GLU 16 H GLU 16 5.037 -7.956 -2.842 127 HA GLU 16 HA GLU 16 4.753 -5.234 -4.050 128 HB2 GLU 16 1HB GLU 16 4.110 -7.998 -5.165 129 HB3 GLU 16 2HB GLU 16 3.861 -6.481 -6.018 130 HG2 GLU 16 1HG GLU 16 6.290 -6.045 -5.935 131 HG3 GLU 16 2HG GLU 16 6.528 -7.581 -5.105 132 H PHE 17 H PHE 17 2.831 -4.278 -4.430 133 HA PHE 17 HA PHE 17 0.375 -5.575 -3.380 134 HB2 PHE 17 1HB PHE 17 -0.113 -3.677 -1.894 135 HB3 PHE 17 2HB PHE 17 1.369 -4.479 -1.399 136 HD1 PHE 17 1HD PHE 17 -0.046 -1.468 -2.965 137 HD2 PHE 17 2HD PHE 17 3.498 -3.373 -1.529 138 HE1 PHE 17 1HE PHE 17 1.152 0.692 -3.061 139 HE2 PHE 17 2HE PHE 17 4.699 -1.213 -1.622 140 HZ PHE 17 HZ PHE 17 3.525 0.819 -2.390 141 H GLU 18 H GLU 18 -1.565 -4.480 -3.888 142 HA GLU 18 HA GLU 18 -1.254 -2.622 -6.227 143 HB2 GLU 18 1HB GLU 18 -3.392 -4.713 -5.641 144 HB3 GLU 18 2HB GLU 18 -3.504 -3.524 -6.932 145 HG2 GLU 18 1HG GLU 18 -1.438 -4.458 -7.938 146 HG3 GLU 18 2HG GLU 18 -1.398 -5.681 -6.669 147 H LEU 19 H LEU 19 -2.574 -0.879 -6.440 148 HA LEU 19 HA LEU 19 -3.983 -0.102 -3.908 149 HB2 LEU 19 1HB LEU 19 -2.631 1.692 -5.964 150 HB3 LEU 19 2HB LEU 19 -3.404 2.218 -4.466 151 HG LEU 19 HG LEU 19 -0.886 0.526 -4.663 152 HD11 LEU 19 1HD1 LEU 19 0.221 2.547 -3.819 153 HD12 LEU 19 1HD2 LEU 19 -0.558 2.833 -5.393 154 HD13 LEU 19 1HD3 LEU 19 -1.322 3.427 -3.899 155 HD21 LEU 19 2HD3 LEU 19 -2.258 0.012 -2.672 156 HD22 LEU 19 2HD1 LEU 19 -0.776 0.888 -2.221 157 HD23 LEU 19 2HD2 LEU 19 -2.335 1.746 -2.277 158 H PHE 20 H PHE 20 -5.781 1.317 -4.076 159 HA PHE 20 HA PHE 20 -7.265 0.934 -6.659 160 HB2 PHE 20 1HB PHE 20 -8.423 0.812 -3.842 161 HB3 PHE 20 2HB PHE 20 -9.307 0.592 -5.344 162 HD1 PHE 20 2HD PHE 20 -8.847 -1.417 -6.768 163 HD2 PHE 20 1HD PHE 20 -7.234 -0.970 -2.837 164 HE1 PHE 20 2HE PHE 20 -8.400 -3.846 -6.678 165 HE2 PHE 20 1HE PHE 20 -6.784 -3.400 -2.744 166 HZ PHE 20 HZ PHE 20 -7.368 -4.837 -4.665 167 HA PRO 21 HA PRO 21 -7.208 5.422 -5.615 168 HB2 PRO 21 1HB PRO 21 -6.620 6.228 -8.186 169 HB3 PRO 21 2HB PRO 21 -5.333 5.757 -7.069 170 HG2 PRO 21 1HG PRO 21 -6.696 4.089 -9.228 171 HG3 PRO 21 2HG PRO 21 -4.967 4.277 -8.921 172 HD2 PRO 21 1HD PRO 21 -6.296 2.117 -7.979 173 HD3 PRO 21 2HD PRO 21 -5.006 2.909 -6.986 174 H ASN 22 H ASN 22 -8.786 3.335 -7.886 175 HA ASN 22 HA ASN 22 -10.862 5.216 -8.643 176 HB2 ASN 22 1HB ASN 22 -10.308 3.088 -9.859 177 HB3 ASN 22 2HB ASN 22 -11.008 2.192 -8.517 178 HD21 ASN 22 2HD2 ASN 22 -13.035 1.607 -8.782 179 HD22 ASN 22 2HD1 ASN 22 -14.215 2.419 -9.755 180 H GLU 23 H GLU 23 -10.277 3.232 -5.837 181 HA GLU 23 HA GLU 23 -13.063 3.732 -4.878 182 HB2 GLU 23 1HB GLU 23 -10.881 1.914 -3.770 183 HB3 GLU 23 2HB GLU 23 -12.518 2.049 -3.144 184 HG2 GLU 23 1HG GLU 23 -13.420 1.158 -5.233 185 HG3 GLU 23 2HG GLU 23 -11.799 1.084 -5.921 186 H ALA 24 H ALA 24 -9.686 4.423 -4.182 187 HA ALA 24 HA ALA 24 -10.655 6.502 -2.283 188 HB1 ALA 24 3HB ALA 24 -8.318 4.624 -1.781 189 HB2 ALA 24 1HB ALA 24 -8.772 6.011 -0.766 190 HB3 ALA 24 2HB ALA 24 -9.870 4.618 -0.913 191 HA PRO 25 HA PRO 25 -7.968 8.109 -5.705 192 HB2 PRO 25 1HB PRO 25 -9.742 10.465 -4.883 193 HB3 PRO 25 2HB PRO 25 -9.224 10.000 -6.509 194 HG2 PRO 25 1HG PRO 25 -11.712 9.422 -5.775 195 HG3 PRO 25 2HG PRO 25 -10.779 8.199 -6.642 196 HD2 PRO 25 1HD PRO 25 -11.389 8.401 -3.676 197 HD3 PRO 25 2HD PRO 25 -11.310 6.933 -4.730 198 H VAL 26 H VAL 26 -9.016 10.008 -2.850 199 HA VAL 26 HA VAL 26 -6.636 11.670 -2.954 200 HB VAL 26 HB VAL 26 -8.642 11.134 -0.709 201 HG11 VAL 26 1HG1 VAL 26 -7.801 13.202 0.293 202 HG12 VAL 26 1HG2 VAL 26 -6.537 11.955 0.179 203 HG13 VAL 26 1HG3 VAL 26 -6.558 13.310 -0.974 204 HG21 VAL 26 2HG3 VAL 26 -9.651 12.122 -2.736 205 HG22 VAL 26 2HG1 VAL 26 -9.607 13.303 -1.407 206 HG23 VAL 26 2HG2 VAL 26 -8.418 13.406 -2.727 207 H THR 27 H THR 27 -7.548 8.951 -0.841 208 HA THR 27 HA THR 27 -5.186 9.094 0.768 209 HB THR 27 HB THR 27 -6.897 6.652 0.122 210 HG1 THR 27 1HG THR 27 -8.211 8.185 1.042 211 HG21 THR 27 2HG3 THR 27 -5.042 7.267 2.453 212 HG22 THR 27 2HG1 THR 27 -6.056 5.816 2.281 213 HG23 THR 27 2HG2 THR 27 -4.716 6.106 1.145 214 H VAL 28 H VAL 28 -5.916 7.083 -2.088 215 HA VAL 28 HA VAL 28 -3.330 5.765 -2.106 216 HB VAL 28 HB VAL 28 -5.395 6.255 -4.306 217 HG11 VAL 28 1HG1 VAL 28 -4.248 4.490 -5.552 218 HG12 VAL 28 1HG2 VAL 28 -3.197 5.899 -5.273 219 HG13 VAL 28 1HG3 VAL 28 -2.987 4.424 -4.297 220 HG21 VAL 28 2HG3 VAL 28 -6.210 4.874 -2.427 221 HG22 VAL 28 2HG1 VAL 28 -5.993 3.890 -3.894 222 HG23 VAL 28 2HG2 VAL 28 -4.788 3.815 -2.586 223 H ALA 29 H ALA 29 -4.558 8.666 -3.728 224 HA ALA 29 HA ALA 29 -2.280 9.087 -5.372 225 HB1 ALA 29 3HB ALA 29 -4.153 11.130 -4.125 226 HB2 ALA 29 1HB ALA 29 -3.040 11.433 -5.478 227 HB3 ALA 29 2HB ALA 29 -4.396 10.298 -5.678 228 H ASN 30 H ASN 30 -2.993 10.237 -2.075 229 HA ASN 30 HA ASN 30 -0.565 11.768 -1.807 230 HB2 ASN 30 1HB ASN 30 -2.495 10.581 0.195 231 HB3 ASN 30 2HB ASN 30 -1.072 11.494 0.677 232 HD21 ASN 30 2HD2 ASN 30 -3.673 12.264 1.302 233 HD22 ASN 30 2HD1 ASN 30 -4.030 13.743 0.474 234 H PHE 31 H PHE 31 -1.405 8.427 -0.930 235 HA PHE 31 HA PHE 31 1.071 7.750 0.309 236 HB2 PHE 31 1HB PHE 31 -0.968 6.311 0.348 237 HB3 PHE 31 2HB PHE 31 -0.773 5.997 -1.369 238 HD1 PHE 31 1HD PHE 31 0.739 5.471 1.964 239 HD2 PHE 31 2HD PHE 31 0.769 4.381 -2.167 240 HE1 PHE 31 1HE PHE 31 2.207 3.551 2.483 241 HE2 PHE 31 2HE PHE 31 2.235 2.458 -1.651 242 HZ PHE 31 HZ PHE 31 2.954 2.044 0.675 243 H GLU 32 H GLU 32 0.076 7.376 -3.102 244 HA GLU 32 HA GLU 32 2.596 6.388 -4.024 245 HB2 GLU 32 1HB GLU 32 0.561 6.235 -5.390 246 HB3 GLU 32 2HB GLU 32 0.434 7.988 -5.457 247 HG2 GLU 32 1HG GLU 32 2.518 8.111 -6.734 248 HG3 GLU 32 2HG GLU 32 2.699 6.362 -6.633 249 H LYS 33 H LYS 33 1.345 9.709 -3.769 250 HA LYS 33 HA LYS 33 3.519 11.044 -4.997 251 HB2 LYS 33 1HB LYS 33 1.396 12.145 -4.312 252 HB3 LYS 33 2HB LYS 33 1.844 11.952 -2.623 253 HG2 LYS 33 1HG LYS 33 3.773 13.427 -2.932 254 HG3 LYS 33 2HG LYS 33 3.400 13.578 -4.655 255 HD2 LYS 33 1HD LYS 33 1.229 14.608 -4.114 256 HD3 LYS 33 2HD LYS 33 1.557 14.417 -2.385 257 HE2 LYS 33 1HE LYS 33 3.526 15.894 -2.588 258 HE3 LYS 33 2HE LYS 33 3.223 16.073 -4.318 259 HZ1 LYS 33 3HZ LYS 33 1.396 16.918 -2.169 260 HZ2 LYS 33 1HZ LYS 33 2.350 17.912 -3.075 261 HZ3 LYS 33 2HZ LYS 33 1.112 17.084 -3.786 262 H LEU 34 H LEU 34 3.105 10.184 -1.556 263 HA LEU 34 HA LEU 34 5.621 11.203 -0.685 264 HB2 LEU 34 1HB LEU 34 3.899 8.906 0.323 265 HB3 LEU 34 2HB LEU 34 5.350 9.467 1.159 266 HG LEU 34 HG LEU 34 2.902 11.185 0.620 267 HD11 LEU 34 1HD1 LEU 34 2.431 10.874 3.010 268 HD12 LEU 34 1HD2 LEU 34 2.382 9.332 2.123 269 HD13 LEU 34 1HD3 LEU 34 3.793 9.735 3.130 270 HD21 LEU 34 2HD3 LEU 34 5.028 12.429 0.834 271 HD22 LEU 34 2HD1 LEU 34 3.984 12.695 2.252 272 HD23 LEU 34 2HD2 LEU 34 5.370 11.582 2.362 273 H ALA 35 H ALA 35 4.741 7.949 -1.841 274 HA ALA 35 HA ALA 35 7.318 6.800 -1.499 275 HB1 ALA 35 3HB ALA 35 5.187 6.161 -3.569 276 HB2 ALA 35 1HB ALA 35 6.566 5.122 -3.144 277 HB3 ALA 35 2HB ALA 35 5.303 5.464 -1.937 278 H ASN 36 H ASN 36 5.912 8.602 -4.215 279 HA ASN 36 HA ASN 36 8.158 8.185 -5.990 280 HB2 ASN 36 1HB ASN 36 5.898 10.189 -5.921 281 HB3 ASN 36 2HB ASN 36 7.159 10.237 -7.145 282 HD21 ASN 36 2HD2 ASN 36 4.471 9.872 -7.746 283 HD22 ASN 36 2HD1 ASN 36 4.252 8.280 -8.390 284 H GLU 37 H GLU 37 7.455 10.519 -3.466 285 HA GLU 37 HA GLU 37 9.758 12.207 -4.191 286 HB2 GLU 37 1HB GLU 37 7.876 12.182 -1.795 287 HB3 GLU 37 2HB GLU 37 9.186 13.336 -1.998 288 HG2 GLU 37 1HG GLU 37 8.154 14.210 -4.022 289 HG3 GLU 37 2HG GLU 37 6.881 12.995 -3.928 290 H GLY 38 H GLY 38 9.546 9.205 -2.919 291 HA2 GLY 38 1HA GLY 38 11.239 7.898 -2.009 292 HA3 GLY 38 2HA GLY 38 12.291 9.334 -1.979 293 H PHE 39 H PHE 39 9.140 9.495 -0.511 294 HA PHE 39 HA PHE 39 10.234 10.273 2.040 295 HB2 PHE 39 1HB PHE 39 8.027 11.056 1.266 296 HB3 PHE 39 2HB PHE 39 7.422 9.408 1.241 297 HD1 PHE 39 1HD PHE 39 8.799 12.012 3.516 298 HD2 PHE 39 2HD PHE 39 6.451 8.463 3.142 299 HE1 PHE 39 1HE PHE 39 8.076 12.244 5.869 300 HE2 PHE 39 2HE PHE 39 5.725 8.692 5.493 301 HZ PHE 39 HZ PHE 39 6.539 10.584 6.858 302 H TYR 40 H TYR 40 8.407 7.340 1.105 303 HA TYR 40 HA TYR 40 8.865 6.102 3.695 304 HB2 TYR 40 1HB TYR 40 7.867 4.984 1.048 305 HB3 TYR 40 2HB TYR 40 7.930 4.066 2.546 306 HD1 TYR 40 2HD TYR 40 6.804 5.394 4.628 307 HD2 TYR 40 1HD TYR 40 5.845 5.901 0.476 308 HE1 TYR 40 2HE TYR 40 4.571 6.252 5.249 309 HE2 TYR 40 1HE TYR 40 3.612 6.759 1.098 310 HH TYR 40 HH TYR 40 2.750 7.387 4.453 311 H ASN 41 H ASN 41 10.554 6.117 0.633 312 HA ASN 41 HA ASN 41 12.279 3.877 1.121 313 HB2 ASN 41 1HB ASN 41 12.055 5.020 -1.064 314 HB3 ASN 41 2HB ASN 41 12.852 6.438 -0.396 315 HD21 ASN 41 2HD2 ASN 41 13.712 4.861 -2.620 316 HD22 ASN 41 2HD1 ASN 41 15.262 4.204 -2.215 317 H GLY 42 H GLY 42 13.385 3.554 2.880 318 HA2 GLY 42 1HA GLY 42 15.517 4.078 3.967 319 HA3 GLY 42 2HA GLY 42 15.102 5.804 3.846 320 H LEU 43 H LEU 43 12.223 4.803 4.552 321 HA LEU 43 HA LEU 43 12.586 5.091 7.478 322 HB2 LEU 43 1HB LEU 43 10.059 4.905 5.787 323 HB3 LEU 43 2HB LEU 43 10.129 5.308 7.505 324 HG LEU 43 HG LEU 43 11.161 6.992 5.199 325 HD11 LEU 43 1HD1 LEU 43 9.421 8.550 5.953 326 HD12 LEU 43 1HD2 LEU 43 8.734 6.982 5.467 327 HD13 LEU 43 1HD3 LEU 43 8.911 7.380 7.193 328 HD21 LEU 43 2HD3 LEU 43 12.651 7.141 7.166 329 HD22 LEU 43 2HD1 LEU 43 11.723 8.644 6.950 330 HD23 LEU 43 2HD2 LEU 43 11.245 7.476 8.206 331 H THR 44 H THR 44 10.852 3.791 8.779 332 HA THR 44 HA THR 44 11.317 0.915 8.077 333 HB THR 44 HB THR 44 12.087 0.436 10.307 334 HG1 THR 44 1HG THR 44 12.222 2.152 11.863 335 HG21 THR 44 2HG3 THR 44 13.444 2.978 9.333 336 HG22 THR 44 2HG1 THR 44 14.136 1.794 10.464 337 HG23 THR 44 2HG2 THR 44 13.809 1.328 8.778 338 H PHE 45 H PHE 45 10.094 -0.578 9.544 339 HA PHE 45 HA PHE 45 7.456 0.603 10.309 340 HB2 PHE 45 1HB PHE 45 8.428 -2.259 9.955 341 HB3 PHE 45 2HB PHE 45 6.882 -1.865 10.687 342 HD1 PHE 45 1HD PHE 45 8.868 -1.616 7.573 343 HD2 PHE 45 2HD PHE 45 5.007 -1.271 9.371 344 HE1 PHE 45 1HE PHE 45 7.834 -1.509 5.330 345 HE2 PHE 45 2HE PHE 45 3.969 -1.167 7.130 346 HZ PHE 45 HZ PHE 45 5.385 -1.284 5.108 347 H HIS 46 H HIS 46 7.723 1.628 12.187 348 HA HIS 46 HA HIS 46 9.546 0.648 14.227 349 HB2 HIS 46 1HB HIS 46 9.009 3.077 13.888 350 HB3 HIS 46 2HB HIS 46 7.362 2.766 14.419 351 HD2 HIS 46 2HD HIS 46 10.956 3.077 15.949 352 HE1 HIS 46 1HE HIS 46 8.127 2.835 19.126 353 H ARG 47 H ARG 47 6.137 0.246 13.572 354 HA ARG 47 HA ARG 47 5.836 -1.103 16.238 355 HB2 ARG 47 1HB ARG 47 3.808 0.522 14.654 356 HB3 ARG 47 2HB ARG 47 3.429 -0.415 16.091 357 HG2 ARG 47 1HG ARG 47 4.880 1.005 17.443 358 HG3 ARG 47 2HG ARG 47 5.349 1.926 15.994 359 HD2 ARG 47 1HD ARG 47 2.933 2.459 15.677 360 HD3 ARG 47 2HD ARG 47 2.639 1.737 17.276 361 HE ARG 47 HE ARG 47 3.849 4.304 16.688 362 HH11 ARG 47 1HH1 ARG 47 3.559 1.719 19.050 363 HH12 ARG 47 1HH2 ARG 47 3.962 2.745 20.408 364 HH21 ARG 47 2HH1 ARG 47 4.370 5.626 18.460 365 HH22 ARG 47 2HH2 ARG 47 4.421 4.957 20.075 366 H VAL 48 H VAL 48 6.591 -3.005 15.079 367 HA VAL 48 HA VAL 48 4.457 -4.244 13.360 368 HB VAL 48 HB VAL 48 7.316 -5.151 13.948 369 HG11 VAL 48 1HG1 VAL 48 6.962 -6.707 12.093 370 HG12 VAL 48 1HG2 VAL 48 5.818 -6.990 13.427 371 HG13 VAL 48 1HG3 VAL 48 5.278 -6.154 11.950 372 HG21 VAL 48 2HG3 VAL 48 7.271 -3.051 12.645 373 HG22 VAL 48 2HG1 VAL 48 7.801 -4.417 11.634 374 HG23 VAL 48 2HG2 VAL 48 6.141 -3.792 11.487 375 H ILE 49 H ILE 49 2.978 -5.348 14.309 376 HA ILE 49 HA ILE 49 3.891 -7.303 16.408 377 HB ILE 49 HB ILE 49 1.089 -6.158 15.957 378 HG12 ILE 49 1HG1 ILE 49 2.966 -5.631 18.268 379 HG13 ILE 49 1HG2 ILE 49 2.748 -4.537 16.911 380 HG21 ILE 49 2HG1 ILE 49 0.539 -7.346 18.041 381 HG22 ILE 49 2HG2 ILE 49 1.099 -8.479 16.788 382 HG23 ILE 49 2HG3 ILE 49 2.192 -8.002 18.108 383 HD11 ILE 49 1HD3 ILE 49 0.583 -5.422 18.832 384 HD12 ILE 49 1HD1 ILE 49 1.408 -3.847 18.818 385 HD13 ILE 49 1HD2 ILE 49 0.363 -4.316 17.456 386 HA PRO 50 HA PRO 50 3.334 -9.967 12.870 387 HB2 PRO 50 1HB PRO 50 4.276 -11.849 15.082 388 HB3 PRO 50 2HB PRO 50 4.830 -11.765 13.405 389 HG2 PRO 50 1HG PRO 50 6.394 -10.741 15.297 390 HG3 PRO 50 2HG PRO 50 6.173 -9.837 13.796 391 HD2 PRO 50 1HD PRO 50 4.867 -9.407 16.506 392 HD3 PRO 50 2HD PRO 50 5.483 -8.181 15.327 393 H GLY 51 H GLY 51 1.616 -10.952 12.255 394 HA2 GLY 51 1HA GLY 51 -0.273 -12.320 12.371 395 HA3 GLY 51 2HA GLY 51 0.079 -12.634 14.087 396 H PHE 52 H PHE 52 0.198 -9.334 13.462 397 HA PHE 52 HA PHE 52 -2.721 -8.940 13.993 398 HB2 PHE 52 1HB PHE 52 -1.455 -8.789 16.151 399 HB3 PHE 52 2HB PHE 52 -0.444 -7.534 15.453 400 HD1 PHE 52 1HD PHE 52 -3.626 -7.102 14.091 401 HD2 PHE 52 2HD PHE 52 -1.444 -6.545 17.722 402 HE1 PHE 52 1HE PHE 52 -5.257 -5.387 14.807 403 HE2 PHE 52 2HE PHE 52 -3.075 -4.832 18.442 404 HZ PHE 52 HZ PHE 52 -4.980 -4.252 16.982 405 H VAL 53 H VAL 53 0.087 -6.750 13.796 406 HA VAL 53 HA VAL 53 -0.779 -5.566 11.261 407 HB VAL 53 HB VAL 53 -2.527 -4.707 12.898 408 HG11 VAL 53 1HG1 VAL 53 -1.828 -3.094 14.600 409 HG12 VAL 53 1HG2 VAL 53 -1.163 -4.717 14.906 410 HG13 VAL 53 1HG3 VAL 53 -0.123 -3.441 14.228 411 HG21 VAL 53 2HG3 VAL 53 -1.865 -3.407 10.904 412 HG22 VAL 53 2HG1 VAL 53 -2.228 -2.331 12.274 413 HG23 VAL 53 2HG2 VAL 53 -0.538 -2.662 11.828 414 H SER 54 H SER 54 0.709 -4.403 10.319 415 HA SER 54 HA SER 54 3.231 -3.811 11.901 416 HB2 SER 54 1HB SER 54 4.352 -3.937 9.751 417 HB3 SER 54 2HB SER 54 3.763 -5.449 10.426 418 HG SER 54 HG SER 54 2.355 -3.890 8.557 419 H GLN 55 H GLN 55 2.826 -1.680 12.485 420 HA GLN 55 HA GLN 55 2.064 0.231 10.328 421 HB2 GLN 55 1HB GLN 55 0.867 0.348 12.524 422 HB3 GLN 55 2HB GLN 55 2.399 0.657 13.329 423 HG2 GLN 55 1HG GLN 55 2.656 2.753 12.133 424 HG3 GLN 55 2HG GLN 55 1.161 2.430 11.212 425 HE21 GLN 55 2HE2 GLN 55 1.140 4.761 12.418 426 HE22 GLN 55 2HE1 GLN 55 0.188 4.751 13.865 427 H GLY 56 H GLY 56 3.354 1.681 9.459 428 HA2 GLY 56 1HA GLY 56 5.929 2.360 10.672 429 HA3 GLY 56 2HA GLY 56 6.054 1.344 9.217 430 H GLY 57 H GLY 57 7.257 3.294 8.455 431 HA2 GLY 57 1HA GLY 57 7.176 4.871 6.705 432 HA3 GLY 57 2HA GLY 57 5.412 4.991 6.904 433 H CYS 58 H CYS 58 7.115 5.140 9.849 434 HA CYS 58 HA CYS 58 6.393 7.949 10.349 435 HB2 CYS 58 1HB CYS 58 6.257 6.292 12.069 436 HB3 CYS 58 2HB CYS 58 7.997 6.053 11.994 437 HG CYS 58 HG CYS 58 7.330 7.395 14.101 438 HA PRO 59 HA PRO 59 10.298 9.401 8.689 439 HB2 PRO 59 1HB PRO 59 9.772 12.074 8.982 440 HB3 PRO 59 2HB PRO 59 8.934 11.140 7.736 441 HG2 PRO 59 1HG PRO 59 7.965 11.916 10.520 442 HG3 PRO 59 2HG PRO 59 7.109 12.068 8.983 443 HD2 PRO 59 1HD PRO 59 6.666 9.955 10.645 444 HD3 PRO 59 2HD PRO 59 6.628 9.764 8.846 445 H ARG 60 H ARG 60 8.994 9.898 11.850 446 HA ARG 60 HA ARG 60 11.518 11.129 12.812 447 HB2 ARG 60 1HB ARG 60 8.979 10.351 14.301 448 HB3 ARG 60 2HB ARG 60 10.337 11.233 14.983 449 HG2 ARG 60 1HG ARG 60 9.899 13.053 13.299 450 HG3 ARG 60 2HG ARG 60 8.412 12.182 12.854 451 HD2 ARG 60 1HD ARG 60 7.893 13.892 14.433 452 HD3 ARG 60 2HD ARG 60 7.699 12.302 15.207 453 HE ARG 60 HE ARG 60 10.318 13.244 15.701 454 HH11 ARG 60 1HH1 ARG 60 6.986 13.966 16.548 455 HH12 ARG 60 1HH2 ARG 60 7.398 14.649 18.105 456 HH21 ARG 60 2HH1 ARG 60 10.841 14.134 17.723 457 HH22 ARG 60 2HH2 ARG 60 9.580 14.746 18.771 458 H GLY 61 H GLY 61 9.919 8.044 12.692 459 HA2 GLY 61 1HA GLY 61 10.821 5.947 13.128 460 HA3 GLY 61 2HA GLY 61 12.356 6.731 13.567 461 H ASN 62 H ASN 62 9.566 7.962 15.143 462 HA ASN 62 HA ASN 62 10.450 6.630 17.674 463 HB2 ASN 62 1HB ASN 62 8.941 9.207 17.166 464 HB3 ASN 62 2HB ASN 62 9.180 8.505 18.760 465 HD21 ASN 62 2HD2 ASN 62 10.097 11.055 17.661 466 HD22 ASN 62 2HD1 ASN 62 11.821 11.057 17.833 467 H GLY 63 H GLY 63 8.209 6.201 15.328 468 HA2 GLY 63 1HA GLY 63 6.463 4.576 15.507 469 HA3 GLY 63 2HA GLY 63 6.335 4.921 17.248 470 H THR 64 H THR 64 6.510 7.889 16.530 471 HA THR 64 HA THR 64 3.817 8.239 15.266 472 HB THR 64 HB THR 64 4.845 9.720 17.727 473 HG1 THR 64 1HG THR 64 3.048 8.635 18.715 474 HG21 THR 64 2HG3 THR 64 2.213 9.907 16.213 475 HG22 THR 64 2HG1 THR 64 2.617 10.771 17.715 476 HG23 THR 64 2HG2 THR 64 3.501 11.135 16.214 477 H GLY 65 H GLY 65 3.849 9.466 13.572 478 HA2 GLY 65 1HA GLY 65 6.327 10.959 12.984 479 HA3 GLY 65 2HA GLY 65 5.005 10.595 11.850 480 H ASP 66 H ASP 66 5.552 12.955 11.367 481 HA ASP 66 HA ASP 66 3.644 14.647 12.926 482 HB2 ASP 66 1HB ASP 66 5.998 15.157 13.660 483 HB3 ASP 66 2HB ASP 66 6.406 15.542 11.993 484 H ALA 67 H ALA 67 2.121 14.363 11.329 485 HA ALA 67 HA ALA 67 2.573 16.090 8.977 486 HB1 ALA 67 3HB ALA 67 1.712 13.186 8.728 487 HB2 ALA 67 1HB ALA 67 1.739 14.377 7.408 488 HB3 ALA 67 2HB ALA 67 3.260 13.869 8.180 489 H GLY 68 H GLY 68 0.641 16.670 7.854 490 HA2 GLY 68 1HA GLY 68 -1.897 16.069 9.263 491 HA3 GLY 68 2HA GLY 68 -1.363 17.766 9.207 492 H TYR 69 H TYR 69 -2.326 14.965 7.264 493 HA TYR 69 HA TYR 69 -2.650 16.719 4.868 494 HB2 TYR 69 1HB TYR 69 -2.713 13.698 5.222 495 HB3 TYR 69 2HB TYR 69 -3.089 14.516 3.711 496 HD1 TYR 69 2HD TYR 69 -1.327 15.842 2.537 497 HD2 TYR 69 1HD TYR 69 -0.474 13.376 5.943 498 HE1 TYR 69 2HE TYR 69 1.075 15.861 1.950 499 HE2 TYR 69 1HE TYR 69 1.927 13.396 5.356 500 HH TYR 69 HH TYR 69 3.107 15.166 2.493 501 H THR 70 H THR 70 -4.529 17.108 3.869 502 HA THR 70 HA THR 70 -6.983 16.594 5.440 503 HB THR 70 HB THR 70 -6.569 18.118 2.829 504 HG1 THR 70 1HG THR 70 -6.790 19.937 4.250 505 HG21 THR 70 2HG3 THR 70 -8.933 18.002 4.740 506 HG22 THR 70 2HG1 THR 70 -8.803 19.042 3.304 507 HG23 THR 70 2HG2 THR 70 -8.873 17.274 3.119 508 H ILE 71 H ILE 71 -7.420 14.460 5.316 509 HA ILE 71 HA ILE 71 -8.227 13.492 2.584 510 HB ILE 71 HB ILE 71 -7.079 11.847 4.896 511 HG12 ILE 71 1HG1 ILE 71 -5.826 12.480 2.215 512 HG13 ILE 71 1HG2 ILE 71 -5.399 13.263 3.728 513 HG21 ILE 71 2HG1 ILE 71 -7.148 9.988 3.285 514 HG22 ILE 71 2HG2 ILE 71 -8.776 10.644 3.573 515 HG23 ILE 71 2HG3 ILE 71 -7.902 11.055 2.078 516 HD11 ILE 71 1HD3 ILE 71 -5.130 10.309 3.130 517 HD12 ILE 71 1HD1 ILE 71 -3.815 11.505 3.172 518 HD13 ILE 71 1HD2 ILE 71 -4.699 11.101 4.663 519 HA PRO 72 HA PRO 72 -12.125 13.390 4.729 520 HB2 PRO 72 1HB PRO 72 -13.608 13.127 2.428 521 HB3 PRO 72 2HB PRO 72 -12.944 14.699 2.891 522 HG2 PRO 72 1HG PRO 72 -11.818 12.655 0.929 523 HG3 PRO 72 2HG PRO 72 -12.041 14.389 0.689 524 HD2 PRO 72 1HD PRO 72 -9.622 13.396 1.396 525 HD3 PRO 72 2HD PRO 72 -10.207 14.972 2.066 526 H CYS 73 H CYS 73 -13.706 11.846 5.053 527 HA CYS 73 HA CYS 73 -12.729 9.139 5.197 528 HB2 CYS 73 1HB CYS 73 -14.355 10.063 6.707 529 HB3 CYS 73 2HB CYS 73 -15.539 10.103 5.409 530 HG CYS 73 HG CYS 73 -16.056 8.165 7.009 531 H GLU 74 H GLU 74 -12.147 8.230 3.230 532 HA GLU 74 HA GLU 74 -14.027 8.422 0.941 533 HB2 GLU 74 1HB GLU 74 -11.272 7.144 1.196 534 HB3 GLU 74 2HB GLU 74 -12.203 7.251 -0.291 535 HG2 GLU 74 1HG GLU 74 -12.163 9.788 0.045 536 HG3 GLU 74 2HG GLU 74 -10.943 9.492 1.282 537 H THR 75 H THR 75 -15.728 7.228 1.962 538 HA THR 75 HA THR 75 -15.247 4.274 1.855 539 HB THR 75 HB THR 75 -17.477 4.088 2.944 540 HG1 THR 75 1HG THR 75 -18.423 6.061 3.715 541 HG21 THR 75 2HG3 THR 75 -15.570 5.980 4.372 542 HG22 THR 75 2HG1 THR 75 -16.826 4.986 5.145 543 HG23 THR 75 2HG2 THR 75 -15.443 4.206 4.342 544 H ASP 76 H ASP 76 -16.128 6.744 -0.133 545 HA ASP 76 HA ASP 76 -18.445 5.740 -1.468 546 HB2 ASP 76 1HB ASP 76 -17.467 8.023 -1.811 547 HB3 ASP 76 2HB ASP 76 -16.098 7.295 -2.640 548 H ASN 77 H ASN 77 -18.603 3.678 -1.998 549 HA ASN 77 HA ASN 77 -18.043 1.591 -2.866 550 HB2 ASN 77 1HB ASN 77 -16.625 3.372 -4.867 551 HB3 ASN 77 2HB ASN 77 -16.841 1.637 -5.059 552 HD21 ASN 77 2HD2 ASN 77 -17.822 3.786 -6.731 553 HD22 ASN 77 2HD1 ASN 77 -19.548 3.638 -6.763 554 H ASN 78 H ASN 78 -16.476 2.468 -0.706 555 HA ASN 78 HA ASN 78 -14.068 0.811 -1.176 556 HB2 ASN 78 1HB ASN 78 -13.414 3.156 -1.771 557 HB3 ASN 78 2HB ASN 78 -13.835 3.648 -0.136 558 HD21 ASN 78 2HD2 ASN 78 -12.059 3.967 0.994 559 HD22 ASN 78 2HD1 ASN 78 -10.660 2.948 1.002 560 HA PRO 79 HA PRO 79 -15.962 0.043 2.974 561 HB2 PRO 79 1HB PRO 79 -15.047 -2.688 2.028 562 HB3 PRO 79 2HB PRO 79 -16.569 -2.253 2.818 563 HG2 PRO 79 1HG PRO 79 -16.606 -2.813 0.212 564 HG3 PRO 79 2HG PRO 79 -17.546 -1.441 0.806 565 HD2 PRO 79 1HD PRO 79 -14.798 -1.447 -0.518 566 HD3 PRO 79 2HD PRO 79 -16.218 -0.379 -0.857 567 H HIS 80 H HIS 80 -14.771 0.288 4.643 568 HA HIS 80 HA HIS 80 -11.843 -0.031 4.372 569 HB2 HIS 80 1HB HIS 80 -13.563 1.021 6.659 570 HB3 HIS 80 2HB HIS 80 -11.806 1.008 6.645 571 HD2 HIS 80 2HD HIS 80 -12.393 2.071 3.199 572 HE1 HIS 80 1HE HIS 80 -12.894 5.659 5.443 573 H ARG 81 H ARG 81 -12.613 -2.456 4.072 574 HA ARG 81 HA ARG 81 -12.894 -3.869 6.637 575 HB2 ARG 81 1HB ARG 81 -13.942 -4.716 4.534 576 HB3 ARG 81 2HB ARG 81 -12.345 -4.918 3.832 577 HG2 ARG 81 1HG ARG 81 -11.792 -6.578 5.573 578 HG3 ARG 81 2HG ARG 81 -13.431 -6.392 6.244 579 HD2 ARG 81 1HD ARG 81 -12.821 -7.227 3.420 580 HD3 ARG 81 2HD ARG 81 -13.163 -8.341 4.764 581 HE ARG 81 HE ARG 81 -15.053 -6.672 3.313 582 HH11 ARG 81 1HH1 ARG 81 -14.436 -8.514 6.240 583 HH12 ARG 81 1HH2 ARG 81 -16.132 -8.741 6.604 584 HH21 ARG 81 2HH1 ARG 81 -17.251 -6.974 3.795 585 HH22 ARG 81 2HH2 ARG 81 -17.726 -7.870 5.222 586 H HIS 82 H HIS 82 -11.338 -4.276 7.971 587 HA HIS 82 HA HIS 82 -8.535 -4.260 6.934 588 HB2 HIS 82 1HB HIS 82 -9.675 -3.912 9.739 589 HB3 HIS 82 2HB HIS 82 -7.955 -4.043 9.392 590 HD2 HIS 82 2HD HIS 82 -6.748 -1.713 8.471 591 HE1 HIS 82 1HE HIS 82 -10.293 0.652 8.387 592 H VAL 83 H VAL 83 -8.571 -6.335 6.049 593 HA VAL 83 HA VAL 83 -8.266 -8.474 8.151 594 HB VAL 83 HB VAL 83 -9.112 -10.088 6.479 595 HG11 VAL 83 1HG1 VAL 83 -11.478 -9.463 6.503 596 HG12 VAL 83 1HG2 VAL 83 -10.693 -9.161 8.071 597 HG13 VAL 83 1HG3 VAL 83 -11.035 -7.804 6.969 598 HG21 VAL 83 2HG3 VAL 83 -8.449 -8.839 4.453 599 HG22 VAL 83 2HG1 VAL 83 -10.176 -9.269 4.400 600 HG23 VAL 83 2HG2 VAL 83 -9.684 -7.607 4.805 601 H THR 84 H THR 84 -7.266 -10.477 6.826 602 HA THR 84 HA THR 84 -4.520 -9.881 6.769 603 HB THR 84 HB THR 84 -5.932 -12.106 5.230 604 HG1 THR 84 1HG THR 84 -4.828 -12.139 7.864 605 HG21 THR 84 2HG3 THR 84 -3.090 -11.858 6.285 606 HG22 THR 84 2HG1 THR 84 -3.783 -13.284 5.482 607 HG23 THR 84 2HG2 THR 84 -3.574 -11.767 4.576 608 H GLY 85 H GLY 85 -3.429 -8.546 5.570 609 HA2 GLY 85 1HA GLY 85 -2.222 -8.385 3.484 610 HA3 GLY 85 2HA GLY 85 -3.686 -8.911 2.622 611 H ALA 86 H ALA 86 -5.132 -6.993 4.633 612 HA ALA 86 HA ALA 86 -5.515 -4.944 2.670 613 HB1 ALA 86 3HB ALA 86 -6.284 -4.994 5.610 614 HB2 ALA 86 1HB ALA 86 -6.915 -3.863 4.391 615 HB3 ALA 86 2HB ALA 86 -7.269 -5.602 4.260 616 H MET 87 H MET 87 -4.805 -2.905 2.456 617 HA MET 87 HA MET 87 -2.750 -1.974 4.438 618 HB2 MET 87 1HB MET 87 -3.000 -1.275 1.490 619 HB3 MET 87 2HB MET 87 -1.779 -0.664 2.595 620 HG2 MET 87 1HG MET 87 -0.937 -2.988 2.900 621 HG3 MET 87 2HG MET 87 -2.121 -3.546 1.716 622 HE1 MET 87 3HE MET 87 1.155 -1.520 2.356 623 HE2 MET 87 1HE MET 87 1.440 -0.745 0.779 624 HE3 MET 87 2HE MET 87 0.064 -0.233 1.787 625 H SER 88 H SER 88 -3.088 -0.199 5.528 626 HA SER 88 HA SER 88 -5.366 1.622 4.714 627 HB2 SER 88 1HB SER 88 -6.324 -0.032 6.099 628 HB3 SER 88 2HB SER 88 -5.123 0.267 7.346 629 HG SER 88 HG SER 88 -5.829 2.403 7.422 630 H MET 89 H MET 89 -4.989 3.716 5.159 631 HA MET 89 HA MET 89 -2.383 4.491 6.293 632 HB2 MET 89 1HB MET 89 -4.726 6.102 5.220 633 HB3 MET 89 2HB MET 89 -3.228 6.810 5.808 634 HG2 MET 89 1HG MET 89 -3.486 4.914 3.456 635 HG3 MET 89 2HG MET 89 -3.269 6.664 3.367 636 HE1 MET 89 3HE MET 89 -1.171 7.402 5.519 637 HE2 MET 89 1HE MET 89 0.355 7.204 4.625 638 HE3 MET 89 2HE MET 89 -1.060 7.927 3.822 639 H ALA 90 H ALA 90 -1.989 5.673 8.105 640 HA ALA 90 HA ALA 90 -3.858 5.268 10.301 641 HB1 ALA 90 3HB ALA 90 -1.272 6.859 10.153 642 HB2 ALA 90 1HB ALA 90 -2.160 6.457 11.641 643 HB3 ALA 90 2HB ALA 90 -1.429 5.162 10.662 644 H HIS 91 H HIS 91 -5.678 6.373 10.338 645 HA HIS 91 HA HIS 91 -5.514 9.331 9.863 646 HB2 HIS 91 1HB HIS 91 -7.722 7.359 9.146 647 HB3 HIS 91 2HB HIS 91 -7.952 9.102 9.157 648 HD2 HIS 91 2HD HIS 91 -4.560 9.071 7.607 649 HE1 HIS 91 1HE HIS 91 -7.198 8.035 4.443 650 H ARG 92 H ARG 92 -6.774 10.690 11.092 651 HA ARG 92 HA ARG 92 -7.845 9.440 13.604 652 HB2 ARG 92 1HB ARG 92 -6.435 12.115 13.247 653 HB3 ARG 92 2HB ARG 92 -7.186 11.562 14.736 654 HG2 ARG 92 1HG ARG 92 -5.586 9.702 14.868 655 HG3 ARG 92 2HG ARG 92 -4.827 10.256 13.356 656 HD2 ARG 92 1HD ARG 92 -4.300 12.385 14.415 657 HD3 ARG 92 2HD ARG 92 -5.029 11.801 15.930 658 HE ARG 92 HE ARG 92 -3.044 9.972 15.016 659 HH11 ARG 92 1HH1 ARG 92 -3.409 13.139 16.492 660 HH12 ARG 92 1HH2 ARG 92 -1.864 13.075 17.309 661 HH21 ARG 92 2HH1 ARG 92 -1.040 9.901 16.082 662 HH22 ARG 92 2HH2 ARG 92 -0.521 11.243 17.078 663 H GLY 93 H GLY 93 -9.447 9.736 11.369 664 HA2 GLY 93 1HA GLY 93 -11.805 10.438 11.630 665 HA3 GLY 93 2HA GLY 93 -11.204 12.000 12.235 666 H ARG 94 H ARG 94 -12.931 12.327 10.328 667 HA ARG 94 HA ARG 94 -11.955 12.156 7.623 668 HB2 ARG 94 1HB ARG 94 -13.799 13.597 7.061 669 HB3 ARG 94 2HB ARG 94 -14.365 12.477 8.292 670 HG2 ARG 94 1HG ARG 94 -14.227 14.185 9.997 671 HG3 ARG 94 2HG ARG 94 -13.483 15.321 8.845 672 HD2 ARG 94 1HD ARG 94 -15.486 15.296 7.500 673 HD3 ARG 94 2HD ARG 94 -16.230 14.115 8.604 674 HE ARG 94 HE ARG 94 -16.635 15.796 10.127 675 HH11 ARG 94 1HH1 ARG 94 -14.512 16.985 7.593 676 HH12 ARG 94 1HH2 ARG 94 -14.654 18.657 8.087 677 HH21 ARG 94 2HH1 ARG 94 -16.810 17.969 10.759 678 HH22 ARG 94 2HH2 ARG 94 -15.955 19.215 9.878 679 H ASP 95 H ASP 95 -11.059 13.629 6.263 680 HA ASP 95 HA ASP 95 -9.558 15.318 5.699 681 HB2 ASP 95 1HB ASP 95 -11.179 16.865 7.768 682 HB3 ASP 95 2HB ASP 95 -10.127 17.572 6.550 683 H THR 96 H THR 96 -8.775 13.484 7.807 684 HA THR 96 HA THR 96 -6.611 15.103 9.001 685 HB THR 96 HB THR 96 -8.501 13.511 10.787 686 HG1 THR 96 1HG THR 96 -9.567 15.383 10.212 687 HG21 THR 96 2HG3 THR 96 -6.182 15.384 11.397 688 HG22 THR 96 2HG1 THR 96 -7.214 14.575 12.599 689 HG23 THR 96 2HG2 THR 96 -6.151 13.612 11.545 690 H GLY 97 H GLY 97 -5.426 13.804 7.522 691 HA2 GLY 97 1HA GLY 97 -5.030 11.019 8.550 692 HA3 GLY 97 2HA GLY 97 -4.800 11.495 6.851 693 H SER 98 H SER 98 -2.889 10.208 8.629 694 HA SER 98 HA SER 98 -0.737 12.317 8.885 695 HB2 SER 98 1HB SER 98 0.352 10.998 10.325 696 HB3 SER 98 2HB SER 98 -1.333 10.886 10.806 697 HG SER 98 HG SER 98 -1.468 8.948 9.682 698 H CYS 99 H CYS 99 1.488 11.191 8.478 699 HA CYS 99 HA CYS 99 1.565 10.231 5.654 700 HB2 CYS 99 1HB CYS 99 3.884 10.497 5.785 701 HB3 CYS 99 2HB CYS 99 3.058 11.956 6.311 702 HG CYS 99 HG CYS 99 3.276 11.416 8.878 703 H GLN 100 H GLN 100 1.111 8.801 8.655 704 HA GLN 100 HA GLN 100 2.934 6.508 8.178 705 HB2 GLN 100 1HB GLN 100 1.058 7.229 10.468 706 HB3 GLN 100 2HB GLN 100 1.971 5.728 10.397 707 HG2 GLN 100 1HG GLN 100 4.073 6.987 10.387 708 HG3 GLN 100 2HG GLN 100 3.149 8.515 10.450 709 HE21 GLN 100 2HE2 GLN 100 4.163 5.644 12.212 710 HE22 GLN 100 2HE1 GLN 100 3.723 6.213 13.788 711 H PHE 101 H PHE 101 2.311 4.398 7.941 712 HA PHE 101 HA PHE 101 -0.602 3.868 7.573 713 HB2 PHE 101 1HB PHE 101 -0.282 2.763 5.480 714 HB3 PHE 101 2HB PHE 101 0.508 4.324 5.321 715 HD1 PHE 101 2HD PHE 101 3.000 4.471 5.478 716 HD2 PHE 101 1HD PHE 101 0.932 0.738 5.292 717 HE1 PHE 101 2HE PHE 101 5.097 3.346 4.809 718 HE2 PHE 101 1HE PHE 101 3.027 -0.392 4.626 719 HZ PHE 101 HZ PHE 101 5.110 0.912 4.384 720 H PHE 102 H PHE 102 -1.031 1.502 7.337 721 HA PHE 102 HA PHE 102 1.005 -0.250 8.580 722 HB2 PHE 102 1HB PHE 102 -0.514 -1.012 10.351 723 HB3 PHE 102 2HB PHE 102 -0.185 0.704 10.533 724 HD1 PHE 102 2HD PHE 102 -1.910 2.371 10.066 725 HD2 PHE 102 1HD PHE 102 -2.712 -1.813 9.758 726 HE1 PHE 102 2HE PHE 102 -4.338 2.837 10.088 727 HE2 PHE 102 1HE PHE 102 -5.141 -1.351 9.777 728 HZ PHE 102 HZ PHE 102 -5.954 0.975 9.941 729 H ILE 103 H ILE 103 0.739 -2.401 8.208 730 HA ILE 103 HA ILE 103 -1.500 -3.113 6.329 731 HB ILE 103 HB ILE 103 1.226 -4.452 6.699 732 HG12 ILE 103 1HG1 ILE 103 0.289 -2.761 4.373 733 HG13 ILE 103 1HG2 ILE 103 1.319 -2.169 5.668 734 HG21 ILE 103 2HG1 ILE 103 0.598 -5.712 4.679 735 HG22 ILE 103 2HG2 ILE 103 -0.566 -5.991 5.995 736 HG23 ILE 103 2HG3 ILE 103 -0.984 -4.895 4.657 737 HD11 ILE 103 1HD3 ILE 103 1.980 -4.442 3.781 738 HD12 ILE 103 1HD1 ILE 103 2.630 -2.788 3.715 739 HD13 ILE 103 1HD2 ILE 103 3.023 -3.843 5.093 740 H VAL 104 H VAL 104 -2.905 -4.595 6.768 741 HA VAL 104 HA VAL 104 -2.899 -5.620 9.561 742 HB VAL 104 HB VAL 104 -4.969 -5.869 7.325 743 HG11 VAL 104 1HG1 VAL 104 -6.520 -6.446 9.128 744 HG12 VAL 104 1HG2 VAL 104 -5.177 -7.607 9.007 745 HG13 VAL 104 1HG3 VAL 104 -5.181 -6.383 10.299 746 HG21 VAL 104 2HG3 VAL 104 -4.572 -3.513 7.958 747 HG22 VAL 104 2HG1 VAL 104 -6.166 -4.066 8.525 748 HG23 VAL 104 2HG2 VAL 104 -4.811 -3.931 9.671 749 H HIS 105 H HIS 105 -2.697 -7.599 10.243 750 HA HIS 105 HA HIS 105 -1.661 -9.529 8.218 751 HB2 HIS 105 1HB HIS 105 -1.466 -9.583 11.260 752 HB3 HIS 105 2HB HIS 105 -0.685 -10.703 10.154 753 HD2 HIS 105 2HD HIS 105 0.014 -7.620 8.347 754 HE1 HIS 105 1HE HIS 105 2.953 -7.625 11.433 755 H GLU 106 H GLU 106 -4.099 -9.183 10.751 756 HA GLU 106 HA GLU 106 -5.434 -11.621 9.640 757 HB2 GLU 106 1HB GLU 106 -5.085 -10.957 12.595 758 HB3 GLU 106 2HB GLU 106 -6.071 -12.266 11.956 759 HG2 GLU 106 1HG GLU 106 -3.078 -12.026 11.577 760 HG3 GLU 106 2HG GLU 106 -3.864 -12.982 12.830 761 HA PRO 107 HA PRO 107 -9.202 -9.358 9.533 762 HB2 PRO 107 1HB PRO 107 -10.294 -11.717 11.128 763 HB3 PRO 107 2HB PRO 107 -10.948 -10.995 9.652 764 HG2 PRO 107 1HG PRO 107 -9.673 -13.320 9.453 765 HG3 PRO 107 2HG PRO 107 -9.348 -12.068 8.250 766 HD2 PRO 107 1HD PRO 107 -7.699 -12.868 10.679 767 HD3 PRO 107 2HD PRO 107 -7.143 -12.454 9.008 768 H GLN 108 H GLN 108 -9.543 -7.676 10.669 769 HA GLN 108 HA GLN 108 -9.876 -8.014 13.627 770 HB2 GLN 108 1HB GLN 108 -8.414 -5.783 12.152 771 HB3 GLN 108 2HB GLN 108 -8.859 -5.715 13.851 772 HG2 GLN 108 1HG GLN 108 -7.063 -7.827 12.644 773 HG3 GLN 108 2HG GLN 108 -6.500 -6.339 13.456 774 HE21 GLN 108 2HE2 GLN 108 -6.467 -9.426 13.985 775 HE22 GLN 108 2HE1 GLN 108 -6.892 -9.527 15.661 776 HA PRO 109 HA PRO 109 -13.792 -6.290 12.030 777 HB2 PRO 109 1HB PRO 109 -14.443 -7.297 14.832 778 HB3 PRO 109 2HB PRO 109 -15.389 -7.488 13.350 779 HG2 PRO 109 1HG PRO 109 -14.041 -9.593 14.263 780 HG3 PRO 109 2HG PRO 109 -14.014 -9.252 12.531 781 HD2 PRO 109 1HD PRO 109 -11.908 -8.637 14.640 782 HD3 PRO 109 2HD PRO 109 -11.688 -9.271 12.960 783 H HIS 110 H HIS 110 -11.954 -5.859 14.983 784 HA HIS 110 HA HIS 110 -13.543 -3.562 15.851 785 HB2 HIS 110 1HB HIS 110 -10.828 -4.624 16.749 786 HB3 HIS 110 2HB HIS 110 -11.671 -3.283 17.515 787 HD2 HIS 110 2HD HIS 110 -11.453 -7.060 17.810 788 HE1 HIS 110 1HE HIS 110 -15.037 -5.909 19.809 789 H LEU 111 H LEU 111 -10.966 -4.059 13.642 790 HA LEU 111 HA LEU 111 -10.186 -1.194 13.715 791 HB2 LEU 111 1HB LEU 111 -9.121 -3.709 12.469 792 HB3 LEU 111 2HB LEU 111 -8.796 -2.184 11.639 793 HG LEU 111 HG LEU 111 -7.629 -1.319 13.601 794 HD11 LEU 111 1HD1 LEU 111 -7.278 -2.734 15.575 795 HD12 LEU 111 1HD2 LEU 111 -9.003 -2.383 15.318 796 HD13 LEU 111 1HD3 LEU 111 -8.342 -3.975 14.876 797 HD21 LEU 111 2HD3 LEU 111 -6.378 -2.679 11.959 798 HD22 LEU 111 2HD1 LEU 111 -5.735 -2.908 13.602 799 HD23 LEU 111 2HD2 LEU 111 -6.778 -4.152 12.875 800 H ASP 112 H ASP 112 -12.447 -3.195 12.175 801 HA ASP 112 HA ASP 112 -12.432 -2.083 9.533 802 HB2 ASP 112 1HB ASP 112 -14.634 -3.384 11.184 803 HB3 ASP 112 2HB ASP 112 -14.845 -2.906 9.506 804 H GLY 113 H GLY 113 -12.941 -0.198 8.773 805 HA2 GLY 113 1HA GLY 113 -14.287 1.677 8.409 806 HA3 GLY 113 2HA GLY 113 -15.293 1.206 9.798 807 H VAL 114 H VAL 114 -12.110 1.081 10.753 808 HA VAL 114 HA VAL 114 -12.350 3.664 12.222 809 HB VAL 114 HB VAL 114 -10.250 1.445 12.329 810 HG11 VAL 114 1HG1 VAL 114 -9.529 2.512 14.409 811 HG12 VAL 114 1HG2 VAL 114 -9.353 3.596 13.009 812 HG13 VAL 114 1HG3 VAL 114 -10.705 3.822 14.144 813 HG21 VAL 114 2HG3 VAL 114 -12.476 0.685 13.089 814 HG22 VAL 114 2HG1 VAL 114 -11.349 0.826 14.459 815 HG23 VAL 114 2HG2 VAL 114 -12.580 2.082 14.186 816 H HIS 115 H HIS 115 -9.996 2.082 10.059 817 HA HIS 115 HA HIS 115 -9.045 4.844 9.371 818 HB2 HIS 115 1HB HIS 115 -7.537 2.194 9.285 819 HB3 HIS 115 2HB HIS 115 -6.912 3.724 8.686 820 HD2 HIS 115 2HD HIS 115 -7.305 1.810 12.025 821 HE1 HIS 115 1HE HIS 115 -5.660 5.641 12.906 822 H THR 116 H THR 116 -7.955 4.864 7.154 823 HA THR 116 HA THR 116 -10.066 3.911 5.282 824 HB THR 116 HB THR 116 -7.813 5.920 4.838 825 HG1 THR 116 1HG THR 116 -10.574 6.257 5.491 826 HG21 THR 116 2HG3 THR 116 -10.305 5.269 3.219 827 HG22 THR 116 2HG1 THR 116 -9.129 6.552 2.854 828 HG23 THR 116 2HG2 THR 116 -8.637 4.844 2.773 829 H VAL 117 H VAL 117 -9.748 1.951 4.538 830 HA VAL 117 HA VAL 117 -7.096 0.961 3.736 831 HB VAL 117 HB VAL 117 -9.914 -0.011 3.056 832 HG11 VAL 117 1HG1 VAL 117 -8.822 -2.118 2.460 833 HG12 VAL 117 1HG2 VAL 117 -8.269 -0.769 1.441 834 HG13 VAL 117 1HG3 VAL 117 -7.231 -1.376 2.753 835 HG21 VAL 117 2HG3 VAL 117 -9.446 -0.058 5.482 836 HG22 VAL 117 2HG1 VAL 117 -9.499 -1.705 4.812 837 HG23 VAL 117 2HG2 VAL 117 -7.932 -0.943 5.175 838 H PHE 118 H PHE 118 -6.113 0.923 1.854 839 HA PHE 118 HA PHE 118 -7.386 2.525 -0.329 840 HB2 PHE 118 1HB PHE 118 -5.465 3.963 -0.494 841 HB3 PHE 118 2HB PHE 118 -6.000 4.011 1.179 842 HD1 PHE 118 2HD PHE 118 -4.730 2.790 2.929 843 HD2 PHE 118 1HD PHE 118 -3.325 3.109 -1.093 844 HE1 PHE 118 2HE PHE 118 -2.459 2.163 3.675 845 HE2 PHE 118 1HE PHE 118 -1.052 2.479 -0.351 846 HZ PHE 118 HZ PHE 118 -0.619 2.006 2.033 847 H GLY 119 H GLY 119 -5.485 -0.105 0.681 848 HA2 GLY 119 1HA GLY 119 -5.108 -0.977 -2.081 849 HA3 GLY 119 2HA GLY 119 -3.593 -0.549 -1.254 850 H GLN 120 H GLN 120 -3.438 -2.985 -1.930 851 HA GLN 120 HA GLN 120 -3.713 -4.523 0.550 852 HB2 GLN 120 1HB GLN 120 -5.955 -4.842 -0.499 853 HB3 GLN 120 2HB GLN 120 -5.182 -5.419 -1.968 854 HG2 GLN 120 1HG GLN 120 -4.238 -7.321 -0.744 855 HG3 GLN 120 2HG GLN 120 -5.017 -6.733 0.753 856 HE21 GLN 120 2HE2 GLN 120 -5.649 -9.214 0.169 857 HE22 GLN 120 2HE1 GLN 120 -7.225 -9.349 -0.537 858 H VAL 121 H VAL 121 -2.131 -5.908 0.804 859 HA VAL 121 HA VAL 121 -0.041 -6.114 -1.241 860 HB VAL 121 HB VAL 121 -0.464 -7.626 1.382 861 HG11 VAL 121 1HG1 VAL 121 1.916 -8.170 1.220 862 HG12 VAL 121 1HG2 VAL 121 0.985 -8.838 -0.142 863 HG13 VAL 121 1HG3 VAL 121 1.986 -7.385 -0.375 864 HG21 VAL 121 2HG3 VAL 121 -0.235 -5.187 1.703 865 HG22 VAL 121 2HG1 VAL 121 1.210 -6.045 2.286 866 HG23 VAL 121 2HG2 VAL 121 1.250 -5.195 0.722 867 H THR 122 H THR 122 0.531 -7.676 -2.559 868 HA THR 122 HA THR 122 -1.516 -9.848 -2.900 869 HB THR 122 HB THR 122 -1.099 -9.711 -5.322 870 HG1 THR 122 1HG THR 122 0.226 -7.968 -6.090 871 HG21 THR 122 2HG3 THR 122 -1.694 -6.985 -4.109 872 HG22 THR 122 2HG1 THR 122 -2.104 -7.504 -5.760 873 HG23 THR 122 2HG2 THR 122 -2.877 -8.290 -4.363 874 H SER 123 H SER 123 1.869 -8.988 -2.820 875 HA SER 123 HA SER 123 2.582 -11.924 -2.820 876 HB2 SER 123 1HB SER 123 2.833 -11.221 -5.068 877 HB3 SER 123 2HB SER 123 3.880 -9.903 -4.567 878 HG SER 123 HG SER 123 5.017 -11.742 -5.182 879 H GLY 124 H GLY 124 3.950 -12.375 -1.207 880 HA2 GLY 124 1HA GLY 124 5.682 -11.999 0.358 881 HA3 GLY 124 2HA GLY 124 5.704 -10.278 -0.089 882 H MET 125 H MET 125 2.550 -11.420 0.354 883 HA MET 125 HA MET 125 1.965 -9.729 2.560 884 HB2 MET 125 1HB MET 125 0.281 -10.692 0.989 885 HB3 MET 125 2HB MET 125 0.531 -12.274 1.713 886 HG2 MET 125 1HG MET 125 -0.267 -11.400 3.884 887 HG3 MET 125 2HG MET 125 -0.534 -9.822 3.142 888 HE1 MET 125 3HE MET 125 -1.791 -13.440 3.647 889 HE2 MET 125 1HE MET 125 -2.963 -13.661 2.325 890 HE3 MET 125 2HE MET 125 -1.221 -13.562 1.964 891 H ASP 126 H ASP 126 2.835 -13.173 2.501 892 HA ASP 126 HA ASP 126 2.468 -13.586 5.328 893 HB2 ASP 126 1HB ASP 126 4.124 -15.023 3.219 894 HB3 ASP 126 2HB ASP 126 4.065 -15.549 4.896 895 H VAL 127 H VAL 127 5.244 -12.551 3.387 896 HA VAL 127 HA VAL 127 7.183 -12.480 5.511 897 HB VAL 127 HB VAL 127 6.841 -10.690 3.057 898 HG11 VAL 127 1HG1 VAL 127 9.200 -10.120 3.363 899 HG12 VAL 127 1HG2 VAL 127 8.206 -9.601 4.743 900 HG13 VAL 127 1HG3 VAL 127 9.228 -11.052 4.879 901 HG21 VAL 127 2HG3 VAL 127 7.134 -13.083 2.519 902 HG22 VAL 127 2HG1 VAL 127 8.581 -12.148 2.075 903 HG23 VAL 127 2HG2 VAL 127 8.581 -13.141 3.552 904 H VAL 128 H VAL 128 4.779 -10.078 4.485 905 HA VAL 128 HA VAL 128 5.501 -8.153 6.552 906 HB VAL 128 HB VAL 128 2.895 -8.628 5.025 907 HG11 VAL 128 1HG1 VAL 128 2.281 -6.365 5.725 908 HG12 VAL 128 1HG2 VAL 128 2.481 -7.461 7.113 909 HG13 VAL 128 1HG3 VAL 128 3.751 -6.276 6.723 910 HG21 VAL 128 2HG3 VAL 128 4.807 -8.032 3.578 911 HG22 VAL 128 2HG1 VAL 128 3.638 -6.693 3.674 912 HG23 VAL 128 2HG2 VAL 128 5.151 -6.622 4.610 913 H ARG 129 H ARG 129 3.170 -10.820 6.410 914 HA ARG 129 HA ARG 129 1.816 -10.167 8.836 915 HB2 ARG 129 1HB ARG 129 2.285 -12.807 7.407 916 HB3 ARG 129 2HB ARG 129 1.296 -12.672 8.854 917 HG2 ARG 129 1HG ARG 129 -0.306 -11.292 7.737 918 HG3 ARG 129 2HG ARG 129 0.753 -11.114 6.317 919 HD2 ARG 129 1HD ARG 129 -0.867 -12.701 5.743 920 HD3 ARG 129 2HD ARG 129 0.623 -13.615 6.079 921 HE ARG 129 HE ARG 129 -1.273 -13.315 8.297 922 HH11 ARG 129 1HH1 ARG 129 -0.022 -15.315 5.695 923 HH12 ARG 129 1HH2 ARG 129 -0.653 -16.802 6.366 924 HH21 ARG 129 2HH1 ARG 129 -2.086 -15.251 9.159 925 HH22 ARG 129 2HH2 ARG 129 -1.821 -16.767 8.328 926 H THR 130 H THR 130 4.780 -11.997 8.244 927 HA THR 130 HA THR 130 5.148 -12.141 11.220 928 HB THR 130 HB THR 130 6.730 -14.014 10.756 929 HG1 THR 130 1HG THR 130 6.672 -14.902 8.614 930 HG21 THR 130 2HG3 THR 130 3.952 -14.414 9.582 931 HG22 THR 130 2HG1 THR 130 5.032 -15.700 10.169 932 HG23 THR 130 2HG2 THR 130 4.372 -14.502 11.308 933 H MET 131 H MET 131 5.702 -9.868 9.435 934 HA MET 131 HA MET 131 8.535 -9.678 8.969 935 HB2 MET 131 1HB MET 131 6.834 -8.186 7.930 936 HB3 MET 131 2HB MET 131 6.507 -7.474 9.504 937 HG2 MET 131 1HG MET 131 8.635 -6.443 9.606 938 HG3 MET 131 2HG MET 131 9.273 -7.432 8.289 939 HE1 MET 131 3HE MET 131 6.717 -4.584 9.247 940 HE2 MET 131 1HE MET 131 6.043 -4.176 7.651 941 HE3 MET 131 2HE MET 131 5.705 -5.765 8.382 942 H LYS 132 H LYS 132 10.167 -8.669 10.074 943 HA LYS 132 HA LYS 132 9.931 -8.843 13.009 944 HB2 LYS 132 1HB LYS 132 12.252 -8.131 11.172 945 HB3 LYS 132 2HB LYS 132 12.366 -8.215 12.925 946 HG2 LYS 132 1HG LYS 132 11.775 -10.607 12.859 947 HG3 LYS 132 2HG LYS 132 11.644 -10.526 11.097 948 HD2 LYS 132 1HD LYS 132 14.018 -9.867 10.940 949 HD3 LYS 132 2HD LYS 132 14.154 -9.921 12.704 950 HE2 LYS 132 1HE LYS 132 13.590 -12.327 12.677 951 HE3 LYS 132 2HE LYS 132 13.443 -12.278 10.919 952 HZ1 LYS 132 3HZ LYS 132 15.897 -11.709 12.442 953 HZ2 LYS 132 1HZ LYS 132 15.578 -13.091 11.602 954 HZ3 LYS 132 2HZ LYS 132 15.759 -11.661 10.799 955 H ASN 133 H ASN 133 10.312 -7.217 14.477 956 HA ASN 133 HA ASN 133 9.159 -4.657 13.729 957 HB2 ASN 133 1HB ASN 133 9.043 -5.865 16.000 958 HB3 ASN 133 2HB ASN 133 10.666 -5.245 16.277 959 HD21 ASN 133 2HD2 ASN 133 9.956 -3.981 18.002 960 HD22 ASN 133 2HD1 ASN 133 9.048 -2.526 17.760 961 H GLY 134 H GLY 134 10.025 -2.849 13.085 962 HA2 GLY 134 1HA GLY 134 11.656 -1.164 12.920 963 HA3 GLY 134 2HA GLY 134 12.840 -2.245 13.692 964 H ASP 135 H ASP 135 11.037 -3.681 11.162 965 HA ASP 135 HA ASP 135 13.306 -4.139 9.483 966 HB2 ASP 135 1HB ASP 135 11.104 -5.438 9.512 967 HB3 ASP 135 2HB ASP 135 10.387 -4.105 8.618 968 H VAL 136 H VAL 136 14.263 -3.082 7.911 969 HA VAL 136 HA VAL 136 13.399 -0.240 7.538 970 HB VAL 136 HB VAL 136 15.980 -1.658 6.721 971 HG11 VAL 136 1HG1 VAL 136 16.877 0.608 6.510 972 HG12 VAL 136 1HG2 VAL 136 15.502 0.331 5.414 973 HG13 VAL 136 1HG3 VAL 136 15.277 1.279 6.905 974 HG21 VAL 136 2HG3 VAL 136 15.688 -1.682 9.174 975 HG22 VAL 136 2HG1 VAL 136 16.980 -0.556 8.698 976 HG23 VAL 136 2HG2 VAL 136 15.380 0.071 9.157 977 H MET 137 H MET 137 12.528 0.540 5.832 978 HA MET 137 HA MET 137 12.125 -1.210 3.489 979 HB2 MET 137 1HB MET 137 11.234 1.641 4.061 980 HB3 MET 137 2HB MET 137 10.763 0.695 2.656 981 HG2 MET 137 1HG MET 137 9.688 -0.962 4.182 982 HG3 MET 137 2HG MET 137 10.088 0.083 5.548 983 HE1 MET 137 3HE MET 137 9.517 2.936 4.999 984 HE2 MET 137 1HE MET 137 7.759 3.079 5.240 985 HE3 MET 137 2HE MET 137 8.724 2.047 6.323 986 H LYS 138 H LYS 138 13.877 -1.513 2.306 987 HA LYS 138 HA LYS 138 15.943 0.448 1.931 988 HB2 LYS 138 1HB LYS 138 16.309 -1.981 1.626 989 HB3 LYS 138 2HB LYS 138 15.216 -1.983 0.248 990 HG2 LYS 138 1HG LYS 138 16.733 -0.535 -1.005 991 HG3 LYS 138 2HG LYS 138 17.810 -0.418 0.393 992 HD2 LYS 138 1HD LYS 138 18.207 -2.849 0.311 993 HD3 LYS 138 2HD LYS 138 17.098 -2.993 -1.062 994 HE2 LYS 138 1HE LYS 138 18.566 -1.486 -2.385 995 HE3 LYS 138 2HE LYS 138 19.683 -1.392 -1.021 996 HZ1 LYS 138 3HZ LYS 138 18.966 -3.851 -2.473 997 HZ2 LYS 138 1HZ LYS 138 20.380 -3.017 -2.621 998 HZ3 LYS 138 2HZ LYS 138 20.008 -3.763 -1.198 999 H GLU 139 H GLU 139 13.140 -0.458 -0.063 1000 HA GLU 139 HA GLU 139 13.330 2.116 -1.494 1001 HB2 GLU 139 1HB GLU 139 14.907 0.548 -2.710 1002 HB3 GLU 139 2HB GLU 139 13.541 -0.515 -3.015 1003 HG2 GLU 139 1HG GLU 139 12.422 1.286 -4.272 1004 HG3 GLU 139 2HG GLU 139 13.799 2.345 -3.971 1005 H VAL 140 H VAL 140 11.372 2.851 -1.296 1006 HA VAL 140 HA VAL 140 9.074 0.980 -1.855 1007 HB VAL 140 HB VAL 140 9.102 3.678 -0.420 1008 HG11 VAL 140 1HG1 VAL 140 6.802 3.116 0.200 1009 HG12 VAL 140 1HG2 VAL 140 7.010 3.223 -1.564 1010 HG13 VAL 140 1HG3 VAL 140 6.904 1.631 -0.775 1011 HG21 VAL 140 2HG3 VAL 140 10.250 1.933 0.899 1012 HG22 VAL 140 2HG1 VAL 140 8.684 2.358 1.631 1013 HG23 VAL 140 2HG2 VAL 140 8.848 0.854 0.694 1014 H LYS 141 H LYS 141 8.221 1.053 -3.728 1015 HA LYS 141 HA LYS 141 8.156 3.686 -5.157 1016 HB2 LYS 141 1HB LYS 141 8.871 0.986 -6.368 1017 HB3 LYS 141 2HB LYS 141 8.642 2.478 -7.268 1018 HG2 LYS 141 1HG LYS 141 10.752 2.143 -5.120 1019 HG3 LYS 141 2HG LYS 141 11.031 1.821 -6.837 1020 HD2 LYS 141 1HD LYS 141 10.374 4.157 -7.369 1021 HD3 LYS 141 2HD LYS 141 10.139 4.473 -5.643 1022 HE2 LYS 141 1HE LYS 141 12.525 3.921 -5.232 1023 HE3 LYS 141 2HE LYS 141 12.753 3.647 -6.960 1024 HZ1 LYS 141 3HZ LYS 141 11.942 6.195 -5.728 1025 HZ2 LYS 141 1HZ LYS 141 13.441 5.838 -6.316 1026 HZ3 LYS 141 2HZ LYS 141 12.155 5.939 -7.343 1027 H VAL 142 H VAL 142 6.368 4.186 -6.244 1028 HA VAL 142 HA VAL 142 4.333 2.031 -6.723 1029 HB VAL 142 HB VAL 142 3.748 4.826 -5.634 1030 HG11 VAL 142 1HG1 VAL 142 1.433 4.044 -5.500 1031 HG12 VAL 142 1HG2 VAL 142 2.048 4.026 -7.170 1032 HG13 VAL 142 1HG3 VAL 142 1.911 2.505 -6.255 1033 HG21 VAL 142 2HG3 VAL 142 4.708 3.350 -3.901 1034 HG22 VAL 142 2HG1 VAL 142 2.980 3.644 -3.600 1035 HG23 VAL 142 2HG2 VAL 142 3.511 2.096 -4.302 1036 H PHE 143 H PHE 143 3.582 1.932 -8.653 1037 HA PHE 143 HA PHE 143 4.085 4.286 -10.448 1038 HB2 PHE 143 1HB PHE 143 4.297 1.320 -11.124 1039 HB3 PHE 143 2HB PHE 143 4.498 2.644 -12.261 1040 HD1 PHE 143 2HD PHE 143 6.465 4.124 -12.125 1041 HD2 PHE 143 1HD PHE 143 6.036 0.705 -9.599 1042 HE1 PHE 143 2HE PHE 143 8.878 4.216 -11.595 1043 HE2 PHE 143 1HE PHE 143 8.448 0.795 -9.066 1044 HZ PHE 143 HZ PHE 143 9.870 2.551 -10.064 1045 H ASP 144 H ASP 144 2.528 4.962 -11.741 1046 HA ASP 144 HA ASP 144 -0.166 3.873 -11.373 1047 HB2 ASP 144 1HB ASP 144 0.311 6.325 -11.687 1048 HB3 ASP 144 2HB ASP 144 0.847 5.983 -13.327 1049 H GLU 145 H GLU 145 -1.262 2.503 -12.547 1050 HA GLU 145 HA GLU 145 0.193 1.032 -14.631 1051 HB2 GLU 145 1HB GLU 145 -2.634 0.730 -13.529 1052 HB3 GLU 145 2HB GLU 145 -1.876 -0.374 -14.668 1053 HG2 GLU 145 1HG GLU 145 -0.141 -0.900 -12.991 1054 HG3 GLU 145 2HG GLU 145 -0.930 0.186 -11.850 1055 HA PRO 146 HA PRO 146 -1.236 2.974 -18.292 1056 HB2 PRO 146 1HB PRO 146 -1.870 0.101 -19.105 1057 HB3 PRO 146 2HB PRO 146 -0.967 1.323 -20.011 1058 HG2 PRO 146 1HG PRO 146 0.401 -0.620 -18.818 1059 HG3 PRO 146 2HG PRO 146 1.006 1.035 -18.708 1060 HD2 PRO 146 1HD PRO 146 -0.531 -0.587 -16.647 1061 HD3 PRO 146 2HD PRO 146 0.869 0.534 -16.405 Start of MODEL 6 1 H MET 1 1H MET 1 -6.840 4.838 -15.116 2 HA MET 1 HA MET 1 -8.245 2.667 -14.135 3 HB2 MET 1 1HB MET 1 -5.455 2.946 -15.309 4 HB3 MET 1 2HB MET 1 -6.326 1.433 -15.116 5 HG2 MET 1 1HG MET 1 -7.205 3.753 -16.859 6 HG3 MET 1 2HG MET 1 -6.413 2.279 -17.420 7 HE1 MET 1 3HE MET 1 -7.683 -0.060 -15.841 8 HE2 MET 1 1HE MET 1 -9.083 -0.471 -16.861 9 HE3 MET 1 2HE MET 1 -7.526 -0.045 -17.615 10 H ALA 2 H ALA 2 -6.793 0.791 -13.217 11 HA ALA 2 HA ALA 2 -6.195 1.607 -10.483 12 HB1 ALA 2 3HB ALA 2 -5.874 -1.074 -11.879 13 HB2 ALA 2 1HB ALA 2 -5.737 -0.792 -10.128 14 HB3 ALA 2 2HB ALA 2 -7.295 -0.540 -10.951 15 H LYS 3 H LYS 3 -4.196 0.771 -9.389 16 HA LYS 3 HA LYS 3 -1.775 0.762 -11.090 17 HB2 LYS 3 1HB LYS 3 -0.716 2.594 -9.830 18 HB3 LYS 3 2HB LYS 3 -2.126 3.162 -10.714 19 HG2 LYS 3 1HG LYS 3 -3.451 2.998 -8.586 20 HG3 LYS 3 2HG LYS 3 -1.947 2.605 -7.742 21 HD2 LYS 3 1HD LYS 3 -2.268 4.954 -7.476 22 HD3 LYS 3 2HD LYS 3 -0.982 4.764 -8.678 23 HE2 LYS 3 1HE LYS 3 -2.519 5.203 -10.493 24 HE3 LYS 3 2HE LYS 3 -3.905 5.169 -9.399 25 HZ1 LYS 3 3HZ LYS 3 -1.729 7.152 -9.338 26 HZ2 LYS 3 1HZ LYS 3 -3.250 7.401 -9.923 27 HZ3 LYS 3 2HZ LYS 3 -3.022 7.118 -8.314 28 H LYS 4 H LYS 4 0.199 0.378 -9.839 29 HA LYS 4 HA LYS 4 -0.377 -1.196 -7.356 30 HB2 LYS 4 1HB LYS 4 1.402 -2.075 -9.665 31 HB3 LYS 4 2HB LYS 4 1.176 -2.938 -8.150 32 HG2 LYS 4 1HG LYS 4 -1.236 -3.227 -8.707 33 HG3 LYS 4 2HG LYS 4 -0.938 -2.441 -10.264 34 HD2 LYS 4 1HD LYS 4 0.715 -4.196 -10.832 35 HD3 LYS 4 2HD LYS 4 0.411 -4.981 -9.275 36 HE2 LYS 4 1HE LYS 4 -2.015 -5.194 -9.945 37 HE3 LYS 4 2HE LYS 4 -1.570 -4.597 -11.546 38 HZ1 LYS 4 3HZ LYS 4 -0.497 -7.023 -10.270 39 HZ2 LYS 4 1HZ LYS 4 -1.620 -6.980 -11.477 40 HZ3 LYS 4 2HZ LYS 4 -0.080 -6.464 -11.764 41 H GLY 5 H GLY 5 1.772 -1.910 -6.337 42 HA2 GLY 5 1HA GLY 5 3.972 -0.001 -6.725 43 HA3 GLY 5 2HA GLY 5 3.107 0.147 -5.177 44 H TYR 6 H TYR 6 5.693 -0.405 -4.958 45 HA TYR 6 HA TYR 6 5.750 -3.225 -4.041 46 HB2 TYR 6 1HB TYR 6 6.583 -3.443 -6.317 47 HB3 TYR 6 2HB TYR 6 7.678 -2.085 -6.096 48 HD1 TYR 6 1HD TYR 6 6.910 -5.469 -4.701 49 HD2 TYR 6 2HD TYR 6 9.869 -2.452 -5.445 50 HE1 TYR 6 1HE TYR 6 8.681 -7.017 -3.940 51 HE2 TYR 6 2HE TYR 6 11.640 -4.001 -4.684 52 HH TYR 6 HH TYR 6 12.108 -6.026 -3.921 53 H ILE 7 H ILE 7 6.601 -3.375 -2.127 54 HA ILE 7 HA ILE 7 8.496 -1.231 -1.221 55 HB ILE 7 HB ILE 7 6.927 -3.339 0.350 56 HG12 ILE 7 1HG1 ILE 7 6.569 -0.334 0.278 57 HG13 ILE 7 1HG2 ILE 7 5.567 -1.480 -0.599 58 HG21 ILE 7 2HG1 ILE 7 7.772 -2.166 2.344 59 HG22 ILE 7 2HG2 ILE 7 9.110 -2.829 1.378 60 HG23 ILE 7 2HG3 ILE 7 8.739 -1.091 1.308 61 HD11 ILE 7 1HD3 ILE 7 5.888 -1.353 2.408 62 HD12 ILE 7 1HD1 ILE 7 4.493 -0.777 1.466 63 HD13 ILE 7 1HD2 ILE 7 4.875 -2.515 1.519 64 H LEU 8 H LEU 8 10.500 -1.609 -1.663 65 HA LEU 8 HA LEU 8 11.602 -4.320 -1.165 66 HB2 LEU 8 1HB LEU 8 12.455 -3.034 -3.089 67 HB3 LEU 8 2HB LEU 8 12.900 -1.700 -2.021 68 HG LEU 8 HG LEU 8 14.547 -3.223 -0.895 69 HD11 LEU 8 1HD1 LEU 8 15.132 -5.323 -2.025 70 HD12 LEU 8 1HD2 LEU 8 13.457 -5.343 -1.425 71 HD13 LEU 8 1HD3 LEU 8 13.780 -5.090 -3.158 72 HD21 LEU 8 2HD3 LEU 8 15.206 -1.656 -2.691 73 HD22 LEU 8 2HD1 LEU 8 16.161 -3.157 -2.768 74 HD23 LEU 8 2HD2 LEU 8 14.823 -2.893 -3.912 75 H MET 9 H MET 9 12.208 -4.982 0.720 76 HA MET 9 HA MET 9 12.603 -3.003 2.899 77 HB2 MET 9 1HB MET 9 12.591 -6.041 2.986 78 HB3 MET 9 2HB MET 9 12.579 -4.957 4.370 79 HG2 MET 9 1HG MET 9 10.372 -5.205 2.305 80 HG3 MET 9 2HG MET 9 10.365 -5.908 3.924 81 HE1 MET 9 3HE MET 9 11.554 -3.744 5.808 82 HE2 MET 9 1HE MET 9 10.100 -2.820 6.257 83 HE3 MET 9 2HE MET 9 10.023 -4.595 6.132 84 H GLU 10 H GLU 10 14.392 -2.942 4.248 85 HA GLU 10 HA GLU 10 16.913 -3.028 2.895 86 HB2 GLU 10 1HB GLU 10 16.153 -2.867 5.835 87 HB3 GLU 10 2HB GLU 10 17.824 -2.833 5.292 88 HG2 GLU 10 1HG GLU 10 15.737 -0.871 4.330 89 HG3 GLU 10 2HG GLU 10 16.740 -0.604 5.755 90 H ASN 11 H ASN 11 15.128 -5.471 4.593 91 HA ASN 11 HA ASN 11 17.532 -7.195 4.866 92 HB2 ASN 11 1HB ASN 11 14.644 -7.521 5.715 93 HB3 ASN 11 2HB ASN 11 15.857 -8.784 5.885 94 HD21 ASN 11 2HD2 ASN 11 14.359 -7.442 7.956 95 HD22 ASN 11 2HD1 ASN 11 15.517 -6.683 8.996 96 H GLY 12 H GLY 12 15.816 -6.352 2.321 97 HA2 GLY 12 1HA GLY 12 15.985 -7.385 0.209 98 HA3 GLY 12 2HA GLY 12 16.398 -8.923 1.002 99 H GLY 13 H GLY 13 13.746 -7.430 2.477 100 HA2 GLY 13 1HA GLY 13 11.920 -9.501 1.722 101 HA3 GLY 13 2HA GLY 13 11.504 -7.992 2.568 102 H LYS 14 H LYS 14 10.296 -9.600 0.249 103 HA LYS 14 HA LYS 14 10.185 -7.356 -1.744 104 HB2 LYS 14 1HB LYS 14 9.917 -10.346 -2.251 105 HB3 LYS 14 2HB LYS 14 9.751 -9.081 -3.460 106 HG2 LYS 14 1HG LYS 14 12.132 -8.420 -3.012 107 HG3 LYS 14 2HG LYS 14 12.265 -9.822 -1.941 108 HD2 LYS 14 1HD LYS 14 11.648 -11.310 -3.829 109 HD3 LYS 14 2HD LYS 14 11.551 -9.902 -4.896 110 HE2 LYS 14 1HE LYS 14 13.951 -9.407 -4.400 111 HE3 LYS 14 2HE LYS 14 14.028 -10.878 -3.427 112 HZ1 LYS 14 3HZ LYS 14 13.400 -10.764 -6.301 113 HZ2 LYS 14 1HZ LYS 14 14.834 -11.242 -5.642 114 HZ3 LYS 14 2HZ LYS 14 13.471 -12.138 -5.391 115 H ILE 15 H ILE 15 8.438 -6.302 -0.975 116 HA ILE 15 HA ILE 15 5.904 -7.902 -0.708 117 HB ILE 15 HB ILE 15 6.660 -5.186 0.487 118 HG12 ILE 15 1HG1 ILE 15 6.204 -7.779 1.967 119 HG13 ILE 15 1HG2 ILE 15 7.797 -7.243 1.455 120 HG21 ILE 15 2HG1 ILE 15 4.533 -5.395 1.709 121 HG22 ILE 15 2HG2 ILE 15 4.261 -5.378 -0.048 122 HG23 ILE 15 2HG3 ILE 15 4.183 -6.913 0.849 123 HD11 ILE 15 1HD3 ILE 15 5.932 -5.732 3.298 124 HD12 ILE 15 1HD1 ILE 15 7.377 -6.652 3.775 125 HD13 ILE 15 1HD2 ILE 15 7.543 -5.188 2.777 126 H GLU 16 H GLU 16 4.955 -7.958 -2.576 127 HA GLU 16 HA GLU 16 4.658 -5.384 -4.073 128 HB2 GLU 16 1HB GLU 16 5.535 -7.380 -5.314 129 HB3 GLU 16 2HB GLU 16 4.052 -8.245 -4.936 130 HG2 GLU 16 1HG GLU 16 2.750 -6.604 -6.207 131 HG3 GLU 16 2HG GLU 16 4.219 -5.694 -6.557 132 H PHE 17 H PHE 17 2.797 -4.381 -4.352 133 HA PHE 17 HA PHE 17 0.324 -5.651 -3.274 134 HB2 PHE 17 1HB PHE 17 -0.128 -3.753 -1.823 135 HB3 PHE 17 2HB PHE 17 1.427 -4.440 -1.381 136 HD1 PHE 17 1HD PHE 17 -0.286 -1.571 -2.879 137 HD2 PHE 17 2HD PHE 17 3.496 -3.240 -1.799 138 HE1 PHE 17 1HE PHE 17 0.767 0.651 -3.139 139 HE2 PHE 17 2HE PHE 17 4.552 -1.020 -2.057 140 HZ PHE 17 HZ PHE 17 3.186 0.926 -2.729 141 H GLU 18 H GLU 18 -1.621 -4.556 -3.792 142 HA GLU 18 HA GLU 18 -1.348 -2.796 -6.205 143 HB2 GLU 18 1HB GLU 18 -3.679 -4.527 -5.275 144 HB3 GLU 18 2HB GLU 18 -3.699 -3.481 -6.688 145 HG2 GLU 18 1HG GLU 18 -1.860 -4.818 -7.676 146 HG3 GLU 18 2HG GLU 18 -1.912 -5.887 -6.277 147 H LEU 19 H LEU 19 -2.749 -1.032 -6.472 148 HA LEU 19 HA LEU 19 -3.776 0.058 -3.872 149 HB2 LEU 19 1HB LEU 19 -2.624 1.486 -6.302 150 HB3 LEU 19 2HB LEU 19 -3.422 2.308 -4.959 151 HG LEU 19 HG LEU 19 -0.895 0.642 -4.690 152 HD11 LEU 19 1HD1 LEU 19 0.254 2.803 -4.515 153 HD12 LEU 19 1HD2 LEU 19 -0.521 2.598 -6.103 154 HD13 LEU 19 1HD3 LEU 19 -1.272 3.644 -4.875 155 HD21 LEU 19 2HD3 LEU 19 -2.275 0.804 -2.645 156 HD22 LEU 19 2HD1 LEU 19 -0.775 1.749 -2.483 157 HD23 LEU 19 2HD2 LEU 19 -2.317 2.575 -2.814 158 H PHE 20 H PHE 20 -5.626 1.390 -3.922 159 HA PHE 20 HA PHE 20 -7.440 0.747 -6.227 160 HB2 PHE 20 1HB PHE 20 -8.190 0.874 -3.275 161 HB3 PHE 20 2HB PHE 20 -9.278 0.525 -4.609 162 HD1 PHE 20 2HD PHE 20 -8.903 -1.583 -5.966 163 HD2 PHE 20 1HD PHE 20 -6.937 -0.827 -2.250 164 HE1 PHE 20 2HE PHE 20 -8.415 -3.996 -5.736 165 HE2 PHE 20 1HE PHE 20 -6.444 -3.238 -2.017 166 HZ PHE 20 HZ PHE 20 -7.183 -4.823 -3.761 167 HA PRO 21 HA PRO 21 -7.302 5.303 -5.654 168 HB2 PRO 21 1HB PRO 21 -7.237 5.845 -8.364 169 HB3 PRO 21 2HB PRO 21 -5.754 5.487 -7.469 170 HG2 PRO 21 1HG PRO 21 -7.473 3.612 -9.149 171 HG3 PRO 21 2HG PRO 21 -5.720 3.820 -9.191 172 HD2 PRO 21 1HD PRO 21 -6.815 1.776 -7.805 173 HD3 PRO 21 2HD PRO 21 -5.382 2.664 -7.147 174 H ASN 22 H ASN 22 -9.318 2.994 -7.184 175 HA ASN 22 HA ASN 22 -11.469 4.972 -7.673 176 HB2 ASN 22 1HB ASN 22 -11.367 1.958 -7.972 177 HB3 ASN 22 2HB ASN 22 -12.766 2.955 -8.348 178 HD21 ASN 22 2HD2 ASN 22 -10.224 1.414 -9.677 179 HD22 ASN 22 2HD1 ASN 22 -10.002 2.364 -11.107 180 H GLU 23 H GLU 23 -10.260 3.243 -5.053 181 HA GLU 23 HA GLU 23 -12.918 3.402 -3.667 182 HB2 GLU 23 1HB GLU 23 -10.454 1.737 -2.995 183 HB3 GLU 23 2HB GLU 23 -11.927 1.796 -2.038 184 HG2 GLU 23 1HG GLU 23 -13.197 0.839 -3.905 185 HG3 GLU 23 2HG GLU 23 -11.738 0.809 -4.892 186 H ALA 24 H ALA 24 -9.543 4.368 -3.595 187 HA ALA 24 HA ALA 24 -10.341 6.460 -1.646 188 HB1 ALA 24 3HB ALA 24 -7.865 4.721 -1.361 189 HB2 ALA 24 1HB ALA 24 -8.255 6.143 -0.366 190 HB3 ALA 24 2HB ALA 24 -9.289 4.696 -0.296 191 HA PRO 25 HA PRO 25 -8.216 7.951 -5.486 192 HB2 PRO 25 1HB PRO 25 -9.972 10.289 -4.578 193 HB3 PRO 25 2HB PRO 25 -9.655 9.736 -6.227 194 HG2 PRO 25 1HG PRO 25 -11.992 9.112 -5.126 195 HG3 PRO 25 2HG PRO 25 -11.125 7.870 -6.037 196 HD2 PRO 25 1HD PRO 25 -11.346 8.245 -3.034 197 HD3 PRO 25 2HD PRO 25 -11.329 6.714 -3.998 198 H VAL 26 H VAL 26 -8.931 9.930 -2.587 199 HA VAL 26 HA VAL 26 -6.667 11.692 -3.099 200 HB VAL 26 HB VAL 26 -8.330 11.189 -0.583 201 HG11 VAL 26 1HG1 VAL 26 -7.453 13.333 0.207 202 HG12 VAL 26 1HG2 VAL 26 -6.163 12.130 -0.024 203 HG13 VAL 26 1HG3 VAL 26 -6.397 13.426 -1.222 204 HG21 VAL 26 2HG3 VAL 26 -9.645 12.041 -2.494 205 HG22 VAL 26 2HG1 VAL 26 -9.473 13.285 -1.233 206 HG23 VAL 26 2HG2 VAL 26 -8.478 13.369 -2.707 207 H THR 27 H THR 27 -7.173 9.010 -0.814 208 HA THR 27 HA THR 27 -4.618 9.296 0.456 209 HB THR 27 HB THR 27 -6.311 6.777 0.131 210 HG1 THR 27 1HG THR 27 -7.534 8.325 1.170 211 HG21 THR 27 2HG3 THR 27 -4.179 7.539 2.163 212 HG22 THR 27 2HG1 THR 27 -5.150 6.049 2.179 213 HG23 THR 27 2HG2 THR 27 -3.990 6.343 0.860 214 H VAL 28 H VAL 28 -5.669 7.223 -2.245 215 HA VAL 28 HA VAL 28 -3.081 5.948 -2.584 216 HB VAL 28 HB VAL 28 -5.432 6.368 -4.491 217 HG11 VAL 28 1HG1 VAL 28 -4.418 4.626 -5.877 218 HG12 VAL 28 1HG2 VAL 28 -3.379 6.065 -5.750 219 HG13 VAL 28 1HG3 VAL 28 -2.996 4.605 -4.807 220 HG21 VAL 28 2HG3 VAL 28 -5.942 4.977 -2.513 221 HG22 VAL 28 2HG1 VAL 28 -5.901 3.990 -3.993 222 HG23 VAL 28 2HG2 VAL 28 -4.526 3.957 -2.864 223 H ALA 29 H ALA 29 -4.574 8.798 -4.074 224 HA ALA 29 HA ALA 29 -2.494 9.286 -5.950 225 HB1 ALA 29 3HB ALA 29 -4.288 11.270 -4.506 226 HB2 ALA 29 1HB ALA 29 -3.331 11.607 -5.967 227 HB3 ALA 29 2HB ALA 29 -4.666 10.432 -6.029 228 H ASN 30 H ASN 30 -2.924 10.530 -2.629 229 HA ASN 30 HA ASN 30 -0.451 12.024 -2.630 230 HB2 ASN 30 1HB ASN 30 -2.249 11.001 -0.424 231 HB3 ASN 30 2HB ASN 30 -0.781 11.915 -0.110 232 HD21 ASN 30 2HD2 ASN 30 -3.346 12.748 0.639 233 HD22 ASN 30 2HD1 ASN 30 -3.733 14.188 -0.243 234 H PHE 31 H PHE 31 -1.303 8.740 -1.593 235 HA PHE 31 HA PHE 31 1.217 8.066 -0.433 236 HB2 PHE 31 1HB PHE 31 -0.807 6.656 -0.202 237 HB3 PHE 31 2HB PHE 31 -0.781 6.312 -1.924 238 HD1 PHE 31 1HD PHE 31 1.065 5.824 1.249 239 HD2 PHE 31 2HD PHE 31 0.594 4.613 -2.820 240 HE1 PHE 31 1HE PHE 31 2.524 3.872 1.664 241 HE2 PHE 31 2HE PHE 31 2.050 2.658 -2.409 242 HZ PHE 31 HZ PHE 31 3.016 2.289 -0.166 243 H GLU 32 H GLU 32 0.049 7.622 -3.780 244 HA GLU 32 HA GLU 32 2.446 6.462 -4.796 245 HB2 GLU 32 1HB GLU 32 0.381 6.429 -6.094 246 HB3 GLU 32 2HB GLU 32 0.322 8.186 -6.134 247 HG2 GLU 32 1HG GLU 32 2.272 8.285 -7.549 248 HG3 GLU 32 2HG GLU 32 2.530 6.549 -7.393 249 H LYS 33 H LYS 33 1.431 9.885 -4.737 250 HA LYS 33 HA LYS 33 3.748 10.942 -5.995 251 HB2 LYS 33 1HB LYS 33 1.695 12.257 -5.562 252 HB3 LYS 33 2HB LYS 33 2.003 12.185 -3.833 253 HG2 LYS 33 1HG LYS 33 4.079 13.473 -4.134 254 HG3 LYS 33 2HG LYS 33 3.795 13.527 -5.880 255 HD2 LYS 33 1HD LYS 33 1.682 14.745 -5.512 256 HD3 LYS 33 2HD LYS 33 1.930 14.664 -3.762 257 HE2 LYS 33 1HE LYS 33 4.024 15.965 -4.001 258 HE3 LYS 33 2HE LYS 33 3.770 16.053 -5.747 259 HZ1 LYS 33 3HZ LYS 33 1.969 17.167 -3.701 260 HZ2 LYS 33 1HZ LYS 33 3.012 18.028 -4.646 261 HZ3 LYS 33 2HZ LYS 33 1.731 17.248 -5.331 262 H LEU 34 H LEU 34 3.096 10.648 -2.488 263 HA LEU 34 HA LEU 34 5.636 11.680 -1.695 264 HB2 LEU 34 1HB LEU 34 3.695 9.789 -0.308 265 HB3 LEU 34 2HB LEU 34 5.125 10.467 0.476 266 HG LEU 34 HG LEU 34 2.816 12.106 -0.626 267 HD11 LEU 34 1HD1 LEU 34 2.215 12.422 1.732 268 HD12 LEU 34 1HD2 LEU 34 2.124 10.710 1.254 269 HD13 LEU 34 1HD3 LEU 34 3.506 11.294 2.212 270 HD21 LEU 34 2HD3 LEU 34 4.996 13.275 -0.600 271 HD22 LEU 34 2HD1 LEU 34 3.901 13.929 0.642 272 HD23 LEU 34 2HD2 LEU 34 5.216 12.823 1.108 273 H ALA 35 H ALA 35 4.565 8.352 -2.306 274 HA ALA 35 HA ALA 35 6.928 7.080 -1.358 275 HB1 ALA 35 3HB ALA 35 5.015 6.204 -3.551 276 HB2 ALA 35 1HB ALA 35 6.200 5.163 -2.731 277 HB3 ALA 35 2HB ALA 35 4.844 5.862 -1.815 278 H ASN 36 H ASN 36 6.042 8.142 -4.651 279 HA ASN 36 HA ASN 36 8.578 7.273 -5.785 280 HB2 ASN 36 1HB ASN 36 6.327 9.023 -6.792 281 HB3 ASN 36 2HB ASN 36 7.791 8.733 -7.723 282 HD21 ASN 36 2HD2 ASN 36 5.171 8.013 -8.507 283 HD22 ASN 36 2HD1 ASN 36 5.109 6.286 -8.629 284 H GLU 37 H GLU 37 7.486 10.131 -4.148 285 HA GLU 37 HA GLU 37 9.836 11.708 -4.962 286 HB2 GLU 37 1HB GLU 37 7.668 12.104 -2.862 287 HB3 GLU 37 2HB GLU 37 9.008 13.221 -3.080 288 HG2 GLU 37 1HG GLU 37 6.983 12.510 -5.213 289 HG3 GLU 37 2HG GLU 37 6.918 13.939 -4.184 290 H GLY 38 H GLY 38 9.265 9.162 -2.813 291 HA2 GLY 38 1HA GLY 38 11.101 8.008 -1.858 292 HA3 GLY 38 2HA GLY 38 12.062 9.504 -1.911 293 H PHE 39 H PHE 39 8.881 9.915 -0.730 294 HA PHE 39 HA PHE 39 9.900 10.523 1.961 295 HB2 PHE 39 1HB PHE 39 7.164 10.692 0.645 296 HB3 PHE 39 2HB PHE 39 7.409 11.027 2.353 297 HD1 PHE 39 2HD PHE 39 9.206 12.817 2.936 298 HD2 PHE 39 1HD PHE 39 7.406 12.387 -0.914 299 HE1 PHE 39 2HE PHE 39 9.816 15.150 2.393 300 HE2 PHE 39 1HE PHE 39 8.018 14.719 -1.462 301 HZ PHE 39 HZ PHE 39 9.222 16.100 0.193 302 H TYR 40 H TYR 40 8.433 7.834 0.373 303 HA TYR 40 HA TYR 40 8.062 6.498 3.025 304 HB2 TYR 40 1HB TYR 40 7.098 5.886 0.222 305 HB3 TYR 40 2HB TYR 40 7.151 4.632 1.453 306 HD1 TYR 40 2HD TYR 40 5.778 4.847 3.521 307 HD2 TYR 40 1HD TYR 40 5.421 7.575 0.228 308 HE1 TYR 40 2HE TYR 40 3.584 5.595 4.379 309 HE2 TYR 40 1HE TYR 40 3.228 8.323 1.086 310 HH TYR 40 HH TYR 40 2.054 7.362 4.223 311 H ASN 41 H ASN 41 10.625 7.197 1.451 312 HA ASN 41 HA ASN 41 11.756 4.424 1.394 313 HB2 ASN 41 1HB ASN 41 12.091 5.763 -0.642 314 HB3 ASN 41 2HB ASN 41 12.864 7.028 0.306 315 HD21 ASN 41 2HD2 ASN 41 13.965 5.515 -1.886 316 HD22 ASN 41 2HD1 ASN 41 15.360 4.690 -1.273 317 H GLY 42 H GLY 42 12.533 3.754 3.225 318 HA2 GLY 42 1HA GLY 42 14.433 3.770 4.703 319 HA3 GLY 42 2HA GLY 42 14.461 5.547 4.619 320 H LEU 43 H LEU 43 11.308 4.335 4.879 321 HA LEU 43 HA LEU 43 11.085 5.316 7.643 322 HB2 LEU 43 1HB LEU 43 9.019 4.036 5.806 323 HB3 LEU 43 2HB LEU 43 8.680 4.847 7.338 324 HG LEU 43 HG LEU 43 9.633 6.113 4.751 325 HD11 LEU 43 1HD1 LEU 43 7.514 7.337 4.949 326 HD12 LEU 43 1HD2 LEU 43 7.254 5.578 4.878 327 HD13 LEU 43 1HD3 LEU 43 7.131 6.435 6.434 328 HD21 LEU 43 2HD3 LEU 43 10.808 7.119 6.680 329 HD22 LEU 43 2HD1 LEU 43 9.602 8.242 6.006 330 HD23 LEU 43 2HD2 LEU 43 9.249 7.354 7.507 331 H THR 44 H THR 44 10.135 4.148 9.370 332 HA THR 44 HA THR 44 11.090 1.303 9.314 333 HB THR 44 HB THR 44 11.024 3.222 11.684 334 HG1 THR 44 1HG THR 44 13.325 3.170 11.393 335 HG21 THR 44 2HG3 THR 44 12.234 0.453 11.332 336 HG22 THR 44 2HG1 THR 44 12.363 1.471 12.784 337 HG23 THR 44 2HG2 THR 44 10.779 0.837 12.280 338 H PHE 45 H PHE 45 9.918 -0.294 10.223 339 HA PHE 45 HA PHE 45 7.130 0.342 11.013 340 HB2 PHE 45 1HB PHE 45 8.680 -2.250 10.645 341 HB3 PHE 45 2HB PHE 45 7.060 -2.206 11.323 342 HD1 PHE 45 1HD PHE 45 9.075 -1.629 8.297 343 HD2 PHE 45 2HD PHE 45 5.138 -1.794 9.947 344 HE1 PHE 45 1HE PHE 45 8.123 -1.667 6.016 345 HE2 PHE 45 2HE PHE 45 4.182 -1.834 7.667 346 HZ PHE 45 HZ PHE 45 5.676 -1.769 5.702 347 H HIS 46 H HIS 46 6.789 1.094 12.965 348 HA HIS 46 HA HIS 46 8.883 0.647 15.004 349 HB2 HIS 46 1HB HIS 46 7.728 2.429 16.246 350 HB3 HIS 46 2HB HIS 46 8.067 2.947 14.600 351 HD2 HIS 46 2HD HIS 46 5.183 3.017 16.980 352 HE1 HIS 46 1HE HIS 46 3.427 3.039 13.096 353 H ARG 47 H ARG 47 5.741 -0.519 14.233 354 HA ARG 47 HA ARG 47 5.756 -2.103 16.752 355 HB2 ARG 47 1HB ARG 47 3.436 -0.400 15.767 356 HB3 ARG 47 2HB ARG 47 3.277 -1.669 16.972 357 HG2 ARG 47 1HG ARG 47 5.091 0.729 17.303 358 HG3 ARG 47 2HG ARG 47 3.415 0.643 17.894 359 HD2 ARG 47 1HD ARG 47 4.042 -1.365 19.188 360 HD3 ARG 47 2HD ARG 47 5.729 -1.102 18.690 361 HE ARG 47 HE ARG 47 4.180 0.441 20.624 362 HH11 ARG 47 1HH1 ARG 47 7.053 0.278 18.609 363 HH12 ARG 47 1HH2 ARG 47 7.940 1.446 19.562 364 HH21 ARG 47 2HH1 ARG 47 5.342 1.956 21.853 365 HH22 ARG 47 2HH2 ARG 47 6.973 2.397 21.398 366 H VAL 48 H VAL 48 6.390 -3.824 15.444 367 HA VAL 48 HA VAL 48 4.300 -4.838 13.541 368 HB VAL 48 HB VAL 48 7.129 -5.829 14.137 369 HG11 VAL 48 1HG1 VAL 48 6.835 -7.211 12.140 370 HG12 VAL 48 1HG2 VAL 48 5.650 -7.609 13.405 371 HG13 VAL 48 1HG3 VAL 48 5.155 -6.643 11.995 372 HG21 VAL 48 2HG3 VAL 48 7.125 -3.621 13.030 373 HG22 VAL 48 2HG1 VAL 48 7.686 -4.891 11.918 374 HG23 VAL 48 2HG2 VAL 48 6.032 -4.250 11.774 375 H ILE 49 H ILE 49 2.828 -6.138 14.167 376 HA ILE 49 HA ILE 49 3.530 -8.134 16.307 377 HB ILE 49 HB ILE 49 0.788 -6.923 15.688 378 HG12 ILE 49 1HG1 ILE 49 2.525 -6.453 18.120 379 HG13 ILE 49 1HG2 ILE 49 2.395 -5.337 16.769 380 HG21 ILE 49 2HG1 ILE 49 0.082 -8.127 17.716 381 HG22 ILE 49 2HG2 ILE 49 0.706 -9.254 16.488 382 HG23 ILE 49 2HG3 ILE 49 1.716 -8.811 17.884 383 HD11 ILE 49 1HD3 ILE 49 0.117 -6.230 18.550 384 HD12 ILE 49 1HD1 ILE 49 0.955 -4.662 18.607 385 HD13 ILE 49 1HD2 ILE 49 -0.016 -5.100 17.181 386 HA PRO 50 HA PRO 50 3.095 -10.674 12.627 387 HB2 PRO 50 1HB PRO 50 4.082 -12.592 14.785 388 HB3 PRO 50 2HB PRO 50 4.637 -12.445 13.113 389 HG2 PRO 50 1HG PRO 50 6.174 -11.444 15.038 390 HG3 PRO 50 2HG PRO 50 5.936 -10.501 13.564 391 HD2 PRO 50 1HD PRO 50 4.606 -10.184 16.281 392 HD3 PRO 50 2HD PRO 50 5.210 -8.908 15.150 393 H GLY 51 H GLY 51 1.300 -11.492 12.029 394 HA2 GLY 51 1HA GLY 51 -0.445 -13.100 12.141 395 HA3 GLY 51 2HA GLY 51 -0.183 -13.254 13.893 396 H PHE 52 H PHE 52 -0.085 -10.031 13.325 397 HA PHE 52 HA PHE 52 -3.054 -9.674 13.541 398 HB2 PHE 52 1HB PHE 52 -2.012 -9.558 15.810 399 HB3 PHE 52 2HB PHE 52 -0.932 -8.296 15.241 400 HD1 PHE 52 1HD PHE 52 -4.036 -7.907 13.632 401 HD2 PHE 52 2HD PHE 52 -2.075 -7.258 17.372 402 HE1 PHE 52 1HE PHE 52 -5.724 -6.199 14.219 403 HE2 PHE 52 2HE PHE 52 -3.763 -5.551 17.963 404 HZ PHE 52 HZ PHE 52 -5.586 -5.020 16.385 405 H VAL 53 H VAL 53 -0.134 -7.603 13.494 406 HA VAL 53 HA VAL 53 -0.878 -6.258 11.017 407 HB VAL 53 HB VAL 53 -2.674 -5.415 12.603 408 HG11 VAL 53 1HG1 VAL 53 -2.015 -3.908 14.415 409 HG12 VAL 53 1HG2 VAL 53 -1.417 -5.565 14.674 410 HG13 VAL 53 1HG3 VAL 53 -0.305 -4.294 14.112 411 HG21 VAL 53 2HG3 VAL 53 -1.871 -4.044 10.710 412 HG22 VAL 53 2HG1 VAL 53 -2.271 -3.023 12.112 413 HG23 VAL 53 2HG2 VAL 53 -0.571 -3.389 11.734 414 H SER 54 H SER 54 0.779 -5.338 10.151 415 HA SER 54 HA SER 54 3.197 -4.713 11.834 416 HB2 SER 54 1HB SER 54 2.843 -4.878 8.890 417 HB3 SER 54 2HB SER 54 4.310 -4.425 9.742 418 HG SER 54 HG SER 54 4.403 -6.556 9.363 419 H GLN 55 H GLN 55 2.701 -2.760 12.833 420 HA GLN 55 HA GLN 55 1.746 -0.505 11.159 421 HB2 GLN 55 1HB GLN 55 2.436 -0.664 14.125 422 HB3 GLN 55 2HB GLN 55 1.772 0.748 13.314 423 HG2 GLN 55 1HG GLN 55 -0.286 -0.417 12.834 424 HG3 GLN 55 2HG GLN 55 0.387 -1.935 13.494 425 HE21 GLN 55 2HE2 GLN 55 0.405 -2.285 15.679 426 HE22 GLN 55 2HE1 GLN 55 -0.301 -1.200 16.830 427 H GLY 56 H GLY 56 2.927 1.039 10.329 428 HA2 GLY 56 1HA GLY 56 5.566 1.735 11.285 429 HA3 GLY 56 2HA GLY 56 5.646 0.683 9.853 430 H GLY 57 H GLY 57 6.500 2.253 8.492 431 HA2 GLY 57 1HA GLY 57 6.379 4.018 6.977 432 HA3 GLY 57 2HA GLY 57 4.686 4.281 7.455 433 H CYS 58 H CYS 58 7.180 4.124 9.887 434 HA CYS 58 HA CYS 58 6.657 7.009 10.593 435 HB2 CYS 58 1HB CYS 58 6.114 5.340 12.245 436 HB3 CYS 58 2HB CYS 58 7.795 4.826 12.269 437 HG CYS 58 HG CYS 58 6.561 7.799 12.912 438 HA PRO 59 HA PRO 59 10.791 7.776 8.983 439 HB2 PRO 59 1HB PRO 59 10.206 10.403 10.395 440 HB3 PRO 59 2HB PRO 59 10.755 10.149 8.733 441 HG2 PRO 59 1HG PRO 59 8.219 10.849 9.127 442 HG3 PRO 59 2HG PRO 59 8.579 9.583 7.949 443 HD2 PRO 59 1HD PRO 59 7.613 9.303 10.827 444 HD3 PRO 59 2HD PRO 59 7.042 8.434 9.346 445 H ARG 60 H ARG 60 9.672 8.495 12.260 446 HA ARG 60 HA ARG 60 12.491 8.584 13.196 447 HB2 ARG 60 1HB ARG 60 9.851 9.011 14.648 448 HB3 ARG 60 2HB ARG 60 11.436 9.161 15.387 449 HG2 ARG 60 1HG ARG 60 10.290 10.896 13.189 450 HG3 ARG 60 2HG ARG 60 10.594 11.347 14.885 451 HD2 ARG 60 1HD ARG 60 13.007 10.845 14.470 452 HD3 ARG 60 2HD ARG 60 12.600 10.703 12.744 453 HE ARG 60 HE ARG 60 12.299 12.993 12.623 454 HH11 ARG 60 1HH1 ARG 60 12.746 12.007 15.964 455 HH12 ARG 60 1HH2 ARG 60 12.977 13.640 16.547 456 HH21 ARG 60 2HH1 ARG 60 12.600 15.109 13.391 457 HH22 ARG 60 2HH2 ARG 60 12.894 15.396 15.092 458 H GLY 61 H GLY 61 9.895 6.368 12.921 459 HA2 GLY 61 1HA GLY 61 9.832 4.110 13.451 460 HA3 GLY 61 2HA GLY 61 11.520 4.234 14.000 461 H ASN 62 H ASN 62 9.399 6.526 15.398 462 HA ASN 62 HA ASN 62 9.140 4.834 17.866 463 HB2 ASN 62 1HB ASN 62 9.783 7.790 17.655 464 HB3 ASN 62 2HB ASN 62 9.392 6.951 19.150 465 HD21 ASN 62 2HD2 ASN 62 11.851 7.955 17.153 466 HD22 ASN 62 2HD1 ASN 62 13.126 6.953 17.762 467 H GLY 63 H GLY 63 7.395 5.869 15.429 468 HA2 GLY 63 1HA GLY 63 5.020 5.915 15.382 469 HA3 GLY 63 2HA GLY 63 5.000 6.301 17.118 470 H THR 64 H THR 64 7.340 8.228 15.910 471 HA THR 64 HA THR 64 5.489 10.553 15.826 472 HB THR 64 HB THR 64 8.535 10.407 15.970 473 HG1 THR 64 1HG THR 64 8.112 11.117 18.137 474 HG21 THR 64 2HG3 THR 64 6.634 12.770 16.221 475 HG22 THR 64 2HG1 THR 64 8.395 12.816 16.467 476 HG23 THR 64 2HG2 THR 64 7.731 12.461 14.855 477 H GLY 65 H GLY 65 4.673 11.150 13.994 478 HA2 GLY 65 1HA GLY 65 5.935 10.529 11.447 479 HA3 GLY 65 2HA GLY 65 4.471 11.506 11.703 480 H ASP 66 H ASP 66 7.747 11.536 10.865 481 HA ASP 66 HA ASP 66 7.810 14.525 11.074 482 HB2 ASP 66 1HB ASP 66 9.273 13.345 12.820 483 HB3 ASP 66 2HB ASP 66 10.223 12.715 11.480 484 H ALA 67 H ALA 67 6.903 13.100 8.857 485 HA ALA 67 HA ALA 67 9.148 13.128 6.937 486 HB1 ALA 67 3HB ALA 67 6.182 12.587 6.546 487 HB2 ALA 67 1HB ALA 67 7.444 12.396 5.308 488 HB3 ALA 67 2HB ALA 67 7.452 11.358 6.754 489 H GLY 68 H GLY 68 6.643 15.214 8.081 490 HA2 GLY 68 1HA GLY 68 6.527 17.538 7.595 491 HA3 GLY 68 2HA GLY 68 7.474 17.267 6.113 492 H TYR 69 H TYR 69 5.454 14.819 5.887 493 HA TYR 69 HA TYR 69 3.156 16.393 4.785 494 HB2 TYR 69 1HB TYR 69 4.654 14.134 3.403 495 HB3 TYR 69 2HB TYR 69 3.118 14.795 2.857 496 HD1 TYR 69 1HD TYR 69 6.713 15.498 3.315 497 HD2 TYR 69 2HD TYR 69 2.985 16.898 1.719 498 HE1 TYR 69 1HE TYR 69 7.916 17.225 2.021 499 HE2 TYR 69 2HE TYR 69 4.188 18.626 0.425 500 HH TYR 69 HH TYR 69 7.730 18.919 0.595 501 H THR 70 H THR 70 1.174 15.523 4.937 502 HA THR 70 HA THR 70 0.960 12.822 6.205 503 HB THR 70 HB THR 70 -0.790 13.678 7.728 504 HG1 THR 70 1HG THR 70 -1.028 15.980 7.884 505 HG21 THR 70 2HG3 THR 70 1.808 15.251 7.919 506 HG22 THR 70 2HG1 THR 70 0.661 14.964 9.249 507 HG23 THR 70 2HG2 THR 70 1.547 13.599 8.527 508 H ILE 71 H ILE 71 -1.111 11.827 6.030 509 HA ILE 71 HA ILE 71 -2.763 12.912 3.761 510 HB ILE 71 HB ILE 71 -2.154 9.993 4.455 511 HG12 ILE 71 1HG1 ILE 71 -1.345 11.611 2.028 512 HG13 ILE 71 1HG2 ILE 71 -0.281 11.177 3.357 513 HG21 ILE 71 2HG1 ILE 71 -3.474 9.475 2.443 514 HG22 ILE 71 2HG2 ILE 71 -4.462 10.326 3.654 515 HG23 ILE 71 2HG3 ILE 71 -3.843 11.203 2.235 516 HD11 ILE 71 1HD3 ILE 71 -1.689 9.233 1.514 517 HD12 ILE 71 1HD1 ILE 71 0.030 9.687 1.462 518 HD13 ILE 71 1HD2 ILE 71 -0.612 8.793 2.861 519 HA PRO 72 HA PRO 72 -5.747 13.171 7.035 520 HB2 PRO 72 1HB PRO 72 -7.345 13.925 4.551 521 HB3 PRO 72 2HB PRO 72 -7.286 14.756 6.110 522 HG2 PRO 72 1HG PRO 72 -5.968 15.829 4.064 523 HG3 PRO 72 2HG PRO 72 -5.188 15.781 5.648 524 HD2 PRO 72 1HD PRO 72 -4.779 13.951 3.250 525 HD3 PRO 72 2HD PRO 72 -3.546 14.652 4.374 526 H CYS 73 H CYS 73 -7.324 11.917 7.733 527 HA CYS 73 HA CYS 73 -7.660 9.268 6.663 528 HB2 CYS 73 1HB CYS 73 -7.981 9.758 8.960 529 HB3 CYS 73 2HB CYS 73 -9.372 10.764 8.587 530 HG CYS 73 HG CYS 73 -10.762 8.888 7.449 531 H GLU 74 H GLU 74 -8.384 9.118 4.561 532 HA GLU 74 HA GLU 74 -10.599 10.771 3.583 533 HB2 GLU 74 1HB GLU 74 -8.694 9.929 2.139 534 HB3 GLU 74 2HB GLU 74 -9.328 8.300 2.333 535 HG2 GLU 74 1HG GLU 74 -11.429 8.981 1.254 536 HG3 GLU 74 2HG GLU 74 -10.807 10.620 1.072 537 H THR 75 H THR 75 -12.669 10.407 3.611 538 HA THR 75 HA THR 75 -13.610 7.626 4.223 539 HB THR 75 HB THR 75 -14.745 10.221 5.360 540 HG1 THR 75 1HG THR 75 -13.366 8.050 6.609 541 HG21 THR 75 2HG3 THR 75 -15.535 7.314 5.794 542 HG22 THR 75 2HG1 THR 75 -16.231 8.721 6.630 543 HG23 THR 75 2HG2 THR 75 -16.470 8.519 4.879 544 H ASP 76 H ASP 76 -14.760 6.825 2.678 545 HA ASP 76 HA ASP 76 -16.853 8.470 1.397 546 HB2 ASP 76 1HB ASP 76 -16.111 8.003 -0.876 547 HB3 ASP 76 2HB ASP 76 -14.840 8.869 -0.024 548 H ASN 77 H ASN 77 -16.975 6.505 -0.821 549 HA ASN 77 HA ASN 77 -18.984 4.863 0.433 550 HB2 ASN 77 1HB ASN 77 -17.697 4.810 -2.304 551 HB3 ASN 77 2HB ASN 77 -18.959 3.686 -1.819 552 HD21 ASN 77 2HD2 ASN 77 -19.180 5.502 -3.946 553 HD22 ASN 77 2HD1 ASN 77 -20.428 6.640 -3.562 554 H ASN 78 H ASN 78 -15.585 4.416 -0.142 555 HA ASN 78 HA ASN 78 -15.511 1.556 -0.170 556 HB2 ASN 78 1HB ASN 78 -13.609 2.945 -0.843 557 HB3 ASN 78 2HB ASN 78 -13.445 3.551 0.800 558 HD21 ASN 78 2HD2 ASN 78 -11.239 2.695 0.457 559 HD22 ASN 78 2HD1 ASN 78 -10.942 1.035 0.845 560 HA PRO 79 HA PRO 79 -16.892 0.733 3.963 561 HB2 PRO 79 1HB PRO 79 -15.714 -1.952 3.135 562 HB3 PRO 79 2HB PRO 79 -17.297 -1.623 3.854 563 HG2 PRO 79 1HG PRO 79 -17.195 -2.193 1.261 564 HG3 PRO 79 2HG PRO 79 -18.232 -0.868 1.797 565 HD2 PRO 79 1HD PRO 79 -15.455 -0.748 0.552 566 HD3 PRO 79 2HD PRO 79 -16.902 0.281 0.210 567 H HIS 80 H HIS 80 -13.736 0.130 2.586 568 HA HIS 80 HA HIS 80 -11.644 -0.035 3.578 569 HB2 HIS 80 1HB HIS 80 -13.036 1.265 5.960 570 HB3 HIS 80 2HB HIS 80 -11.299 1.122 5.740 571 HD2 HIS 80 2HD HIS 80 -13.898 3.729 5.234 572 HE1 HIS 80 1HE HIS 80 -10.942 4.558 2.277 573 H ARG 81 H ARG 81 -12.616 -2.373 3.446 574 HA ARG 81 HA ARG 81 -12.846 -3.668 6.072 575 HB2 ARG 81 1HB ARG 81 -12.529 -4.773 3.255 576 HB3 ARG 81 2HB ARG 81 -12.744 -5.768 4.688 577 HG2 ARG 81 1HG ARG 81 -14.756 -3.671 3.863 578 HG3 ARG 81 2HG ARG 81 -14.800 -5.351 3.277 579 HD2 ARG 81 1HD ARG 81 -14.910 -6.133 5.584 580 HD3 ARG 81 2HD ARG 81 -14.913 -4.446 6.145 581 HE ARG 81 HE ARG 81 -16.996 -4.752 4.274 582 HH11 ARG 81 1HH1 ARG 81 -16.109 -5.863 7.487 583 HH12 ARG 81 1HH2 ARG 81 -17.767 -6.052 8.015 584 HH21 ARG 81 2HH1 ARG 81 -19.142 -5.002 4.972 585 HH22 ARG 81 2HH2 ARG 81 -19.484 -5.565 6.592 586 H HIS 82 H HIS 82 -11.395 -4.827 7.174 587 HA HIS 82 HA HIS 82 -8.560 -4.486 6.255 588 HB2 HIS 82 1HB HIS 82 -9.771 -4.450 9.049 589 HB3 HIS 82 2HB HIS 82 -8.043 -4.579 8.750 590 HD2 HIS 82 2HD HIS 82 -6.734 -2.062 8.297 591 HE1 HIS 82 1HE HIS 82 -10.338 0.176 8.061 592 H VAL 83 H VAL 83 -8.337 -6.401 5.196 593 HA VAL 83 HA VAL 83 -8.360 -8.835 6.976 594 HB VAL 83 HB VAL 83 -8.883 -10.160 4.970 595 HG11 VAL 83 1HG1 VAL 83 -11.197 -9.457 4.596 596 HG12 VAL 83 1HG2 VAL 83 -10.750 -9.390 6.318 597 HG13 VAL 83 1HG3 VAL 83 -10.844 -7.890 5.363 598 HG21 VAL 83 2HG3 VAL 83 -7.803 -8.683 3.310 599 HG22 VAL 83 2HG1 VAL 83 -9.485 -9.038 2.849 600 HG23 VAL 83 2HG2 VAL 83 -9.073 -7.462 3.567 601 H THR 84 H THR 84 -7.136 -10.610 5.431 602 HA THR 84 HA THR 84 -4.406 -10.072 5.956 603 HB THR 84 HB THR 84 -5.573 -12.001 3.899 604 HG1 THR 84 1HG THR 84 -4.862 -12.385 6.642 605 HG21 THR 84 2HG3 THR 84 -2.887 -11.957 5.327 606 HG22 THR 84 2HG1 THR 84 -3.463 -13.231 4.227 607 HG23 THR 84 2HG2 THR 84 -3.153 -11.591 3.607 608 H GLY 85 H GLY 85 -3.134 -8.606 5.169 609 HA2 GLY 85 1HA GLY 85 -1.678 -8.002 3.352 610 HA3 GLY 85 2HA GLY 85 -2.979 -8.392 2.203 611 H ALA 86 H ALA 86 -4.784 -6.914 4.303 612 HA ALA 86 HA ALA 86 -5.187 -4.686 2.619 613 HB1 ALA 86 3HB ALA 86 -5.971 -5.025 5.536 614 HB2 ALA 86 1HB ALA 86 -6.652 -3.828 4.410 615 HB3 ALA 86 2HB ALA 86 -6.914 -5.567 4.129 616 H MET 87 H MET 87 -4.247 -2.811 2.354 617 HA MET 87 HA MET 87 -2.347 -1.858 4.463 618 HB2 MET 87 1HB MET 87 -2.626 -1.060 1.543 619 HB3 MET 87 2HB MET 87 -1.448 -0.404 2.671 620 HG2 MET 87 1HG MET 87 -0.428 -2.636 2.910 621 HG3 MET 87 2HG MET 87 -1.614 -3.299 1.783 622 HE1 MET 87 3HE MET 87 1.640 -1.272 2.272 623 HE2 MET 87 1HE MET 87 1.831 -0.414 0.724 624 HE3 MET 87 2HE MET 87 0.531 0.054 1.847 625 H SER 88 H SER 88 -2.906 -0.311 5.766 626 HA SER 88 HA SER 88 -5.177 1.538 4.987 627 HB2 SER 88 1HB SER 88 -6.120 -0.335 6.114 628 HB3 SER 88 2HB SER 88 -5.057 -0.064 7.486 629 HG SER 88 HG SER 88 -7.163 0.895 7.589 630 H MET 89 H MET 89 -4.997 3.567 5.792 631 HA MET 89 HA MET 89 -2.370 4.335 6.855 632 HB2 MET 89 1HB MET 89 -4.843 6.007 6.276 633 HB3 MET 89 2HB MET 89 -3.239 6.630 6.639 634 HG2 MET 89 1HG MET 89 -3.978 4.968 4.212 635 HG3 MET 89 2HG MET 89 -3.743 6.717 4.242 636 HE1 MET 89 3HE MET 89 -1.266 7.138 6.129 637 HE2 MET 89 1HE MET 89 0.073 7.076 4.957 638 HE3 MET 89 2HE MET 89 -1.438 7.918 4.537 639 H ALA 90 H ALA 90 -1.940 5.460 8.739 640 HA ALA 90 HA ALA 90 -3.854 4.899 10.938 641 HB1 ALA 90 3HB ALA 90 -0.993 5.922 10.997 642 HB2 ALA 90 1HB ALA 90 -1.985 5.532 12.420 643 HB3 ALA 90 2HB ALA 90 -1.511 4.245 11.285 644 H HIS 91 H HIS 91 -4.778 6.418 12.218 645 HA HIS 91 HA HIS 91 -4.346 9.277 11.684 646 HB2 HIS 91 1HB HIS 91 -6.528 9.753 10.808 647 HB3 HIS 91 2HB HIS 91 -5.853 8.479 9.800 648 HD2 HIS 91 2HD HIS 91 -7.336 6.147 9.708 649 HE1 HIS 91 1HE HIS 91 -10.205 7.263 12.654 650 H ARG 92 H ARG 92 -6.004 10.619 12.881 651 HA ARG 92 HA ARG 92 -7.040 9.179 15.291 652 HB2 ARG 92 1HB ARG 92 -5.602 11.861 15.312 653 HB3 ARG 92 2HB ARG 92 -6.341 11.076 16.699 654 HG2 ARG 92 1HG ARG 92 -4.055 9.866 15.130 655 HG3 ARG 92 2HG ARG 92 -3.850 10.895 16.569 656 HD2 ARG 92 1HD ARG 92 -5.250 9.310 17.834 657 HD3 ARG 92 2HD ARG 92 -5.288 8.258 16.400 658 HE ARG 92 HE ARG 92 -3.013 8.768 18.182 659 HH11 ARG 92 1HH1 ARG 92 -4.213 7.323 15.212 660 HH12 ARG 92 1HH2 ARG 92 -2.857 6.230 15.050 661 HH21 ARG 92 2HH1 ARG 92 -1.259 7.343 17.959 662 HH22 ARG 92 2HH2 ARG 92 -1.184 6.241 16.604 663 H GLY 93 H GLY 93 -8.577 9.698 13.096 664 HA2 GLY 93 1HA GLY 93 -10.924 10.631 13.717 665 HA3 GLY 93 2HA GLY 93 -10.068 12.189 13.781 666 H ARG 94 H ARG 94 -12.179 11.925 12.082 667 HA ARG 94 HA ARG 94 -11.393 11.101 9.411 668 HB2 ARG 94 1HB ARG 94 -13.619 12.914 10.418 669 HB3 ARG 94 2HB ARG 94 -13.429 12.434 8.740 670 HG2 ARG 94 1HG ARG 94 -13.749 10.079 9.364 671 HG3 ARG 94 2HG ARG 94 -13.936 10.563 11.067 672 HD2 ARG 94 1HD ARG 94 -15.662 11.565 8.818 673 HD3 ARG 94 2HD ARG 94 -16.060 10.178 9.858 674 HE ARG 94 HE ARG 94 -15.501 12.276 11.584 675 HH11 ARG 94 1HH1 ARG 94 -17.788 11.641 8.994 676 HH12 ARG 94 1HH2 ARG 94 -19.035 12.661 9.677 677 HH21 ARG 94 2HH1 ARG 94 -17.128 13.596 12.460 678 HH22 ARG 94 2HH2 ARG 94 -18.662 13.767 11.639 679 H ASP 95 H ASP 95 -10.662 12.206 7.701 680 HA ASP 95 HA ASP 95 -9.218 13.746 6.714 681 HB2 ASP 95 1HB ASP 95 -11.079 15.683 8.157 682 HB3 ASP 95 2HB ASP 95 -9.961 16.121 6.874 683 H THR 96 H THR 96 -8.416 12.682 9.278 684 HA THR 96 HA THR 96 -6.413 14.741 9.969 685 HB THR 96 HB THR 96 -8.218 13.568 12.128 686 HG1 THR 96 1HG THR 96 -9.409 15.100 11.014 687 HG21 THR 96 2HG3 THR 96 -6.080 15.732 12.182 688 HG22 THR 96 2HG1 THR 96 -7.074 15.213 13.562 689 HG23 THR 96 2HG2 THR 96 -5.906 14.086 12.832 690 H GLY 97 H GLY 97 -5.185 13.091 8.849 691 HA2 GLY 97 1HA GLY 97 -4.342 10.978 10.781 692 HA3 GLY 97 2HA GLY 97 -4.690 10.554 9.088 693 H SER 98 H SER 98 -2.320 9.814 9.605 694 HA SER 98 HA SER 98 -0.392 12.049 8.892 695 HB2 SER 98 1HB SER 98 1.246 11.080 10.099 696 HB3 SER 98 2HB SER 98 -0.168 11.115 11.143 697 HG SER 98 HG SER 98 -0.549 8.961 10.566 698 H CYS 99 H CYS 99 1.699 10.898 8.023 699 HA CYS 99 HA CYS 99 1.050 9.437 5.541 700 HB2 CYS 99 1HB CYS 99 3.325 9.531 5.059 701 HB3 CYS 99 2HB CYS 99 2.747 11.113 5.569 702 HG CYS 99 HG CYS 99 3.620 10.940 8.010 703 H GLN 100 H GLN 100 1.591 8.578 8.817 704 HA GLN 100 HA GLN 100 2.950 6.049 8.364 705 HB2 GLN 100 1HB GLN 100 1.283 7.049 10.712 706 HB3 GLN 100 2HB GLN 100 2.223 5.564 10.713 707 HG2 GLN 100 1HG GLN 100 4.282 6.895 10.343 708 HG3 GLN 100 2HG GLN 100 3.295 8.380 10.459 709 HE21 GLN 100 2HE2 GLN 100 3.147 9.301 12.392 710 HE22 GLN 100 2HE1 GLN 100 3.439 8.521 13.911 711 H PHE 101 H PHE 101 2.130 3.953 8.613 712 HA PHE 101 HA PHE 101 -0.781 3.570 8.259 713 HB2 PHE 101 1HB PHE 101 -0.583 2.415 6.138 714 HB3 PHE 101 2HB PHE 101 0.096 4.025 5.948 715 HD1 PHE 101 2HD PHE 101 2.557 4.335 5.843 716 HD2 PHE 101 1HD PHE 101 0.755 0.462 5.888 717 HE1 PHE 101 2HE PHE 101 4.659 3.350 4.993 718 HE2 PHE 101 1HE PHE 101 2.856 -0.528 5.040 719 HZ PHE 101 HZ PHE 101 4.808 0.916 4.592 720 H PHE 102 H PHE 102 -1.139 1.115 7.724 721 HA PHE 102 HA PHE 102 0.905 -0.632 8.947 722 HB2 PHE 102 1HB PHE 102 -0.679 -1.591 10.580 723 HB3 PHE 102 2HB PHE 102 -0.373 0.105 10.922 724 HD1 PHE 102 2HD PHE 102 -2.099 1.789 10.578 725 HD2 PHE 102 1HD PHE 102 -2.843 -2.347 9.800 726 HE1 PHE 102 2HE PHE 102 -4.530 2.234 10.548 727 HE2 PHE 102 1HE PHE 102 -5.275 -1.904 9.766 728 HZ PHE 102 HZ PHE 102 -6.119 0.386 10.141 729 H ILE 103 H ILE 103 0.701 -2.784 8.470 730 HA ILE 103 HA ILE 103 -1.368 -3.411 6.377 731 HB ILE 103 HB ILE 103 1.379 -4.679 6.835 732 HG12 ILE 103 1HG1 ILE 103 0.510 -2.834 4.600 733 HG13 ILE 103 1HG2 ILE 103 1.474 -2.338 5.982 734 HG21 ILE 103 2HG1 ILE 103 0.936 -5.809 4.694 735 HG22 ILE 103 2HG2 ILE 103 -0.298 -6.228 5.904 736 HG23 ILE 103 2HG3 ILE 103 -0.674 -5.053 4.623 737 HD11 ILE 103 1HD3 ILE 103 2.259 -4.427 3.939 738 HD12 ILE 103 1HD1 ILE 103 2.876 -2.762 4.043 739 HD13 ILE 103 1HD2 ILE 103 3.235 -3.927 5.341 740 H VAL 104 H VAL 104 -2.885 -4.742 6.800 741 HA VAL 104 HA VAL 104 -2.883 -6.095 9.436 742 HB VAL 104 HB VAL 104 -4.951 -6.037 7.184 743 HG11 VAL 104 1HG1 VAL 104 -6.521 -6.813 8.893 744 HG12 VAL 104 1HG2 VAL 104 -5.201 -7.976 8.624 745 HG13 VAL 104 1HG3 VAL 104 -5.188 -6.930 10.064 746 HG21 VAL 104 2HG3 VAL 104 -4.511 -3.793 8.120 747 HG22 VAL 104 2HG1 VAL 104 -6.117 -4.382 8.606 748 HG23 VAL 104 2HG2 VAL 104 -4.765 -4.426 9.764 749 H HIS 105 H HIS 105 -2.892 -8.174 9.902 750 HA HIS 105 HA HIS 105 -1.757 -9.898 7.753 751 HB2 HIS 105 1HB HIS 105 -1.907 -10.303 10.773 752 HB3 HIS 105 2HB HIS 105 -1.125 -11.394 9.639 753 HD2 HIS 105 2HD HIS 105 -0.122 -8.008 8.434 754 HE1 HIS 105 1HE HIS 105 2.763 -9.026 11.400 755 H GLU 106 H GLU 106 -4.495 -9.667 9.955 756 HA GLU 106 HA GLU 106 -5.761 -11.943 8.494 757 HB2 GLU 106 1HB GLU 106 -5.617 -11.643 11.524 758 HB3 GLU 106 2HB GLU 106 -6.617 -12.812 10.676 759 HG2 GLU 106 1HG GLU 106 -4.587 -13.854 9.732 760 HG3 GLU 106 2HG GLU 106 -3.594 -12.689 10.606 761 HA PRO 107 HA PRO 107 -9.457 -9.566 8.323 762 HB2 PRO 107 1HB PRO 107 -10.710 -12.068 9.543 763 HB3 PRO 107 2HB PRO 107 -11.247 -11.152 8.129 764 HG2 PRO 107 1HG PRO 107 -10.001 -13.465 7.724 765 HG3 PRO 107 2HG PRO 107 -9.571 -12.082 6.713 766 HD2 PRO 107 1HD PRO 107 -8.108 -13.233 9.119 767 HD3 PRO 107 2HD PRO 107 -7.430 -12.605 7.563 768 H GLN 108 H GLN 108 -9.841 -8.011 9.614 769 HA GLN 108 HA GLN 108 -10.404 -8.670 12.484 770 HB2 GLN 108 1HB GLN 108 -8.829 -6.322 11.349 771 HB3 GLN 108 2HB GLN 108 -9.423 -6.388 13.002 772 HG2 GLN 108 1HG GLN 108 -7.531 -8.408 11.784 773 HG3 GLN 108 2HG GLN 108 -7.045 -7.005 12.776 774 HE21 GLN 108 2HE2 GLN 108 -7.028 -10.113 13.041 775 HE22 GLN 108 2HE1 GLN 108 -7.624 -10.365 14.648 776 HA PRO 109 HA PRO 109 -14.228 -6.792 10.876 777 HB2 PRO 109 1HB PRO 109 -14.991 -7.969 13.583 778 HB3 PRO 109 2HB PRO 109 -15.882 -8.058 12.058 779 HG2 PRO 109 1HG PRO 109 -14.580 -10.227 12.883 780 HG3 PRO 109 2HG PRO 109 -14.487 -9.775 11.178 781 HD2 PRO 109 1HD PRO 109 -12.457 -9.316 13.397 782 HD3 PRO 109 2HD PRO 109 -12.179 -9.838 11.687 783 H HIS 110 H HIS 110 -12.472 -6.537 13.889 784 HA HIS 110 HA HIS 110 -14.120 -4.347 14.899 785 HB2 HIS 110 1HB HIS 110 -11.380 -5.384 15.744 786 HB3 HIS 110 2HB HIS 110 -12.281 -4.142 16.601 787 HD2 HIS 110 2HD HIS 110 -11.866 -7.889 16.688 788 HE1 HIS 110 1HE HIS 110 -15.605 -7.089 18.572 789 H LEU 111 H LEU 111 -11.585 -4.599 12.629 790 HA LEU 111 HA LEU 111 -10.898 -1.711 12.950 791 HB2 LEU 111 1HB LEU 111 -9.638 -3.917 11.270 792 HB3 LEU 111 2HB LEU 111 -9.081 -2.242 11.321 793 HG LEU 111 HG LEU 111 -9.041 -4.206 13.639 794 HD11 LEU 111 1HD1 LEU 111 -6.607 -4.084 13.346 795 HD12 LEU 111 1HD2 LEU 111 -7.414 -4.719 11.893 796 HD13 LEU 111 1HD3 LEU 111 -6.831 -3.038 11.926 797 HD21 LEU 111 2HD3 LEU 111 -9.432 -1.873 14.360 798 HD22 LEU 111 2HD1 LEU 111 -7.794 -2.414 14.797 799 HD23 LEU 111 2HD2 LEU 111 -8.034 -1.342 13.396 800 H ASP 112 H ASP 112 -12.929 -3.743 11.182 801 HA ASP 112 HA ASP 112 -12.778 -2.565 8.577 802 HB2 ASP 112 1HB ASP 112 -15.057 -3.939 10.056 803 HB3 ASP 112 2HB ASP 112 -15.165 -3.433 8.377 804 H GLY 113 H GLY 113 -13.035 -0.560 8.027 805 HA2 GLY 113 1HA GLY 113 -14.367 1.322 7.566 806 HA3 GLY 113 2HA GLY 113 -15.537 0.784 8.793 807 H VAL 114 H VAL 114 -12.518 0.539 10.142 808 HA VAL 114 HA VAL 114 -12.927 3.027 11.728 809 HB VAL 114 HB VAL 114 -10.891 0.759 11.969 810 HG11 VAL 114 1HG1 VAL 114 -10.428 1.682 14.187 811 HG12 VAL 114 1HG2 VAL 114 -10.051 2.841 12.891 812 HG13 VAL 114 1HG3 VAL 114 -11.535 3.034 13.855 813 HG21 VAL 114 2HG3 VAL 114 -13.209 0.014 12.385 814 HG22 VAL 114 2HG1 VAL 114 -12.269 0.044 13.895 815 HG23 VAL 114 2HG2 VAL 114 -13.431 1.345 13.545 816 H HIS 115 H HIS 115 -10.346 1.556 9.760 817 HA HIS 115 HA HIS 115 -9.152 4.301 9.574 818 HB2 HIS 115 1HB HIS 115 -7.832 1.563 9.331 819 HB3 HIS 115 2HB HIS 115 -7.022 3.090 9.016 820 HD2 HIS 115 2HD HIS 115 -7.984 0.836 12.003 821 HE1 HIS 115 1HE HIS 115 -6.251 4.399 13.574 822 H THR 116 H THR 116 -7.781 4.558 7.552 823 HA THR 116 HA THR 116 -9.700 4.112 5.327 824 HB THR 116 HB THR 116 -7.243 5.908 5.532 825 HG1 THR 116 1HG THR 116 -9.805 6.952 5.261 826 HG21 THR 116 2HG3 THR 116 -9.405 5.714 3.401 827 HG22 THR 116 2HG1 THR 116 -8.095 6.916 3.451 828 HG23 THR 116 2HG2 THR 116 -7.715 5.194 3.215 829 H VAL 117 H VAL 117 -9.504 2.354 4.195 830 HA VAL 117 HA VAL 117 -6.809 1.183 3.675 831 HB VAL 117 HB VAL 117 -9.609 0.297 2.824 832 HG11 VAL 117 1HG1 VAL 117 -8.539 -1.834 2.278 833 HG12 VAL 117 1HG2 VAL 117 -7.885 -0.492 1.309 834 HG13 VAL 117 1HG3 VAL 117 -6.951 -1.139 2.680 835 HG21 VAL 117 2HG3 VAL 117 -9.299 0.217 5.275 836 HG22 VAL 117 2HG1 VAL 117 -9.354 -1.422 4.586 837 HG23 VAL 117 2HG2 VAL 117 -7.794 -0.707 5.055 838 H PHE 118 H PHE 118 -5.732 1.162 1.855 839 HA PHE 118 HA PHE 118 -6.885 2.754 -0.403 840 HB2 PHE 118 1HB PHE 118 -4.864 4.094 -0.537 841 HB3 PHE 118 2HB PHE 118 -5.537 4.261 1.076 842 HD1 PHE 118 2HD PHE 118 -4.454 3.181 3.005 843 HD2 PHE 118 1HD PHE 118 -2.740 3.040 -0.905 844 HE1 PHE 118 2HE PHE 118 -2.284 2.513 3.983 845 HE2 PHE 118 1HE PHE 118 -0.569 2.370 0.069 846 HZ PHE 118 HZ PHE 118 -0.341 2.106 2.513 847 H GLY 119 H GLY 119 -5.020 0.126 0.733 848 HA2 GLY 119 1HA GLY 119 -4.633 -0.817 -2.016 849 HA3 GLY 119 2HA GLY 119 -3.130 -0.450 -1.140 850 H GLN 120 H GLN 120 -3.106 -2.910 -1.812 851 HA GLN 120 HA GLN 120 -3.344 -4.344 0.720 852 HB2 GLN 120 1HB GLN 120 -5.655 -4.601 -0.209 853 HB3 GLN 120 2HB GLN 120 -4.975 -5.297 -1.673 854 HG2 GLN 120 1HG GLN 120 -4.051 -7.161 -0.365 855 HG3 GLN 120 2HG GLN 120 -4.763 -6.457 1.113 856 HE21 GLN 120 2HE2 GLN 120 -5.756 -8.670 1.160 857 HE22 GLN 120 2HE1 GLN 120 -7.259 -8.887 0.327 858 H VAL 121 H VAL 121 -1.691 -5.623 0.955 859 HA VAL 121 HA VAL 121 0.169 -6.221 -1.198 860 HB VAL 121 HB VAL 121 -0.232 -7.549 1.527 861 HG11 VAL 121 1HG1 VAL 121 2.067 -8.340 1.255 862 HG12 VAL 121 1HG2 VAL 121 0.990 -8.977 -0.010 863 HG13 VAL 121 1HG3 VAL 121 2.112 -7.646 -0.383 864 HG21 VAL 121 2HG3 VAL 121 0.256 -5.134 1.697 865 HG22 VAL 121 2HG1 VAL 121 1.645 -6.103 2.242 866 HG23 VAL 121 2HG2 VAL 121 1.668 -5.341 0.634 867 H THR 122 H THR 122 0.362 -7.780 -2.578 868 HA THR 122 HA THR 122 -1.793 -9.870 -2.529 869 HB THR 122 HB THR 122 -1.780 -9.780 -5.001 870 HG1 THR 122 1HG THR 122 -0.604 -8.043 -5.992 871 HG21 THR 122 2HG3 THR 122 -2.165 -7.045 -3.723 872 HG22 THR 122 2HG1 THR 122 -2.845 -7.576 -5.279 873 HG23 THR 122 2HG2 THR 122 -3.373 -8.350 -3.767 874 H SER 123 H SER 123 1.574 -9.144 -2.878 875 HA SER 123 HA SER 123 2.173 -12.098 -3.048 876 HB2 SER 123 1HB SER 123 2.179 -11.366 -5.294 877 HB3 SER 123 2HB SER 123 3.309 -10.078 -4.904 878 HG SER 123 HG SER 123 4.322 -11.928 -5.679 879 H GLY 124 H GLY 124 3.835 -12.665 -1.771 880 HA2 GLY 124 1HA GLY 124 5.826 -12.429 -0.545 881 HA3 GLY 124 2HA GLY 124 5.847 -10.691 -0.929 882 H MET 125 H MET 125 2.836 -11.893 0.184 883 HA MET 125 HA MET 125 2.715 -10.189 2.453 884 HB2 MET 125 1HB MET 125 0.748 -11.216 1.307 885 HB3 MET 125 2HB MET 125 1.200 -12.781 1.968 886 HG2 MET 125 1HG MET 125 -0.574 -11.837 3.292 887 HG3 MET 125 2HG MET 125 0.901 -11.879 4.261 888 HE1 MET 125 3HE MET 125 0.670 -10.131 6.026 889 HE2 MET 125 1HE MET 125 -0.272 -8.635 5.821 890 HE3 MET 125 2HE MET 125 -1.063 -10.219 5.627 891 H ASP 126 H ASP 126 3.981 -13.443 2.112 892 HA ASP 126 HA ASP 126 4.191 -14.188 4.828 893 HB2 ASP 126 1HB ASP 126 6.057 -14.659 2.471 894 HB3 ASP 126 2HB ASP 126 6.321 -15.380 4.053 895 H VAL 127 H VAL 127 6.249 -12.012 2.934 896 HA VAL 127 HA VAL 127 8.265 -11.607 4.960 897 HB VAL 127 HB VAL 127 7.231 -9.752 2.761 898 HG11 VAL 127 1HG1 VAL 127 9.351 -8.558 3.023 899 HG12 VAL 127 1HG2 VAL 127 8.366 -8.499 4.504 900 HG13 VAL 127 1HG3 VAL 127 9.763 -9.596 4.408 901 HG21 VAL 127 2HG3 VAL 127 8.144 -11.886 1.915 902 HG22 VAL 127 2HG1 VAL 127 9.227 -10.531 1.523 903 HG23 VAL 127 2HG2 VAL 127 9.627 -11.630 2.864 904 H VAL 128 H VAL 128 5.100 -10.150 4.461 905 HA VAL 128 HA VAL 128 5.496 -8.133 6.564 906 HB VAL 128 HB VAL 128 2.973 -9.226 5.227 907 HG11 VAL 128 1HG1 VAL 128 1.871 -7.226 6.106 908 HG12 VAL 128 1HG2 VAL 128 2.488 -8.272 7.406 909 HG13 VAL 128 1HG3 VAL 128 3.362 -6.785 6.970 910 HG21 VAL 128 2HG3 VAL 128 4.509 -8.105 3.650 911 HG22 VAL 128 2HG1 VAL 128 3.051 -7.123 3.925 912 HG23 VAL 128 2HG2 VAL 128 4.581 -6.688 4.724 913 H ARG 129 H ARG 129 3.865 -11.284 6.380 914 HA ARG 129 HA ARG 129 2.844 -11.158 9.070 915 HB2 ARG 129 1HB ARG 129 3.461 -13.512 7.243 916 HB3 ARG 129 2HB ARG 129 2.657 -13.664 8.797 917 HG2 ARG 129 1HG ARG 129 0.766 -12.381 8.020 918 HG3 ARG 129 2HG ARG 129 1.597 -12.018 6.488 919 HD2 ARG 129 1HD ARG 129 0.012 -13.775 6.157 920 HD3 ARG 129 2HD ARG 129 1.661 -14.424 6.000 921 HE ARG 129 HE ARG 129 0.674 -14.709 8.677 922 HH11 ARG 129 1HH1 ARG 129 0.448 -16.070 5.445 923 HH12 ARG 129 1HH2 ARG 129 0.014 -17.667 6.013 924 HH21 ARG 129 2HH1 ARG 129 0.110 -16.786 9.401 925 HH22 ARG 129 2HH2 ARG 129 -0.177 -18.073 8.251 926 H THR 130 H THR 130 5.910 -12.223 7.711 927 HA THR 130 HA THR 130 6.810 -13.010 10.453 928 HB THR 130 HB THR 130 8.754 -14.019 9.309 929 HG1 THR 130 1HG THR 130 8.736 -14.032 6.989 930 HG21 THR 130 2HG3 THR 130 6.108 -14.804 8.029 931 HG22 THR 130 2HG1 THR 130 7.571 -15.811 8.100 932 HG23 THR 130 2HG2 THR 130 6.713 -15.381 9.598 933 H MET 131 H MET 131 6.445 -10.226 9.122 934 HA MET 131 HA MET 131 9.056 -9.037 9.005 935 HB2 MET 131 1HB MET 131 6.914 -8.015 8.157 936 HB3 MET 131 2HB MET 131 6.437 -7.730 9.824 937 HG2 MET 131 1HG MET 131 8.385 -6.267 10.147 938 HG3 MET 131 2HG MET 131 8.901 -6.574 8.488 939 HE1 MET 131 3HE MET 131 6.540 -6.438 6.620 940 HE2 MET 131 1HE MET 131 6.368 -4.694 6.312 941 HE3 MET 131 2HE MET 131 7.989 -5.424 6.416 942 H LYS 132 H LYS 132 10.260 -7.888 10.447 943 HA LYS 132 HA LYS 132 9.602 -8.402 13.329 944 HB2 LYS 132 1HB LYS 132 12.280 -7.909 11.967 945 HB3 LYS 132 2HB LYS 132 12.051 -8.037 13.706 946 HG2 LYS 132 1HG LYS 132 11.255 -10.357 13.436 947 HG3 LYS 132 2HG LYS 132 11.487 -10.228 11.687 948 HD2 LYS 132 1HD LYS 132 13.899 -9.789 12.041 949 HD3 LYS 132 2HD LYS 132 13.664 -9.927 13.790 950 HE2 LYS 132 1HE LYS 132 12.893 -12.261 13.501 951 HE3 LYS 132 2HE LYS 132 13.134 -12.125 11.757 952 HZ1 LYS 132 3HZ LYS 132 15.243 -11.872 13.796 953 HZ2 LYS 132 1HZ LYS 132 14.989 -13.179 12.823 954 HZ3 LYS 132 2HZ LYS 132 15.467 -11.743 12.167 955 H ASN 133 H ASN 133 9.846 -6.809 14.854 956 HA ASN 133 HA ASN 133 9.154 -4.140 13.966 957 HB2 ASN 133 1HB ASN 133 8.447 -5.166 16.137 958 HB3 ASN 133 2HB ASN 133 10.110 -5.044 16.695 959 HD21 ASN 133 2HD2 ASN 133 7.728 -3.795 17.774 960 HD22 ASN 133 2HD1 ASN 133 8.003 -2.086 17.727 961 H GLY 134 H GLY 134 10.345 -2.556 13.297 962 HA2 GLY 134 1HA GLY 134 12.278 -1.097 13.632 963 HA3 GLY 134 2HA GLY 134 13.231 -2.530 14.078 964 H ASP 135 H ASP 135 11.408 -3.671 11.671 965 HA ASP 135 HA ASP 135 13.475 -3.617 9.673 966 HB2 ASP 135 1HB ASP 135 10.527 -4.346 9.626 967 HB3 ASP 135 2HB ASP 135 11.507 -4.382 8.165 968 H VAL 136 H VAL 136 13.778 -2.487 7.843 969 HA VAL 136 HA VAL 136 12.237 0.102 7.676 970 HB VAL 136 HB VAL 136 15.185 -0.454 7.087 971 HG11 VAL 136 1HG1 VAL 136 15.358 1.959 6.730 972 HG12 VAL 136 1HG2 VAL 136 14.243 1.192 5.574 973 HG13 VAL 136 1HG3 VAL 136 13.600 2.118 6.953 974 HG21 VAL 136 2HG3 VAL 136 14.689 -0.407 9.508 975 HG22 VAL 136 2HG1 VAL 136 15.611 1.034 9.018 976 HG23 VAL 136 2HG2 VAL 136 13.859 1.156 9.308 977 H MET 137 H MET 137 11.484 0.799 5.842 978 HA MET 137 HA MET 137 11.521 -1.040 3.548 979 HB2 MET 137 1HB MET 137 10.299 1.721 3.898 980 HB3 MET 137 2HB MET 137 10.055 0.673 2.508 981 HG2 MET 137 1HG MET 137 9.074 -1.040 4.095 982 HG3 MET 137 2HG MET 137 9.138 0.198 5.352 983 HE1 MET 137 3HE MET 137 8.391 2.878 4.027 984 HE2 MET 137 1HE MET 137 6.614 2.873 4.153 985 HE3 MET 137 2HE MET 137 7.606 2.265 5.503 986 H LYS 138 H LYS 138 13.405 -1.203 2.547 987 HA LYS 138 HA LYS 138 15.363 0.842 2.348 988 HB2 LYS 138 1HB LYS 138 15.809 -1.567 1.934 989 HB3 LYS 138 2HB LYS 138 14.852 -1.493 0.462 990 HG2 LYS 138 1HG LYS 138 16.438 0.031 -0.563 991 HG3 LYS 138 2HG LYS 138 17.359 0.140 0.944 992 HD2 LYS 138 1HD LYS 138 17.876 -2.267 0.821 993 HD3 LYS 138 2HD LYS 138 16.924 -2.404 -0.665 994 HE2 LYS 138 1HE LYS 138 18.449 -0.801 -1.782 995 HE3 LYS 138 2HE LYS 138 19.405 -0.682 -0.303 996 HZ1 LYS 138 3HZ LYS 138 18.987 -3.138 -1.874 997 HZ2 LYS 138 1HZ LYS 138 20.360 -2.226 -1.849 998 HZ3 LYS 138 2HZ LYS 138 19.879 -3.027 -0.490 999 H GLU 139 H GLU 139 12.733 -0.016 0.120 1000 HA GLU 139 HA GLU 139 12.742 2.690 -0.986 1001 HB2 GLU 139 1HB GLU 139 14.634 1.559 -2.231 1002 HB3 GLU 139 2HB GLU 139 13.478 0.373 -2.821 1003 HG2 GLU 139 1HG GLU 139 12.204 2.180 -3.926 1004 HG3 GLU 139 2HG GLU 139 13.392 3.351 -3.354 1005 H VAL 140 H VAL 140 10.720 3.197 -1.137 1006 HA VAL 140 HA VAL 140 8.769 1.094 -2.074 1007 HB VAL 140 HB VAL 140 8.263 3.664 -0.499 1008 HG11 VAL 140 1HG1 VAL 140 5.995 2.784 -0.230 1009 HG12 VAL 140 1HG2 VAL 140 6.410 3.046 -1.940 1010 HG13 VAL 140 1HG3 VAL 140 6.411 1.399 -1.266 1011 HG21 VAL 140 2HG3 VAL 140 9.448 1.976 0.863 1012 HG22 VAL 140 2HG1 VAL 140 7.761 2.155 1.397 1013 HG23 VAL 140 2HG2 VAL 140 8.235 0.754 0.406 1014 H LYS 141 H LYS 141 8.095 1.206 -4.016 1015 HA LYS 141 HA LYS 141 7.887 3.915 -5.287 1016 HB2 LYS 141 1HB LYS 141 8.952 1.334 -6.495 1017 HB3 LYS 141 2HB LYS 141 8.493 2.737 -7.448 1018 HG2 LYS 141 1HG LYS 141 10.605 2.806 -5.275 1019 HG3 LYS 141 2HG LYS 141 10.946 2.521 -6.989 1020 HD2 LYS 141 1HD LYS 141 10.035 4.701 -7.586 1021 HD3 LYS 141 2HD LYS 141 9.513 4.979 -5.917 1022 HE2 LYS 141 1HE LYS 141 11.614 6.173 -6.439 1023 HE3 LYS 141 2HE LYS 141 11.836 4.985 -5.151 1024 HZ1 LYS 141 3HZ LYS 141 12.552 4.591 -7.980 1025 HZ2 LYS 141 1HZ LYS 141 13.605 4.896 -6.749 1026 HZ3 LYS 141 2HZ LYS 141 12.758 3.481 -6.778 1027 H VAL 142 H VAL 142 6.266 4.242 -6.770 1028 HA VAL 142 HA VAL 142 4.162 2.095 -6.928 1029 HB VAL 142 HB VAL 142 3.714 5.082 -6.457 1030 HG11 VAL 142 1HG1 VAL 142 1.349 4.478 -6.288 1031 HG12 VAL 142 1HG2 VAL 142 2.022 4.093 -7.889 1032 HG13 VAL 142 1HG3 VAL 142 1.749 2.794 -6.701 1033 HG21 VAL 142 2HG3 VAL 142 4.509 3.927 -4.423 1034 HG22 VAL 142 2HG1 VAL 142 2.793 4.375 -4.273 1035 HG23 VAL 142 2HG2 VAL 142 3.245 2.691 -4.629 1036 H PHE 143 H PHE 143 3.242 1.743 -8.786 1037 HA PHE 143 HA PHE 143 4.007 3.556 -11.046 1038 HB2 PHE 143 1HB PHE 143 4.137 0.512 -11.077 1039 HB3 PHE 143 2HB PHE 143 4.509 1.582 -12.419 1040 HD1 PHE 143 2HD PHE 143 6.538 2.997 -12.363 1041 HD2 PHE 143 1HD PHE 143 5.710 0.108 -9.326 1042 HE1 PHE 143 2HE PHE 143 8.899 3.086 -11.638 1043 HE2 PHE 143 1HE PHE 143 8.070 0.196 -8.597 1044 HZ PHE 143 HZ PHE 143 9.665 1.686 -9.753 1045 H ASP 144 H ASP 144 2.642 3.666 -12.772 1046 HA ASP 144 HA ASP 144 -0.157 3.070 -12.168 1047 HB2 ASP 144 1HB ASP 144 0.618 5.122 -13.421 1048 HB3 ASP 144 2HB ASP 144 1.100 4.082 -14.754 1049 H GLU 145 H GLU 145 -0.064 0.797 -11.916 1050 HA GLU 145 HA GLU 145 -0.052 -0.623 -14.562 1051 HB2 GLU 145 1HB GLU 145 0.659 -1.625 -11.776 1052 HB3 GLU 145 2HB GLU 145 0.369 -2.694 -13.142 1053 HG2 GLU 145 1HG GLU 145 2.260 -1.818 -14.330 1054 HG3 GLU 145 2HG GLU 145 2.478 -0.529 -13.148 1055 HA PRO 146 HA PRO 146 -4.474 -0.686 -13.452 1056 HB2 PRO 146 1HB PRO 146 -4.301 -1.733 -16.310 1057 HB3 PRO 146 2HB PRO 146 -5.464 -0.587 -15.631 1058 HG2 PRO 146 1HG PRO 146 -3.523 0.362 -17.183 1059 HG3 PRO 146 2HG PRO 146 -3.926 1.231 -15.699 1060 HD2 PRO 146 1HD PRO 146 -1.624 -0.684 -16.236 1061 HD3 PRO 146 2HD PRO 146 -1.620 0.878 -15.324 Start of MODEL 7 1 H MET 1 1H MET 1 -7.904 2.544 -16.010 2 HA MET 1 HA MET 1 -5.230 3.054 -15.519 3 HB2 MET 1 1HB MET 1 -7.843 4.235 -14.523 4 HB3 MET 1 2HB MET 1 -6.268 4.928 -14.166 5 HG2 MET 1 1HG MET 1 -5.862 5.277 -16.564 6 HG3 MET 1 2HG MET 1 -7.424 4.550 -16.943 7 HE1 MET 1 3HE MET 1 -5.517 7.624 -15.494 8 HE2 MET 1 1HE MET 1 -6.827 8.589 -14.772 9 HE3 MET 1 2HE MET 1 -6.357 7.036 -14.037 10 H ALA 2 H ALA 2 -5.390 0.604 -14.461 11 HA ALA 2 HA ALA 2 -5.930 0.662 -11.617 12 HB1 ALA 2 3HB ALA 2 -4.262 -1.262 -13.275 13 HB2 ALA 2 1HB ALA 2 -4.788 -1.526 -11.597 14 HB3 ALA 2 2HB ALA 2 -5.993 -1.430 -12.903 15 H LYS 3 H LYS 3 -4.450 0.505 -9.896 16 HA LYS 3 HA LYS 3 -1.735 1.632 -10.510 17 HB2 LYS 3 1HB LYS 3 -3.521 2.218 -8.114 18 HB3 LYS 3 2HB LYS 3 -1.858 2.759 -8.290 19 HG2 LYS 3 1HG LYS 3 -4.081 3.508 -10.209 20 HG3 LYS 3 2HG LYS 3 -3.591 4.485 -8.817 21 HD2 LYS 3 1HD LYS 3 -1.249 4.521 -9.764 22 HD3 LYS 3 2HD LYS 3 -1.883 3.725 -11.212 23 HE2 LYS 3 1HE LYS 3 -1.707 6.211 -11.431 24 HE3 LYS 3 2HE LYS 3 -3.341 5.593 -11.689 25 HZ1 LYS 3 3HZ LYS 3 -2.347 6.801 -9.194 26 HZ2 LYS 3 1HZ LYS 3 -3.340 7.527 -10.293 27 HZ3 LYS 3 2HZ LYS 3 -3.873 6.223 -9.436 28 H LYS 4 H LYS 4 -0.000 0.878 -9.407 29 HA LYS 4 HA LYS 4 -0.473 -1.262 -7.382 30 HB2 LYS 4 1HB LYS 4 1.372 -1.513 -9.791 31 HB3 LYS 4 2HB LYS 4 1.320 -2.633 -8.437 32 HG2 LYS 4 1HG LYS 4 -1.047 -3.160 -8.993 33 HG3 LYS 4 2HG LYS 4 -0.931 -2.084 -10.393 34 HD2 LYS 4 1HD LYS 4 0.880 -3.463 -11.328 35 HD3 LYS 4 2HD LYS 4 0.830 -4.517 -9.907 36 HE2 LYS 4 1HE LYS 4 -1.589 -5.009 -10.465 37 HE3 LYS 4 2HE LYS 4 -1.362 -4.118 -11.972 38 HZ1 LYS 4 3HZ LYS 4 0.155 -6.506 -11.156 39 HZ2 LYS 4 1HZ LYS 4 -1.052 -6.463 -12.279 40 HZ3 LYS 4 2HZ LYS 4 0.368 -5.672 -12.563 41 H GLY 5 H GLY 5 1.558 -1.879 -6.258 42 HA2 GLY 5 1HA GLY 5 3.655 0.198 -6.266 43 HA3 GLY 5 2HA GLY 5 2.708 0.038 -4.769 44 H TYR 6 H TYR 6 5.494 -0.379 -4.917 45 HA TYR 6 HA TYR 6 5.598 -3.159 -3.908 46 HB2 TYR 6 1HB TYR 6 6.179 -3.490 -6.251 47 HB3 TYR 6 2HB TYR 6 7.330 -2.162 -6.199 48 HD1 TYR 6 1HD TYR 6 6.610 -5.495 -4.676 49 HD2 TYR 6 2HD TYR 6 9.565 -2.548 -5.673 50 HE1 TYR 6 1HE TYR 6 8.400 -7.073 -4.033 51 HE2 TYR 6 2HE TYR 6 11.355 -4.125 -5.029 52 HH TYR 6 HH TYR 6 11.839 -6.157 -4.291 53 H ILE 7 H ILE 7 6.696 -3.287 -2.120 54 HA ILE 7 HA ILE 7 8.766 -1.172 -1.568 55 HB ILE 7 HB ILE 7 6.982 -2.748 0.355 56 HG12 ILE 7 1HG1 ILE 7 7.136 0.243 -0.048 57 HG13 ILE 7 1HG2 ILE 7 5.977 -0.780 -0.882 58 HG21 ILE 7 2HG1 ILE 7 8.106 -1.471 2.135 59 HG22 ILE 7 2HG2 ILE 7 9.265 -2.486 1.246 60 HG23 ILE 7 2HG3 ILE 7 9.190 -0.737 0.929 61 HD11 ILE 7 1HD3 ILE 7 6.229 -0.478 2.118 62 HD12 ILE 7 1HD1 ILE 7 4.982 0.252 1.081 63 HD13 ILE 7 1HD2 ILE 7 5.056 -1.516 1.273 64 H LEU 8 H LEU 8 10.720 -1.806 -1.802 65 HA LEU 8 HA LEU 8 11.431 -4.592 -1.011 66 HB2 LEU 8 1HB LEU 8 12.340 -3.794 -3.148 67 HB3 LEU 8 2HB LEU 8 13.016 -2.366 -2.358 68 HG LEU 8 HG LEU 8 14.499 -3.918 -1.018 69 HD11 LEU 8 1HD1 LEU 8 14.779 -6.205 -1.864 70 HD12 LEU 8 1HD2 LEU 8 13.137 -5.933 -1.233 71 HD13 LEU 8 1HD3 LEU 8 13.423 -5.954 -2.990 72 HD21 LEU 8 2HD3 LEU 8 15.278 -2.698 -3.022 73 HD22 LEU 8 2HD1 LEU 8 16.037 -4.304 -2.914 74 HD23 LEU 8 2HD2 LEU 8 14.700 -4.027 -4.056 75 H MET 9 H MET 9 12.409 -5.116 0.784 76 HA MET 9 HA MET 9 13.008 -2.892 2.687 77 HB2 MET 9 1HB MET 9 12.560 -5.860 3.165 78 HB3 MET 9 2HB MET 9 12.877 -4.666 4.414 79 HG2 MET 9 1HG MET 9 10.469 -4.642 2.573 80 HG3 MET 9 2HG MET 9 10.488 -5.277 4.221 81 HE1 MET 9 3HE MET 9 8.593 -3.807 5.153 82 HE2 MET 9 1HE MET 9 8.437 -2.062 4.838 83 HE3 MET 9 2HE MET 9 8.318 -3.224 3.493 84 H GLU 10 H GLU 10 14.836 -2.948 4.031 85 HA GLU 10 HA GLU 10 17.252 -3.532 2.549 86 HB2 GLU 10 1HB GLU 10 16.730 -2.684 5.424 87 HB3 GLU 10 2HB GLU 10 18.348 -2.924 4.781 88 HG2 GLU 10 1HG GLU 10 17.884 -1.194 3.057 89 HG3 GLU 10 2HG GLU 10 16.307 -0.921 3.793 90 H ASN 11 H ASN 11 15.297 -5.377 4.703 91 HA ASN 11 HA ASN 11 17.498 -7.286 5.281 92 HB2 ASN 11 1HB ASN 11 15.927 -8.390 6.720 93 HB3 ASN 11 2HB ASN 11 15.877 -6.665 7.056 94 HD21 ASN 11 2HD2 ASN 11 13.804 -7.737 8.011 95 HD22 ASN 11 2HD1 ASN 11 12.399 -7.609 7.007 96 H GLY 12 H GLY 12 15.816 -6.697 2.625 97 HA2 GLY 12 1HA GLY 12 15.976 -8.084 0.713 98 HA3 GLY 12 2HA GLY 12 16.170 -9.505 1.767 99 H GLY 13 H GLY 13 13.701 -7.711 3.042 100 HA2 GLY 13 1HA GLY 13 11.645 -9.551 2.280 101 HA3 GLY 13 2HA GLY 13 11.406 -7.988 3.097 102 H LYS 14 H LYS 14 9.997 -9.435 0.818 103 HA LYS 14 HA LYS 14 10.055 -7.145 -1.114 104 HB2 LYS 14 1HB LYS 14 9.865 -10.108 -1.789 105 HB3 LYS 14 2HB LYS 14 9.640 -8.796 -2.936 106 HG2 LYS 14 1HG LYS 14 11.984 -8.057 -2.497 107 HG3 LYS 14 2HG LYS 14 12.192 -9.462 -1.444 108 HD2 LYS 14 1HD LYS 14 11.664 -10.965 -3.337 109 HD3 LYS 14 2HD LYS 14 11.453 -9.559 -4.392 110 HE2 LYS 14 1HE LYS 14 13.805 -8.912 -4.013 111 HE3 LYS 14 2HE LYS 14 14.021 -10.297 -2.940 112 HZ1 LYS 14 3HZ LYS 14 13.340 -10.444 -5.801 113 HZ2 LYS 14 1HZ LYS 14 14.819 -10.753 -5.141 114 HZ3 LYS 14 2HZ LYS 14 13.540 -11.738 -4.798 115 H ILE 15 H ILE 15 8.249 -6.096 -0.828 116 HA ILE 15 HA ILE 15 5.724 -7.694 -0.472 117 HB ILE 15 HB ILE 15 6.396 -4.885 0.542 118 HG12 ILE 15 1HG1 ILE 15 5.977 -7.419 2.142 119 HG13 ILE 15 1HG2 ILE 15 7.550 -6.743 1.750 120 HG21 ILE 15 2HG1 ILE 15 4.220 -5.034 1.683 121 HG22 ILE 15 2HG2 ILE 15 4.027 -5.160 -0.081 122 HG23 ILE 15 2HG3 ILE 15 3.929 -6.621 0.931 123 HD11 ILE 15 1HD3 ILE 15 5.387 -5.365 3.356 124 HD12 ILE 15 1HD1 ILE 15 6.865 -6.120 3.998 125 HD13 ILE 15 1HD2 ILE 15 6.981 -4.681 2.956 126 H GLU 16 H GLU 16 4.718 -7.861 -2.279 127 HA GLU 16 HA GLU 16 4.479 -5.395 -3.971 128 HB2 GLU 16 1HB GLU 16 5.499 -7.454 -5.037 129 HB3 GLU 16 2HB GLU 16 3.984 -8.298 -4.753 130 HG2 GLU 16 1HG GLU 16 2.802 -6.714 -6.191 131 HG3 GLU 16 2HG GLU 16 4.290 -5.803 -6.439 132 H PHE 17 H PHE 17 2.585 -4.506 -4.413 133 HA PHE 17 HA PHE 17 0.088 -5.818 -3.521 134 HB2 PHE 17 1HB PHE 17 -0.473 -3.906 -2.017 135 HB3 PHE 17 2HB PHE 17 0.868 -4.869 -1.417 136 HD1 PHE 17 2HD PHE 17 3.179 -4.002 -1.537 137 HD2 PHE 17 1HD PHE 17 -0.185 -1.621 -2.657 138 HE1 PHE 17 2HE PHE 17 4.570 -1.965 -1.371 139 HE2 PHE 17 1HE PHE 17 1.202 0.419 -2.495 140 HZ PHE 17 HZ PHE 17 3.580 0.246 -1.852 141 H GLU 18 H GLU 18 -1.822 -4.498 -3.928 142 HA GLU 18 HA GLU 18 -1.378 -2.735 -6.315 143 HB2 GLU 18 1HB GLU 18 -3.802 -4.375 -5.464 144 HB3 GLU 18 2HB GLU 18 -3.785 -3.261 -6.822 145 HG2 GLU 18 1HG GLU 18 -2.015 -4.612 -7.895 146 HG3 GLU 18 2HG GLU 18 -2.077 -5.741 -6.543 147 H LEU 19 H LEU 19 -2.598 -0.864 -6.583 148 HA LEU 19 HA LEU 19 -3.642 0.257 -4.004 149 HB2 LEU 19 1HB LEU 19 -2.406 1.667 -6.405 150 HB3 LEU 19 2HB LEU 19 -3.099 2.482 -4.999 151 HG LEU 19 HG LEU 19 -0.690 0.631 -4.902 152 HD11 LEU 19 1HD1 LEU 19 0.608 2.698 -4.643 153 HD12 LEU 19 1HD2 LEU 19 -0.227 2.640 -6.212 154 HD13 LEU 19 1HD3 LEU 19 -0.867 3.658 -4.901 155 HD21 LEU 19 2HD3 LEU 19 -1.994 0.761 -2.806 156 HD22 LEU 19 2HD1 LEU 19 -0.428 1.593 -2.641 157 HD23 LEU 19 2HD2 LEU 19 -1.920 2.538 -2.869 158 H PHE 20 H PHE 20 -5.533 1.371 -3.947 159 HA PHE 20 HA PHE 20 -7.275 0.967 -6.356 160 HB2 PHE 20 1HB PHE 20 -7.983 0.335 -3.458 161 HB3 PHE 20 2HB PHE 20 -9.074 0.216 -4.830 162 HD1 PHE 20 1HD PHE 20 -6.172 -1.278 -3.149 163 HD2 PHE 20 2HD PHE 20 -8.928 -1.613 -6.397 164 HE1 PHE 20 1HE PHE 20 -5.455 -3.616 -3.514 165 HE2 PHE 20 2HE PHE 20 -8.216 -3.952 -6.763 166 HZ PHE 20 HZ PHE 20 -6.477 -4.953 -5.321 167 HA PRO 21 HA PRO 21 -7.813 5.368 -5.176 168 HB2 PRO 21 1HB PRO 21 -8.754 5.143 -8.058 169 HB3 PRO 21 2HB PRO 21 -7.747 6.399 -7.328 170 HG2 PRO 21 1HG PRO 21 -6.578 4.610 -8.914 171 HG3 PRO 21 2HG PRO 21 -5.776 5.068 -7.408 172 HD2 PRO 21 1HD PRO 21 -7.455 2.597 -8.011 173 HD3 PRO 21 2HD PRO 21 -5.884 2.717 -7.120 174 H ASN 22 H ASN 22 -9.770 2.871 -6.683 175 HA ASN 22 HA ASN 22 -12.300 4.210 -6.335 176 HB2 ASN 22 1HB ASN 22 -11.529 1.295 -6.582 177 HB3 ASN 22 2HB ASN 22 -13.195 1.833 -6.418 178 HD21 ASN 22 2HD2 ASN 22 -12.186 0.419 -8.622 179 HD22 ASN 22 2HD1 ASN 22 -12.286 1.442 -10.016 180 H GLU 23 H GLU 23 -10.245 2.360 -4.177 181 HA GLU 23 HA GLU 23 -12.292 2.315 -2.055 182 HB2 GLU 23 1HB GLU 23 -9.332 1.595 -2.093 183 HB3 GLU 23 2HB GLU 23 -10.358 1.451 -0.674 184 HG2 GLU 23 1HG GLU 23 -11.757 -0.189 -1.806 185 HG3 GLU 23 2HG GLU 23 -10.826 0.004 -3.289 186 H ALA 24 H ALA 24 -9.391 4.173 -2.873 187 HA ALA 24 HA ALA 24 -10.333 6.354 -1.163 188 HB1 ALA 24 3HB ALA 24 -7.712 4.945 -0.545 189 HB2 ALA 24 1HB ALA 24 -8.271 6.468 0.187 190 HB3 ALA 24 2HB ALA 24 -9.163 4.957 0.485 191 HA PRO 25 HA PRO 25 -8.423 7.698 -5.070 192 HB2 PRO 25 1HB PRO 25 -9.995 10.139 -4.118 193 HB3 PRO 25 2HB PRO 25 -9.895 9.469 -5.752 194 HG2 PRO 25 1HG PRO 25 -12.105 9.017 -4.343 195 HG3 PRO 25 2HG PRO 25 -11.400 7.688 -5.268 196 HD2 PRO 25 1HD PRO 25 -11.224 8.259 -2.290 197 HD3 PRO 25 2HD PRO 25 -11.416 6.675 -3.140 198 H VAL 26 H VAL 26 -8.856 10.000 -2.355 199 HA VAL 26 HA VAL 26 -6.477 11.487 -3.142 200 HB VAL 26 HB VAL 26 -8.088 11.441 -0.544 201 HG11 VAL 26 1HG1 VAL 26 -7.009 13.580 -0.046 202 HG12 VAL 26 1HG2 VAL 26 -5.832 12.251 -0.155 203 HG13 VAL 26 1HG3 VAL 26 -5.997 13.408 -1.499 204 HG21 VAL 26 2HG3 VAL 26 -9.390 12.165 -2.515 205 HG22 VAL 26 2HG1 VAL 26 -9.074 13.534 -1.423 206 HG23 VAL 26 2HG2 VAL 26 -8.125 13.351 -2.917 207 H THR 27 H THR 27 -7.097 8.989 -0.716 208 HA THR 27 HA THR 27 -4.583 9.204 0.620 209 HB THR 27 HB THR 27 -6.310 6.724 0.193 210 HG1 THR 27 1HG THR 27 -7.475 8.346 1.242 211 HG21 THR 27 2HG3 THR 27 -4.194 7.374 2.280 212 HG22 THR 27 2HG1 THR 27 -5.203 5.909 2.238 213 HG23 THR 27 2HG2 THR 27 -4.014 6.209 0.948 214 H VAL 28 H VAL 28 -5.555 7.113 -2.104 215 HA VAL 28 HA VAL 28 -2.954 5.910 -2.471 216 HB VAL 28 HB VAL 28 -5.256 6.435 -4.412 217 HG11 VAL 28 1HG1 VAL 28 -4.193 4.789 -5.877 218 HG12 VAL 28 1HG2 VAL 28 -3.171 6.225 -5.635 219 HG13 VAL 28 1HG3 VAL 28 -2.798 4.710 -4.776 220 HG21 VAL 28 2HG3 VAL 28 -5.803 4.921 -2.538 221 HG22 VAL 28 2HG1 VAL 28 -5.718 4.028 -4.074 222 HG23 VAL 28 2HG2 VAL 28 -4.371 3.933 -2.915 223 H ALA 29 H ALA 29 -4.426 8.813 -3.891 224 HA ALA 29 HA ALA 29 -2.270 9.468 -5.607 225 HB1 ALA 29 3HB ALA 29 -4.128 11.326 -4.079 226 HB2 ALA 29 1HB ALA 29 -3.116 11.783 -5.469 227 HB3 ALA 29 2HB ALA 29 -4.442 10.614 -5.678 228 H ASN 30 H ASN 30 -2.806 10.317 -2.187 229 HA ASN 30 HA ASN 30 -0.388 11.875 -1.935 230 HB2 ASN 30 1HB ASN 30 -2.182 10.495 0.070 231 HB3 ASN 30 2HB ASN 30 -0.746 11.394 0.542 232 HD21 ASN 30 2HD2 ASN 30 -3.317 12.062 1.376 233 HD22 ASN 30 2HD1 ASN 30 -3.743 13.595 0.693 234 H PHE 31 H PHE 31 -1.132 8.452 -1.358 235 HA PHE 31 HA PHE 31 1.388 7.672 -0.299 236 HB2 PHE 31 1HB PHE 31 -0.616 6.190 -0.421 237 HB3 PHE 31 2HB PHE 31 -0.455 6.122 -2.169 238 HD1 PHE 31 1HD PHE 31 1.110 5.149 1.029 239 HD2 PHE 31 2HD PHE 31 1.142 4.702 -3.219 240 HE1 PHE 31 1HE PHE 31 2.632 3.213 1.247 241 HE2 PHE 31 2HE PHE 31 2.662 2.763 -3.005 242 HZ PHE 31 HZ PHE 31 3.407 2.020 -0.771 243 H GLU 32 H GLU 32 0.327 7.799 -3.708 244 HA GLU 32 HA GLU 32 2.847 6.972 -4.800 245 HB2 GLU 32 1HB GLU 32 0.571 8.644 -5.937 246 HB3 GLU 32 2HB GLU 32 1.977 8.171 -6.881 247 HG2 GLU 32 1HG GLU 32 1.426 5.786 -6.452 248 HG3 GLU 32 2HG GLU 32 -0.021 6.302 -5.588 249 H LYS 33 H LYS 33 1.527 10.210 -4.126 250 HA LYS 33 HA LYS 33 3.701 11.707 -5.184 251 HB2 LYS 33 1HB LYS 33 1.537 12.698 -4.466 252 HB3 LYS 33 2HB LYS 33 1.933 12.345 -2.789 253 HG2 LYS 33 1HG LYS 33 3.836 13.879 -2.880 254 HG3 LYS 33 2HG LYS 33 3.525 14.192 -4.593 255 HD2 LYS 33 1HD LYS 33 1.314 15.126 -4.041 256 HD3 LYS 33 2HD LYS 33 1.581 14.773 -2.327 257 HE2 LYS 33 1HE LYS 33 3.529 16.294 -2.313 258 HE3 LYS 33 2HE LYS 33 3.277 16.642 -4.026 259 HZ1 LYS 33 3HZ LYS 33 1.366 17.232 -1.866 260 HZ2 LYS 33 1HZ LYS 33 2.327 18.329 -2.636 261 HZ3 LYS 33 2HZ LYS 33 1.130 17.555 -3.466 262 H LEU 34 H LEU 34 3.206 10.489 -1.865 263 HA LEU 34 HA LEU 34 5.667 11.540 -0.840 264 HB2 LEU 34 1HB LEU 34 3.917 9.198 0.001 265 HB3 LEU 34 2HB LEU 34 5.345 9.705 0.909 266 HG LEU 34 HG LEU 34 2.931 11.475 0.381 267 HD11 LEU 34 1HD1 LEU 34 2.367 11.036 2.729 268 HD12 LEU 34 1HD2 LEU 34 2.335 9.546 1.756 269 HD13 LEU 34 1HD3 LEU 34 3.711 9.875 2.835 270 HD21 LEU 34 2HD3 LEU 34 5.061 12.677 0.744 271 HD22 LEU 34 2HD1 LEU 34 3.968 12.875 2.134 272 HD23 LEU 34 2HD2 LEU 34 5.336 11.742 2.233 273 H ALA 35 H ALA 35 4.866 8.375 -2.250 274 HA ALA 35 HA ALA 35 7.430 7.201 -1.872 275 HB1 ALA 35 3HB ALA 35 5.410 6.740 -4.096 276 HB2 ALA 35 1HB ALA 35 6.771 5.669 -3.690 277 HB3 ALA 35 2HB ALA 35 5.447 5.905 -2.525 278 H ASN 36 H ASN 36 6.144 9.184 -4.528 279 HA ASN 36 HA ASN 36 8.516 9.023 -6.163 280 HB2 ASN 36 1HB ASN 36 6.228 10.994 -6.022 281 HB3 ASN 36 2HB ASN 36 7.558 11.166 -7.158 282 HD21 ASN 36 2HD2 ASN 36 4.852 10.825 -7.868 283 HD22 ASN 36 2HD1 ASN 36 4.703 9.321 -8.712 284 H GLU 37 H GLU 37 7.570 11.089 -3.477 285 HA GLU 37 HA GLU 37 9.866 12.879 -3.815 286 HB2 GLU 37 1HB GLU 37 7.887 12.446 -1.539 287 HB3 GLU 37 2HB GLU 37 9.173 13.645 -1.498 288 HG2 GLU 37 1HG GLU 37 8.212 14.803 -3.408 289 HG3 GLU 37 2HG GLU 37 6.973 13.560 -3.573 290 H GLY 38 H GLY 38 9.540 9.719 -2.770 291 HA2 GLY 38 1HA GLY 38 11.255 8.318 -2.020 292 HA3 GLY 38 2HA GLY 38 12.296 9.743 -1.789 293 H PHE 39 H PHE 39 9.124 9.877 -0.429 294 HA PHE 39 HA PHE 39 10.137 10.124 2.271 295 HB2 PHE 39 1HB PHE 39 8.077 11.263 1.583 296 HB3 PHE 39 2HB PHE 39 7.319 9.731 1.181 297 HD1 PHE 39 1HD PHE 39 8.722 11.691 4.011 298 HD2 PHE 39 2HD PHE 39 6.153 8.500 2.795 299 HE1 PHE 39 1HE PHE 39 7.844 11.522 6.316 300 HE2 PHE 39 2HE PHE 39 5.271 8.331 5.099 301 HZ PHE 39 HZ PHE 39 6.118 9.841 6.859 302 H TYR 40 H TYR 40 8.260 7.558 0.640 303 HA TYR 40 HA TYR 40 8.366 5.808 2.961 304 HB2 TYR 40 1HB TYR 40 7.582 5.426 0.058 305 HB3 TYR 40 2HB TYR 40 7.642 4.078 1.186 306 HD1 TYR 40 2HD TYR 40 6.220 4.197 3.300 307 HD2 TYR 40 1HD TYR 40 5.724 6.850 -0.036 308 HE1 TYR 40 2HE TYR 40 3.937 4.742 4.073 309 HE2 TYR 40 1HE TYR 40 3.441 7.395 0.738 310 HH TYR 40 HH TYR 40 1.885 7.030 2.281 311 H ASN 41 H ASN 41 10.497 6.476 0.311 312 HA ASN 41 HA ASN 41 12.044 4.025 0.507 313 HB2 ASN 41 1HB ASN 41 12.050 5.549 -1.470 314 HB3 ASN 41 2HB ASN 41 12.890 6.754 -0.504 315 HD21 ASN 41 2HD2 ASN 41 13.738 5.357 -2.926 316 HD22 ASN 41 2HD1 ASN 41 15.226 4.565 -2.525 317 H GLY 42 H GLY 42 12.759 3.435 2.427 318 HA2 GLY 42 1HA GLY 42 14.618 3.560 3.966 319 HA3 GLY 42 2HA GLY 42 14.598 5.332 3.808 320 H LEU 43 H LEU 43 11.442 4.544 3.922 321 HA LEU 43 HA LEU 43 11.111 5.502 6.632 322 HB2 LEU 43 1HB LEU 43 9.514 5.592 4.512 323 HB3 LEU 43 2HB LEU 43 8.956 4.030 5.121 324 HG LEU 43 HG LEU 43 8.354 5.116 7.281 325 HD11 LEU 43 1HD1 LEU 43 8.331 7.567 7.402 326 HD12 LEU 43 1HD2 LEU 43 9.983 6.934 7.212 327 HD13 LEU 43 1HD3 LEU 43 9.139 7.655 5.820 328 HD21 LEU 43 2HD3 LEU 43 6.697 4.833 5.467 329 HD22 LEU 43 2HD1 LEU 43 6.400 6.333 6.379 330 HD23 LEU 43 2HD2 LEU 43 7.181 6.403 4.780 331 H THR 44 H THR 44 10.275 4.498 8.442 332 HA THR 44 HA THR 44 10.908 1.563 8.510 333 HB THR 44 HB THR 44 11.913 1.867 10.701 334 HG1 THR 44 1HG THR 44 11.286 4.640 10.398 335 HG21 THR 44 2HG3 THR 44 12.942 3.988 8.778 336 HG22 THR 44 2HG1 THR 44 13.847 3.285 10.138 337 HG23 THR 44 2HG2 THR 44 13.383 2.265 8.756 338 H PHE 45 H PHE 45 9.870 0.304 10.107 339 HA PHE 45 HA PHE 45 7.257 1.385 11.019 340 HB2 PHE 45 1HB PHE 45 8.543 -1.370 11.196 341 HB3 PHE 45 2HB PHE 45 6.993 -0.974 11.920 342 HD1 PHE 45 1HD PHE 45 8.743 -0.733 8.620 343 HD2 PHE 45 2HD PHE 45 5.080 -1.401 10.716 344 HE1 PHE 45 1HE PHE 45 7.615 -1.245 6.481 345 HE2 PHE 45 2HE PHE 45 3.948 -1.917 8.579 346 HZ PHE 45 HZ PHE 45 5.217 -1.837 6.461 347 H HIS 46 H HIS 46 6.611 0.668 13.292 348 HA HIS 46 HA HIS 46 8.825 1.095 15.229 349 HB2 HIS 46 1HB HIS 46 7.568 2.908 16.359 350 HB3 HIS 46 2HB HIS 46 8.057 3.374 14.735 351 HD2 HIS 46 2HD HIS 46 5.794 3.569 12.797 352 HE1 HIS 46 1HE HIS 46 2.918 3.426 15.918 353 H ARG 47 H ARG 47 5.610 0.039 14.437 354 HA ARG 47 HA ARG 47 5.697 -1.668 16.879 355 HB2 ARG 47 1HB ARG 47 3.336 0.032 15.988 356 HB3 ARG 47 2HB ARG 47 3.212 -1.288 17.140 357 HG2 ARG 47 1HG ARG 47 4.971 1.141 17.545 358 HG3 ARG 47 2HG ARG 47 3.314 0.969 18.173 359 HD2 ARG 47 1HD ARG 47 4.053 -1.085 19.344 360 HD3 ARG 47 2HD ARG 47 5.715 -0.714 18.834 361 HE ARG 47 HE ARG 47 4.131 0.652 20.870 362 HH11 ARG 47 1HH1 ARG 47 6.973 0.725 18.807 363 HH12 ARG 47 1HH2 ARG 47 7.823 1.882 19.806 364 HH21 ARG 47 2HH1 ARG 47 5.244 2.153 22.159 365 HH22 ARG 47 2HH2 ARG 47 6.845 2.691 21.703 366 H VAL 48 H VAL 48 6.441 -3.188 15.277 367 HA VAL 48 HA VAL 48 4.327 -4.234 13.445 368 HB VAL 48 HB VAL 48 7.166 -5.201 14.041 369 HG11 VAL 48 1HG1 VAL 48 6.902 -6.559 12.022 370 HG12 VAL 48 1HG2 VAL 48 5.719 -6.995 13.278 371 HG13 VAL 48 1HG3 VAL 48 5.213 -6.016 11.879 372 HG21 VAL 48 2HG3 VAL 48 7.129 -2.977 12.965 373 HG22 VAL 48 2HG1 VAL 48 7.716 -4.221 11.836 374 HG23 VAL 48 2HG2 VAL 48 6.051 -3.606 11.696 375 H ILE 49 H ILE 49 3.009 -5.788 13.820 376 HA ILE 49 HA ILE 49 3.542 -7.573 16.177 377 HB ILE 49 HB ILE 49 0.812 -6.460 15.373 378 HG12 ILE 49 1HG1 ILE 49 2.547 -5.581 17.692 379 HG13 ILE 49 1HG2 ILE 49 2.307 -4.666 16.212 380 HG21 ILE 49 2HG1 ILE 49 0.117 -7.383 17.545 381 HG22 ILE 49 2HG2 ILE 49 0.790 -8.653 16.498 382 HG23 ILE 49 2HG3 ILE 49 1.769 -7.984 17.823 383 HD11 ILE 49 1HD3 ILE 49 0.142 -5.444 18.179 384 HD12 ILE 49 1HD1 ILE 49 0.880 -3.836 17.997 385 HD13 ILE 49 1HD2 ILE 49 -0.100 -4.518 16.678 386 HA PRO 50 HA PRO 50 3.123 -10.283 12.576 387 HB2 PRO 50 1HB PRO 50 4.361 -12.037 14.737 388 HB3 PRO 50 2HB PRO 50 4.813 -11.915 13.032 389 HG2 PRO 50 1HG PRO 50 6.384 -10.752 14.836 390 HG3 PRO 50 2HG PRO 50 6.007 -9.879 13.348 391 HD2 PRO 50 1HD PRO 50 4.791 -9.558 16.119 392 HD3 PRO 50 2HD PRO 50 5.279 -8.282 14.933 393 H GLY 51 H GLY 51 1.378 -11.294 12.135 394 HA2 GLY 51 1HA GLY 51 -0.181 -13.064 12.466 395 HA3 GLY 51 2HA GLY 51 0.155 -13.023 14.212 396 H PHE 52 H PHE 52 -0.066 -9.883 13.526 397 HA PHE 52 HA PHE 52 -3.057 -9.777 13.678 398 HB2 PHE 52 1HB PHE 52 -1.050 -8.280 15.414 399 HB3 PHE 52 2HB PHE 52 -2.759 -7.884 15.321 400 HD1 PHE 52 1HD PHE 52 -0.292 -10.330 16.502 401 HD2 PHE 52 2HD PHE 52 -4.433 -9.286 16.355 402 HE1 PHE 52 1HE PHE 52 -0.769 -11.982 18.278 403 HE2 PHE 52 2HE PHE 52 -4.913 -10.936 18.134 404 HZ PHE 52 HZ PHE 52 -3.079 -12.285 19.094 405 H VAL 53 H VAL 53 -0.780 -7.114 13.992 406 HA VAL 53 HA VAL 53 -1.057 -6.240 11.203 407 HB VAL 53 HB VAL 53 -3.310 -5.632 12.164 408 HG11 VAL 53 1HG1 VAL 53 -3.443 -3.917 13.904 409 HG12 VAL 53 1HG2 VAL 53 -2.659 -5.403 14.492 410 HG13 VAL 53 1HG3 VAL 53 -1.674 -3.974 14.094 411 HG21 VAL 53 2HG3 VAL 53 -2.272 -4.251 10.400 412 HG22 VAL 53 2HG1 VAL 53 -3.210 -3.244 11.527 413 HG23 VAL 53 2HG2 VAL 53 -1.435 -3.289 11.641 414 H SER 54 H SER 54 0.508 -4.999 10.594 415 HA SER 54 HA SER 54 2.489 -4.096 12.675 416 HB2 SER 54 1HB SER 54 3.953 -3.798 10.775 417 HB3 SER 54 2HB SER 54 3.463 -5.449 11.122 418 HG SER 54 HG SER 54 2.429 -5.550 9.339 419 H GLN 55 H GLN 55 2.738 -2.007 13.144 420 HA GLN 55 HA GLN 55 1.505 0.018 11.307 421 HB2 GLN 55 1HB GLN 55 0.510 -0.132 13.624 422 HB3 GLN 55 2HB GLN 55 2.087 0.274 14.287 423 HG2 GLN 55 1HG GLN 55 2.033 2.432 13.107 424 HG3 GLN 55 2HG GLN 55 0.418 2.019 12.465 425 HE21 GLN 55 2HE2 GLN 55 0.250 4.251 13.675 426 HE22 GLN 55 2HE1 GLN 55 -0.331 4.139 15.304 427 H GLY 56 H GLY 56 2.718 1.441 10.341 428 HA2 GLY 56 1HA GLY 56 5.404 2.053 11.447 429 HA3 GLY 56 2HA GLY 56 5.306 1.383 9.801 430 H GLY 57 H GLY 57 6.483 3.619 9.645 431 HA2 GLY 57 1HA GLY 57 5.752 5.281 7.896 432 HA3 GLY 57 2HA GLY 57 4.388 5.652 8.976 433 H CYS 58 H CYS 58 7.690 4.977 10.040 434 HA CYS 58 HA CYS 58 7.939 7.842 11.016 435 HB2 CYS 58 1HB CYS 58 8.824 5.359 12.406 436 HB3 CYS 58 2HB CYS 58 9.139 7.018 12.895 437 HG CYS 58 HG CYS 58 6.169 5.735 12.364 438 HA PRO 59 HA PRO 59 11.807 7.752 8.872 439 HB2 PRO 59 1HB PRO 59 13.029 9.883 10.062 440 HB3 PRO 59 2HB PRO 59 11.588 10.145 9.073 441 HG2 PRO 59 1HG PRO 59 11.808 9.909 12.105 442 HG3 PRO 59 2HG PRO 59 10.955 11.135 11.163 443 HD2 PRO 59 1HD PRO 59 9.653 8.975 12.216 444 HD3 PRO 59 2HD PRO 59 9.163 9.705 10.635 445 H ARG 60 H ARG 60 11.615 7.377 12.317 446 HA ARG 60 HA ARG 60 14.245 5.964 12.234 447 HB2 ARG 60 1HB ARG 60 13.380 7.968 14.355 448 HB3 ARG 60 2HB ARG 60 14.817 6.961 14.434 449 HG2 ARG 60 1HG ARG 60 14.326 9.008 12.260 450 HG3 ARG 60 2HG ARG 60 15.228 9.326 13.761 451 HD2 ARG 60 1HD ARG 60 16.771 7.511 13.175 452 HD3 ARG 60 2HD ARG 60 15.899 7.303 11.638 453 HE ARG 60 HE ARG 60 17.708 9.478 12.383 454 HH11 ARG 60 1HH1 ARG 60 15.302 8.270 10.126 455 HH12 ARG 60 1HH2 ARG 60 15.794 9.341 8.833 456 HH21 ARG 60 2HH1 ARG 60 18.339 10.861 10.697 457 HH22 ARG 60 2HH2 ARG 60 17.514 10.808 9.156 458 H GLY 61 H GLY 61 11.041 5.751 12.761 459 HA2 GLY 61 1HA GLY 61 9.781 4.074 13.764 460 HA3 GLY 61 2HA GLY 61 11.289 3.322 14.337 461 H ASN 62 H ASN 62 10.377 6.678 14.942 462 HA ASN 62 HA ASN 62 10.560 6.104 17.862 463 HB2 ASN 62 1HB ASN 62 10.883 8.486 18.126 464 HB3 ASN 62 2HB ASN 62 12.010 7.863 16.928 465 HD21 ASN 62 2HD2 ASN 62 11.765 10.429 16.804 466 HD22 ASN 62 2HD1 ASN 62 10.741 10.954 15.509 467 H GLY 63 H GLY 63 8.182 6.069 15.660 468 HA2 GLY 63 1HA GLY 63 5.910 5.779 16.179 469 HA3 GLY 63 2HA GLY 63 6.197 6.474 17.791 470 H THR 64 H THR 64 7.654 8.431 15.515 471 HA THR 64 HA THR 64 5.208 10.145 15.224 472 HB THR 64 HB THR 64 8.056 11.075 15.800 473 HG1 THR 64 1HG THR 64 7.058 11.796 17.767 474 HG21 THR 64 2HG3 THR 64 5.462 12.628 15.457 475 HG22 THR 64 2HG1 THR 64 7.038 13.316 15.913 476 HG23 THR 64 2HG2 THR 64 6.814 12.595 14.300 477 H GLY 65 H GLY 65 4.715 10.819 13.290 478 HA2 GLY 65 1HA GLY 65 6.231 9.819 11.030 479 HA3 GLY 65 2HA GLY 65 4.771 10.833 10.968 480 H ASP 66 H ASP 66 7.017 11.127 9.255 481 HA ASP 66 HA ASP 66 8.273 13.658 10.262 482 HB2 ASP 66 1HB ASP 66 9.665 11.513 9.539 483 HB3 ASP 66 2HB ASP 66 9.319 12.081 7.911 484 H ALA 67 H ALA 67 5.780 12.657 8.415 485 HA ALA 67 HA ALA 67 6.230 14.323 6.065 486 HB1 ALA 67 3HB ALA 67 3.703 13.004 7.119 487 HB2 ALA 67 1HB ALA 67 3.890 13.758 5.518 488 HB3 ALA 67 2HB ALA 67 4.833 12.306 5.936 489 H GLY 68 H GLY 68 4.061 14.534 8.902 490 HA2 GLY 68 1HA GLY 68 3.236 16.423 9.980 491 HA3 GLY 68 2HA GLY 68 4.300 17.428 8.969 492 H TYR 69 H TYR 69 2.256 15.166 7.343 493 HA TYR 69 HA TYR 69 0.699 17.470 6.245 494 HB2 TYR 69 1HB TYR 69 1.122 14.663 5.145 495 HB3 TYR 69 2HB TYR 69 0.214 15.947 4.358 496 HD1 TYR 69 1HD TYR 69 2.260 18.157 5.311 497 HD2 TYR 69 2HD TYR 69 2.622 14.400 3.271 498 HE1 TYR 69 1HE TYR 69 4.329 18.951 4.217 499 HE2 TYR 69 2HE TYR 69 4.692 15.193 2.177 500 HH TYR 69 HH TYR 69 6.128 16.864 1.950 501 H THR 70 H THR 70 -1.530 17.175 5.694 502 HA THR 70 HA THR 70 -2.915 15.439 7.712 503 HB THR 70 HB THR 70 -3.851 18.033 6.404 504 HG1 THR 70 1HG THR 70 -3.664 18.789 8.589 505 HG21 THR 70 2HG3 THR 70 -5.156 16.270 8.513 506 HG22 THR 70 2HG1 THR 70 -5.768 17.839 7.940 507 HG23 THR 70 2HG2 THR 70 -5.700 16.451 6.829 508 H ILE 71 H ILE 71 -3.866 13.728 6.986 509 HA ILE 71 HA ILE 71 -4.918 13.753 4.169 510 HB ILE 71 HB ILE 71 -4.163 11.417 5.997 511 HG12 ILE 71 1HG1 ILE 71 -2.840 12.355 3.442 512 HG13 ILE 71 1HG2 ILE 71 -2.247 12.707 5.057 513 HG21 ILE 71 2HG1 ILE 71 -4.632 10.012 4.030 514 HG22 ILE 71 2HG2 ILE 71 -6.086 10.896 4.544 515 HG23 ILE 71 2HG3 ILE 71 -5.165 11.448 3.126 516 HD11 ILE 71 1HD3 ILE 71 -2.582 9.947 3.861 517 HD12 ILE 71 1HD1 ILE 71 -1.053 10.831 4.074 518 HD13 ILE 71 1HD2 ILE 71 -1.982 10.304 5.498 519 HA PRO 72 HA PRO 72 -8.930 13.758 5.943 520 HB2 PRO 72 1HB PRO 72 -10.303 13.619 3.578 521 HB3 PRO 72 2HB PRO 72 -9.458 15.107 4.021 522 HG2 PRO 72 1HG PRO 72 -8.526 12.856 2.187 523 HG3 PRO 72 2HG PRO 72 -8.505 14.594 1.879 524 HD2 PRO 72 1HD PRO 72 -6.282 13.294 2.758 525 HD3 PRO 72 2HD PRO 72 -6.659 14.979 3.298 526 H CYS 73 H CYS 73 -10.366 12.324 6.567 527 HA CYS 73 HA CYS 73 -9.890 9.465 6.109 528 HB2 CYS 73 1HB CYS 73 -10.654 10.243 8.210 529 HB3 CYS 73 2HB CYS 73 -12.124 10.877 7.484 530 HG CYS 73 HG CYS 73 -12.675 8.759 8.808 531 H GLU 74 H GLU 74 -10.531 8.371 4.365 532 HA GLU 74 HA GLU 74 -12.872 9.409 2.802 533 HB2 GLU 74 1HB GLU 74 -10.500 7.693 1.955 534 HB3 GLU 74 2HB GLU 74 -11.885 8.041 0.929 535 HG2 GLU 74 1HG GLU 74 -11.360 10.464 1.095 536 HG3 GLU 74 2HG GLU 74 -9.928 10.061 2.042 537 H THR 75 H THR 75 -14.580 8.195 2.363 538 HA THR 75 HA THR 75 -14.536 5.369 3.375 539 HB THR 75 HB THR 75 -16.905 5.640 4.008 540 HG1 THR 75 1HG THR 75 -17.792 7.782 3.941 541 HG21 THR 75 2HG3 THR 75 -15.138 7.822 5.180 542 HG22 THR 75 2HG1 THR 75 -16.606 7.153 5.929 543 HG23 THR 75 2HG2 THR 75 -15.173 6.123 5.703 544 H ASP 76 H ASP 76 -14.960 7.437 0.744 545 HA ASP 76 HA ASP 76 -16.576 5.365 -0.706 546 HB2 ASP 76 1HB ASP 76 -16.201 8.341 -1.252 547 HB3 ASP 76 2HB ASP 76 -17.043 7.236 -2.329 548 H ASN 77 H ASN 77 -14.339 4.816 -3.305 549 HA ASN 77 HA ASN 77 -17.155 5.218 -2.384 550 HB2 ASN 77 1HB ASN 77 -15.988 4.096 -4.943 551 HB3 ASN 77 2HB ASN 77 -17.700 4.046 -4.543 552 HD21 ASN 77 2HD2 ASN 77 -15.276 5.798 -6.023 553 HD22 ASN 77 2HD1 ASN 77 -16.092 7.319 -6.167 554 H ASN 78 H ASN 78 -14.648 2.784 -2.781 555 HA ASN 78 HA ASN 78 -16.487 0.574 -2.159 556 HB2 ASN 78 1HB ASN 78 -13.489 0.750 -2.528 557 HB3 ASN 78 2HB ASN 78 -14.318 -0.733 -2.075 558 HD21 ASN 78 2HD2 ASN 78 -12.801 -0.435 -4.405 559 HD22 ASN 78 2HD1 ASN 78 -13.858 -0.574 -5.771 560 HA PRO 79 HA PRO 79 -16.106 0.660 2.207 561 HB2 PRO 79 1HB PRO 79 -16.545 -2.003 2.744 562 HB3 PRO 79 2HB PRO 79 -17.863 -0.974 2.167 563 HG2 PRO 79 1HG PRO 79 -16.078 -2.866 0.576 564 HG3 PRO 79 2HG PRO 79 -17.838 -2.732 0.535 565 HD2 PRO 79 1HD PRO 79 -16.313 -1.506 -1.342 566 HD3 PRO 79 2HD PRO 79 -17.810 -0.716 -0.702 567 H HIS 80 H HIS 80 -14.896 -0.177 3.979 568 HA HIS 80 HA HIS 80 -12.144 -0.879 3.023 569 HB2 HIS 80 1HB HIS 80 -13.026 0.592 5.545 570 HB3 HIS 80 2HB HIS 80 -11.363 0.220 5.112 571 HD2 HIS 80 2HD HIS 80 -13.725 3.107 4.804 572 HE1 HIS 80 1HE HIS 80 -10.947 3.584 1.607 573 H ARG 81 H ARG 81 -11.579 -2.874 3.311 574 HA ARG 81 HA ARG 81 -12.495 -4.254 5.814 575 HB2 ARG 81 1HB ARG 81 -11.561 -5.464 3.182 576 HB3 ARG 81 2HB ARG 81 -12.083 -6.361 4.600 577 HG2 ARG 81 1HG ARG 81 -13.832 -4.511 2.958 578 HG3 ARG 81 2HG ARG 81 -13.807 -6.290 2.869 579 HD2 ARG 81 1HD ARG 81 -14.590 -4.586 5.220 580 HD3 ARG 81 2HD ARG 81 -15.645 -5.603 4.211 581 HE ARG 81 HE ARG 81 -13.869 -6.458 6.353 582 HH11 ARG 81 1HH1 ARG 81 -15.714 -7.425 3.524 583 HH12 ARG 81 1HH2 ARG 81 -15.817 -9.102 4.009 584 HH21 ARG 81 2HH1 ARG 81 -14.010 -8.638 6.972 585 HH22 ARG 81 2HH2 ARG 81 -14.853 -9.790 5.961 586 H HIS 82 H HIS 82 -11.095 -5.152 7.173 587 HA HIS 82 HA HIS 82 -8.188 -4.820 6.504 588 HB2 HIS 82 1HB HIS 82 -9.680 -4.545 9.140 589 HB3 HIS 82 2HB HIS 82 -7.940 -4.794 9.070 590 HD2 HIS 82 2HD HIS 82 -6.499 -2.487 8.809 591 HE1 HIS 82 1HE HIS 82 -9.707 0.047 7.608 592 H VAL 83 H VAL 83 -7.930 -6.813 5.573 593 HA VAL 83 HA VAL 83 -7.927 -9.085 7.546 594 HB VAL 83 HB VAL 83 -8.636 -10.594 5.731 595 HG11 VAL 83 1HG1 VAL 83 -10.976 -9.912 5.526 596 HG12 VAL 83 1HG2 VAL 83 -10.361 -9.690 7.181 597 HG13 VAL 83 1HG3 VAL 83 -10.552 -8.284 6.106 598 HG21 VAL 83 2HG3 VAL 83 -7.732 -9.285 3.841 599 HG22 VAL 83 2HG1 VAL 83 -9.450 -9.669 3.585 600 HG23 VAL 83 2HG2 VAL 83 -8.973 -8.036 4.110 601 H THR 84 H THR 84 -6.729 -11.001 6.492 602 HA THR 84 HA THR 84 -4.007 -10.418 6.440 603 HB THR 84 HB THR 84 -5.427 -12.629 4.889 604 HG1 THR 84 1HG THR 84 -4.260 -12.619 7.498 605 HG21 THR 84 2HG3 THR 84 -2.547 -12.379 5.838 606 HG22 THR 84 2HG1 THR 84 -3.267 -13.803 5.051 607 HG23 THR 84 2HG2 THR 84 -3.096 -12.279 4.149 608 H GLY 85 H GLY 85 -3.015 -8.934 5.321 609 HA2 GLY 85 1HA GLY 85 -1.850 -8.273 3.384 610 HA3 GLY 85 2HA GLY 85 -2.920 -9.297 2.398 611 H ALA 86 H ALA 86 -3.334 -6.524 4.644 612 HA ALA 86 HA ALA 86 -4.547 -5.003 2.394 613 HB1 ALA 86 3HB ALA 86 -5.756 -5.262 5.171 614 HB2 ALA 86 1HB ALA 86 -6.335 -4.181 3.883 615 HB3 ALA 86 2HB ALA 86 -6.423 -5.946 3.670 616 H MET 87 H MET 87 -4.423 -2.758 2.543 617 HA MET 87 HA MET 87 -2.506 -1.759 4.621 618 HB2 MET 87 1HB MET 87 -2.429 -1.127 1.649 619 HB3 MET 87 2HB MET 87 -1.368 -0.456 2.879 620 HG2 MET 87 1HG MET 87 -0.422 -2.681 3.303 621 HG3 MET 87 2HG MET 87 -1.516 -3.386 2.111 622 HE1 MET 87 3HE MET 87 1.618 -1.145 2.745 623 HE2 MET 87 1HE MET 87 1.941 -0.473 1.129 624 HE3 MET 87 2HE MET 87 0.492 0.036 2.031 625 H SER 88 H SER 88 -3.270 -0.166 5.736 626 HA SER 88 HA SER 88 -5.154 1.809 4.417 627 HB2 SER 88 1HB SER 88 -6.543 1.863 6.244 628 HB3 SER 88 2HB SER 88 -6.438 0.211 5.654 629 HG SER 88 HG SER 88 -4.992 1.307 7.808 630 H MET 89 H MET 89 -5.186 3.869 5.446 631 HA MET 89 HA MET 89 -2.629 4.542 6.826 632 HB2 MET 89 1HB MET 89 -4.746 6.329 5.576 633 HB3 MET 89 2HB MET 89 -3.235 6.876 6.288 634 HG2 MET 89 1HG MET 89 -3.519 5.117 3.836 635 HG3 MET 89 2HG MET 89 -3.095 6.830 3.858 636 HE1 MET 89 3HE MET 89 -1.103 7.171 6.228 637 HE2 MET 89 1HE MET 89 0.457 6.862 5.428 638 HE3 MET 89 2HE MET 89 -0.801 7.803 4.590 639 H ALA 90 H ALA 90 -2.486 5.541 8.757 640 HA ALA 90 HA ALA 90 -4.716 4.992 10.568 641 HB1 ALA 90 3HB ALA 90 -2.013 6.289 11.063 642 HB2 ALA 90 1HB ALA 90 -3.168 5.785 12.318 643 HB3 ALA 90 2HB ALA 90 -2.400 4.566 11.272 644 H HIS 91 H HIS 91 -6.093 6.352 11.512 645 HA HIS 91 HA HIS 91 -5.581 9.252 11.486 646 HB2 HIS 91 1HB HIS 91 -7.538 9.893 10.285 647 HB3 HIS 91 2HB HIS 91 -6.737 8.704 9.269 648 HD2 HIS 91 2HD HIS 91 -8.179 6.355 8.808 649 HE1 HIS 91 1HE HIS 91 -11.595 7.479 11.096 650 H ARG 92 H ARG 92 -7.395 10.451 12.567 651 HA ARG 92 HA ARG 92 -8.809 8.726 14.563 652 HB2 ARG 92 1HB ARG 92 -7.343 11.325 15.165 653 HB3 ARG 92 2HB ARG 92 -8.323 10.413 16.303 654 HG2 ARG 92 1HG ARG 92 -5.830 9.315 14.984 655 HG3 ARG 92 2HG ARG 92 -5.863 10.120 16.572 656 HD2 ARG 92 1HD ARG 92 -7.484 8.439 17.341 657 HD3 ARG 92 2HD ARG 92 -7.313 7.606 15.778 658 HE ARG 92 HE ARG 92 -5.362 7.724 17.962 659 HH11 ARG 92 1HH1 ARG 92 -6.053 6.832 14.635 660 HH12 ARG 92 1HH2 ARG 92 -4.711 5.717 14.523 661 HH21 ARG 92 2HH1 ARG 92 -3.622 6.273 17.804 662 HH22 ARG 92 2HH2 ARG 92 -3.334 5.399 16.317 663 H GLY 93 H GLY 93 -9.832 9.781 12.144 664 HA2 GLY 93 1HA GLY 93 -12.253 10.616 12.331 665 HA3 GLY 93 2HA GLY 93 -11.532 12.040 13.116 666 H ARG 94 H ARG 94 -12.793 13.017 11.241 667 HA ARG 94 HA ARG 94 -11.663 12.758 8.566 668 HB2 ARG 94 1HB ARG 94 -14.030 13.461 9.038 669 HB3 ARG 94 2HB ARG 94 -13.418 14.953 9.736 670 HG2 ARG 94 1HG ARG 94 -12.552 15.678 7.611 671 HG3 ARG 94 2HG ARG 94 -12.935 14.105 6.870 672 HD2 ARG 94 1HD ARG 94 -15.302 14.496 7.304 673 HD3 ARG 94 2HD ARG 94 -14.901 16.084 7.998 674 HE ARG 94 HE ARG 94 -14.898 15.316 5.178 675 HH11 ARG 94 1HH1 ARG 94 -13.952 17.683 7.595 676 HH12 ARG 94 1HH2 ARG 94 -13.787 18.984 6.438 677 HH21 ARG 94 2HH1 ARG 94 -14.680 17.013 3.684 678 HH22 ARG 94 2HH2 ARG 94 -14.199 18.606 4.224 679 H ASP 95 H ASP 95 -10.041 13.730 7.643 680 HA ASP 95 HA ASP 95 -8.195 15.115 7.367 681 HB2 ASP 95 1HB ASP 95 -9.990 17.015 8.933 682 HB3 ASP 95 2HB ASP 95 -8.454 17.489 8.221 683 H THR 96 H THR 96 -8.089 13.231 9.442 684 HA THR 96 HA THR 96 -6.083 14.651 11.157 685 HB THR 96 HB THR 96 -6.663 13.142 13.029 686 HG1 THR 96 1HG THR 96 -8.519 12.166 11.125 687 HG21 THR 96 2HG3 THR 96 -9.076 14.633 11.927 688 HG22 THR 96 2HG1 THR 96 -8.843 14.130 13.617 689 HG23 THR 96 2HG2 THR 96 -7.766 15.349 12.894 690 H GLY 97 H GLY 97 -6.448 12.602 8.697 691 HA2 GLY 97 1HA GLY 97 -5.024 10.259 9.532 692 HA3 GLY 97 2HA GLY 97 -5.258 10.807 7.856 693 H SER 98 H SER 98 -2.903 9.724 9.518 694 HA SER 98 HA SER 98 -0.911 11.955 9.025 695 HB2 SER 98 1HB SER 98 0.424 11.118 10.632 696 HB3 SER 98 2HB SER 98 -1.193 11.141 11.318 697 HG SER 98 HG SER 98 -1.369 8.956 10.831 698 H CYS 99 H CYS 99 1.351 10.836 8.734 699 HA CYS 99 HA CYS 99 1.315 9.297 6.214 700 HB2 CYS 99 1HB CYS 99 3.658 9.434 6.288 701 HB3 CYS 99 2HB CYS 99 2.913 11.010 6.513 702 HG CYS 99 HG CYS 99 3.165 11.059 9.099 703 H GLN 100 H GLN 100 1.091 8.512 9.535 704 HA GLN 100 HA GLN 100 2.473 5.933 9.362 705 HB2 GLN 100 1HB GLN 100 0.523 7.084 11.403 706 HB3 GLN 100 2HB GLN 100 1.317 5.524 11.566 707 HG2 GLN 100 1HG GLN 100 3.507 6.628 11.582 708 HG3 GLN 100 2HG GLN 100 2.698 8.212 11.420 709 HE21 GLN 100 2HE2 GLN 100 4.256 8.182 13.486 710 HE22 GLN 100 2HE1 GLN 100 3.415 7.917 14.977 711 H PHE 101 H PHE 101 1.545 3.877 9.411 712 HA PHE 101 HA PHE 101 -1.187 3.678 8.266 713 HB2 PHE 101 1HB PHE 101 -0.368 2.500 6.264 714 HB3 PHE 101 2HB PHE 101 0.234 4.150 6.304 715 HD1 PHE 101 1HD PHE 101 1.125 0.608 6.617 716 HD2 PHE 101 2HD PHE 101 2.584 4.622 6.643 717 HE1 PHE 101 1HE PHE 101 3.437 -0.233 6.373 718 HE2 PHE 101 2HE PHE 101 4.897 3.787 6.396 719 HZ PHE 101 HZ PHE 101 5.324 1.357 6.263 720 H PHE 102 H PHE 102 -1.995 1.558 8.104 721 HA PHE 102 HA PHE 102 -0.462 -0.435 9.744 722 HB2 PHE 102 1HB PHE 102 -3.454 -0.160 9.227 723 HB3 PHE 102 2HB PHE 102 -2.715 -1.521 10.057 724 HD1 PHE 102 2HD PHE 102 -1.706 -1.236 12.279 725 HD2 PHE 102 1HD PHE 102 -3.713 1.975 10.300 726 HE1 PHE 102 2HE PHE 102 -1.856 -0.012 14.422 727 HE2 PHE 102 1HE PHE 102 -3.863 3.202 12.440 728 HZ PHE 102 HZ PHE 102 -2.933 2.209 14.501 729 H ILE 103 H ILE 103 0.176 -2.286 8.895 730 HA ILE 103 HA ILE 103 -1.244 -3.235 6.416 731 HB ILE 103 HB ILE 103 1.589 -3.879 7.378 732 HG12 ILE 103 1HG1 ILE 103 0.670 -2.232 5.011 733 HG13 ILE 103 1HG2 ILE 103 1.398 -1.602 6.481 734 HG21 ILE 103 2HG1 ILE 103 1.784 -5.091 5.246 735 HG22 ILE 103 2HG2 ILE 103 0.487 -5.774 6.253 736 HG23 ILE 103 2HG3 ILE 103 0.083 -4.722 4.876 737 HD11 ILE 103 1HD3 ILE 103 2.727 -3.479 4.514 738 HD12 ILE 103 1HD1 ILE 103 3.028 -1.734 4.682 739 HD13 ILE 103 1HD2 ILE 103 3.464 -2.844 6.005 740 H VAL 104 H VAL 104 -2.542 -4.840 6.621 741 HA VAL 104 HA VAL 104 -2.726 -6.029 9.345 742 HB VAL 104 HB VAL 104 -4.565 -6.263 6.914 743 HG11 VAL 104 1HG1 VAL 104 -6.230 -7.042 8.528 744 HG12 VAL 104 1HG2 VAL 104 -4.808 -8.110 8.469 745 HG13 VAL 104 1HG3 VAL 104 -5.010 -6.971 9.821 746 HG21 VAL 104 2HG3 VAL 104 -4.382 -3.931 7.712 747 HG22 VAL 104 2HG1 VAL 104 -5.981 -4.612 8.095 748 HG23 VAL 104 2HG2 VAL 104 -4.746 -4.466 9.369 749 H HIS 105 H HIS 105 -2.267 -7.967 9.939 750 HA HIS 105 HA HIS 105 -1.197 -9.807 7.850 751 HB2 HIS 105 1HB HIS 105 -0.984 -10.002 10.884 752 HB3 HIS 105 2HB HIS 105 -0.127 -10.985 9.706 753 HD2 HIS 105 2HD HIS 105 0.450 -7.668 8.095 754 HE1 HIS 105 1HE HIS 105 3.255 -7.825 11.282 755 H GLU 106 H GLU 106 -3.549 -9.680 10.506 756 HA GLU 106 HA GLU 106 -5.033 -11.836 9.062 757 HB2 GLU 106 1HB GLU 106 -4.496 -11.690 12.057 758 HB3 GLU 106 2HB GLU 106 -5.741 -12.702 11.341 759 HG2 GLU 106 1HG GLU 106 -3.982 -13.877 10.031 760 HG3 GLU 106 2HG GLU 106 -2.763 -12.909 10.857 761 HA PRO 107 HA PRO 107 -8.640 -9.416 9.248 762 HB2 PRO 107 1HB PRO 107 -9.851 -11.780 10.765 763 HB3 PRO 107 2HB PRO 107 -10.521 -10.910 9.380 764 HG2 PRO 107 1HG PRO 107 -9.429 -13.296 8.953 765 HG3 PRO 107 2HG PRO 107 -9.072 -11.986 7.824 766 HD2 PRO 107 1HD PRO 107 -7.362 -13.102 10.071 767 HD3 PRO 107 2HD PRO 107 -6.864 -12.534 8.426 768 H GLN 108 H GLN 108 -9.039 -7.791 10.449 769 HA GLN 108 HA GLN 108 -9.239 -8.211 13.404 770 HB2 GLN 108 1HB GLN 108 -7.672 -6.037 11.955 771 HB3 GLN 108 2HB GLN 108 -8.100 -5.955 13.658 772 HG2 GLN 108 1HG GLN 108 -6.442 -8.157 12.413 773 HG3 GLN 108 2HG GLN 108 -5.791 -6.722 13.253 774 HE21 GLN 108 2HE2 GLN 108 -6.054 -9.852 13.692 775 HE22 GLN 108 2HE1 GLN 108 -6.442 -9.946 15.378 776 HA PRO 109 HA PRO 109 -13.113 -6.213 12.025 777 HB2 PRO 109 1HB PRO 109 -13.662 -7.253 14.839 778 HB3 PRO 109 2HB PRO 109 -14.709 -7.333 13.418 779 HG2 PRO 109 1HG PRO 109 -13.458 -9.552 14.184 780 HG3 PRO 109 2HG PRO 109 -13.514 -9.157 12.463 781 HD2 PRO 109 1HD PRO 109 -11.243 -8.764 14.448 782 HD3 PRO 109 2HD PRO 109 -11.174 -9.342 12.735 783 H HIS 110 H HIS 110 -11.146 -5.999 14.930 784 HA HIS 110 HA HIS 110 -12.313 -3.660 16.048 785 HB2 HIS 110 1HB HIS 110 -10.598 -4.981 17.230 786 HB3 HIS 110 2HB HIS 110 -9.402 -4.567 16.011 787 HD2 HIS 110 2HD HIS 110 -7.896 -2.243 16.671 788 HE1 HIS 110 1HE HIS 110 -10.623 -0.812 19.599 789 H LEU 111 H LEU 111 -9.959 -4.028 13.431 790 HA LEU 111 HA LEU 111 -9.888 -1.058 13.138 791 HB2 LEU 111 1HB LEU 111 -8.208 -3.246 11.844 792 HB3 LEU 111 2HB LEU 111 -7.992 -1.511 11.597 793 HG LEU 111 HG LEU 111 -7.596 -2.981 14.228 794 HD11 LEU 111 1HD1 LEU 111 -5.217 -2.517 13.835 795 HD12 LEU 111 1HD2 LEU 111 -5.907 -3.545 12.557 796 HD13 LEU 111 1HD3 LEU 111 -5.617 -1.816 12.249 797 HD21 LEU 111 2HD3 LEU 111 -8.374 -0.651 14.503 798 HD22 LEU 111 2HD1 LEU 111 -6.668 -0.817 14.979 799 HD23 LEU 111 2HD2 LEU 111 -7.087 -0.092 13.409 800 H ASP 112 H ASP 112 -11.306 -3.863 11.792 801 HA ASP 112 HA ASP 112 -11.462 -3.075 9.041 802 HB2 ASP 112 1HB ASP 112 -11.990 -5.374 10.049 803 HB3 ASP 112 2HB ASP 112 -13.527 -4.701 10.574 804 H GLY 113 H GLY 113 -12.351 -1.401 8.160 805 HA2 GLY 113 1HA GLY 113 -14.169 -0.060 7.519 806 HA3 GLY 113 2HA GLY 113 -15.113 -0.701 8.884 807 H VAL 114 H VAL 114 -12.091 0.164 10.001 808 HA VAL 114 HA VAL 114 -13.161 2.734 11.121 809 HB VAL 114 HB VAL 114 -10.729 1.043 11.880 810 HG11 VAL 114 1HG1 VAL 114 -10.614 2.471 13.863 811 HG12 VAL 114 1HG2 VAL 114 -10.397 3.400 12.361 812 HG13 VAL 114 1HG3 VAL 114 -11.950 3.460 13.228 813 HG21 VAL 114 2HG3 VAL 114 -12.868 -0.081 12.393 814 HG22 VAL 114 2HG1 VAL 114 -12.057 0.452 13.884 815 HG23 VAL 114 2HG2 VAL 114 -13.435 1.377 13.240 816 H HIS 115 H HIS 115 -10.225 1.454 9.559 817 HA HIS 115 HA HIS 115 -9.406 4.289 9.076 818 HB2 HIS 115 1HB HIS 115 -7.817 1.689 8.946 819 HB3 HIS 115 2HB HIS 115 -7.171 3.276 8.555 820 HD2 HIS 115 2HD HIS 115 -7.827 1.057 11.639 821 HE1 HIS 115 1HE HIS 115 -6.541 4.868 13.050 822 H THR 116 H THR 116 -8.558 4.928 7.067 823 HA THR 116 HA THR 116 -10.165 3.894 4.849 824 HB THR 116 HB THR 116 -8.014 6.053 4.978 825 HG1 THR 116 1HG THR 116 -10.869 6.127 4.866 826 HG21 THR 116 2HG3 THR 116 -9.923 5.309 2.729 827 HG22 THR 116 2HG1 THR 116 -8.825 6.708 2.746 828 HG23 THR 116 2HG2 THR 116 -8.163 5.056 2.722 829 H VAL 117 H VAL 117 -9.693 2.041 3.959 830 HA VAL 117 HA VAL 117 -6.901 1.160 3.554 831 HB VAL 117 HB VAL 117 -9.559 0.074 2.503 832 HG11 VAL 117 1HG1 VAL 117 -8.301 -1.964 2.005 833 HG12 VAL 117 1HG2 VAL 117 -7.694 -0.565 1.088 834 HG13 VAL 117 1HG3 VAL 117 -6.796 -1.157 2.506 835 HG21 VAL 117 2HG3 VAL 117 -9.388 -0.013 4.967 836 HG22 VAL 117 2HG1 VAL 117 -9.278 -1.643 4.263 837 HG23 VAL 117 2HG2 VAL 117 -7.807 -0.818 4.831 838 H PHE 118 H PHE 118 -5.695 1.150 1.809 839 HA PHE 118 HA PHE 118 -6.774 2.606 -0.576 840 HB2 PHE 118 1HB PHE 118 -4.845 4.036 -0.655 841 HB3 PHE 118 2HB PHE 118 -5.506 4.168 0.967 842 HD1 PHE 118 2HD PHE 118 -4.351 3.153 2.879 843 HD2 PHE 118 1HD PHE 118 -2.696 3.034 -1.058 844 HE1 PHE 118 2HE PHE 118 -2.145 2.563 3.827 845 HE2 PHE 118 1HE PHE 118 -0.489 2.442 -0.115 846 HZ PHE 118 HZ PHE 118 -0.214 2.206 2.329 847 H GLY 119 H GLY 119 -4.863 0.098 0.771 848 HA2 GLY 119 1HA GLY 119 -4.071 -0.746 -1.967 849 HA3 GLY 119 2HA GLY 119 -2.803 -0.558 -0.733 850 H GLN 120 H GLN 120 -3.229 -2.988 -1.994 851 HA GLN 120 HA GLN 120 -3.921 -4.640 0.369 852 HB2 GLN 120 1HB GLN 120 -6.006 -4.516 -1.029 853 HB3 GLN 120 2HB GLN 120 -5.103 -5.158 -2.393 854 HG2 GLN 120 1HG GLN 120 -4.606 -7.196 -1.010 855 HG3 GLN 120 2HG GLN 120 -5.739 -6.549 0.209 856 HE21 GLN 120 2HE2 GLN 120 -6.341 -8.968 -0.726 857 HE22 GLN 120 2HE1 GLN 120 -7.660 -8.910 -1.848 858 H VAL 121 H VAL 121 -2.489 -6.132 0.739 859 HA VAL 121 HA VAL 121 -0.216 -6.477 -1.079 860 HB VAL 121 HB VAL 121 -1.043 -8.010 1.434 861 HG11 VAL 121 1HG1 VAL 121 1.292 -8.737 1.513 862 HG12 VAL 121 1HG2 VAL 121 0.469 -9.294 0.035 863 HG13 VAL 121 1HG3 VAL 121 1.598 -7.920 -0.038 864 HG21 VAL 121 2HG3 VAL 121 -0.667 -5.606 1.860 865 HG22 VAL 121 2HG1 VAL 121 0.635 -6.590 2.568 866 HG23 VAL 121 2HG2 VAL 121 0.913 -5.707 1.048 867 H THR 122 H THR 122 0.249 -7.926 -2.511 868 HA THR 122 HA THR 122 -1.803 -10.071 -2.958 869 HB THR 122 HB THR 122 -1.361 -9.845 -5.372 870 HG1 THR 122 1HG THR 122 -0.046 -8.062 -6.058 871 HG21 THR 122 2HG3 THR 122 -1.993 -7.173 -4.061 872 HG22 THR 122 2HG1 THR 122 -2.382 -7.632 -5.735 873 HG23 THR 122 2HG2 THR 122 -3.162 -8.477 -4.376 874 H SER 123 H SER 123 1.578 -9.215 -2.810 875 HA SER 123 HA SER 123 2.284 -12.146 -2.797 876 HB2 SER 123 1HB SER 123 2.497 -11.533 -5.068 877 HB3 SER 123 2HB SER 123 3.541 -10.185 -4.641 878 HG SER 123 HG SER 123 4.685 -12.035 -5.206 879 H GLY 124 H GLY 124 3.979 -12.603 -1.476 880 HA2 GLY 124 1HA GLY 124 5.847 -12.128 -0.090 881 HA3 GLY 124 2HA GLY 124 5.551 -10.387 -0.297 882 H MET 125 H MET 125 2.678 -12.057 0.307 883 HA MET 125 HA MET 125 2.020 -10.846 2.737 884 HB2 MET 125 1HB MET 125 0.469 -12.176 1.295 885 HB3 MET 125 2HB MET 125 1.242 -13.651 1.857 886 HG2 MET 125 1HG MET 125 -0.780 -13.359 3.089 887 HG3 MET 125 2HG MET 125 0.562 -13.053 4.193 888 HE1 MET 125 3HE MET 125 1.165 -10.760 5.228 889 HE2 MET 125 1HE MET 125 -0.257 -9.800 5.703 890 HE3 MET 125 2HE MET 125 -0.222 -11.555 6.011 891 H ASP 126 H ASP 126 3.837 -13.854 2.249 892 HA ASP 126 HA ASP 126 4.059 -14.608 4.986 893 HB2 ASP 126 1HB ASP 126 5.934 -14.982 2.618 894 HB3 ASP 126 2HB ASP 126 6.250 -15.676 4.202 895 H VAL 127 H VAL 127 6.233 -12.563 3.024 896 HA VAL 127 HA VAL 127 8.032 -11.896 5.175 897 HB VAL 127 HB VAL 127 7.216 -10.340 2.672 898 HG11 VAL 127 1HG1 VAL 127 9.270 -9.054 3.010 899 HG12 VAL 127 1HG2 VAL 127 8.124 -8.843 4.354 900 HG13 VAL 127 1HG3 VAL 127 9.545 -9.897 4.552 901 HG21 VAL 127 2HG3 VAL 127 8.258 -12.532 2.210 902 HG22 VAL 127 2HG1 VAL 127 9.353 -11.202 1.768 903 HG23 VAL 127 2HG2 VAL 127 9.622 -12.111 3.274 904 H VAL 128 H VAL 128 5.006 -10.400 4.104 905 HA VAL 128 HA VAL 128 5.145 -8.135 5.894 906 HB VAL 128 HB VAL 128 2.765 -9.648 4.712 907 HG11 VAL 128 1HG1 VAL 128 1.443 -7.663 5.260 908 HG12 VAL 128 1HG2 VAL 128 2.099 -8.449 6.715 909 HG13 VAL 128 1HG3 VAL 128 2.847 -6.958 6.094 910 HG21 VAL 128 2HG3 VAL 128 4.255 -8.614 3.033 911 HG22 VAL 128 2HG1 VAL 128 2.700 -7.753 3.122 912 HG23 VAL 128 2HG2 VAL 128 4.146 -7.059 3.892 913 H ARG 129 H ARG 129 3.639 -11.338 6.296 914 HA ARG 129 HA ARG 129 2.563 -10.670 8.898 915 HB2 ARG 129 1HB ARG 129 1.693 -12.495 7.394 916 HB3 ARG 129 2HB ARG 129 3.159 -13.410 7.714 917 HG2 ARG 129 1HG ARG 129 2.590 -13.622 10.053 918 HG3 ARG 129 2HG ARG 129 1.183 -12.552 9.843 919 HD2 ARG 129 1HD ARG 129 0.311 -14.196 8.181 920 HD3 ARG 129 2HD ARG 129 1.624 -15.286 8.681 921 HE ARG 129 HE ARG 129 -0.782 -14.601 10.168 922 HH11 ARG 129 1HH1 ARG 129 2.476 -15.903 10.327 923 HH12 ARG 129 1HH2 ARG 129 2.186 -16.788 11.807 924 HH21 ARG 129 2HH1 ARG 129 -1.148 -15.754 12.090 925 HH22 ARG 129 2HH2 ARG 129 0.134 -16.705 12.805 926 H THR 130 H THR 130 5.563 -12.175 7.804 927 HA THR 130 HA THR 130 6.397 -12.562 10.639 928 HB THR 130 HB THR 130 8.351 -13.738 9.664 929 HG1 THR 130 1HG THR 130 8.344 -14.060 7.367 930 HG21 THR 130 2HG3 THR 130 5.697 -14.638 8.478 931 HG22 THR 130 2HG1 THR 130 7.141 -15.653 8.695 932 HG23 THR 130 2HG2 THR 130 6.283 -15.013 10.115 933 H MET 131 H MET 131 6.105 -9.922 9.137 934 HA MET 131 HA MET 131 8.685 -8.764 8.788 935 HB2 MET 131 1HB MET 131 6.500 -7.714 8.141 936 HB3 MET 131 2HB MET 131 6.164 -7.430 9.842 937 HG2 MET 131 1HG MET 131 8.161 -5.988 9.997 938 HG3 MET 131 2HG MET 131 8.494 -6.270 8.287 939 HE1 MET 131 3HE MET 131 5.723 -6.217 6.869 940 HE2 MET 131 1HE MET 131 5.550 -4.487 6.489 941 HE3 MET 131 2HE MET 131 7.133 -5.285 6.309 942 H LYS 132 H LYS 132 10.151 -7.828 10.055 943 HA LYS 132 HA LYS 132 9.929 -8.395 12.965 944 HB2 LYS 132 1HB LYS 132 12.244 -7.418 11.247 945 HB3 LYS 132 2HB LYS 132 12.333 -7.682 12.984 946 HG2 LYS 132 1HG LYS 132 11.875 -10.069 12.673 947 HG3 LYS 132 2HG LYS 132 11.706 -9.823 10.929 948 HD2 LYS 132 1HD LYS 132 14.047 -9.049 10.802 949 HD3 LYS 132 2HD LYS 132 14.219 -9.262 12.549 950 HE2 LYS 132 1HE LYS 132 13.748 -11.680 12.299 951 HE3 LYS 132 2HE LYS 132 13.587 -11.468 10.553 952 HZ1 LYS 132 3HZ LYS 132 16.024 -10.943 12.119 953 HZ2 LYS 132 1HZ LYS 132 15.759 -12.250 11.149 954 HZ3 LYS 132 2HZ LYS 132 15.873 -10.743 10.489 955 H ASN 133 H ASN 133 10.243 -6.884 14.573 956 HA ASN 133 HA ASN 133 8.873 -4.391 14.101 957 HB2 ASN 133 1HB ASN 133 9.044 -5.755 16.275 958 HB3 ASN 133 2HB ASN 133 10.620 -5.005 16.485 959 HD21 ASN 133 2HD2 ASN 133 9.877 -3.980 18.371 960 HD22 ASN 133 2HD1 ASN 133 8.847 -2.589 18.296 961 H GLY 134 H GLY 134 9.512 -2.490 13.481 962 HA2 GLY 134 1HA GLY 134 10.960 -0.659 13.215 963 HA3 GLY 134 2HA GLY 134 12.293 -1.627 13.886 964 H ASP 135 H ASP 135 10.484 -3.236 11.478 965 HA ASP 135 HA ASP 135 12.512 -3.663 9.631 966 HB2 ASP 135 1HB ASP 135 10.167 -4.644 9.587 967 HB3 ASP 135 2HB ASP 135 9.606 -3.131 8.888 968 H VAL 136 H VAL 136 13.613 -2.612 8.166 969 HA VAL 136 HA VAL 136 12.866 0.268 7.670 970 HB VAL 136 HB VAL 136 15.585 -1.107 7.445 971 HG11 VAL 136 1HG1 VAL 136 16.458 1.171 7.258 972 HG12 VAL 136 1HG2 VAL 136 15.323 0.782 5.944 973 HG13 VAL 136 1HG3 VAL 136 14.798 1.810 7.300 974 HG21 VAL 136 2HG3 VAL 136 14.834 -0.994 9.795 975 HG22 VAL 136 2HG1 VAL 136 16.169 0.144 9.498 976 HG23 VAL 136 2HG2 VAL 136 14.495 0.744 9.605 977 H MET 137 H MET 137 12.264 0.893 5.798 978 HA MET 137 HA MET 137 12.255 -0.936 3.525 979 HB2 MET 137 1HB MET 137 11.608 2.025 3.758 980 HB3 MET 137 2HB MET 137 11.373 1.066 2.304 981 HG2 MET 137 1HG MET 137 9.764 -0.366 3.505 982 HG3 MET 137 2HG MET 137 10.004 0.592 4.967 983 HE1 MET 137 3HE MET 137 7.583 1.309 5.374 984 HE2 MET 137 1HE MET 137 6.470 1.839 4.090 985 HE3 MET 137 2HE MET 137 7.121 0.180 4.077 986 H LYS 138 H LYS 138 13.384 -0.892 1.653 987 HA LYS 138 HA LYS 138 15.950 0.650 1.763 988 HB2 LYS 138 1HB LYS 138 16.148 -1.824 1.601 989 HB3 LYS 138 2HB LYS 138 15.194 -1.802 0.124 990 HG2 LYS 138 1HG LYS 138 16.931 -0.486 -1.006 991 HG3 LYS 138 2HG LYS 138 17.885 -0.453 0.484 992 HD2 LYS 138 1HD LYS 138 17.996 -2.941 0.445 993 HD3 LYS 138 2HD LYS 138 17.094 -2.939 -1.078 994 HE2 LYS 138 1HE LYS 138 18.886 -1.652 -2.163 995 HE3 LYS 138 2HE LYS 138 19.778 -1.579 -0.642 996 HZ1 LYS 138 3HZ LYS 138 19.118 -4.040 -2.117 997 HZ2 LYS 138 1HZ LYS 138 20.597 -3.311 -2.062 998 HZ3 LYS 138 2HZ LYS 138 19.951 -3.971 -0.695 999 H GLU 139 H GLU 139 13.282 -0.240 -0.423 1000 HA GLU 139 HA GLU 139 13.475 2.357 -1.759 1001 HB2 GLU 139 1HB GLU 139 15.303 0.974 -2.856 1002 HB3 GLU 139 2HB GLU 139 14.061 -0.154 -3.381 1003 HG2 GLU 139 1HG GLU 139 12.988 1.583 -4.705 1004 HG3 GLU 139 2HG GLU 139 14.140 2.780 -4.116 1005 H VAL 140 H VAL 140 11.588 2.996 -2.460 1006 HA VAL 140 HA VAL 140 9.410 0.925 -2.727 1007 HB VAL 140 HB VAL 140 9.215 3.728 -1.524 1008 HG11 VAL 140 1HG1 VAL 140 6.924 3.083 -0.955 1009 HG12 VAL 140 1HG2 VAL 140 7.205 3.064 -2.712 1010 HG13 VAL 140 1HG3 VAL 140 7.151 1.534 -1.802 1011 HG21 VAL 140 2HG3 VAL 140 10.396 2.161 -0.022 1012 HG22 VAL 140 2HG1 VAL 140 8.778 2.550 0.608 1013 HG23 VAL 140 2HG2 VAL 140 9.066 0.990 -0.197 1014 H LYS 141 H LYS 141 8.265 0.911 -4.456 1015 HA LYS 141 HA LYS 141 8.389 3.323 -6.235 1016 HB2 LYS 141 1HB LYS 141 8.597 0.394 -7.040 1017 HB3 LYS 141 2HB LYS 141 8.388 1.728 -8.166 1018 HG2 LYS 141 1HG LYS 141 10.552 2.685 -7.405 1019 HG3 LYS 141 2HG LYS 141 10.764 1.292 -6.334 1020 HD2 LYS 141 1HD LYS 141 10.673 -0.224 -8.293 1021 HD3 LYS 141 2HD LYS 141 10.475 1.175 -9.360 1022 HE2 LYS 141 1HE LYS 141 12.666 2.055 -8.593 1023 HE3 LYS 141 2HE LYS 141 12.866 0.638 -7.559 1024 HZ1 LYS 141 3HZ LYS 141 12.622 0.589 -10.493 1025 HZ2 LYS 141 1HZ LYS 141 14.015 0.384 -9.634 1026 HZ3 LYS 141 2HZ LYS 141 12.807 -0.735 -9.527 1027 H VAL 142 H VAL 142 6.611 3.796 -7.472 1028 HA VAL 142 HA VAL 142 4.204 2.017 -7.104 1029 HB VAL 142 HB VAL 142 2.817 4.059 -7.272 1030 HG11 VAL 142 1HG1 VAL 142 3.282 5.020 -5.071 1031 HG12 VAL 142 1HG2 VAL 142 3.388 3.243 -5.058 1032 HG13 VAL 142 1HG3 VAL 142 4.874 4.223 -5.061 1033 HG21 VAL 142 2HG3 VAL 142 4.401 5.427 -8.584 1034 HG22 VAL 142 2HG1 VAL 142 3.879 6.288 -7.118 1035 HG23 VAL 142 2HG2 VAL 142 5.485 5.525 -7.177 1036 H PHE 143 H PHE 143 2.679 2.005 -8.793 1037 HA PHE 143 HA PHE 143 3.976 2.470 -11.450 1038 HB2 PHE 143 1HB PHE 143 2.653 -0.138 -10.604 1039 HB3 PHE 143 2HB PHE 143 3.425 0.201 -12.144 1040 HD1 PHE 143 2HD PHE 143 5.876 0.394 -12.302 1041 HD2 PHE 143 1HD PHE 143 3.933 -0.702 -8.658 1042 HE1 PHE 143 2HE PHE 143 8.022 -0.457 -11.416 1043 HE2 PHE 143 1HE PHE 143 6.079 -1.551 -7.768 1044 HZ PHE 143 HZ PHE 143 8.123 -1.428 -9.148 1045 H ASP 144 H ASP 144 2.719 3.438 -12.819 1046 HA ASP 144 HA ASP 144 -0.233 3.336 -12.399 1047 HB2 ASP 144 1HB ASP 144 0.853 5.563 -12.729 1048 HB3 ASP 144 2HB ASP 144 1.453 5.029 -14.293 1049 H GLU 145 H GLU 145 -1.261 1.730 -13.281 1050 HA GLU 145 HA GLU 145 -0.169 0.520 -15.779 1051 HB2 GLU 145 1HB GLU 145 -2.324 -0.461 -13.858 1052 HB3 GLU 145 2HB GLU 145 -1.727 -1.341 -15.258 1053 HG2 GLU 145 1HG GLU 145 -0.128 -0.589 -12.801 1054 HG3 GLU 145 2HG GLU 145 -0.756 -2.187 -13.199 1055 HA PRO 146 HA PRO 146 -3.375 2.209 -18.212 1056 HB2 PRO 146 1HB PRO 146 -3.290 0.512 -20.348 1057 HB3 PRO 146 2HB PRO 146 -1.900 1.550 -20.004 1058 HG2 PRO 146 1HG PRO 146 -2.322 -1.380 -19.277 1059 HG3 PRO 146 2HG PRO 146 -0.906 -0.630 -20.018 1060 HD2 PRO 146 1HD PRO 146 -1.037 -1.114 -17.329 1061 HD3 PRO 146 2HD PRO 146 -0.159 0.319 -18.000 Start of MODEL 8 1 H MET 1 1H MET 1 -6.777 5.156 -14.154 2 HA MET 1 HA MET 1 -8.520 3.487 -12.801 3 HB2 MET 1 1HB MET 1 -6.110 2.965 -14.579 4 HB3 MET 1 2HB MET 1 -7.297 1.755 -14.112 5 HG2 MET 1 1HG MET 1 -9.057 3.003 -15.282 6 HG3 MET 1 2HG MET 1 -7.893 4.257 -15.718 7 HE1 MET 1 3HE MET 1 -9.260 0.695 -16.397 8 HE2 MET 1 1HE MET 1 -7.986 -0.047 -17.394 9 HE3 MET 1 2HE MET 1 -7.687 0.284 -15.669 10 H ALA 2 H ALA 2 -7.244 1.173 -12.365 11 HA ALA 2 HA ALA 2 -6.333 1.531 -9.668 12 HB1 ALA 2 3HB ALA 2 -6.117 -0.885 -11.500 13 HB2 ALA 2 1HB ALA 2 -5.876 -0.894 -9.738 14 HB3 ALA 2 2HB ALA 2 -7.476 -0.512 -10.416 15 H LYS 3 H LYS 3 -4.318 0.960 -8.732 16 HA LYS 3 HA LYS 3 -1.987 1.267 -10.589 17 HB2 LYS 3 1HB LYS 3 -2.355 2.678 -7.916 18 HB3 LYS 3 2HB LYS 3 -0.913 2.736 -8.919 19 HG2 LYS 3 1HG LYS 3 -2.169 3.877 -10.695 20 HG3 LYS 3 2HG LYS 3 -3.642 3.791 -9.716 21 HD2 LYS 3 1HD LYS 3 -2.559 5.146 -7.957 22 HD3 LYS 3 2HD LYS 3 -1.077 5.221 -8.922 23 HE2 LYS 3 1HE LYS 3 -2.300 6.388 -10.722 24 HE3 LYS 3 2HE LYS 3 -3.790 6.297 -9.779 25 HZ1 LYS 3 3HZ LYS 3 -1.343 7.721 -8.971 26 HZ2 LYS 3 1HZ LYS 3 -2.724 8.418 -9.542 27 HZ3 LYS 3 2HZ LYS 3 -2.735 7.636 -8.090 28 H LYS 4 H LYS 4 0.109 0.809 -9.404 29 HA LYS 4 HA LYS 4 -0.236 -1.208 -7.234 30 HB2 LYS 4 1HB LYS 4 1.314 -1.630 -9.817 31 HB3 LYS 4 2HB LYS 4 1.521 -2.623 -8.381 32 HG2 LYS 4 1HG LYS 4 -0.869 -3.282 -8.509 33 HG3 LYS 4 2HG LYS 4 -1.031 -2.325 -9.988 34 HD2 LYS 4 1HD LYS 4 0.687 -3.708 -11.089 35 HD3 LYS 4 2HD LYS 4 0.888 -4.652 -9.606 36 HE2 LYS 4 1HE LYS 4 -1.558 -5.262 -9.755 37 HE3 LYS 4 2HE LYS 4 -1.605 -4.469 -11.332 38 HZ1 LYS 4 3HZ LYS 4 0.121 -6.745 -10.615 39 HZ2 LYS 4 1HZ LYS 4 -1.246 -6.819 -11.535 40 HZ3 LYS 4 2HZ LYS 4 0.078 -6.004 -12.088 41 H GLY 5 H GLY 5 1.777 -1.737 -6.135 42 HA2 GLY 5 1HA GLY 5 3.965 0.220 -6.484 43 HA3 GLY 5 2HA GLY 5 3.113 0.236 -4.923 44 H TYR 6 H TYR 6 5.822 -0.283 -5.046 45 HA TYR 6 HA TYR 6 5.919 -3.111 -4.124 46 HB2 TYR 6 1HB TYR 6 6.599 -3.258 -6.469 47 HB3 TYR 6 2HB TYR 6 7.739 -1.936 -6.259 48 HD1 TYR 6 1HD TYR 6 6.959 -5.373 -5.016 49 HD2 TYR 6 2HD TYR 6 9.948 -2.363 -5.667 50 HE1 TYR 6 1HE TYR 6 8.723 -6.991 -4.405 51 HE2 TYR 6 2HE TYR 6 11.712 -3.982 -5.057 52 HH TYR 6 HH TYR 6 12.168 -6.066 -4.453 53 H ILE 7 H ILE 7 6.904 -3.301 -2.279 54 HA ILE 7 HA ILE 7 8.994 -1.255 -1.564 55 HB ILE 7 HB ILE 7 7.121 -2.888 0.223 56 HG12 ILE 7 1HG1 ILE 7 7.366 0.116 -0.000 57 HG13 ILE 7 1HG2 ILE 7 6.211 -0.823 -0.933 58 HG21 ILE 7 2HG1 ILE 7 8.226 -1.743 2.102 59 HG22 ILE 7 2HG2 ILE 7 9.384 -2.740 1.191 60 HG23 ILE 7 2HG3 ILE 7 9.364 -0.975 0.970 61 HD11 ILE 7 1HD3 ILE 7 6.365 -0.708 2.087 62 HD12 ILE 7 1HD1 ILE 7 5.175 0.118 1.054 63 HD13 ILE 7 1HD2 ILE 7 5.196 -1.661 1.141 64 H LEU 8 H LEU 8 10.918 -1.965 -1.933 65 HA LEU 8 HA LEU 8 11.613 -4.741 -1.143 66 HB2 LEU 8 1HB LEU 8 12.641 -3.812 -3.180 67 HB3 LEU 8 2HB LEU 8 13.271 -2.441 -2.260 68 HG LEU 8 HG LEU 8 14.678 -4.061 -0.942 69 HD11 LEU 8 1HD1 LEU 8 14.978 -6.316 -1.863 70 HD12 LEU 8 1HD2 LEU 8 13.311 -6.053 -1.301 71 HD13 LEU 8 1HD3 LEU 8 13.681 -6.009 -3.041 72 HD21 LEU 8 2HD3 LEU 8 15.563 -2.772 -2.858 73 HD22 LEU 8 2HD1 LEU 8 16.303 -4.389 -2.776 74 HD23 LEU 8 2HD2 LEU 8 15.024 -4.054 -3.969 75 H MET 9 H MET 9 12.258 -5.314 0.763 76 HA MET 9 HA MET 9 12.798 -3.200 2.777 77 HB2 MET 9 1HB MET 9 12.557 -6.211 3.114 78 HB3 MET 9 2HB MET 9 12.615 -5.017 4.402 79 HG2 MET 9 1HG MET 9 10.409 -5.295 2.341 80 HG3 MET 9 2HG MET 9 10.340 -5.825 4.024 81 HE1 MET 9 3HE MET 9 11.688 -3.562 5.679 82 HE2 MET 9 1HE MET 9 10.304 -2.495 6.019 83 HE3 MET 9 2HE MET 9 10.101 -4.263 6.082 84 H GLU 10 H GLU 10 14.565 -3.271 4.210 85 HA GLU 10 HA GLU 10 17.093 -3.594 2.910 86 HB2 GLU 10 1HB GLU 10 16.311 -3.337 5.839 87 HB3 GLU 10 2HB GLU 10 17.984 -3.414 5.305 88 HG2 GLU 10 1HG GLU 10 16.024 -1.331 4.325 89 HG3 GLU 10 2HG GLU 10 17.055 -1.116 5.738 90 H ASN 11 H ASN 11 15.080 -5.844 4.619 91 HA ASN 11 HA ASN 11 17.304 -7.767 4.982 92 HB2 ASN 11 1HB ASN 11 14.352 -7.859 5.651 93 HB3 ASN 11 2HB ASN 11 15.443 -9.219 5.881 94 HD21 ASN 11 2HD2 ASN 11 13.939 -7.771 7.872 95 HD22 ASN 11 2HD1 ASN 11 15.091 -7.115 8.987 96 H GLY 12 H GLY 12 15.660 -6.788 2.377 97 HA2 GLY 12 1HA GLY 12 15.901 -7.799 0.253 98 HA3 GLY 12 2HA GLY 12 16.199 -9.367 1.039 99 H GLY 13 H GLY 13 13.583 -7.821 2.477 100 HA2 GLY 13 1HA GLY 13 11.688 -9.764 1.566 101 HA3 GLY 13 2HA GLY 13 11.317 -8.284 2.480 102 H LYS 14 H LYS 14 10.177 -9.749 -0.003 103 HA LYS 14 HA LYS 14 10.201 -7.388 -1.858 104 HB2 LYS 14 1HB LYS 14 9.793 -10.338 -2.488 105 HB3 LYS 14 2HB LYS 14 9.651 -9.026 -3.650 106 HG2 LYS 14 1HG LYS 14 12.050 -8.456 -3.240 107 HG3 LYS 14 2HG LYS 14 12.163 -9.868 -2.179 108 HD2 LYS 14 1HD LYS 14 11.496 -11.334 -4.061 109 HD3 LYS 14 2HD LYS 14 11.392 -9.921 -5.121 110 HE2 LYS 14 1HE LYS 14 13.812 -9.458 -4.663 111 HE3 LYS 14 2HE LYS 14 13.888 -10.950 -3.722 112 HZ1 LYS 14 3HZ LYS 14 13.198 -10.765 -6.578 113 HZ2 LYS 14 1HZ LYS 14 14.637 -11.280 -5.961 114 HZ3 LYS 14 2HZ LYS 14 13.267 -12.159 -5.699 115 H ILE 15 H ILE 15 8.506 -6.239 -1.166 116 HA ILE 15 HA ILE 15 5.886 -7.679 -0.869 117 HB ILE 15 HB ILE 15 6.769 -4.927 0.137 118 HG12 ILE 15 1HG1 ILE 15 6.199 -7.401 1.776 119 HG13 ILE 15 1HG2 ILE 15 7.814 -6.935 1.264 120 HG21 ILE 15 2HG1 ILE 15 4.630 -4.947 1.355 121 HG22 ILE 15 2HG2 ILE 15 4.366 -5.041 -0.402 122 HG23 ILE 15 2HG3 ILE 15 4.210 -6.502 0.601 123 HD11 ILE 15 1HD3 ILE 15 5.955 -5.271 2.977 124 HD12 ILE 15 1HD1 ILE 15 7.367 -6.196 3.537 125 HD13 ILE 15 1HD2 ILE 15 7.589 -4.799 2.457 126 H GLU 16 H GLU 16 4.702 -7.729 -2.560 127 HA GLU 16 HA GLU 16 4.510 -5.217 -4.194 128 HB2 GLU 16 1HB GLU 16 5.459 -7.227 -5.397 129 HB3 GLU 16 2HB GLU 16 3.955 -8.080 -5.077 130 HG2 GLU 16 1HG GLU 16 2.715 -6.418 -6.385 131 HG3 GLU 16 2HG GLU 16 4.205 -5.525 -6.679 132 H PHE 17 H PHE 17 2.635 -4.246 -4.433 133 HA PHE 17 HA PHE 17 0.175 -5.603 -3.445 134 HB2 PHE 17 1HB PHE 17 -0.331 -3.683 -1.964 135 HB3 PHE 17 2HB PHE 17 1.115 -4.534 -1.444 136 HD1 PHE 17 1HD PHE 17 -0.168 -1.467 -3.022 137 HD2 PHE 17 2HD PHE 17 3.274 -3.489 -1.502 138 HE1 PHE 17 1HE PHE 17 1.097 0.656 -3.068 139 HE2 PHE 17 2HE PHE 17 4.542 -1.367 -1.544 140 HZ PHE 17 HZ PHE 17 3.452 0.706 -2.329 141 H GLU 18 H GLU 18 -1.779 -4.525 -3.945 142 HA GLU 18 HA GLU 18 -1.524 -2.714 -6.311 143 HB2 GLU 18 1HB GLU 18 -3.889 -4.313 -5.241 144 HB3 GLU 18 2HB GLU 18 -3.946 -3.253 -6.643 145 HG2 GLU 18 1HG GLU 18 -2.294 -4.666 -7.790 146 HG3 GLU 18 2HG GLU 18 -2.220 -5.724 -6.383 147 H LEU 19 H LEU 19 -2.903 -0.898 -6.529 148 HA LEU 19 HA LEU 19 -3.833 0.220 -3.908 149 HB2 LEU 19 1HB LEU 19 -2.419 1.655 -6.192 150 HB3 LEU 19 2HB LEU 19 -3.177 2.467 -4.818 151 HG LEU 19 HG LEU 19 -0.857 0.518 -4.583 152 HD11 LEU 19 1HD1 LEU 19 0.517 2.523 -4.235 153 HD12 LEU 19 1HD2 LEU 19 -0.214 2.500 -5.857 154 HD13 LEU 19 1HD3 LEU 19 -0.892 3.550 -4.589 155 HD21 LEU 19 2HD3 LEU 19 -2.289 0.713 -2.577 156 HD22 LEU 19 2HD1 LEU 19 -0.701 1.471 -2.308 157 HD23 LEU 19 2HD2 LEU 19 -2.128 2.485 -2.634 158 H PHE 20 H PHE 20 -5.687 1.395 -3.872 159 HA PHE 20 HA PHE 20 -7.368 1.021 -6.332 160 HB2 PHE 20 1HB PHE 20 -8.219 0.613 -3.434 161 HB3 PHE 20 2HB PHE 20 -9.229 0.397 -4.855 162 HD1 PHE 20 2HD PHE 20 -8.769 -1.474 -6.434 163 HD2 PHE 20 1HD PHE 20 -6.727 -1.084 -2.701 164 HE1 PHE 20 2HE PHE 20 -8.087 -3.847 -6.562 165 HE2 PHE 20 1HE PHE 20 -6.041 -3.457 -2.827 166 HZ PHE 20 HZ PHE 20 -6.721 -4.838 -4.758 167 HA PRO 21 HA PRO 21 -7.782 5.408 -5.094 168 HB2 PRO 21 1HB PRO 21 -7.564 6.406 -7.638 169 HB3 PRO 21 2HB PRO 21 -6.109 5.989 -6.722 170 HG2 PRO 21 1HG PRO 21 -7.580 4.345 -8.826 171 HG3 PRO 21 2HG PRO 21 -5.849 4.678 -8.713 172 HD2 PRO 21 1HD PRO 21 -6.901 2.348 -7.776 173 HD3 PRO 21 2HD PRO 21 -5.517 3.160 -6.938 174 H ASN 22 H ASN 22 -9.430 3.083 -6.905 175 HA ASN 22 HA ASN 22 -11.721 4.685 -7.663 176 HB2 ASN 22 1HB ASN 22 -11.334 1.728 -7.160 177 HB3 ASN 22 2HB ASN 22 -12.881 2.422 -7.623 178 HD21 ASN 22 2HD2 ASN 22 -11.445 0.513 -9.118 179 HD22 ASN 22 2HD1 ASN 22 -10.996 1.239 -10.626 180 H GLU 23 H GLU 23 -10.669 3.207 -4.674 181 HA GLU 23 HA GLU 23 -13.261 4.047 -3.414 182 HB2 GLU 23 1HB GLU 23 -12.760 2.407 -1.658 183 HB3 GLU 23 2HB GLU 23 -12.798 1.621 -3.230 184 HG2 GLU 23 1HG GLU 23 -10.322 1.689 -3.300 185 HG3 GLU 23 2HG GLU 23 -10.315 2.415 -1.695 186 H ALA 24 H ALA 24 -9.779 4.357 -3.357 187 HA ALA 24 HA ALA 24 -10.172 6.626 -1.466 188 HB1 ALA 24 3HB ALA 24 -7.914 4.595 -1.345 189 HB2 ALA 24 1HB ALA 24 -8.040 6.068 -0.356 190 HB3 ALA 24 2HB ALA 24 -9.236 4.764 -0.166 191 HA PRO 25 HA PRO 25 -7.949 7.758 -5.363 192 HB2 PRO 25 1HB PRO 25 -9.431 10.069 -5.788 193 HB3 PRO 25 2HB PRO 25 -9.982 8.494 -6.373 194 HG2 PRO 25 1HG PRO 25 -10.758 9.964 -3.819 195 HG3 PRO 25 2HG PRO 25 -11.816 9.175 -4.993 196 HD2 PRO 25 1HD PRO 25 -11.144 7.893 -2.721 197 HD3 PRO 25 2HD PRO 25 -11.222 6.986 -4.285 198 H VAL 26 H VAL 26 -8.708 9.391 -2.388 199 HA VAL 26 HA VAL 26 -6.672 11.507 -2.875 200 HB VAL 26 HB VAL 26 -8.335 10.817 -0.404 201 HG11 VAL 26 1HG1 VAL 26 -7.709 13.049 0.379 202 HG12 VAL 26 1HG2 VAL 26 -6.290 12.000 0.152 203 HG13 VAL 26 1HG3 VAL 26 -6.669 13.257 -1.051 204 HG21 VAL 26 2HG3 VAL 26 -9.737 11.506 -2.319 205 HG22 VAL 26 2HG1 VAL 26 -9.709 12.766 -1.062 206 HG23 VAL 26 2HG2 VAL 26 -8.729 12.957 -2.536 207 H THR 27 H THR 27 -7.105 8.718 -0.704 208 HA THR 27 HA THR 27 -4.585 9.127 0.636 209 HB THR 27 HB THR 27 -6.223 6.571 0.321 210 HG1 THR 27 1HG THR 27 -7.013 7.222 2.403 211 HG21 THR 27 2HG3 THR 27 -4.088 7.362 2.340 212 HG22 THR 27 2HG1 THR 27 -5.040 5.860 2.362 213 HG23 THR 27 2HG2 THR 27 -3.893 6.167 1.037 214 H VAL 28 H VAL 28 -5.539 7.073 -2.106 215 HA VAL 28 HA VAL 28 -2.926 5.861 -2.457 216 HB VAL 28 HB VAL 28 -5.236 6.358 -4.396 217 HG11 VAL 28 1HG1 VAL 28 -4.164 4.706 -5.849 218 HG12 VAL 28 1HG2 VAL 28 -3.148 6.148 -5.616 219 HG13 VAL 28 1HG3 VAL 28 -2.769 4.642 -4.745 220 HG21 VAL 28 2HG3 VAL 28 -5.777 4.856 -2.511 221 HG22 VAL 28 2HG1 VAL 28 -5.687 3.951 -4.041 222 HG23 VAL 28 2HG2 VAL 28 -4.340 3.872 -2.880 223 H ALA 29 H ALA 29 -4.405 8.799 -3.761 224 HA ALA 29 HA ALA 29 -2.323 9.397 -5.607 225 HB1 ALA 29 3HB ALA 29 -4.123 11.290 -4.051 226 HB2 ALA 29 1HB ALA 29 -3.164 11.715 -5.487 227 HB3 ALA 29 2HB ALA 29 -4.497 10.544 -5.623 228 H ASN 30 H ASN 30 -2.769 10.460 -2.224 229 HA ASN 30 HA ASN 30 -0.256 11.893 -2.126 230 HB2 ASN 30 1HB ASN 30 -2.177 10.867 -0.036 231 HB3 ASN 30 2HB ASN 30 -0.647 11.613 0.404 232 HD21 ASN 30 2HD2 ASN 30 -3.855 12.173 -0.166 233 HD22 ASN 30 2HD1 ASN 30 -3.797 13.880 -0.456 234 H PHE 31 H PHE 31 -1.219 8.582 -1.329 235 HA PHE 31 HA PHE 31 1.217 7.734 -0.124 236 HB2 PHE 31 1HB PHE 31 -0.843 6.353 -0.173 237 HB3 PHE 31 2HB PHE 31 -0.703 6.185 -1.916 238 HD1 PHE 31 1HD PHE 31 0.781 5.250 1.324 239 HD2 PHE 31 2HD PHE 31 0.840 4.647 -2.905 240 HE1 PHE 31 1HE PHE 31 2.181 3.236 1.632 241 HE2 PHE 31 2HE PHE 31 2.238 2.631 -2.601 242 HZ PHE 31 HZ PHE 31 2.909 1.926 -0.330 243 H GLU 32 H GLU 32 0.250 7.560 -3.563 244 HA GLU 32 HA GLU 32 2.767 6.560 -4.492 245 HB2 GLU 32 1HB GLU 32 0.732 6.487 -5.875 246 HB3 GLU 32 2HB GLU 32 0.651 8.242 -5.900 247 HG2 GLU 32 1HG GLU 32 2.704 8.370 -7.184 248 HG3 GLU 32 2HG GLU 32 2.928 6.626 -7.064 249 H LYS 33 H LYS 33 1.536 9.900 -4.267 250 HA LYS 33 HA LYS 33 3.767 11.176 -5.464 251 HB2 LYS 33 1HB LYS 33 1.623 12.313 -4.928 252 HB3 LYS 33 2HB LYS 33 1.986 12.188 -3.213 253 HG2 LYS 33 1HG LYS 33 3.937 13.642 -3.486 254 HG3 LYS 33 2HG LYS 33 3.648 13.727 -5.229 255 HD2 LYS 33 1HD LYS 33 1.459 14.784 -4.833 256 HD3 LYS 33 2HD LYS 33 1.704 14.661 -3.084 257 HE2 LYS 33 1HE LYS 33 3.693 16.118 -3.257 258 HE3 LYS 33 2HE LYS 33 3.461 16.236 -5.003 259 HZ1 LYS 33 3HZ LYS 33 1.554 17.164 -2.961 260 HZ2 LYS 33 1HZ LYS 33 2.549 18.121 -3.863 261 HZ3 LYS 33 2HZ LYS 33 1.336 17.273 -4.592 262 H LEU 34 H LEU 34 3.207 10.411 -2.024 263 HA LEU 34 HA LEU 34 5.706 11.596 -1.175 264 HB2 LEU 34 1HB LEU 34 3.839 9.580 0.136 265 HB3 LEU 34 2HB LEU 34 5.243 10.289 0.941 266 HG LEU 34 HG LEU 34 2.885 11.894 -0.106 267 HD11 LEU 34 1HD1 LEU 34 2.211 12.044 2.249 268 HD12 LEU 34 1HD2 LEU 34 2.188 10.364 1.664 269 HD13 LEU 34 1HD3 LEU 34 3.523 10.929 2.697 270 HD21 LEU 34 2HD3 LEU 34 5.024 13.126 0.056 271 HD22 LEU 34 2HD1 LEU 34 3.875 13.667 1.304 272 HD23 LEU 34 2HD2 LEU 34 5.213 12.575 1.738 273 H ALA 35 H ALA 35 4.705 8.262 -1.893 274 HA ALA 35 HA ALA 35 7.125 7.015 -1.081 275 HB1 ALA 35 3HB ALA 35 5.191 6.206 -3.283 276 HB2 ALA 35 1HB ALA 35 6.422 5.157 -2.545 277 HB3 ALA 35 2HB ALA 35 5.067 5.762 -1.565 278 H ASN 36 H ASN 36 6.179 8.438 -4.197 279 HA ASN 36 HA ASN 36 8.735 7.637 -5.432 280 HB2 ASN 36 1HB ASN 36 6.347 9.217 -6.410 281 HB3 ASN 36 2HB ASN 36 7.809 8.996 -7.363 282 HD21 ASN 36 2HD2 ASN 36 5.231 8.119 -8.101 283 HD22 ASN 36 2HD1 ASN 36 5.261 6.389 -8.191 284 H GLU 37 H GLU 37 7.873 10.018 -3.310 285 HA GLU 37 HA GLU 37 9.973 11.870 -4.370 286 HB2 GLU 37 1HB GLU 37 7.736 12.169 -2.347 287 HB3 GLU 37 2HB GLU 37 9.109 13.267 -2.335 288 HG2 GLU 37 1HG GLU 37 8.618 13.877 -4.685 289 HG3 GLU 37 2HG GLU 37 7.213 12.813 -4.649 290 H GLY 38 H GLY 38 9.629 9.248 -2.332 291 HA2 GLY 38 1HA GLY 38 11.509 8.227 -1.323 292 HA3 GLY 38 2HA GLY 38 12.351 9.795 -1.318 293 H PHE 39 H PHE 39 9.104 9.896 -0.228 294 HA PHE 39 HA PHE 39 9.955 10.447 2.532 295 HB2 PHE 39 1HB PHE 39 7.285 10.436 1.084 296 HB3 PHE 39 2HB PHE 39 7.388 10.623 2.828 297 HD1 PHE 39 2HD PHE 39 8.727 12.564 3.765 298 HD2 PHE 39 1HD PHE 39 7.645 12.253 -0.357 299 HE1 PHE 39 2HE PHE 39 9.108 14.991 3.484 300 HE2 PHE 39 1HE PHE 39 8.027 14.678 -0.642 301 HZ PHE 39 HZ PHE 39 8.758 16.047 1.278 302 H TYR 40 H TYR 40 8.347 7.843 0.777 303 HA TYR 40 HA TYR 40 8.091 6.304 3.318 304 HB2 TYR 40 1HB TYR 40 7.082 5.778 0.497 305 HB3 TYR 40 2HB TYR 40 6.895 4.655 1.837 306 HD1 TYR 40 1HD TYR 40 6.612 7.386 3.683 307 HD2 TYR 40 2HD TYR 40 4.561 5.572 0.380 308 HE1 TYR 40 1HE TYR 40 4.526 8.530 4.350 309 HE2 TYR 40 2HE TYR 40 2.474 6.716 1.048 310 HH TYR 40 HH TYR 40 2.018 8.120 4.023 311 H ASN 41 H ASN 41 10.300 6.788 0.833 312 HA ASN 41 HA ASN 41 11.327 4.042 0.725 313 HB2 ASN 41 1HB ASN 41 11.511 5.698 -1.157 314 HB3 ASN 41 2HB ASN 41 12.647 6.615 -0.176 315 HD21 ASN 41 2HD2 ASN 41 13.266 5.537 -2.675 316 HD22 ASN 41 2HD1 ASN 41 14.476 4.314 -2.465 317 H GLY 42 H GLY 42 11.461 3.715 3.033 318 HA2 GLY 42 1HA GLY 42 13.676 3.081 4.123 319 HA3 GLY 42 2HA GLY 42 14.026 4.825 4.105 320 H LEU 43 H LEU 43 10.786 3.615 4.663 321 HA LEU 43 HA LEU 43 10.634 4.831 7.295 322 HB2 LEU 43 1HB LEU 43 8.807 2.863 5.857 323 HB3 LEU 43 2HB LEU 43 8.414 3.668 7.379 324 HG LEU 43 HG LEU 43 8.828 5.028 4.693 325 HD11 LEU 43 1HD1 LEU 43 6.423 5.486 4.863 326 HD12 LEU 43 1HD2 LEU 43 6.760 3.738 4.836 327 HD13 LEU 43 1HD3 LEU 43 6.350 4.543 6.370 328 HD21 LEU 43 2HD3 LEU 43 9.590 6.412 6.595 329 HD22 LEU 43 2HD1 LEU 43 8.086 7.057 5.895 330 HD23 LEU 43 2HD2 LEU 43 8.036 6.136 7.418 331 H THR 44 H THR 44 10.267 3.845 9.290 332 HA THR 44 HA THR 44 11.437 1.086 9.487 333 HB THR 44 HB THR 44 11.633 3.371 11.500 334 HG1 THR 44 1HG THR 44 13.876 3.238 10.923 335 HG21 THR 44 2HG3 THR 44 12.818 0.569 11.510 336 HG22 THR 44 2HG1 THR 44 13.126 1.837 12.720 337 HG23 THR 44 2HG2 THR 44 11.496 1.141 12.554 338 H PHE 45 H PHE 45 10.110 -0.409 10.086 339 HA PHE 45 HA PHE 45 7.463 0.237 11.125 340 HB2 PHE 45 1HB PHE 45 8.970 -2.368 10.676 341 HB3 PHE 45 2HB PHE 45 7.358 -2.318 11.373 342 HD1 PHE 45 1HD PHE 45 9.337 -1.542 8.346 343 HD2 PHE 45 2HD PHE 45 5.435 -1.994 10.025 344 HE1 PHE 45 1HE PHE 45 8.358 -1.508 6.076 345 HE2 PHE 45 2HE PHE 45 4.453 -1.962 7.756 346 HZ PHE 45 HZ PHE 45 5.916 -1.717 5.781 347 H HIS 46 H HIS 46 7.330 1.104 13.067 348 HA HIS 46 HA HIS 46 9.131 0.140 15.215 349 HB2 HIS 46 1HB HIS 46 7.099 2.410 15.120 350 HB3 HIS 46 2HB HIS 46 8.096 2.025 16.516 351 HD2 HIS 46 2HD HIS 46 8.312 4.328 13.413 352 HE1 HIS 46 1HE HIS 46 12.269 3.699 14.823 353 H ARG 47 H ARG 47 6.043 -0.540 14.028 354 HA ARG 47 HA ARG 47 5.382 -1.956 16.576 355 HB2 ARG 47 1HB ARG 47 3.475 -0.257 14.920 356 HB3 ARG 47 2HB ARG 47 2.988 -1.325 16.228 357 HG2 ARG 47 1HG ARG 47 4.859 1.029 16.577 358 HG3 ARG 47 2HG ARG 47 3.101 1.075 16.855 359 HD2 ARG 47 1HD ARG 47 3.353 -0.706 18.521 360 HD3 ARG 47 2HD ARG 47 5.115 -0.648 18.279 361 HE ARG 47 HE ARG 47 3.438 1.312 19.661 362 HH11 ARG 47 1HH1 ARG 47 6.580 0.536 18.294 363 HH12 ARG 47 1HH2 ARG 47 7.426 1.751 19.228 364 HH21 ARG 47 2HH1 ARG 47 4.546 2.885 20.867 365 HH22 ARG 47 2HH2 ARG 47 6.275 3.080 20.684 366 H VAL 48 H VAL 48 6.177 -3.821 15.560 367 HA VAL 48 HA VAL 48 4.271 -4.945 13.512 368 HB VAL 48 HB VAL 48 7.067 -5.870 14.333 369 HG11 VAL 48 1HG1 VAL 48 6.882 -7.406 12.438 370 HG12 VAL 48 1HG2 VAL 48 5.633 -7.712 13.667 371 HG13 VAL 48 1HG3 VAL 48 5.211 -6.862 12.160 372 HG21 VAL 48 2HG3 VAL 48 7.116 -3.755 13.055 373 HG22 VAL 48 2HG1 VAL 48 7.738 -5.105 12.078 374 HG23 VAL 48 2HG2 VAL 48 6.093 -4.489 11.797 375 H ILE 49 H ILE 49 2.672 -5.964 14.344 376 HA ILE 49 HA ILE 49 3.247 -7.854 16.614 377 HB ILE 49 HB ILE 49 0.681 -6.271 16.082 378 HG12 ILE 49 1HG1 ILE 49 2.648 -5.955 18.360 379 HG13 ILE 49 1HG2 ILE 49 2.586 -4.906 16.952 380 HG21 ILE 49 2HG1 ILE 49 -0.062 -7.227 18.225 381 HG22 ILE 49 2HG2 ILE 49 0.285 -8.508 17.040 382 HG23 ILE 49 2HG3 ILE 49 1.449 -8.159 18.339 383 HD11 ILE 49 1HD3 ILE 49 0.343 -5.329 18.938 384 HD12 ILE 49 1HD1 ILE 49 1.414 -3.913 18.837 385 HD13 ILE 49 1HD2 ILE 49 0.281 -4.269 17.512 386 HA PRO 50 HA PRO 50 2.084 -10.788 13.441 387 HB2 PRO 50 1HB PRO 50 2.613 -12.475 15.923 388 HB3 PRO 50 2HB PRO 50 3.171 -12.754 14.268 389 HG2 PRO 50 1HG PRO 50 4.923 -11.838 16.048 390 HG3 PRO 50 2HG PRO 50 4.908 -11.132 14.430 391 HD2 PRO 50 1HD PRO 50 3.703 -10.050 17.007 392 HD3 PRO 50 2HD PRO 50 4.614 -9.169 15.716 393 H GLY 51 H GLY 51 0.145 -11.312 12.968 394 HA2 GLY 51 1HA GLY 51 -1.947 -12.387 13.421 395 HA3 GLY 51 2HA GLY 51 -1.731 -12.051 15.155 396 H PHE 52 H PHE 52 -0.835 -9.244 14.414 397 HA PHE 52 HA PHE 52 -3.578 -8.121 13.950 398 HB2 PHE 52 1HB PHE 52 -1.171 -7.087 15.495 399 HB3 PHE 52 2HB PHE 52 -2.505 -6.042 15.029 400 HD1 PHE 52 1HD PHE 52 -4.266 -8.853 15.442 401 HD2 PHE 52 2HD PHE 52 -1.881 -6.211 17.804 402 HE1 PHE 52 1HE PHE 52 -5.512 -9.539 17.463 403 HE2 PHE 52 2HE PHE 52 -3.124 -6.896 19.829 404 HZ PHE 52 HZ PHE 52 -4.941 -8.560 19.657 405 H VAL 53 H VAL 53 -0.833 -6.050 13.861 406 HA VAL 53 HA VAL 53 -0.876 -5.939 10.870 407 HB VAL 53 HB VAL 53 -1.257 -3.527 10.902 408 HG11 VAL 53 1HG1 VAL 53 -3.589 -3.431 11.631 409 HG12 VAL 53 1HG2 VAL 53 -3.233 -4.926 10.734 410 HG13 VAL 53 1HG3 VAL 53 -3.378 -4.964 12.508 411 HG21 VAL 53 2HG3 VAL 53 -0.197 -3.057 13.083 412 HG22 VAL 53 2HG1 VAL 53 -1.828 -2.350 13.002 413 HG23 VAL 53 2HG2 VAL 53 -1.555 -3.852 13.916 414 H SER 54 H SER 54 0.850 -4.879 9.907 415 HA SER 54 HA SER 54 3.167 -4.202 11.736 416 HB2 SER 54 1HB SER 54 3.077 -4.953 8.868 417 HB3 SER 54 2HB SER 54 4.468 -4.247 9.677 418 HG SER 54 HG SER 54 3.268 -6.713 9.982 419 H GLN 55 H GLN 55 3.207 -2.088 12.227 420 HA GLN 55 HA GLN 55 2.144 -0.137 10.224 421 HB2 GLN 55 1HB GLN 55 1.117 -0.162 12.527 422 HB3 GLN 55 2HB GLN 55 2.690 0.244 13.198 423 HG2 GLN 55 1HG GLN 55 2.701 2.365 12.042 424 HG3 GLN 55 2HG GLN 55 1.178 1.949 11.209 425 HE21 GLN 55 2HE2 GLN 55 0.601 4.095 12.217 426 HE22 GLN 55 2HE1 GLN 55 -0.076 4.059 13.811 427 H GLY 56 H GLY 56 3.387 1.216 9.199 428 HA2 GLY 56 1HA GLY 56 6.269 0.928 9.491 429 HA3 GLY 56 2HA GLY 56 5.411 1.965 8.327 430 H GLY 57 H GLY 57 7.487 3.197 9.154 431 HA2 GLY 57 1HA GLY 57 6.945 4.657 11.676 432 HA3 GLY 57 2HA GLY 57 8.441 4.717 10.714 433 H CYS 58 H CYS 58 7.984 7.088 11.283 434 HA CYS 58 HA CYS 58 6.068 8.428 9.394 435 HB2 CYS 58 1HB CYS 58 6.099 9.103 11.716 436 HB3 CYS 58 2HB CYS 58 7.769 9.620 11.529 437 HG CYS 58 HG CYS 58 5.106 10.636 9.901 438 HA PRO 59 HA PRO 59 9.295 9.195 6.396 439 HB2 PRO 59 1HB PRO 59 7.625 11.730 6.088 440 HB3 PRO 59 2HB PRO 59 8.206 10.640 4.822 441 HG2 PRO 59 1HG PRO 59 5.640 10.513 5.504 442 HG3 PRO 59 2HG PRO 59 6.528 9.006 5.262 443 HD2 PRO 59 1HD PRO 59 5.788 10.403 7.862 444 HD3 PRO 59 2HD PRO 59 5.747 8.639 7.462 445 H ARG 60 H ARG 60 8.239 11.446 8.868 446 HA ARG 60 HA ARG 60 10.657 13.115 8.451 447 HB2 ARG 60 1HB ARG 60 8.327 13.340 10.395 448 HB3 ARG 60 2HB ARG 60 9.660 14.481 10.300 449 HG2 ARG 60 1HG ARG 60 9.014 15.044 7.988 450 HG3 ARG 60 2HG ARG 60 7.649 13.906 8.110 451 HD2 ARG 60 1HD ARG 60 6.745 15.190 9.960 452 HD3 ARG 60 2HD ARG 60 8.109 16.325 9.840 453 HE ARG 60 HE ARG 60 6.906 16.178 7.311 454 HH11 ARG 60 1HH1 ARG 60 6.099 17.241 10.560 455 HH12 ARG 60 1HH2 ARG 60 4.981 18.470 10.016 456 HH21 ARG 60 2HH1 ARG 60 5.452 17.778 6.615 457 HH22 ARG 60 2HH2 ARG 60 4.613 18.775 7.783 458 H GLY 61 H GLY 61 10.122 10.245 9.878 459 HA2 GLY 61 1HA GLY 61 11.660 9.029 11.134 460 HA3 GLY 61 2HA GLY 61 12.639 10.504 11.318 461 H ASN 62 H ASN 62 9.280 10.699 12.123 462 HA ASN 62 HA ASN 62 9.999 11.168 14.958 463 HB2 ASN 62 1HB ASN 62 7.422 11.526 13.405 464 HB3 ASN 62 2HB ASN 62 7.592 11.849 15.125 465 HD21 ASN 62 2HD2 ASN 62 6.858 13.723 13.112 466 HD22 ASN 62 2HD1 ASN 62 8.072 14.958 13.082 467 H GLY 63 H GLY 63 8.420 8.762 12.981 468 HA2 GLY 63 1HA GLY 63 8.038 6.525 13.699 469 HA3 GLY 63 2HA GLY 63 8.109 7.065 15.393 470 H THR 64 H THR 64 6.306 9.398 14.241 471 HA THR 64 HA THR 64 3.733 7.864 14.255 472 HB THR 64 HB THR 64 4.320 10.413 15.827 473 HG1 THR 64 1HG THR 64 3.899 8.997 17.616 474 HG21 THR 64 2HG3 THR 64 1.796 8.731 15.593 475 HG22 THR 64 2HG1 THR 64 2.017 10.138 16.659 476 HG23 THR 64 2HG2 THR 64 2.035 10.348 14.892 477 H GLY 65 H GLY 65 2.322 8.381 12.775 478 HA2 GLY 65 1HA GLY 65 2.882 9.787 10.493 479 HA3 GLY 65 2HA GLY 65 1.233 9.640 11.142 480 H ASP 66 H ASP 66 3.547 11.786 10.132 481 HA ASP 66 HA ASP 66 2.245 14.016 11.655 482 HB2 ASP 66 1HB ASP 66 4.600 13.515 12.477 483 HB3 ASP 66 2HB ASP 66 5.184 13.905 10.865 484 H ALA 67 H ALA 67 0.982 13.561 9.516 485 HA ALA 67 HA ALA 67 2.215 14.541 7.086 486 HB1 ALA 67 3HB ALA 67 -0.712 14.134 7.795 487 HB2 ALA 67 1HB ALA 67 -0.070 14.423 6.162 488 HB3 ALA 67 2HB ALA 67 0.358 12.933 7.036 489 H GLY 68 H GLY 68 1.792 16.430 5.930 490 HA2 GLY 68 1HA GLY 68 0.794 18.698 7.595 491 HA3 GLY 68 2HA GLY 68 1.827 18.844 6.153 492 H TYR 69 H TYR 69 -1.116 16.889 6.613 493 HA TYR 69 HA TYR 69 -2.779 18.674 5.001 494 HB2 TYR 69 1HB TYR 69 -3.114 17.085 3.141 495 HB3 TYR 69 2HB TYR 69 -1.464 17.692 3.190 496 HD1 TYR 69 1HD TYR 69 -3.567 14.794 4.248 497 HD2 TYR 69 2HD TYR 69 0.341 16.224 3.209 498 HE1 TYR 69 1HE TYR 69 -2.714 12.474 4.265 499 HE2 TYR 69 2HE TYR 69 1.195 13.906 3.226 500 HH TYR 69 HH TYR 69 -0.743 11.240 4.374 501 H THR 70 H THR 70 -4.841 17.412 4.311 502 HA THR 70 HA THR 70 -5.631 15.634 6.589 503 HB THR 70 HB THR 70 -7.232 17.998 5.511 504 HG1 THR 70 1HG THR 70 -6.888 18.776 7.669 505 HG21 THR 70 2HG3 THR 70 -7.834 16.005 7.728 506 HG22 THR 70 2HG1 THR 70 -8.827 17.415 7.295 507 HG23 THR 70 2HG2 THR 70 -8.641 16.071 6.145 508 H ILE 71 H ILE 71 -6.528 13.830 6.012 509 HA ILE 71 HA ILE 71 -8.064 13.767 3.426 510 HB ILE 71 HB ILE 71 -6.383 11.544 4.693 511 HG12 ILE 71 1HG1 ILE 71 -5.961 13.059 2.106 512 HG13 ILE 71 1HG2 ILE 71 -5.043 13.296 3.584 513 HG21 ILE 71 2HG1 ILE 71 -6.999 10.248 2.692 514 HG22 ILE 71 2HG2 ILE 71 -8.441 10.701 3.630 515 HG23 ILE 71 2HG3 ILE 71 -8.036 11.585 2.141 516 HD11 ILE 71 1HD3 ILE 71 -5.172 10.735 1.976 517 HD12 ILE 71 1HD1 ILE 71 -3.827 11.898 2.011 518 HD13 ILE 71 1HD2 ILE 71 -4.243 10.975 3.475 519 HA PRO 72 HA PRO 72 -11.356 12.706 6.156 520 HB2 PRO 72 1HB PRO 72 -13.292 12.650 4.213 521 HB3 PRO 72 2HB PRO 72 -12.636 14.195 4.770 522 HG2 PRO 72 1HG PRO 72 -11.865 12.570 2.308 523 HG3 PRO 72 2HG PRO 72 -12.237 14.293 2.406 524 HD2 PRO 72 1HD PRO 72 -9.664 13.415 2.415 525 HD3 PRO 72 2HD PRO 72 -10.170 14.839 3.411 526 H CYS 73 H CYS 73 -12.391 10.923 6.736 527 HA CYS 73 HA CYS 73 -11.292 8.380 5.868 528 HB2 CYS 73 1HB CYS 73 -12.015 8.778 8.110 529 HB3 CYS 73 2HB CYS 73 -13.678 8.934 7.563 530 HG CYS 73 HG CYS 73 -13.348 6.677 8.740 531 H GLU 74 H GLU 74 -11.874 7.137 4.208 532 HA GLU 74 HA GLU 74 -14.124 7.904 2.496 533 HB2 GLU 74 1HB GLU 74 -12.217 5.526 2.396 534 HB3 GLU 74 2HB GLU 74 -13.395 5.923 1.152 535 HG2 GLU 74 1HG GLU 74 -11.130 7.740 2.001 536 HG3 GLU 74 2HG GLU 74 -11.066 6.624 0.639 537 H THR 75 H THR 75 -16.116 7.514 3.039 538 HA THR 75 HA THR 75 -16.771 4.774 4.064 539 HB THR 75 HB THR 75 -18.510 5.766 5.505 540 HG1 THR 75 1HG THR 75 -18.511 8.071 5.749 541 HG21 THR 75 2HG3 THR 75 -15.780 7.032 5.948 542 HG22 THR 75 2HG1 THR 75 -17.045 6.824 7.180 543 HG23 THR 75 2HG2 THR 75 -16.260 5.398 6.460 544 H ASP 76 H ASP 76 -17.200 7.098 1.693 545 HA ASP 76 HA ASP 76 -19.983 6.211 1.073 546 HB2 ASP 76 1HB ASP 76 -18.276 8.444 -0.110 547 HB3 ASP 76 2HB ASP 76 -19.928 8.073 -0.584 548 H ASN 77 H ASN 77 -16.913 5.223 0.435 549 HA ASN 77 HA ASN 77 -17.625 4.347 -2.345 550 HB2 ASN 77 1HB ASN 77 -14.932 4.710 -1.007 551 HB3 ASN 77 2HB ASN 77 -15.161 3.946 -2.574 552 HD21 ASN 77 2HD2 ASN 77 -13.679 6.348 -1.912 553 HD22 ASN 77 2HD1 ASN 77 -14.378 7.630 -2.844 554 H ASN 78 H ASN 78 -15.888 2.316 -2.697 555 HA ASN 78 HA ASN 78 -17.267 0.076 -1.714 556 HB2 ASN 78 1HB ASN 78 -14.380 0.363 -2.581 557 HB3 ASN 78 2HB ASN 78 -15.139 -1.182 -2.224 558 HD21 ASN 78 2HD2 ASN 78 -14.031 -0.405 -4.715 559 HD22 ASN 78 2HD1 ASN 78 -15.311 -0.390 -5.881 560 HA PRO 79 HA PRO 79 -16.453 -0.352 2.545 561 HB2 PRO 79 1HB PRO 79 -16.168 -3.290 1.755 562 HB3 PRO 79 2HB PRO 79 -17.135 -2.597 3.063 563 HG2 PRO 79 1HG PRO 79 -18.390 -3.386 0.855 564 HG3 PRO 79 2HG PRO 79 -18.848 -1.846 1.589 565 HD2 PRO 79 1HD PRO 79 -17.091 -2.370 -0.832 566 HD3 PRO 79 2HD PRO 79 -18.318 -1.067 -0.570 567 H HIS 80 H HIS 80 -14.788 -0.321 3.831 568 HA HIS 80 HA HIS 80 -12.172 -1.165 2.635 569 HB2 HIS 80 1HB HIS 80 -12.705 0.938 4.777 570 HB3 HIS 80 2HB HIS 80 -11.143 0.543 4.075 571 HD2 HIS 80 2HD HIS 80 -14.469 2.531 3.004 572 HE1 HIS 80 1HE HIS 80 -11.335 3.244 0.226 573 H ARG 81 H ARG 81 -12.630 -3.332 3.365 574 HA ARG 81 HA ARG 81 -12.707 -3.791 6.273 575 HB2 ARG 81 1HB ARG 81 -12.460 -5.686 3.905 576 HB3 ARG 81 2HB ARG 81 -12.587 -6.200 5.581 577 HG2 ARG 81 1HG ARG 81 -14.818 -5.182 5.737 578 HG3 ARG 81 2HG ARG 81 -14.689 -4.655 4.041 579 HD2 ARG 81 1HD ARG 81 -14.471 -6.975 3.344 580 HD3 ARG 81 2HD ARG 81 -14.624 -7.493 5.039 581 HE ARG 81 HE ARG 81 -16.839 -5.876 4.436 582 HH11 ARG 81 1HH1 ARG 81 -15.481 -8.972 3.481 583 HH12 ARG 81 1HH2 ARG 81 -17.035 -9.677 3.095 584 HH21 ARG 81 2HH1 ARG 81 -18.851 -6.803 3.932 585 HH22 ARG 81 2HH2 ARG 81 -18.943 -8.449 3.351 586 H HIS 82 H HIS 82 -11.153 -4.502 7.582 587 HA HIS 82 HA HIS 82 -8.379 -4.328 6.490 588 HB2 HIS 82 1HB HIS 82 -9.463 -4.187 9.335 589 HB3 HIS 82 2HB HIS 82 -7.751 -4.190 8.934 590 HD2 HIS 82 2HD HIS 82 -6.710 -1.713 8.371 591 HE1 HIS 82 1HE HIS 82 -10.416 0.369 8.053 592 H VAL 83 H VAL 83 -8.465 -6.387 5.485 593 HA VAL 83 HA VAL 83 -8.295 -8.678 7.442 594 HB VAL 83 HB VAL 83 -9.105 -10.110 5.615 595 HG11 VAL 83 1HG1 VAL 83 -11.415 -9.320 5.451 596 HG12 VAL 83 1HG2 VAL 83 -10.770 -9.154 7.102 597 HG13 VAL 83 1HG3 VAL 83 -10.911 -7.723 6.052 598 HG21 VAL 83 2HG3 VAL 83 -8.165 -8.809 3.737 599 HG22 VAL 83 2HG1 VAL 83 -9.902 -9.112 3.496 600 HG23 VAL 83 2HG2 VAL 83 -9.344 -7.512 4.042 601 H THR 84 H THR 84 -7.218 -10.612 6.230 602 HA THR 84 HA THR 84 -4.463 -10.082 6.243 603 HB THR 84 HB THR 84 -5.899 -12.261 4.661 604 HG1 THR 84 1HG THR 84 -4.870 -12.240 7.329 605 HG21 THR 84 2HG3 THR 84 -3.058 -12.083 5.732 606 HG22 THR 84 2HG1 THR 84 -3.778 -13.488 4.914 607 HG23 THR 84 2HG2 THR 84 -3.532 -11.968 4.021 608 H GLY 85 H GLY 85 -3.402 -8.658 5.116 609 HA2 GLY 85 1HA GLY 85 -2.154 -8.436 3.027 610 HA3 GLY 85 2HA GLY 85 -3.637 -8.864 2.143 611 H ALA 86 H ALA 86 -5.307 -7.173 3.920 612 HA ALA 86 HA ALA 86 -5.350 -4.884 2.235 613 HB1 ALA 86 3HB ALA 86 -6.558 -5.262 4.999 614 HB2 ALA 86 1HB ALA 86 -6.993 -3.983 3.841 615 HB3 ALA 86 2HB ALA 86 -7.327 -5.687 3.452 616 H MET 87 H MET 87 -4.605 -2.855 2.367 617 HA MET 87 HA MET 87 -2.814 -2.225 4.694 618 HB2 MET 87 1HB MET 87 -1.484 -2.732 2.683 619 HB3 MET 87 2HB MET 87 -2.406 -1.559 1.754 620 HG2 MET 87 1HG MET 87 -1.507 0.272 3.018 621 HG3 MET 87 2HG MET 87 -0.771 -0.820 4.193 622 HE1 MET 87 3HE MET 87 -0.647 0.637 0.566 623 HE2 MET 87 1HE MET 87 0.641 -0.333 -0.187 624 HE3 MET 87 2HE MET 87 -0.912 -1.093 0.240 625 H SER 88 H SER 88 -3.191 -0.431 5.758 626 HA SER 88 HA SER 88 -5.382 1.373 4.676 627 HB2 SER 88 1HB SER 88 -6.373 -0.162 6.121 628 HB3 SER 88 2HB SER 88 -5.171 0.135 7.366 629 HG SER 88 HG SER 88 -5.845 2.251 7.464 630 H MET 89 H MET 89 -5.188 3.512 5.129 631 HA MET 89 HA MET 89 -2.636 4.440 6.329 632 HB2 MET 89 1HB MET 89 -3.446 5.423 4.191 633 HB3 MET 89 2HB MET 89 -4.898 5.984 5.007 634 HG2 MET 89 1HG MET 89 -3.386 7.825 4.806 635 HG3 MET 89 2HG MET 89 -3.461 7.373 6.511 636 HE1 MET 89 3HE MET 89 -1.319 7.596 3.284 637 HE2 MET 89 1HE MET 89 0.095 6.584 3.669 638 HE3 MET 89 2HE MET 89 -1.498 5.829 3.416 639 H ALA 90 H ALA 90 -2.380 5.206 8.271 640 HA ALA 90 HA ALA 90 -4.575 5.123 10.156 641 HB1 ALA 90 3HB ALA 90 -1.773 6.269 10.431 642 HB2 ALA 90 1HB ALA 90 -2.911 5.977 11.767 643 HB3 ALA 90 2HB ALA 90 -2.268 4.607 10.829 644 H HIS 91 H HIS 91 -5.701 6.710 11.148 645 HA HIS 91 HA HIS 91 -5.564 9.385 9.815 646 HB2 HIS 91 1HB HIS 91 -7.792 7.918 11.278 647 HB3 HIS 91 2HB HIS 91 -7.876 9.637 10.918 648 HD2 HIS 91 2HD HIS 91 -7.826 6.180 8.818 649 HE1 HIS 91 1HE HIS 91 -9.302 9.388 6.455 650 H ARG 92 H ARG 92 -4.607 10.951 10.816 651 HA ARG 92 HA ARG 92 -4.146 10.856 13.718 652 HB2 ARG 92 1HB ARG 92 -2.445 11.814 12.203 653 HB3 ARG 92 2HB ARG 92 -3.598 13.013 11.640 654 HG2 ARG 92 1HG ARG 92 -3.691 13.991 13.898 655 HG3 ARG 92 2HG ARG 92 -2.508 12.783 14.456 656 HD2 ARG 92 1HD ARG 92 -1.423 14.870 13.969 657 HD3 ARG 92 2HD ARG 92 -0.910 13.622 12.809 658 HE ARG 92 HE ARG 92 -3.138 15.264 11.915 659 HH11 ARG 92 1HH1 ARG 92 0.353 14.907 12.042 660 HH12 ARG 92 1HH2 ARG 92 0.635 15.931 10.651 661 HH21 ARG 92 2HH1 ARG 92 -2.762 16.591 10.112 662 HH22 ARG 92 2HH2 ARG 92 -1.129 16.885 9.559 663 H GLY 93 H GLY 93 -6.531 10.653 14.086 664 HA2 GLY 93 1HA GLY 93 -8.140 11.917 15.358 665 HA3 GLY 93 2HA GLY 93 -7.654 13.384 14.477 666 H ARG 94 H ARG 94 -10.215 13.215 14.537 667 HA ARG 94 HA ARG 94 -11.547 11.416 12.756 668 HB2 ARG 94 1HB ARG 94 -12.653 12.866 14.498 669 HB3 ARG 94 2HB ARG 94 -12.341 14.263 13.479 670 HG2 ARG 94 1HG ARG 94 -13.761 13.323 11.718 671 HG3 ARG 94 2HG ARG 94 -14.059 11.886 12.725 672 HD2 ARG 94 1HD ARG 94 -14.744 14.718 13.474 673 HD3 ARG 94 2HD ARG 94 -15.877 13.510 12.828 674 HE ARG 94 HE ARG 94 -14.802 13.672 15.523 675 HH11 ARG 94 1HH1 ARG 94 -16.321 11.616 13.114 676 HH12 ARG 94 1HH2 ARG 94 -16.966 10.498 14.293 677 HH21 ARG 94 2HH1 ARG 94 -15.645 12.214 17.045 678 HH22 ARG 94 2HH2 ARG 94 -16.585 10.835 16.519 679 H ASP 95 H ASP 95 -11.371 11.159 10.686 680 HA ASP 95 HA ASP 95 -11.119 11.654 8.425 681 HB2 ASP 95 1HB ASP 95 -12.469 14.197 9.418 682 HB3 ASP 95 2HB ASP 95 -12.184 13.856 7.717 683 H THR 96 H THR 96 -8.784 11.914 9.779 684 HA THR 96 HA THR 96 -7.478 14.039 8.154 685 HB THR 96 HB THR 96 -6.867 13.645 11.115 686 HG1 THR 96 1HG THR 96 -8.877 14.697 10.843 687 HG21 THR 96 2HG3 THR 96 -5.950 15.713 9.080 688 HG22 THR 96 2HG1 THR 96 -5.512 15.679 10.804 689 HG23 THR 96 2HG2 THR 96 -4.964 14.379 9.721 690 H GLY 97 H GLY 97 -7.128 11.999 6.952 691 HA2 GLY 97 1HA GLY 97 -5.473 9.913 7.902 692 HA3 GLY 97 2HA GLY 97 -5.602 10.432 6.205 693 H SER 98 H SER 98 -3.328 9.629 8.154 694 HA SER 98 HA SER 98 -1.568 12.064 8.033 695 HB2 SER 98 1HB SER 98 -0.160 11.008 9.478 696 HB3 SER 98 2HB SER 98 -1.794 10.831 10.101 697 HG SER 98 HG SER 98 -1.817 8.762 9.107 698 H CYS 99 H CYS 99 0.861 10.883 7.868 699 HA CYS 99 HA CYS 99 1.067 9.771 5.093 700 HB2 CYS 99 1HB CYS 99 3.168 10.638 7.019 701 HB3 CYS 99 2HB CYS 99 3.427 9.996 5.404 702 HG CYS 99 HG CYS 99 3.831 12.532 5.419 703 H GLN 100 H GLN 100 0.753 8.668 8.324 704 HA GLN 100 HA GLN 100 2.598 6.372 7.972 705 HB2 GLN 100 1HB GLN 100 2.532 7.681 10.126 706 HB3 GLN 100 2HB GLN 100 0.872 7.155 10.358 707 HG2 GLN 100 1HG GLN 100 1.509 4.899 10.654 708 HG3 GLN 100 2HG GLN 100 3.158 5.211 10.043 709 HE21 GLN 100 2HE2 GLN 100 4.563 4.983 11.649 710 HE22 GLN 100 2HE1 GLN 100 4.379 5.610 13.253 711 H PHE 101 H PHE 101 2.063 4.366 7.561 712 HA PHE 101 HA PHE 101 -0.831 3.616 7.644 713 HB2 PHE 101 1HB PHE 101 -0.652 2.601 5.418 714 HB3 PHE 101 2HB PHE 101 -0.321 4.324 5.323 715 HD1 PHE 101 2HD PHE 101 1.967 5.142 4.944 716 HD2 PHE 101 1HD PHE 101 1.044 0.971 4.944 717 HE1 PHE 101 2HE PHE 101 4.116 4.669 3.817 718 HE2 PHE 101 1HE PHE 101 3.193 0.493 3.818 719 HZ PHE 101 HZ PHE 101 4.729 2.343 3.256 720 H PHE 102 H PHE 102 -1.119 1.247 7.193 721 HA PHE 102 HA PHE 102 1.141 -0.403 8.184 722 HB2 PHE 102 1HB PHE 102 -0.217 -1.357 10.006 723 HB3 PHE 102 2HB PHE 102 0.035 0.364 10.256 724 HD1 PHE 102 2HD PHE 102 -1.803 1.952 10.000 725 HD2 PHE 102 1HD PHE 102 -2.405 -2.249 9.512 726 HE1 PHE 102 2HE PHE 102 -4.245 2.281 10.205 727 HE2 PHE 102 1HE PHE 102 -4.847 -1.924 9.714 728 HZ PHE 102 HZ PHE 102 -5.767 0.341 10.061 729 H ILE 103 H ILE 103 0.916 -2.608 7.876 730 HA ILE 103 HA ILE 103 -1.270 -3.347 5.946 731 HB ILE 103 HB ILE 103 1.501 -4.585 6.347 732 HG12 ILE 103 1HG1 ILE 103 0.505 -2.998 3.976 733 HG13 ILE 103 1HG2 ILE 103 1.449 -2.298 5.282 734 HG21 ILE 103 2HG1 ILE 103 0.943 -5.896 4.339 735 HG22 ILE 103 2HG2 ILE 103 -0.212 -6.218 5.654 736 HG23 ILE 103 2HG3 ILE 103 -0.676 -5.158 4.302 737 HD11 ILE 103 1HD3 ILE 103 2.331 -4.564 3.479 738 HD12 ILE 103 1HD1 ILE 103 2.861 -2.868 3.387 739 HD13 ILE 103 1HD2 ILE 103 3.287 -3.857 4.804 740 H VAL 104 H VAL 104 -2.579 -4.979 6.261 741 HA VAL 104 HA VAL 104 -2.709 -5.857 9.110 742 HB VAL 104 HB VAL 104 -4.691 -6.165 6.803 743 HG11 VAL 104 1HG1 VAL 104 -6.314 -6.695 8.554 744 HG12 VAL 104 1HG2 VAL 104 -4.973 -7.863 8.515 745 HG13 VAL 104 1HG3 VAL 104 -5.024 -6.608 9.776 746 HG21 VAL 104 2HG3 VAL 104 -4.309 -3.797 7.395 747 HG22 VAL 104 2HG1 VAL 104 -5.926 -4.330 7.910 748 HG23 VAL 104 2HG2 VAL 104 -4.618 -4.173 9.107 749 H HIS 105 H HIS 105 -2.242 -7.730 9.855 750 HA HIS 105 HA HIS 105 -1.410 -9.866 8.009 751 HB2 HIS 105 1HB HIS 105 -1.640 -9.845 11.051 752 HB3 HIS 105 2HB HIS 105 -0.885 -11.107 10.087 753 HD2 HIS 105 2HD HIS 105 0.546 -8.113 8.334 754 HE1 HIS 105 1HE HIS 105 2.923 -8.599 11.823 755 H GLU 106 H GLU 106 -3.984 -9.391 10.431 756 HA GLU 106 HA GLU 106 -5.592 -11.428 8.956 757 HB2 GLU 106 1HB GLU 106 -5.151 -11.376 11.972 758 HB3 GLU 106 2HB GLU 106 -6.328 -12.383 11.142 759 HG2 GLU 106 1HG GLU 106 -4.507 -13.535 9.951 760 HG3 GLU 106 2HG GLU 106 -3.328 -12.525 10.783 761 HA PRO 107 HA PRO 107 -9.039 -8.788 9.174 762 HB2 PRO 107 1HB PRO 107 -10.373 -11.097 10.680 763 HB3 PRO 107 2HB PRO 107 -11.018 -10.156 9.329 764 HG2 PRO 107 1HG PRO 107 -10.083 -12.595 8.826 765 HG3 PRO 107 2HG PRO 107 -9.673 -11.284 7.717 766 HD2 PRO 107 1HD PRO 107 -7.981 -12.566 9.881 767 HD3 PRO 107 2HD PRO 107 -7.487 -11.956 8.251 768 H GLN 108 H GLN 108 -9.188 -7.136 10.394 769 HA GLN 108 HA GLN 108 -9.373 -7.583 13.355 770 HB2 GLN 108 1HB GLN 108 -8.238 -5.145 11.923 771 HB3 GLN 108 2HB GLN 108 -8.306 -5.399 13.661 772 HG2 GLN 108 1HG GLN 108 -6.676 -7.008 11.684 773 HG3 GLN 108 2HG GLN 108 -6.069 -5.778 12.827 774 HE21 GLN 108 2HE2 GLN 108 -5.857 -8.891 12.364 775 HE22 GLN 108 2HE1 GLN 108 -5.983 -9.512 13.976 776 HA PRO 109 HA PRO 109 -13.471 -5.992 12.235 777 HB2 PRO 109 1HB PRO 109 -13.753 -6.869 15.142 778 HB3 PRO 109 2HB PRO 109 -14.859 -7.166 13.795 779 HG2 PRO 109 1HG PRO 109 -13.337 -9.178 14.637 780 HG3 PRO 109 2HG PRO 109 -13.524 -8.924 12.900 781 HD2 PRO 109 1HD PRO 109 -11.210 -8.142 14.714 782 HD3 PRO 109 2HD PRO 109 -11.168 -8.847 13.048 783 H HIS 110 H HIS 110 -11.327 -5.338 14.931 784 HA HIS 110 HA HIS 110 -12.925 -3.042 15.825 785 HB2 HIS 110 1HB HIS 110 -11.098 -2.706 17.445 786 HB3 HIS 110 2HB HIS 110 -11.654 -4.374 17.470 787 HD2 HIS 110 2HD HIS 110 -9.805 -6.269 16.371 788 HE1 HIS 110 1HE HIS 110 -6.545 -3.524 16.326 789 H LEU 111 H LEU 111 -10.669 -3.588 13.370 790 HA LEU 111 HA LEU 111 -10.016 -0.675 13.239 791 HB2 LEU 111 1HB LEU 111 -8.959 -3.052 11.652 792 HB3 LEU 111 2HB LEU 111 -8.450 -1.375 11.428 793 HG LEU 111 HG LEU 111 -7.989 -3.078 13.901 794 HD11 LEU 111 1HD1 LEU 111 -5.633 -2.900 13.238 795 HD12 LEU 111 1HD2 LEU 111 -6.609 -3.701 11.985 796 HD13 LEU 111 1HD3 LEU 111 -6.112 -2.005 11.776 797 HD21 LEU 111 2HD3 LEU 111 -8.386 -0.701 14.456 798 HD22 LEU 111 2HD1 LEU 111 -6.677 -1.139 14.690 799 HD23 LEU 111 2HD2 LEU 111 -7.170 -0.218 13.249 800 H ASP 112 H ASP 112 -12.021 -3.113 11.858 801 HA ASP 112 HA ASP 112 -12.487 -1.957 9.284 802 HB2 ASP 112 1HB ASP 112 -14.299 -3.593 11.108 803 HB3 ASP 112 2HB ASP 112 -14.707 -3.165 9.452 804 H GLY 113 H GLY 113 -12.868 0.114 9.022 805 HA2 GLY 113 1HA GLY 113 -14.644 1.722 8.744 806 HA3 GLY 113 2HA GLY 113 -15.379 1.142 10.258 807 H VAL 114 H VAL 114 -12.218 1.188 10.974 808 HA VAL 114 HA VAL 114 -12.399 3.864 12.286 809 HB VAL 114 HB VAL 114 -10.334 1.619 12.499 810 HG11 VAL 114 1HG1 VAL 114 -9.529 2.824 14.471 811 HG12 VAL 114 1HG2 VAL 114 -9.374 3.794 12.987 812 HG13 VAL 114 1HG3 VAL 114 -10.686 4.134 14.141 813 HG21 VAL 114 2HG3 VAL 114 -12.549 0.967 13.377 814 HG22 VAL 114 2HG1 VAL 114 -11.379 1.186 14.700 815 HG23 VAL 114 2HG2 VAL 114 -12.593 2.445 14.369 816 H HIS 115 H HIS 115 -10.211 2.103 10.098 817 HA HIS 115 HA HIS 115 -9.153 4.790 9.280 818 HB2 HIS 115 1HB HIS 115 -7.719 2.099 9.239 819 HB3 HIS 115 2HB HIS 115 -7.053 3.624 8.672 820 HD2 HIS 115 2HD HIS 115 -7.124 1.560 11.844 821 HE1 HIS 115 1HE HIS 115 -6.106 5.524 13.033 822 H THR 116 H THR 116 -7.977 4.498 7.046 823 HA THR 116 HA THR 116 -10.135 3.450 5.246 824 HB THR 116 HB THR 116 -8.153 5.730 4.814 825 HG1 THR 116 1HG THR 116 -9.730 6.587 6.019 826 HG21 THR 116 2HG3 THR 116 -10.404 4.681 3.055 827 HG22 THR 116 2HG1 THR 116 -9.412 6.122 2.732 828 HG23 THR 116 2HG2 THR 116 -8.665 4.506 2.728 829 H VAL 117 H VAL 117 -9.638 1.562 4.445 830 HA VAL 117 HA VAL 117 -6.903 0.798 3.692 831 HB VAL 117 HB VAL 117 -9.619 -0.356 2.889 832 HG11 VAL 117 1HG1 VAL 117 -8.357 -2.363 2.287 833 HG12 VAL 117 1HG2 VAL 117 -7.866 -0.954 1.319 834 HG13 VAL 117 1HG3 VAL 117 -6.836 -1.517 2.657 835 HG21 VAL 117 2HG3 VAL 117 -9.236 -0.429 5.328 836 HG22 VAL 117 2HG1 VAL 117 -9.146 -2.058 4.620 837 HG23 VAL 117 2HG2 VAL 117 -7.653 -1.196 5.059 838 H PHE 118 H PHE 118 -5.803 1.106 1.954 839 HA PHE 118 HA PHE 118 -7.206 2.386 -0.365 840 HB2 PHE 118 1HB PHE 118 -5.441 4.023 -0.556 841 HB3 PHE 118 2HB PHE 118 -6.061 4.102 1.085 842 HD1 PHE 118 2HD PHE 118 -4.730 3.291 2.969 843 HD2 PHE 118 1HD PHE 118 -3.209 3.231 -1.022 844 HE1 PHE 118 2HE PHE 118 -2.442 2.974 3.849 845 HE2 PHE 118 1HE PHE 118 -0.920 2.910 -0.147 846 HZ PHE 118 HZ PHE 118 -0.536 2.782 2.289 847 H GLY 119 H GLY 119 -5.000 0.074 0.818 848 HA2 GLY 119 1HA GLY 119 -4.431 -0.736 -1.980 849 HA3 GLY 119 2HA GLY 119 -3.051 -0.472 -0.889 850 H GLN 120 H GLN 120 -3.084 -2.890 -1.859 851 HA GLN 120 HA GLN 120 -3.598 -4.548 0.498 852 HB2 GLN 120 1HB GLN 120 -5.816 -4.607 -0.646 853 HB3 GLN 120 2HB GLN 120 -5.036 -5.165 -2.119 854 HG2 GLN 120 1HG GLN 120 -4.314 -7.210 -0.988 855 HG3 GLN 120 2HG GLN 120 -5.081 -6.643 0.522 856 HE21 GLN 120 2HE2 GLN 120 -5.890 -9.032 -0.277 857 HE22 GLN 120 2HE1 GLN 120 -7.460 -8.976 -1.009 858 H VAL 121 H VAL 121 -1.926 -5.777 0.767 859 HA VAL 121 HA VAL 121 0.058 -6.242 -1.315 860 HB VAL 121 HB VAL 121 -0.418 -7.642 1.361 861 HG11 VAL 121 1HG1 VAL 121 1.910 -8.370 1.170 862 HG12 VAL 121 1HG2 VAL 121 0.902 -9.008 -0.151 863 HG13 VAL 121 1HG3 VAL 121 2.003 -7.643 -0.451 864 HG21 VAL 121 2HG3 VAL 121 0.001 -5.219 1.597 865 HG22 VAL 121 2HG1 VAL 121 1.390 -6.165 2.180 866 HG23 VAL 121 2HG2 VAL 121 1.459 -5.370 0.589 867 H THR 122 H THR 122 0.286 -7.691 -2.783 868 HA THR 122 HA THR 122 -1.677 -9.962 -2.782 869 HB THR 122 HB THR 122 -1.492 -9.948 -5.239 870 HG1 THR 122 1HG THR 122 -0.317 -8.202 -6.217 871 HG21 THR 122 2HG3 THR 122 -2.083 -7.184 -4.112 872 HG22 THR 122 2HG1 THR 122 -2.623 -7.806 -5.689 873 HG23 THR 122 2HG2 THR 122 -3.229 -8.543 -4.186 874 H SER 123 H SER 123 1.655 -9.035 -2.870 875 HA SER 123 HA SER 123 2.394 -11.953 -2.673 876 HB2 SER 123 1HB SER 123 2.657 -11.447 -4.968 877 HB3 SER 123 2HB SER 123 3.678 -10.071 -4.579 878 HG SER 123 HG SER 123 4.851 -11.937 -5.026 879 H GLY 124 H GLY 124 4.012 -12.314 -1.246 880 HA2 GLY 124 1HA GLY 124 5.858 -11.767 0.138 881 HA3 GLY 124 2HA GLY 124 5.604 -10.042 -0.215 882 H MET 125 H MET 125 2.757 -11.800 0.539 883 HA MET 125 HA MET 125 2.131 -10.437 2.945 884 HB2 MET 125 1HB MET 125 0.550 -11.791 1.521 885 HB3 MET 125 2HB MET 125 1.283 -13.251 2.169 886 HG2 MET 125 1HG MET 125 -0.671 -12.923 3.429 887 HG3 MET 125 2HG MET 125 0.640 -12.388 4.485 888 HE1 MET 125 3HE MET 125 1.197 -9.867 5.019 889 HE2 MET 125 1HE MET 125 -0.263 -8.947 5.454 890 HE3 MET 125 2HE MET 125 -0.051 -10.613 6.047 891 H ASP 126 H ASP 126 3.803 -13.542 2.478 892 HA ASP 126 HA ASP 126 4.224 -14.157 5.222 893 HB2 ASP 126 1HB ASP 126 5.932 -14.678 2.757 894 HB3 ASP 126 2HB ASP 126 6.321 -15.319 4.346 895 H VAL 127 H VAL 127 6.274 -12.252 3.003 896 HA VAL 127 HA VAL 127 8.322 -11.555 4.846 897 HB VAL 127 HB VAL 127 7.047 -9.901 2.613 898 HG11 VAL 127 1HG1 VAL 127 9.109 -8.584 2.643 899 HG12 VAL 127 1HG2 VAL 127 8.221 -8.466 4.180 900 HG13 VAL 127 1HG3 VAL 127 9.669 -9.494 4.066 901 HG21 VAL 127 2HG3 VAL 127 8.021 -12.043 1.858 902 HG22 VAL 127 2HG1 VAL 127 8.999 -10.666 1.298 903 HG23 VAL 127 2HG2 VAL 127 9.548 -11.641 2.682 904 H VAL 128 H VAL 128 5.256 -9.838 4.245 905 HA VAL 128 HA VAL 128 5.706 -7.764 6.181 906 HB VAL 128 HB VAL 128 3.115 -9.069 5.216 907 HG11 VAL 128 1HG1 VAL 128 1.999 -7.047 6.022 908 HG12 VAL 128 1HG2 VAL 128 2.778 -7.949 7.343 909 HG13 VAL 128 1HG3 VAL 128 3.539 -6.471 6.706 910 HG21 VAL 128 2HG3 VAL 128 4.451 -8.029 3.416 911 HG22 VAL 128 2HG1 VAL 128 2.977 -7.087 3.741 912 HG23 VAL 128 2HG2 VAL 128 4.548 -6.521 4.357 913 H ARG 129 H ARG 129 4.138 -10.935 6.544 914 HA ARG 129 HA ARG 129 3.449 -10.435 9.319 915 HB2 ARG 129 1HB ARG 129 3.628 -12.988 7.675 916 HB3 ARG 129 2HB ARG 129 3.060 -12.937 9.336 917 HG2 ARG 129 1HG ARG 129 1.258 -11.343 8.585 918 HG3 ARG 129 2HG ARG 129 1.773 -11.670 6.914 919 HD2 ARG 129 1HD ARG 129 0.948 -13.788 8.883 920 HD3 ARG 129 2HD ARG 129 -0.137 -13.033 7.692 921 HE ARG 129 HE ARG 129 2.195 -14.030 6.398 922 HH11 ARG 129 1HH1 ARG 129 -0.777 -15.109 7.931 923 HH12 ARG 129 1HH2 ARG 129 -0.880 -16.575 6.983 924 HH21 ARG 129 2HH1 ARG 129 2.049 -15.937 5.174 925 HH22 ARG 129 2HH2 ARG 129 0.719 -17.045 5.423 926 H THR 130 H THR 130 6.332 -11.402 7.721 927 HA THR 130 HA THR 130 7.467 -12.424 10.295 928 HB THR 130 HB THR 130 9.352 -13.239 8.875 929 HG1 THR 130 1HG THR 130 8.281 -11.580 7.100 930 HG21 THR 130 2HG3 THR 130 6.600 -14.110 7.909 931 HG22 THR 130 2HG1 THR 130 8.109 -15.036 7.735 932 HG23 THR 130 2HG2 THR 130 7.437 -14.726 9.353 933 H MET 131 H MET 131 6.954 -9.542 9.250 934 HA MET 131 HA MET 131 9.541 -8.279 9.215 935 HB2 MET 131 1HB MET 131 6.754 -7.337 9.935 936 HB3 MET 131 2HB MET 131 8.152 -6.281 10.081 937 HG2 MET 131 1HG MET 131 8.621 -6.577 7.672 938 HG3 MET 131 2HG MET 131 7.203 -7.619 7.530 939 HE1 MET 131 3HE MET 131 6.406 -6.009 5.530 940 HE2 MET 131 1HE MET 131 6.177 -4.254 5.723 941 HE3 MET 131 2HE MET 131 7.814 -4.952 5.795 942 H LYS 132 H LYS 132 10.503 -6.964 10.847 943 HA LYS 132 HA LYS 132 9.984 -7.985 13.621 944 HB2 LYS 132 1HB LYS 132 12.656 -7.347 12.310 945 HB3 LYS 132 2HB LYS 132 12.438 -7.681 14.022 946 HG2 LYS 132 1HG LYS 132 11.626 -9.948 13.483 947 HG3 LYS 132 2HG LYS 132 11.846 -9.612 11.760 948 HD2 LYS 132 1HD LYS 132 14.263 -9.234 12.141 949 HD3 LYS 132 2HD LYS 132 14.042 -9.570 13.865 950 HE2 LYS 132 1HE LYS 132 13.250 -11.852 13.313 951 HE3 LYS 132 2HE LYS 132 13.483 -11.517 11.595 952 HZ1 LYS 132 3HZ LYS 132 15.603 -11.514 13.639 953 HZ2 LYS 132 1HZ LYS 132 15.335 -12.699 12.523 954 HZ3 LYS 132 2HZ LYS 132 15.821 -11.200 12.035 955 H ASN 133 H ASN 133 10.582 -6.574 15.347 956 HA ASN 133 HA ASN 133 9.696 -3.861 14.930 957 HB2 ASN 133 1HB ASN 133 9.514 -5.151 17.074 958 HB3 ASN 133 2HB ASN 133 11.253 -4.984 17.273 959 HD21 ASN 133 2HD2 ASN 133 9.197 -4.007 19.013 960 HD22 ASN 133 2HD1 ASN 133 9.361 -2.284 19.079 961 H GLY 134 H GLY 134 10.717 -2.420 13.793 962 HA2 GLY 134 1HA GLY 134 12.499 -0.788 13.711 963 HA3 GLY 134 2HA GLY 134 13.619 -2.016 14.346 964 H ASP 135 H ASP 135 11.545 -3.389 12.082 965 HA ASP 135 HA ASP 135 13.585 -3.783 10.090 966 HB2 ASP 135 1HB ASP 135 11.504 -5.223 10.493 967 HB3 ASP 135 2HB ASP 135 10.574 -3.968 9.686 968 H VAL 136 H VAL 136 14.213 -2.700 8.377 969 HA VAL 136 HA VAL 136 12.882 -0.028 7.936 970 HB VAL 136 HB VAL 136 15.808 -0.812 7.541 971 HG11 VAL 136 1HG1 VAL 136 16.170 1.595 7.294 972 HG12 VAL 136 1HG2 VAL 136 15.059 0.958 6.060 973 HG13 VAL 136 1HG3 VAL 136 14.420 1.874 7.446 974 HG21 VAL 136 2HG3 VAL 136 15.202 -0.822 9.937 975 HG22 VAL 136 2HG1 VAL 136 16.248 0.564 9.550 976 HG23 VAL 136 2HG2 VAL 136 14.498 0.803 9.767 977 H MET 137 H MET 137 12.364 0.659 6.012 978 HA MET 137 HA MET 137 12.357 -1.235 3.792 979 HB2 MET 137 1HB MET 137 11.676 1.724 3.941 980 HB3 MET 137 2HB MET 137 11.429 0.714 2.525 981 HG2 MET 137 1HG MET 137 9.874 -0.710 3.833 982 HG3 MET 137 2HG MET 137 10.094 0.357 5.223 983 HE1 MET 137 3HE MET 137 7.571 0.887 5.507 984 HE2 MET 137 1HE MET 137 6.492 1.342 4.166 985 HE3 MET 137 2HE MET 137 7.227 -0.280 4.208 986 H LYS 138 H LYS 138 13.301 -0.956 1.745 987 HA LYS 138 HA LYS 138 15.963 0.422 1.911 988 HB2 LYS 138 1HB LYS 138 16.101 -2.067 1.833 989 HB3 LYS 138 2HB LYS 138 15.187 -2.063 0.332 990 HG2 LYS 138 1HG LYS 138 16.988 -0.807 -0.779 991 HG3 LYS 138 2HG LYS 138 17.905 -0.780 0.733 992 HD2 LYS 138 1HD LYS 138 17.970 -3.256 0.738 993 HD3 LYS 138 2HD LYS 138 17.061 -3.279 -0.781 994 HE2 LYS 138 1HE LYS 138 18.879 -2.058 -1.907 995 HE3 LYS 138 2HE LYS 138 19.782 -1.977 -0.392 996 HZ1 LYS 138 3HZ LYS 138 19.045 -4.449 -1.811 997 HZ2 LYS 138 1HZ LYS 138 20.543 -3.762 -1.780 998 HZ3 LYS 138 2HZ LYS 138 19.888 -4.375 -0.396 999 H GLU 139 H GLU 139 13.348 -0.527 -0.319 1000 HA GLU 139 HA GLU 139 13.767 1.979 -1.829 1001 HB2 GLU 139 1HB GLU 139 15.364 0.397 -2.889 1002 HB3 GLU 139 2HB GLU 139 14.065 -0.765 -3.122 1003 HG2 GLU 139 1HG GLU 139 12.931 0.732 -4.655 1004 HG3 GLU 139 2HG GLU 139 14.115 2.001 -4.346 1005 H VAL 140 H VAL 140 11.881 2.842 -2.079 1006 HA VAL 140 HA VAL 140 9.508 1.030 -2.513 1007 HB VAL 140 HB VAL 140 9.615 3.684 -1.002 1008 HG11 VAL 140 1HG1 VAL 140 7.295 3.182 -0.409 1009 HG12 VAL 140 1HG2 VAL 140 7.515 3.335 -2.168 1010 HG13 VAL 140 1HG3 VAL 140 7.351 1.723 -1.428 1011 HG21 VAL 140 2HG3 VAL 140 10.696 1.862 0.270 1012 HG22 VAL 140 2HG1 VAL 140 9.141 2.318 1.007 1013 HG23 VAL 140 2HG2 VAL 140 9.260 0.838 0.026 1014 H LYS 141 H LYS 141 8.553 1.216 -4.327 1015 HA LYS 141 HA LYS 141 8.398 3.915 -5.594 1016 HB2 LYS 141 1HB LYS 141 9.327 1.356 -6.952 1017 HB3 LYS 141 2HB LYS 141 8.817 2.796 -7.822 1018 HG2 LYS 141 1HG LYS 141 10.638 4.079 -6.695 1019 HG3 LYS 141 2HG LYS 141 11.179 2.574 -5.938 1020 HD2 LYS 141 1HD LYS 141 11.553 1.570 -8.154 1021 HD3 LYS 141 2HD LYS 141 10.964 3.045 -8.935 1022 HE2 LYS 141 1HE LYS 141 12.809 4.332 -7.944 1023 HE3 LYS 141 2HE LYS 141 13.383 2.892 -7.099 1024 HZ1 LYS 141 3HZ LYS 141 13.240 3.214 -10.022 1025 HZ2 LYS 141 1HZ LYS 141 14.609 3.284 -9.107 1026 HZ3 LYS 141 2HZ LYS 141 13.774 1.867 -9.233 1027 H VAL 142 H VAL 142 6.582 4.371 -6.680 1028 HA VAL 142 HA VAL 142 4.495 2.198 -6.827 1029 HB VAL 142 HB VAL 142 4.091 5.151 -6.145 1030 HG11 VAL 142 1HG1 VAL 142 1.761 4.515 -5.757 1031 HG12 VAL 142 1HG2 VAL 142 2.261 4.221 -7.439 1032 HG13 VAL 142 1HG3 VAL 142 2.123 2.859 -6.300 1033 HG21 VAL 142 2HG3 VAL 142 5.103 3.899 -4.271 1034 HG22 VAL 142 2HG1 VAL 142 3.411 4.320 -3.915 1035 HG23 VAL 142 2HG2 VAL 142 3.831 2.662 -4.407 1036 H PHE 143 H PHE 143 3.301 2.015 -8.569 1037 HA PHE 143 HA PHE 143 3.861 3.938 -10.796 1038 HB2 PHE 143 1HB PHE 143 3.903 0.898 -11.021 1039 HB3 PHE 143 2HB PHE 143 4.134 2.040 -12.336 1040 HD1 PHE 143 2HD PHE 143 6.187 3.417 -12.449 1041 HD2 PHE 143 1HD PHE 143 5.672 0.358 -9.512 1042 HE1 PHE 143 2HE PHE 143 8.622 3.420 -12.021 1043 HE2 PHE 143 1HE PHE 143 8.106 0.359 -9.080 1044 HZ PHE 143 HZ PHE 143 9.581 1.892 -10.335 1045 H ASP 144 H ASP 144 2.334 4.041 -12.444 1046 HA ASP 144 HA ASP 144 -0.403 3.372 -11.557 1047 HB2 ASP 144 1HB ASP 144 0.180 5.578 -12.644 1048 HB3 ASP 144 2HB ASP 144 0.552 4.706 -14.126 1049 H GLU 145 H GLU 145 -0.204 1.088 -11.568 1050 HA GLU 145 HA GLU 145 -0.265 -0.067 -14.340 1051 HB2 GLU 145 1HB GLU 145 0.672 -1.350 -11.738 1052 HB3 GLU 145 2HB GLU 145 0.540 -2.179 -13.283 1053 HG2 GLU 145 1HG GLU 145 2.224 -0.631 -14.236 1054 HG3 GLU 145 2HG GLU 145 2.380 0.141 -12.659 1055 HA PRO 146 HA PRO 146 -4.388 -0.974 -12.686 1056 HB2 PRO 146 1HB PRO 146 -5.749 -0.461 -14.988 1057 HB3 PRO 146 2HB PRO 146 -5.185 0.892 -14.000 1058 HG2 PRO 146 1HG PRO 146 -3.909 -0.319 -16.489 1059 HG3 PRO 146 2HG PRO 146 -4.205 1.385 -16.130 1060 HD2 PRO 146 1HD PRO 146 -1.767 0.210 -15.690 1061 HD3 PRO 146 2HD PRO 146 -2.395 1.545 -14.642 Start of MODEL 9 1 H MET 1 1H MET 1 -6.807 5.755 -14.200 2 HA MET 1 HA MET 1 -6.984 3.029 -14.629 3 HB2 MET 1 1HB MET 1 -4.694 5.010 -14.419 4 HB3 MET 1 2HB MET 1 -4.481 3.333 -14.900 5 HG2 MET 1 1HG MET 1 -6.042 3.731 -16.812 6 HG3 MET 1 2HG MET 1 -6.109 5.435 -16.354 7 HE1 MET 1 3HE MET 1 -3.287 6.300 -15.530 8 HE2 MET 1 1HE MET 1 -2.557 6.750 -17.090 9 HE3 MET 1 2HE MET 1 -4.255 7.166 -16.747 10 H ALA 2 H ALA 2 -6.106 1.287 -13.645 11 HA ALA 2 HA ALA 2 -5.974 1.357 -10.762 12 HB1 ALA 2 3HB ALA 2 -5.109 -0.796 -12.723 13 HB2 ALA 2 1HB ALA 2 -5.304 -1.009 -10.968 14 HB3 ALA 2 2HB ALA 2 -6.719 -0.641 -11.984 15 H LYS 3 H LYS 3 -4.221 0.871 -9.399 16 HA LYS 3 HA LYS 3 -1.542 1.534 -10.565 17 HB2 LYS 3 1HB LYS 3 -2.768 2.671 -8.020 18 HB3 LYS 3 2HB LYS 3 -1.090 2.874 -8.504 19 HG2 LYS 3 1HG LYS 3 -1.764 4.135 -10.478 20 HG3 LYS 3 2HG LYS 3 -3.471 3.851 -10.108 21 HD2 LYS 3 1HD LYS 3 -3.158 5.047 -7.932 22 HD3 LYS 3 2HD LYS 3 -1.490 5.403 -8.402 23 HE2 LYS 3 1HE LYS 3 -3.751 6.159 -10.244 24 HE3 LYS 3 2HE LYS 3 -3.386 7.170 -8.843 25 HZ1 LYS 3 3HZ LYS 3 -1.479 6.438 -10.965 26 HZ2 LYS 3 1HZ LYS 3 -2.217 7.902 -10.789 27 HZ3 LYS 3 2HZ LYS 3 -1.138 7.381 -9.655 28 H LYS 4 H LYS 4 0.248 0.683 -9.560 29 HA LYS 4 HA LYS 4 -0.254 -1.149 -7.251 30 HB2 LYS 4 1HB LYS 4 1.389 -1.821 -9.725 31 HB3 LYS 4 2HB LYS 4 1.325 -2.788 -8.259 32 HG2 LYS 4 1HG LYS 4 -1.129 -3.104 -8.623 33 HG3 LYS 4 2HG LYS 4 -0.972 -2.234 -10.156 34 HD2 LYS 4 1HD LYS 4 0.670 -3.915 -10.941 35 HD3 LYS 4 2HD LYS 4 0.506 -4.786 -9.410 36 HE2 LYS 4 1HE LYS 4 -1.978 -4.990 -9.913 37 HE3 LYS 4 2HE LYS 4 -1.630 -4.355 -11.524 38 HZ1 LYS 4 3HZ LYS 4 -0.468 -6.799 -10.364 39 HZ2 LYS 4 1HZ LYS 4 -1.659 -6.740 -11.503 40 HZ3 LYS 4 2HZ LYS 4 -0.142 -6.205 -11.869 41 H GLY 5 H GLY 5 1.874 -1.900 -6.295 42 HA2 GLY 5 1HA GLY 5 4.205 -0.234 -6.730 43 HA3 GLY 5 2HA GLY 5 3.337 0.211 -5.242 44 H TYR 6 H TYR 6 5.763 -0.556 -4.732 45 HA TYR 6 HA TYR 6 5.373 -3.138 -3.351 46 HB2 TYR 6 1HB TYR 6 7.435 -4.129 -4.186 47 HB3 TYR 6 2HB TYR 6 6.341 -3.820 -5.527 48 HD1 TYR 6 1HD TYR 6 9.456 -2.771 -3.867 49 HD2 TYR 6 2HD TYR 6 6.854 -2.197 -7.229 50 HE1 TYR 6 1HE TYR 6 11.231 -1.498 -5.023 51 HE2 TYR 6 2HE TYR 6 8.629 -0.924 -8.386 52 HH TYR 6 HH TYR 6 11.630 -0.071 -6.771 53 H ILE 7 H ILE 7 6.547 -3.382 -1.520 54 HA ILE 7 HA ILE 7 8.466 -1.162 -0.855 55 HB ILE 7 HB ILE 7 6.881 -3.035 0.975 56 HG12 ILE 7 1HG1 ILE 7 6.648 -0.038 0.626 57 HG13 ILE 7 1HG2 ILE 7 5.566 -1.212 -0.105 58 HG21 ILE 7 2HG1 ILE 7 7.855 -1.716 2.812 59 HG22 ILE 7 2HG2 ILE 7 9.123 -2.531 1.867 60 HG23 ILE 7 2HG3 ILE 7 8.824 -0.792 1.640 61 HD11 ILE 7 1HD3 ILE 7 6.004 -0.822 2.864 62 HD12 ILE 7 1HD1 ILE 7 4.601 -0.272 1.919 63 HD13 ILE 7 1HD2 ILE 7 4.909 -2.013 2.123 64 H LEU 8 H LEU 8 10.356 -1.760 -1.581 65 HA LEU 8 HA LEU 8 11.388 -4.459 -1.042 66 HB2 LEU 8 1HB LEU 8 12.088 -3.173 -3.050 67 HB3 LEU 8 2HB LEU 8 12.765 -1.918 -2.008 68 HG LEU 8 HG LEU 8 14.370 -3.649 -1.105 69 HD11 LEU 8 1HD1 LEU 8 14.666 -5.699 -2.422 70 HD12 LEU 8 1HD2 LEU 8 13.058 -5.631 -1.663 71 HD13 LEU 8 1HD3 LEU 8 13.240 -5.278 -3.398 72 HD21 LEU 8 2HD3 LEU 8 14.992 -2.010 -2.850 73 HD22 LEU 8 2HD1 LEU 8 15.803 -3.572 -3.118 74 HD23 LEU 8 2HD2 LEU 8 14.393 -3.122 -4.105 75 H MET 9 H MET 9 12.181 -5.156 0.761 76 HA MET 9 HA MET 9 12.794 -3.200 2.909 77 HB2 MET 9 1HB MET 9 12.747 -6.234 3.025 78 HB3 MET 9 2HB MET 9 12.776 -5.123 4.386 79 HG2 MET 9 1HG MET 9 10.505 -5.511 2.418 80 HG3 MET 9 2HG MET 9 10.554 -6.032 4.104 81 HE1 MET 9 3HE MET 9 11.821 -3.646 5.667 82 HE2 MET 9 1HE MET 9 10.378 -2.688 6.078 83 HE3 MET 9 2HE MET 9 10.322 -4.465 6.168 84 H GLU 10 H GLU 10 14.690 -3.030 3.999 85 HA GLU 10 HA GLU 10 17.051 -3.279 2.382 86 HB2 GLU 10 1HB GLU 10 16.701 -1.597 4.233 87 HB3 GLU 10 2HB GLU 10 16.855 -2.903 5.400 88 HG2 GLU 10 1HG GLU 10 19.141 -3.307 4.743 89 HG3 GLU 10 2HG GLU 10 19.009 -2.163 3.409 90 H ASN 11 H ASN 11 15.501 -5.454 4.605 91 HA ASN 11 HA ASN 11 17.959 -7.107 4.855 92 HB2 ASN 11 1HB ASN 11 15.222 -7.236 6.137 93 HB3 ASN 11 2HB ASN 11 16.423 -8.506 6.319 94 HD21 ASN 11 2HD2 ASN 11 15.253 -5.626 7.547 95 HD22 ASN 11 2HD1 ASN 11 16.572 -5.229 8.597 96 H GLY 12 H GLY 12 16.068 -6.710 2.383 97 HA2 GLY 12 1HA GLY 12 16.533 -8.124 0.507 98 HA3 GLY 12 2HA GLY 12 16.644 -9.520 1.603 99 H GLY 13 H GLY 13 14.065 -7.955 2.760 100 HA2 GLY 13 1HA GLY 13 12.142 -9.737 1.530 101 HA3 GLY 13 2HA GLY 13 11.794 -8.431 2.686 102 H LYS 14 H LYS 14 10.100 -8.955 0.555 103 HA LYS 14 HA LYS 14 10.027 -6.296 -0.643 104 HB2 LYS 14 1HB LYS 14 11.596 -7.500 -2.187 105 HB3 LYS 14 2HB LYS 14 10.343 -8.696 -2.488 106 HG2 LYS 14 1HG LYS 14 8.921 -7.046 -3.533 107 HG3 LYS 14 2HG LYS 14 10.024 -5.741 -3.076 108 HD2 LYS 14 1HD LYS 14 11.802 -6.771 -4.473 109 HD3 LYS 14 2HD LYS 14 10.672 -8.045 -4.952 110 HE2 LYS 14 1HE LYS 14 9.151 -6.263 -5.870 111 HE3 LYS 14 2HE LYS 14 10.405 -5.071 -5.517 112 HZ1 LYS 14 3HZ LYS 14 10.704 -7.381 -7.317 113 HZ2 LYS 14 1HZ LYS 14 10.505 -5.811 -7.782 114 HZ3 LYS 14 2HZ LYS 14 11.876 -6.269 -6.987 115 H ILE 15 H ILE 15 8.048 -5.769 -0.175 116 HA ILE 15 HA ILE 15 5.891 -7.832 -0.488 117 HB ILE 15 HB ILE 15 5.912 -5.155 0.998 118 HG12 ILE 15 1HG1 ILE 15 5.865 -7.955 2.141 119 HG13 ILE 15 1HG2 ILE 15 7.311 -6.966 2.013 120 HG21 ILE 15 2HG1 ILE 15 3.728 -5.881 1.871 121 HG22 ILE 15 2HG2 ILE 15 3.692 -5.737 0.098 122 HG23 ILE 15 2HG3 ILE 15 3.804 -7.342 0.857 123 HD11 ILE 15 1HD3 ILE 15 4.824 -6.264 3.588 124 HD12 ILE 15 1HD1 ILE 15 6.367 -6.852 4.250 125 HD13 ILE 15 1HD2 ILE 15 6.288 -5.261 3.456 126 H GLU 16 H GLU 16 4.868 -7.890 -2.274 127 HA GLU 16 HA GLU 16 4.567 -5.366 -3.842 128 HB2 GLU 16 1HB GLU 16 5.522 -7.390 -4.977 129 HB3 GLU 16 2HB GLU 16 4.032 -8.259 -4.637 130 HG2 GLU 16 1HG GLU 16 2.769 -6.689 -6.022 131 HG3 GLU 16 2HG GLU 16 4.233 -5.754 -6.322 132 H PHE 17 H PHE 17 2.713 -4.386 -4.204 133 HA PHE 17 HA PHE 17 0.206 -5.662 -3.222 134 HB2 PHE 17 1HB PHE 17 -0.327 -3.702 -1.843 135 HB3 PHE 17 2HB PHE 17 1.153 -4.459 -1.274 136 HD1 PHE 17 1HD PHE 17 -0.266 -1.545 -3.006 137 HD2 PHE 17 2HD PHE 17 3.278 -3.340 -1.435 138 HE1 PHE 17 1HE PHE 17 0.909 0.622 -3.188 139 HE2 PHE 17 2HE PHE 17 4.457 -1.174 -1.614 140 HZ PHE 17 HZ PHE 17 3.271 0.808 -2.491 141 H GLU 18 H GLU 18 -1.722 -4.600 -3.849 142 HA GLU 18 HA GLU 18 -1.358 -2.816 -6.230 143 HB2 GLU 18 1HB GLU 18 -3.734 -4.511 -5.347 144 HB3 GLU 18 2HB GLU 18 -3.728 -3.442 -6.742 145 HG2 GLU 18 1HG GLU 18 -1.922 -4.786 -7.756 146 HG3 GLU 18 2HG GLU 18 -1.956 -5.866 -6.365 147 H LEU 19 H LEU 19 -2.845 -1.079 -6.546 148 HA LEU 19 HA LEU 19 -3.824 0.062 -3.948 149 HB2 LEU 19 1HB LEU 19 -2.686 1.477 -6.394 150 HB3 LEU 19 2HB LEU 19 -3.431 2.297 -5.018 151 HG LEU 19 HG LEU 19 -0.920 0.594 -4.855 152 HD11 LEU 19 1HD1 LEU 19 0.253 2.740 -4.655 153 HD12 LEU 19 1HD2 LEU 19 -0.570 2.585 -6.225 154 HD13 LEU 19 1HD3 LEU 19 -1.275 3.603 -4.947 155 HD21 LEU 19 2HD3 LEU 19 -2.239 0.710 -2.767 156 HD22 LEU 19 2HD1 LEU 19 -0.727 1.638 -2.623 157 HD23 LEU 19 2HD2 LEU 19 -2.269 2.486 -2.886 158 H PHE 20 H PHE 20 -5.662 1.411 -4.009 159 HA PHE 20 HA PHE 20 -7.468 0.841 -6.331 160 HB2 PHE 20 1HB PHE 20 -8.234 0.651 -3.387 161 HB3 PHE 20 2HB PHE 20 -9.297 0.381 -4.760 162 HD1 PHE 20 2HD PHE 20 -8.822 -1.572 -6.304 163 HD2 PHE 20 1HD PHE 20 -6.914 -1.083 -2.512 164 HE1 PHE 20 2HE PHE 20 -8.228 -3.972 -6.296 165 HE2 PHE 20 1HE PHE 20 -6.317 -3.482 -2.501 166 HZ PHE 20 HZ PHE 20 -6.974 -4.926 -4.394 167 HA PRO 21 HA PRO 21 -7.366 5.368 -5.520 168 HB2 PRO 21 1HB PRO 21 -8.256 5.083 -8.423 169 HB3 PRO 21 2HB PRO 21 -7.117 6.247 -7.734 170 HG2 PRO 21 1HG PRO 21 -6.139 4.208 -9.133 171 HG3 PRO 21 2HG PRO 21 -5.344 4.659 -7.622 172 HD2 PRO 21 1HD PRO 21 -7.292 2.386 -8.161 173 HD3 PRO 21 2HD PRO 21 -5.787 2.386 -7.158 174 H ASN 22 H ASN 22 -9.709 3.208 -7.028 175 HA ASN 22 HA ASN 22 -11.935 5.049 -6.760 176 HB2 ASN 22 1HB ASN 22 -11.756 2.053 -7.145 177 HB3 ASN 22 2HB ASN 22 -13.286 2.912 -7.018 178 HD21 ASN 22 2HD2 ASN 22 -12.459 1.429 -9.257 179 HD22 ASN 22 2HD1 ASN 22 -12.281 2.519 -10.592 180 H GLU 23 H GLU 23 -10.419 2.703 -4.637 181 HA GLU 23 HA GLU 23 -12.613 2.780 -2.689 182 HB2 GLU 23 1HB GLU 23 -11.116 0.788 -2.976 183 HB3 GLU 23 2HB GLU 23 -9.757 1.751 -2.416 184 HG2 GLU 23 1HG GLU 23 -10.725 1.985 -0.230 185 HG3 GLU 23 2HG GLU 23 -12.237 1.253 -0.762 186 H ALA 24 H ALA 24 -9.417 4.280 -3.035 187 HA ALA 24 HA ALA 24 -10.321 6.393 -1.180 188 HB1 ALA 24 3HB ALA 24 -7.767 4.808 -0.728 189 HB2 ALA 24 1HB ALA 24 -8.252 6.271 0.160 190 HB3 ALA 24 2HB ALA 24 -9.213 4.780 0.308 191 HA PRO 25 HA PRO 25 -8.342 7.882 -5.024 192 HB2 PRO 25 1HB PRO 25 -9.905 10.298 -3.978 193 HB3 PRO 25 2HB PRO 25 -9.756 9.729 -5.646 194 HG2 PRO 25 1HG PRO 25 -12.016 9.216 -4.340 195 HG3 PRO 25 2HG PRO 25 -11.293 7.939 -5.322 196 HD2 PRO 25 1HD PRO 25 -11.232 8.313 -2.312 197 HD3 PRO 25 2HD PRO 25 -11.369 6.786 -3.274 198 H VAL 26 H VAL 26 -8.766 10.024 -2.177 199 HA VAL 26 HA VAL 26 -6.379 11.544 -2.912 200 HB VAL 26 HB VAL 26 -8.017 11.449 -0.332 201 HG11 VAL 26 1HG1 VAL 26 -6.964 13.594 0.194 202 HG12 VAL 26 1HG2 VAL 26 -5.772 12.279 0.072 203 HG13 VAL 26 1HG3 VAL 26 -5.946 13.449 -1.258 204 HG21 VAL 26 2HG3 VAL 26 -9.322 12.181 -2.298 205 HG22 VAL 26 2HG1 VAL 26 -9.023 13.541 -1.189 206 HG23 VAL 26 2HG2 VAL 26 -8.069 13.385 -2.683 207 H THR 27 H THR 27 -7.064 9.033 -0.508 208 HA THR 27 HA THR 27 -4.534 9.184 0.817 209 HB THR 27 HB THR 27 -6.337 6.754 0.416 210 HG1 THR 27 1HG THR 27 -7.478 8.367 1.466 211 HG21 THR 27 2HG3 THR 27 -4.195 7.358 2.490 212 HG22 THR 27 2HG1 THR 27 -5.245 5.923 2.462 213 HG23 THR 27 2HG2 THR 27 -4.054 6.180 1.165 214 H VAL 28 H VAL 28 -5.596 7.120 -1.896 215 HA VAL 28 HA VAL 28 -3.051 5.841 -2.323 216 HB VAL 28 HB VAL 28 -5.332 6.534 -4.234 217 HG11 VAL 28 1HG1 VAL 28 -4.338 4.914 -5.773 218 HG12 VAL 28 1HG2 VAL 28 -3.261 6.299 -5.478 219 HG13 VAL 28 1HG3 VAL 28 -2.942 4.737 -4.685 220 HG21 VAL 28 2HG3 VAL 28 -5.926 4.964 -2.421 221 HG22 VAL 28 2HG1 VAL 28 -5.882 4.134 -3.994 222 HG23 VAL 28 2HG2 VAL 28 -4.534 3.941 -2.848 223 H ALA 29 H ALA 29 -4.409 8.819 -3.717 224 HA ALA 29 HA ALA 29 -2.252 9.367 -5.460 225 HB1 ALA 29 3HB ALA 29 -4.013 11.322 -3.940 226 HB2 ALA 29 1HB ALA 29 -3.007 11.714 -5.352 227 HB3 ALA 29 2HB ALA 29 -4.380 10.594 -5.521 228 H ASN 30 H ASN 30 -2.725 10.400 -2.074 229 HA ASN 30 HA ASN 30 -0.269 11.899 -1.939 230 HB2 ASN 30 1HB ASN 30 -2.042 10.676 0.187 231 HB3 ASN 30 2HB ASN 30 -0.611 11.629 0.557 232 HD21 ASN 30 2HD2 ASN 30 -3.108 12.379 1.429 233 HD22 ASN 30 2HD1 ASN 30 -3.593 13.827 0.612 234 H PHE 31 H PHE 31 -1.085 8.565 -0.981 235 HA PHE 31 HA PHE 31 1.459 7.853 0.066 236 HB2 PHE 31 1HB PHE 31 -0.609 6.442 0.211 237 HB3 PHE 31 2HB PHE 31 -0.487 6.114 -1.510 238 HD1 PHE 31 1HD PHE 31 1.055 5.528 1.781 239 HD2 PHE 31 2HD PHE 31 1.114 4.554 -2.379 240 HE1 PHE 31 1HE PHE 31 2.528 3.600 2.255 241 HE2 PHE 31 2HE PHE 31 2.585 2.624 -1.909 242 HZ PHE 31 HZ PHE 31 3.294 2.148 0.409 243 H GLU 32 H GLU 32 0.253 7.641 -3.285 244 HA GLU 32 HA GLU 32 2.667 6.568 -4.394 245 HB2 GLU 32 1HB GLU 32 0.579 6.544 -5.660 246 HB3 GLU 32 2HB GLU 32 0.473 8.298 -5.611 247 HG2 GLU 32 1HG GLU 32 2.371 8.532 -7.061 248 HG3 GLU 32 2HG GLU 32 2.727 6.808 -6.967 249 H LYS 33 H LYS 33 1.567 9.938 -4.022 250 HA LYS 33 HA LYS 33 3.772 11.131 -5.384 251 HB2 LYS 33 1HB LYS 33 1.944 12.153 -3.182 252 HB3 LYS 33 2HB LYS 33 3.174 13.154 -3.941 253 HG2 LYS 33 1HG LYS 33 2.090 12.876 -6.124 254 HG3 LYS 33 2HG LYS 33 0.875 11.816 -5.397 255 HD2 LYS 33 1HD LYS 33 0.157 13.672 -3.913 256 HD3 LYS 33 2HD LYS 33 1.357 14.730 -4.668 257 HE2 LYS 33 1HE LYS 33 0.245 14.418 -6.861 258 HE3 LYS 33 2HE LYS 33 -0.960 13.378 -6.099 259 HZ1 LYS 33 3HZ LYS 33 -0.498 16.213 -5.452 260 HZ2 LYS 33 1HZ LYS 33 -1.752 15.616 -6.340 261 HZ3 LYS 33 2HZ LYS 33 -1.623 15.241 -4.739 262 H LEU 34 H LEU 34 3.353 10.271 -1.961 263 HA LEU 34 HA LEU 34 5.895 11.352 -1.126 264 HB2 LEU 34 1HB LEU 34 4.088 9.196 0.036 265 HB3 LEU 34 2HB LEU 34 5.551 9.777 0.837 266 HG LEU 34 HG LEU 34 3.171 11.535 0.150 267 HD11 LEU 34 1HD1 LEU 34 2.644 11.393 2.544 268 HD12 LEU 34 1HD2 LEU 34 2.550 9.801 1.754 269 HD13 LEU 34 1HD3 LEU 34 3.957 10.213 2.763 270 HD21 LEU 34 2HD3 LEU 34 5.341 12.707 0.331 271 HD22 LEU 34 2HD1 LEU 34 4.282 13.101 1.707 272 HD23 LEU 34 2HD2 LEU 34 5.621 11.945 1.915 273 H ALA 35 H ALA 35 4.873 8.042 -1.986 274 HA ALA 35 HA ALA 35 7.368 6.815 -1.436 275 HB1 ALA 35 3HB ALA 35 5.274 6.050 -3.502 276 HB2 ALA 35 1HB ALA 35 6.575 4.996 -2.903 277 HB3 ALA 35 2HB ALA 35 5.295 5.545 -1.796 278 H ASN 36 H ASN 36 6.151 8.315 -4.422 279 HA ASN 36 HA ASN 36 8.555 7.505 -5.914 280 HB2 ASN 36 1HB ASN 36 6.125 9.168 -6.613 281 HB3 ASN 36 2HB ASN 36 7.476 8.931 -7.713 282 HD21 ASN 36 2HD2 ASN 36 4.880 8.143 -8.306 283 HD22 ASN 36 2HD1 ASN 36 4.825 6.414 -8.393 284 H GLU 37 H GLU 37 7.882 9.938 -3.724 285 HA GLU 37 HA GLU 37 10.026 11.673 -4.879 286 HB2 GLU 37 1HB GLU 37 8.020 12.035 -2.628 287 HB3 GLU 37 2HB GLU 37 9.416 13.088 -2.800 288 HG2 GLU 37 1HG GLU 37 8.661 13.789 -5.007 289 HG3 GLU 37 2HG GLU 37 7.304 12.667 -4.925 290 H GLY 38 H GLY 38 9.907 8.917 -3.194 291 HA2 GLY 38 1HA GLY 38 11.669 7.825 -2.134 292 HA3 GLY 38 2HA GLY 38 12.625 9.322 -2.235 293 H PHE 39 H PHE 39 9.460 9.579 -0.884 294 HA PHE 39 HA PHE 39 10.498 10.429 1.691 295 HB2 PHE 39 1HB PHE 39 8.414 11.368 0.761 296 HB3 PHE 39 2HB PHE 39 7.668 9.777 0.766 297 HD1 PHE 39 1HD PHE 39 9.018 12.449 2.949 298 HD2 PHE 39 2HD PHE 39 6.649 8.901 2.706 299 HE1 PHE 39 1HE PHE 39 8.196 12.843 5.247 300 HE2 PHE 39 2HE PHE 39 5.823 9.294 5.004 301 HZ PHE 39 HZ PHE 39 6.598 11.266 6.274 302 H TYR 40 H TYR 40 8.502 7.619 0.728 303 HA TYR 40 HA TYR 40 8.674 6.410 3.354 304 HB2 TYR 40 1HB TYR 40 7.786 5.445 0.625 305 HB3 TYR 40 2HB TYR 40 7.903 4.337 1.986 306 HD1 TYR 40 2HD TYR 40 6.687 5.119 4.192 307 HD2 TYR 40 1HD TYR 40 5.808 6.575 0.253 308 HE1 TYR 40 2HE TYR 40 4.438 5.810 4.949 309 HE2 TYR 40 1HE TYR 40 3.559 7.265 1.010 310 HH TYR 40 HH TYR 40 2.522 6.769 4.387 311 H ASN 41 H ASN 41 10.687 6.310 0.499 312 HA ASN 41 HA ASN 41 12.330 4.082 1.233 313 HB2 ASN 41 1HB ASN 41 12.427 5.210 -0.962 314 HB3 ASN 41 2HB ASN 41 13.097 6.645 -0.194 315 HD21 ASN 41 2HD2 ASN 41 14.291 5.058 -2.258 316 HD22 ASN 41 2HD1 ASN 41 15.777 4.433 -1.625 317 H GLY 42 H GLY 42 13.149 3.766 3.148 318 HA2 GLY 42 1HA GLY 42 15.135 4.235 4.490 319 HA3 GLY 42 2HA GLY 42 14.818 5.973 4.278 320 H LEU 43 H LEU 43 11.832 4.823 4.649 321 HA LEU 43 HA LEU 43 11.802 5.325 7.572 322 HB2 LEU 43 1HB LEU 43 9.480 4.782 5.683 323 HB3 LEU 43 2HB LEU 43 9.391 5.447 7.317 324 HG LEU 43 HG LEU 43 10.404 6.805 4.806 325 HD11 LEU 43 1HD1 LEU 43 8.646 8.420 5.376 326 HD12 LEU 43 1HD2 LEU 43 7.987 6.781 5.158 327 HD13 LEU 43 1HD3 LEU 43 8.207 7.441 6.796 328 HD21 LEU 43 2HD3 LEU 43 11.950 7.285 6.674 329 HD22 LEU 43 2HD1 LEU 43 10.974 8.716 6.265 330 HD23 LEU 43 2HD2 LEU 43 10.569 7.742 7.700 331 H THR 44 H THR 44 10.423 3.984 8.963 332 HA THR 44 HA THR 44 11.042 1.111 8.347 333 HB THR 44 HB THR 44 11.663 0.807 10.693 334 HG1 THR 44 1HG THR 44 10.273 2.443 11.559 335 HG21 THR 44 2HG3 THR 44 13.051 3.238 9.501 336 HG22 THR 44 2HG1 THR 44 13.703 2.185 10.777 337 HG23 THR 44 2HG2 THR 44 13.438 1.540 9.139 338 H PHE 45 H PHE 45 9.832 -0.472 9.573 339 HA PHE 45 HA PHE 45 7.070 0.429 10.214 340 HB2 PHE 45 1HB PHE 45 8.387 -2.312 10.054 341 HB3 PHE 45 2HB PHE 45 6.737 -2.067 10.605 342 HD1 PHE 45 2HD PHE 45 4.985 -1.368 9.060 343 HD2 PHE 45 1HD PHE 45 8.983 -2.059 7.724 344 HE1 PHE 45 2HE PHE 45 4.187 -1.449 6.721 345 HE2 PHE 45 1HE PHE 45 8.190 -2.138 5.384 346 HZ PHE 45 HZ PHE 45 5.791 -1.833 4.883 347 H HIS 46 H HIS 46 6.896 1.412 12.101 348 HA HIS 46 HA HIS 46 8.842 0.802 14.217 349 HB2 HIS 46 1HB HIS 46 7.806 2.702 15.391 350 HB3 HIS 46 2HB HIS 46 8.217 3.147 13.741 351 HD2 HIS 46 2HD HIS 46 5.307 3.523 16.052 352 HE1 HIS 46 1HE HIS 46 3.625 3.548 12.135 353 H ARG 47 H ARG 47 5.710 -0.249 13.374 354 HA ARG 47 HA ARG 47 5.573 -1.698 15.981 355 HB2 ARG 47 1HB ARG 47 3.279 -0.220 14.634 356 HB3 ARG 47 2HB ARG 47 3.081 -1.369 15.947 357 HG2 ARG 47 1HG ARG 47 4.707 1.176 16.157 358 HG3 ARG 47 2HG ARG 47 3.005 1.010 16.652 359 HD2 ARG 47 1HD ARG 47 3.688 -0.803 18.181 360 HD3 ARG 47 2HD ARG 47 5.382 -0.464 17.757 361 HE ARG 47 HE ARG 47 3.603 1.149 19.423 362 HH11 ARG 47 1HH1 ARG 47 6.620 0.979 17.630 363 HH12 ARG 47 1HH2 ARG 47 7.364 2.292 18.513 364 HH21 ARG 47 2HH1 ARG 47 4.580 2.851 20.563 365 HH22 ARG 47 2HH2 ARG 47 6.211 3.353 20.173 366 H VAL 48 H VAL 48 6.520 -3.374 14.684 367 HA VAL 48 HA VAL 48 4.749 -4.637 12.654 368 HB VAL 48 HB VAL 48 7.392 -5.543 13.895 369 HG11 VAL 48 1HG1 VAL 48 7.490 -7.116 12.024 370 HG12 VAL 48 1HG2 VAL 48 6.074 -7.404 13.064 371 HG13 VAL 48 1HG3 VAL 48 5.876 -6.586 11.494 372 HG21 VAL 48 2HG3 VAL 48 7.624 -3.453 12.597 373 HG22 VAL 48 2HG1 VAL 48 8.386 -4.818 11.748 374 HG23 VAL 48 2HG2 VAL 48 6.797 -4.216 11.218 375 H ILE 49 H ILE 49 3.254 -6.015 12.996 376 HA ILE 49 HA ILE 49 3.361 -7.671 15.495 377 HB ILE 49 HB ILE 49 0.835 -6.364 14.380 378 HG12 ILE 49 1HG1 ILE 49 2.471 -5.490 16.773 379 HG13 ILE 49 1HG2 ILE 49 2.371 -4.640 15.240 380 HG21 ILE 49 2HG1 ILE 49 -0.133 -7.081 16.527 381 HG22 ILE 49 2HG2 ILE 49 0.507 -8.470 15.619 382 HG23 ILE 49 2HG3 ILE 49 1.424 -7.806 16.992 383 HD11 ILE 49 1HD3 ILE 49 0.060 -5.164 17.121 384 HD12 ILE 49 1HD1 ILE 49 0.919 -3.622 16.902 385 HD13 ILE 49 1HD2 ILE 49 -0.041 -4.305 15.567 386 HA PRO 50 HA PRO 50 2.934 -10.440 11.941 387 HB2 PRO 50 1HB PRO 50 4.143 -12.234 14.071 388 HB3 PRO 50 2HB PRO 50 4.633 -12.052 12.382 389 HG2 PRO 50 1HG PRO 50 6.164 -10.961 14.268 390 HG3 PRO 50 2HG PRO 50 5.834 -10.041 12.797 391 HD2 PRO 50 1HD PRO 50 4.511 -9.815 15.535 392 HD3 PRO 50 2HD PRO 50 5.092 -8.496 14.442 393 H GLY 51 H GLY 51 1.291 -11.644 11.494 394 HA2 GLY 51 1HA GLY 51 -0.319 -13.328 11.882 395 HA3 GLY 51 2HA GLY 51 0.007 -13.229 13.628 396 H PHE 52 H PHE 52 -0.207 -10.111 12.760 397 HA PHE 52 HA PHE 52 -3.193 -9.981 12.829 398 HB2 PHE 52 1HB PHE 52 -1.288 -8.427 14.631 399 HB3 PHE 52 2HB PHE 52 -3.012 -8.121 14.488 400 HD1 PHE 52 2HD PHE 52 -4.648 -9.790 15.309 401 HD2 PHE 52 1HD PHE 52 -0.446 -10.238 15.935 402 HE1 PHE 52 2HE PHE 52 -5.092 -11.449 17.087 403 HE2 PHE 52 1HE PHE 52 -0.886 -11.901 17.711 404 HZ PHE 52 HZ PHE 52 -3.209 -12.506 18.287 405 H VAL 53 H VAL 53 -1.692 -7.049 13.462 406 HA VAL 53 HA VAL 53 -1.480 -6.317 10.560 407 HB VAL 53 HB VAL 53 -3.027 -4.728 12.661 408 HG11 VAL 53 1HG1 VAL 53 -3.678 -3.317 10.770 409 HG12 VAL 53 1HG2 VAL 53 -1.914 -3.340 11.008 410 HG13 VAL 53 1HG3 VAL 53 -2.648 -4.289 9.693 411 HG21 VAL 53 2HG3 VAL 53 -4.258 -6.766 12.006 412 HG22 VAL 53 2HG1 VAL 53 -5.038 -5.311 11.343 413 HG23 VAL 53 2HG2 VAL 53 -4.045 -6.347 10.290 414 H SER 54 H SER 54 0.308 -5.402 10.111 415 HA SER 54 HA SER 54 2.009 -4.240 12.291 416 HB2 SER 54 1HB SER 54 2.595 -4.908 9.457 417 HB3 SER 54 2HB SER 54 3.704 -4.163 10.599 418 HG SER 54 HG SER 54 3.921 -6.386 10.540 419 H GLN 55 H GLN 55 2.912 -2.167 12.111 420 HA GLN 55 HA GLN 55 1.624 -0.309 10.160 421 HB2 GLN 55 1HB GLN 55 0.397 -0.175 12.344 422 HB3 GLN 55 2HB GLN 55 1.911 0.216 13.149 423 HG2 GLN 55 1HG GLN 55 2.105 2.259 11.783 424 HG3 GLN 55 2HG GLN 55 0.540 1.868 11.018 425 HE21 GLN 55 2HE2 GLN 55 0.419 4.217 12.031 426 HE22 GLN 55 2HE1 GLN 55 -0.336 4.275 13.589 427 H GLY 56 H GLY 56 2.855 1.261 9.359 428 HA2 GLY 56 1HA GLY 56 5.500 1.813 10.526 429 HA3 GLY 56 2HA GLY 56 5.512 0.962 8.963 430 H GLY 57 H GLY 57 6.767 3.133 8.649 431 HA2 GLY 57 1HA GLY 57 6.382 4.741 6.816 432 HA3 GLY 57 2HA GLY 57 4.801 5.104 7.547 433 H CYS 58 H CYS 58 7.574 4.587 9.593 434 HA CYS 58 HA CYS 58 7.564 7.534 10.325 435 HB2 CYS 58 1HB CYS 58 7.884 5.160 12.097 436 HB3 CYS 58 2HB CYS 58 8.155 6.837 12.550 437 HG CYS 58 HG CYS 58 5.756 7.657 11.943 438 HA PRO 59 HA PRO 59 11.909 7.401 9.206 439 HB2 PRO 59 1HB PRO 59 11.892 9.722 11.172 440 HB3 PRO 59 2HB PRO 59 12.556 9.678 9.534 441 HG2 PRO 59 1HG PRO 59 10.272 10.983 9.927 442 HG3 PRO 59 2HG PRO 59 10.422 9.941 8.508 443 HD2 PRO 59 1HD PRO 59 9.060 9.367 11.174 444 HD3 PRO 59 2HD PRO 59 8.474 9.018 9.498 445 H ARG 60 H ARG 60 12.638 5.609 10.093 446 HA ARG 60 HA ARG 60 13.624 4.228 11.688 447 HB2 ARG 60 1HB ARG 60 14.531 6.915 12.795 448 HB3 ARG 60 2HB ARG 60 15.217 5.354 13.220 449 HG2 ARG 60 1HG ARG 60 16.025 5.047 10.942 450 HG3 ARG 60 2HG ARG 60 15.270 6.582 10.452 451 HD2 ARG 60 1HD ARG 60 16.666 7.711 12.176 452 HD3 ARG 60 2HD ARG 60 17.519 6.167 12.400 453 HE ARG 60 HE ARG 60 17.534 6.741 9.656 454 HH11 ARG 60 1HH1 ARG 60 18.808 8.093 12.637 455 HH12 ARG 60 1HH2 ARG 60 20.208 8.803 11.864 456 HH21 ARG 60 2HH1 ARG 60 19.354 7.666 8.664 457 HH22 ARG 60 2HH2 ARG 60 20.517 8.562 9.616 458 H GLY 61 H GLY 61 10.884 5.151 12.169 459 HA2 GLY 61 1HA GLY 61 9.303 4.805 13.821 460 HA3 GLY 61 2HA GLY 61 10.571 3.998 14.771 461 H ASN 62 H ASN 62 10.838 7.311 13.611 462 HA ASN 62 HA ASN 62 10.956 8.294 16.402 463 HB2 ASN 62 1HB ASN 62 11.441 9.595 13.713 464 HB3 ASN 62 2HB ASN 62 11.452 10.483 15.229 465 HD21 ASN 62 2HD2 ASN 62 13.625 10.168 13.401 466 HD22 ASN 62 2HD1 ASN 62 14.896 9.351 14.248 467 H GLY 63 H GLY 63 8.623 7.924 13.949 468 HA2 GLY 63 1HA GLY 63 6.318 8.235 14.284 469 HA3 GLY 63 2HA GLY 63 6.668 9.237 15.711 470 H THR 64 H THR 64 8.061 11.296 14.990 471 HA THR 64 HA THR 64 6.164 12.875 13.460 472 HB THR 64 HB THR 64 8.960 13.643 14.406 473 HG1 THR 64 1HG THR 64 7.786 14.483 16.222 474 HG21 THR 64 2HG3 THR 64 6.503 15.302 13.721 475 HG22 THR 64 2HG1 THR 64 8.051 15.932 14.329 476 HG23 THR 64 2HG2 THR 64 7.972 15.163 12.726 477 H GLY 65 H GLY 65 6.140 11.720 11.464 478 HA2 GLY 65 1HA GLY 65 8.441 12.062 9.687 479 HA3 GLY 65 2HA GLY 65 6.821 11.481 9.240 480 H ASP 66 H ASP 66 7.815 13.069 7.434 481 HA ASP 66 HA ASP 66 6.445 15.694 7.895 482 HB2 ASP 66 1HB ASP 66 8.976 15.899 7.990 483 HB3 ASP 66 2HB ASP 66 9.032 15.309 6.335 484 H ALA 67 H ALA 67 4.850 13.988 6.905 485 HA ALA 67 HA ALA 67 5.060 13.405 4.117 486 HB1 ALA 67 3HB ALA 67 2.584 13.744 5.847 487 HB2 ALA 67 1HB ALA 67 2.633 12.980 4.241 488 HB3 ALA 67 2HB ALA 67 3.496 12.236 5.607 489 H GLY 68 H GLY 68 3.542 16.116 5.853 490 HA2 GLY 68 1HA GLY 68 3.202 18.294 5.036 491 HA3 GLY 68 2HA GLY 68 3.721 17.759 3.420 492 H TYR 69 H TYR 69 1.506 15.590 4.732 493 HA TYR 69 HA TYR 69 -0.776 16.939 3.319 494 HB2 TYR 69 1HB TYR 69 -0.089 13.974 3.396 495 HB3 TYR 69 2HB TYR 69 -1.547 14.660 2.693 496 HD1 TYR 69 2HD TYR 69 -1.348 16.221 0.716 497 HD2 TYR 69 1HD TYR 69 1.934 13.884 2.192 498 HE1 TYR 69 2HE TYR 69 -0.173 16.509 -1.438 499 HE2 TYR 69 1HE TYR 69 3.109 14.173 0.037 500 HH TYR 69 HH TYR 69 3.032 15.070 -1.994 501 H THR 70 H THR 70 -2.662 17.083 4.299 502 HA THR 70 HA THR 70 -3.201 15.329 6.645 503 HB THR 70 HB THR 70 -3.537 18.361 6.697 504 HG1 THR 70 1HG THR 70 -1.925 18.183 8.355 505 HG21 THR 70 2HG3 THR 70 -4.060 16.230 8.803 506 HG22 THR 70 2HG1 THR 70 -4.216 17.986 9.035 507 HG23 THR 70 2HG2 THR 70 -5.305 17.137 7.912 508 H ILE 71 H ILE 71 -4.919 14.237 6.114 509 HA ILE 71 HA ILE 71 -7.143 15.658 4.685 510 HB ILE 71 HB ILE 71 -7.406 13.661 3.230 511 HG12 ILE 71 1HG1 ILE 71 -4.814 12.656 4.422 512 HG13 ILE 71 1HG2 ILE 71 -6.404 12.068 4.883 513 HG21 ILE 71 2HG1 ILE 71 -5.419 13.972 1.809 514 HG22 ILE 71 2HG2 ILE 71 -6.029 15.533 2.407 515 HG23 ILE 71 2HG3 ILE 71 -4.587 14.798 3.148 516 HD11 ILE 71 1HD3 ILE 71 -5.204 11.929 2.108 517 HD12 ILE 71 1HD1 ILE 71 -5.356 10.586 3.265 518 HD13 ILE 71 1HD2 ILE 71 -6.815 11.335 2.575 519 HA PRO 72 HA PRO 72 -9.750 13.445 7.416 520 HB2 PRO 72 1HB PRO 72 -12.100 13.524 6.069 521 HB3 PRO 72 2HB PRO 72 -11.370 15.050 6.590 522 HG2 PRO 72 1HG PRO 72 -11.266 13.718 3.849 523 HG3 PRO 72 2HG PRO 72 -11.647 15.399 4.234 524 HD2 PRO 72 1HD PRO 72 -9.129 14.596 3.468 525 HD3 PRO 72 2HD PRO 72 -9.407 15.984 4.595 526 H CYS 73 H CYS 73 -10.809 11.528 7.783 527 HA CYS 73 HA CYS 73 -9.856 9.179 6.424 528 HB2 CYS 73 1HB CYS 73 -10.607 9.166 8.691 529 HB3 CYS 73 2HB CYS 73 -12.253 9.488 8.166 530 HG CYS 73 HG CYS 73 -12.026 7.036 8.892 531 H GLU 74 H GLU 74 -10.251 8.891 4.280 532 HA GLU 74 HA GLU 74 -12.759 9.587 2.994 533 HB2 GLU 74 1HB GLU 74 -10.481 7.741 2.167 534 HB3 GLU 74 2HB GLU 74 -11.849 8.136 1.137 535 HG2 GLU 74 1HG GLU 74 -11.210 10.542 1.284 536 HG3 GLU 74 2HG GLU 74 -9.784 10.070 2.205 537 H THR 75 H THR 75 -14.524 8.454 2.537 538 HA THR 75 HA THR 75 -14.640 5.646 3.590 539 HB THR 75 HB THR 75 -17.008 6.041 4.154 540 HG1 THR 75 1HG THR 75 -17.790 8.220 4.024 541 HG21 THR 75 2HG3 THR 75 -15.170 8.159 5.332 542 HG22 THR 75 2HG1 THR 75 -16.687 7.576 6.054 543 HG23 THR 75 2HG2 THR 75 -15.299 6.474 5.886 544 H ASP 76 H ASP 76 -14.918 7.695 0.916 545 HA ASP 76 HA ASP 76 -16.547 5.647 -0.552 546 HB2 ASP 76 1HB ASP 76 -16.065 8.601 -1.131 547 HB3 ASP 76 2HB ASP 76 -16.898 7.502 -2.221 548 H ASN 77 H ASN 77 -14.240 4.973 -3.054 549 HA ASN 77 HA ASN 77 -17.075 5.514 -2.273 550 HB2 ASN 77 1HB ASN 77 -15.851 4.250 -4.739 551 HB3 ASN 77 2HB ASN 77 -17.579 4.316 -4.419 552 HD21 ASN 77 2HD2 ASN 77 -14.945 5.899 -5.773 553 HD22 ASN 77 2HD1 ASN 77 -15.676 7.448 -6.029 554 H ASN 78 H ASN 78 -14.594 3.141 -2.040 555 HA ASN 78 HA ASN 78 -16.602 0.949 -1.720 556 HB2 ASN 78 1HB ASN 78 -13.610 0.918 -2.192 557 HB3 ASN 78 2HB ASN 78 -14.562 -0.517 -1.839 558 HD21 ASN 78 2HD2 ASN 78 -13.024 0.116 -4.213 559 HD22 ASN 78 2HD1 ASN 78 -14.134 0.076 -5.542 560 HA PRO 79 HA PRO 79 -16.212 0.696 2.637 561 HB2 PRO 79 1HB PRO 79 -15.972 -2.289 2.089 562 HB3 PRO 79 2HB PRO 79 -17.089 -1.461 3.180 563 HG2 PRO 79 1HG PRO 79 -18.038 -2.398 0.877 564 HG3 PRO 79 2HG PRO 79 -18.542 -0.793 1.415 565 HD2 PRO 79 1HD PRO 79 -16.428 -1.551 -0.642 566 HD3 PRO 79 2HD PRO 79 -17.681 -0.248 -0.723 567 H HIS 80 H HIS 80 -14.797 0.152 4.286 568 HA HIS 80 HA HIS 80 -12.036 -0.421 3.262 569 HB2 HIS 80 1HB HIS 80 -12.854 1.499 5.486 570 HB3 HIS 80 2HB HIS 80 -11.205 1.150 4.986 571 HD2 HIS 80 2HD HIS 80 -14.120 3.474 4.032 572 HE1 HIS 80 1HE HIS 80 -11.097 3.938 1.064 573 H ARG 81 H ARG 81 -12.952 -2.650 3.820 574 HA ARG 81 HA ARG 81 -12.649 -3.285 6.696 575 HB2 ARG 81 1HB ARG 81 -13.105 -5.035 4.248 576 HB3 ARG 81 2HB ARG 81 -13.005 -5.634 5.896 577 HG2 ARG 81 1HG ARG 81 -14.989 -4.226 6.475 578 HG3 ARG 81 2HG ARG 81 -15.122 -3.801 4.751 579 HD2 ARG 81 1HD ARG 81 -16.611 -5.580 5.173 580 HD3 ARG 81 2HD ARG 81 -15.236 -6.241 4.258 581 HE ARG 81 HE ARG 81 -14.836 -6.498 7.085 582 HH11 ARG 81 1HH1 ARG 81 -16.562 -7.885 4.358 583 HH12 ARG 81 1HH2 ARG 81 -16.675 -9.477 5.078 584 HH21 ARG 81 2HH1 ARG 81 -14.989 -8.568 8.009 585 HH22 ARG 81 2HH2 ARG 81 -15.785 -9.863 7.144 586 H HIS 82 H HIS 82 -11.077 -4.549 7.598 587 HA HIS 82 HA HIS 82 -8.483 -4.410 6.124 588 HB2 HIS 82 1HB HIS 82 -9.180 -4.684 9.075 589 HB3 HIS 82 2HB HIS 82 -7.549 -4.900 8.457 590 HD2 HIS 82 2HD HIS 82 -6.101 -2.486 8.721 591 HE1 HIS 82 1HE HIS 82 -9.448 0.090 8.261 592 H VAL 83 H VAL 83 -9.146 -6.223 4.788 593 HA VAL 83 HA VAL 83 -9.154 -8.876 6.163 594 HB VAL 83 HB VAL 83 -9.669 -9.756 3.934 595 HG11 VAL 83 1HG1 VAL 83 -11.811 -8.654 3.505 596 HG12 VAL 83 1HG2 VAL 83 -11.537 -8.926 5.243 597 HG13 VAL 83 1HG3 VAL 83 -11.322 -7.300 4.552 598 HG21 VAL 83 2HG3 VAL 83 -8.231 -8.223 2.635 599 HG22 VAL 83 2HG1 VAL 83 -9.890 -8.238 1.992 600 HG23 VAL 83 2HG2 VAL 83 -9.337 -6.876 2.996 601 H THR 84 H THR 84 -8.000 -10.551 4.542 602 HA THR 84 HA THR 84 -5.304 -10.433 5.376 603 HB THR 84 HB THR 84 -6.416 -11.929 2.959 604 HG1 THR 84 1HG THR 84 -6.657 -13.625 4.524 605 HG21 THR 84 2HG3 THR 84 -3.988 -12.435 4.721 606 HG22 THR 84 2HG1 THR 84 -4.548 -13.476 3.393 607 HG23 THR 84 2HG2 THR 84 -3.949 -11.836 3.047 608 H GLY 85 H GLY 85 -3.947 -8.860 4.963 609 HA2 GLY 85 1HA GLY 85 -2.127 -8.277 3.524 610 HA3 GLY 85 2HA GLY 85 -3.147 -8.632 2.110 611 H ALA 86 H ALA 86 -5.218 -7.035 3.985 612 HA ALA 86 HA ALA 86 -5.347 -4.826 2.237 613 HB1 ALA 86 3HB ALA 86 -6.406 -5.057 5.077 614 HB2 ALA 86 1HB ALA 86 -6.919 -3.853 3.871 615 HB3 ALA 86 2HB ALA 86 -7.247 -5.582 3.600 616 H MET 87 H MET 87 -4.753 -2.713 2.305 617 HA MET 87 HA MET 87 -2.880 -1.924 4.514 618 HB2 MET 87 1HB MET 87 -2.605 -1.359 1.540 619 HB3 MET 87 2HB MET 87 -1.614 -0.628 2.794 620 HG2 MET 87 1HG MET 87 -0.726 -2.827 3.409 621 HG3 MET 87 2HG MET 87 -1.763 -3.599 2.208 622 HE1 MET 87 3HE MET 87 1.320 -1.268 2.839 623 HE2 MET 87 1HE MET 87 1.738 -0.750 1.187 624 HE3 MET 87 2HE MET 87 0.227 -0.185 1.942 625 H SER 88 H SER 88 -3.482 -0.243 5.606 626 HA SER 88 HA SER 88 -5.414 1.727 4.338 627 HB2 SER 88 1HB SER 88 -6.603 1.889 6.290 628 HB3 SER 88 2HB SER 88 -6.538 0.201 5.810 629 HG SER 88 HG SER 88 -6.097 0.230 7.907 630 H MET 89 H MET 89 -5.401 3.828 5.377 631 HA MET 89 HA MET 89 -2.778 4.505 6.669 632 HB2 MET 89 1HB MET 89 -3.249 5.657 4.512 633 HB3 MET 89 2HB MET 89 -4.733 6.306 5.192 634 HG2 MET 89 1HG MET 89 -3.450 7.566 6.856 635 HG3 MET 89 2HG MET 89 -1.946 6.874 6.244 636 HE1 MET 89 3HE MET 89 -1.944 6.910 3.226 637 HE2 MET 89 1HE MET 89 -1.406 8.563 2.844 638 HE3 MET 89 2HE MET 89 -0.667 7.677 4.200 639 H ALA 90 H ALA 90 -2.672 5.369 8.614 640 HA ALA 90 HA ALA 90 -4.853 4.972 10.390 641 HB1 ALA 90 3HB ALA 90 -2.392 6.723 10.729 642 HB2 ALA 90 1HB ALA 90 -3.471 6.184 12.037 643 HB3 ALA 90 2HB ALA 90 -2.509 4.993 11.128 644 H HIS 91 H HIS 91 -6.602 6.074 10.831 645 HA HIS 91 HA HIS 91 -6.495 9.049 10.596 646 HB2 HIS 91 1HB HIS 91 -8.711 7.232 9.557 647 HB3 HIS 91 2HB HIS 91 -8.893 8.966 9.784 648 HD2 HIS 91 2HD HIS 91 -7.661 6.522 7.000 649 HE1 HIS 91 1HE HIS 91 -6.324 10.436 6.025 650 H ARG 92 H ARG 92 -7.895 10.201 11.938 651 HA ARG 92 HA ARG 92 -9.237 8.577 14.069 652 HB2 ARG 92 1HB ARG 92 -7.554 11.087 14.436 653 HB3 ARG 92 2HB ARG 92 -8.570 10.380 15.683 654 HG2 ARG 92 1HG ARG 92 -6.400 8.756 14.373 655 HG3 ARG 92 2HG ARG 92 -6.047 9.883 15.706 656 HD2 ARG 92 1HD ARG 92 -6.413 7.971 16.862 657 HD3 ARG 92 2HD ARG 92 -8.061 8.644 16.834 658 HE ARG 92 HE ARG 92 -7.849 7.058 14.565 659 HH11 ARG 92 1HH1 ARG 92 -7.575 6.607 18.038 660 HH12 ARG 92 1HH2 ARG 92 -8.131 4.949 17.993 661 HH21 ARG 92 2HH1 ARG 92 -8.570 4.905 14.519 662 HH22 ARG 92 2HH2 ARG 92 -8.695 3.985 16.002 663 H GLY 93 H GLY 93 -9.863 10.335 11.527 664 HA2 GLY 93 1HA GLY 93 -12.416 11.001 11.772 665 HA3 GLY 93 2HA GLY 93 -11.714 12.270 12.802 666 H ARG 94 H ARG 94 -11.862 14.110 11.686 667 HA ARG 94 HA ARG 94 -11.115 14.111 8.793 668 HB2 ARG 94 1HB ARG 94 -12.471 16.199 10.543 669 HB3 ARG 94 2HB ARG 94 -12.053 16.439 8.853 670 HG2 ARG 94 1HG ARG 94 -13.574 14.608 8.214 671 HG3 ARG 94 2HG ARG 94 -14.006 14.388 9.926 672 HD2 ARG 94 1HD ARG 94 -14.771 16.728 9.982 673 HD3 ARG 94 2HD ARG 94 -14.449 16.835 8.236 674 HE ARG 94 HE ARG 94 -16.101 14.597 8.706 675 HH11 ARG 94 1HH1 ARG 94 -16.220 18.104 8.878 676 HH12 ARG 94 1HH2 ARG 94 -17.939 18.185 8.563 677 HH21 ARG 94 2HH1 ARG 94 -18.332 14.716 8.298 678 HH22 ARG 94 2HH2 ARG 94 -19.135 16.269 8.233 679 H ASP 95 H ASP 95 -9.455 15.190 7.964 680 HA ASP 95 HA ASP 95 -7.319 16.109 7.949 681 HB2 ASP 95 1HB ASP 95 -8.462 17.699 10.285 682 HB3 ASP 95 2HB ASP 95 -6.947 18.062 9.471 683 H THR 96 H THR 96 -7.175 13.703 8.899 684 HA THR 96 HA THR 96 -5.328 13.950 11.242 685 HB THR 96 HB THR 96 -6.207 11.799 12.121 686 HG1 THR 96 1HG THR 96 -8.258 12.133 10.159 687 HG21 THR 96 2HG3 THR 96 -8.356 13.919 11.740 688 HG22 THR 96 2HG1 THR 96 -8.349 12.653 12.988 689 HG23 THR 96 2HG2 THR 96 -7.104 13.925 13.004 690 H GLY 97 H GLY 97 -5.868 12.940 8.087 691 HA2 GLY 97 1HA GLY 97 -4.298 10.548 7.999 692 HA3 GLY 97 2HA GLY 97 -4.650 11.625 6.627 693 H SER 98 H SER 98 -2.173 10.232 7.183 694 HA SER 98 HA SER 98 -0.307 12.586 7.105 695 HB2 SER 98 1HB SER 98 1.149 11.773 8.713 696 HB3 SER 98 2HB SER 98 -0.431 12.074 9.420 697 HG SER 98 HG SER 98 0.193 10.155 10.150 698 H CYS 99 H CYS 99 1.388 9.914 7.908 699 HA CYS 99 HA CYS 99 1.533 8.752 5.112 700 HB2 CYS 99 1HB CYS 99 3.862 8.655 5.192 701 HB3 CYS 99 2HB CYS 99 3.311 10.319 5.319 702 HG CYS 99 HG CYS 99 3.567 10.489 7.899 703 H GLN 100 H GLN 100 1.025 8.289 8.419 704 HA GLN 100 HA GLN 100 2.380 5.721 8.717 705 HB2 GLN 100 1HB GLN 100 0.214 7.119 10.339 706 HB3 GLN 100 2HB GLN 100 0.911 5.568 10.784 707 HG2 GLN 100 1HG GLN 100 3.118 6.586 10.994 708 HG3 GLN 100 2HG GLN 100 2.441 8.161 10.493 709 HE21 GLN 100 2HE2 GLN 100 3.726 8.261 12.786 710 HE22 GLN 100 2HE1 GLN 100 2.652 8.295 14.145 711 H PHE 101 H PHE 101 1.815 3.834 7.997 712 HA PHE 101 HA PHE 101 -1.046 3.399 7.224 713 HB2 PHE 101 1HB PHE 101 -0.385 2.477 5.100 714 HB3 PHE 101 2HB PHE 101 0.355 4.065 5.225 715 HD1 PHE 101 2HD PHE 101 2.770 4.298 5.587 716 HD2 PHE 101 1HD PHE 101 0.941 0.471 5.081 717 HE1 PHE 101 2HE PHE 101 4.987 3.302 5.136 718 HE2 PHE 101 1HE PHE 101 3.156 -0.530 4.631 719 HZ PHE 101 HZ PHE 101 5.180 0.885 4.659 720 H PHE 102 H PHE 102 -1.507 1.108 6.705 721 HA PHE 102 HA PHE 102 -0.030 -0.626 8.664 722 HB2 PHE 102 1HB PHE 102 -2.981 -0.665 7.895 723 HB3 PHE 102 2HB PHE 102 -2.199 -1.800 8.984 724 HD1 PHE 102 1HD PHE 102 -3.329 1.673 8.558 725 HD2 PHE 102 2HD PHE 102 -1.643 -1.192 11.242 726 HE1 PHE 102 1HE PHE 102 -3.793 3.183 10.460 727 HE2 PHE 102 2HE PHE 102 -2.107 0.315 13.146 728 HZ PHE 102 HZ PHE 102 -3.182 2.504 12.754 729 H ILE 103 H ILE 103 0.390 -2.748 8.162 730 HA ILE 103 HA ILE 103 -0.776 -3.756 5.581 731 HB ILE 103 HB ILE 103 1.940 -4.449 6.810 732 HG12 ILE 103 1HG1 ILE 103 1.266 -3.002 4.238 733 HG13 ILE 103 1HG2 ILE 103 1.928 -2.268 5.691 734 HG21 ILE 103 2HG1 ILE 103 2.226 -5.873 4.823 735 HG22 ILE 103 2HG2 ILE 103 0.829 -6.399 5.790 736 HG23 ILE 103 2HG3 ILE 103 0.575 -5.472 4.294 737 HD11 ILE 103 1HD3 ILE 103 3.286 -4.383 4.005 738 HD12 ILE 103 1HD1 ILE 103 3.664 -2.645 4.030 739 HD13 ILE 103 1HD2 ILE 103 3.955 -3.641 5.478 740 H VAL 104 H VAL 104 -2.325 -5.069 5.937 741 HA VAL 104 HA VAL 104 -2.536 -6.472 8.536 742 HB VAL 104 HB VAL 104 -4.293 -6.538 6.035 743 HG11 VAL 104 1HG1 VAL 104 -5.992 -7.511 7.502 744 HG12 VAL 104 1HG2 VAL 104 -4.545 -8.539 7.384 745 HG13 VAL 104 1HG3 VAL 104 -4.817 -7.548 8.837 746 HG21 VAL 104 2HG3 VAL 104 -4.189 -4.297 7.070 747 HG22 VAL 104 2HG1 VAL 104 -5.783 -5.044 7.327 748 HG23 VAL 104 2HG2 VAL 104 -4.594 -5.007 8.651 749 H HIS 105 H HIS 105 -1.797 -8.335 9.027 750 HA HIS 105 HA HIS 105 -1.009 -10.210 6.862 751 HB2 HIS 105 1HB HIS 105 0.476 -9.757 8.887 752 HB3 HIS 105 2HB HIS 105 -0.743 -10.548 9.876 753 HD2 HIS 105 2HD HIS 105 2.097 -11.474 7.380 754 HE1 HIS 105 1HE HIS 105 0.338 -15.085 8.805 755 H GLU 106 H GLU 106 -3.071 -10.228 9.784 756 HA GLU 106 HA GLU 106 -4.808 -12.201 8.331 757 HB2 GLU 106 1HB GLU 106 -4.360 -11.894 11.331 758 HB3 GLU 106 2HB GLU 106 -5.543 -12.965 10.593 759 HG2 GLU 106 1HG GLU 106 -2.552 -13.150 10.168 760 HG3 GLU 106 2HG GLU 106 -3.468 -14.099 11.336 761 HA PRO 107 HA PRO 107 -8.032 -9.294 8.219 762 HB2 PRO 107 1HB PRO 107 -9.712 -11.666 9.161 763 HB3 PRO 107 2HB PRO 107 -10.019 -10.577 7.801 764 HG2 PRO 107 1HG PRO 107 -9.086 -13.012 7.276 765 HG3 PRO 107 2HG PRO 107 -8.406 -11.634 6.405 766 HD2 PRO 107 1HD PRO 107 -7.265 -13.166 8.768 767 HD3 PRO 107 2HD PRO 107 -6.412 -12.502 7.316 768 H GLN 108 H GLN 108 -8.894 -7.874 9.500 769 HA GLN 108 HA GLN 108 -9.217 -8.609 12.383 770 HB2 GLN 108 1HB GLN 108 -7.069 -7.384 12.078 771 HB3 GLN 108 2HB GLN 108 -7.930 -6.070 11.291 772 HG2 GLN 108 1HG GLN 108 -7.334 -5.675 13.683 773 HG3 GLN 108 2HG GLN 108 -9.069 -5.487 13.303 774 HE21 GLN 108 2HE2 GLN 108 -6.632 -7.584 14.795 775 HE22 GLN 108 2HE1 GLN 108 -7.736 -8.472 15.793 776 HA PRO 109 HA PRO 109 -13.206 -7.008 11.007 777 HB2 PRO 109 1HB PRO 109 -13.767 -8.075 13.808 778 HB3 PRO 109 2HB PRO 109 -14.717 -8.311 12.335 779 HG2 PRO 109 1HG PRO 109 -13.228 -10.334 13.208 780 HG3 PRO 109 2HG PRO 109 -13.239 -9.972 11.481 781 HD2 PRO 109 1HD PRO 109 -11.154 -9.259 13.576 782 HD3 PRO 109 2HD PRO 109 -10.915 -9.843 11.881 783 H HIS 110 H HIS 110 -11.399 -6.456 13.963 784 HA HIS 110 HA HIS 110 -13.239 -4.465 14.995 785 HB2 HIS 110 1HB HIS 110 -10.358 -5.182 15.664 786 HB3 HIS 110 2HB HIS 110 -11.235 -3.903 16.492 787 HD2 HIS 110 2HD HIS 110 -13.222 -4.835 18.425 788 HE1 HIS 110 1HE HIS 110 -12.249 -8.928 17.838 789 H LEU 111 H LEU 111 -10.822 -4.403 12.576 790 HA LEU 111 HA LEU 111 -10.525 -1.442 12.831 791 HB2 LEU 111 1HB LEU 111 -9.002 -3.528 11.219 792 HB3 LEU 111 2HB LEU 111 -8.716 -1.789 11.106 793 HG LEU 111 HG LEU 111 -8.310 -3.481 13.598 794 HD11 LEU 111 1HD1 LEU 111 -5.924 -3.103 13.158 795 HD12 LEU 111 1HD2 LEU 111 -6.704 -3.995 11.831 796 HD13 LEU 111 1HD3 LEU 111 -6.336 -2.264 11.644 797 HD21 LEU 111 2HD3 LEU 111 -8.960 -1.143 14.074 798 HD22 LEU 111 2HD1 LEU 111 -7.250 -1.428 14.478 799 HD23 LEU 111 2HD2 LEU 111 -7.680 -0.564 12.982 800 H ASP 112 H ASP 112 -12.492 -3.622 11.329 801 HA ASP 112 HA ASP 112 -12.566 -2.620 8.634 802 HB2 ASP 112 1HB ASP 112 -14.664 -4.019 10.344 803 HB3 ASP 112 2HB ASP 112 -14.892 -3.641 8.642 804 H GLY 113 H GLY 113 -12.780 -0.559 8.197 805 HA2 GLY 113 1HA GLY 113 -14.273 1.232 7.705 806 HA3 GLY 113 2HA GLY 113 -15.315 0.721 9.054 807 H VAL 114 H VAL 114 -12.324 0.504 10.306 808 HA VAL 114 HA VAL 114 -12.619 3.031 11.808 809 HB VAL 114 HB VAL 114 -10.508 0.822 11.885 810 HG11 VAL 114 1HG1 VAL 114 -9.812 1.814 14.010 811 HG12 VAL 114 1HG2 VAL 114 -9.597 2.938 12.648 812 HG13 VAL 114 1HG3 VAL 114 -10.966 3.145 13.766 813 HG21 VAL 114 2HG3 VAL 114 -12.755 0.066 12.579 814 HG22 VAL 114 2HG1 VAL 114 -11.653 0.149 13.973 815 HG23 VAL 114 2HG2 VAL 114 -12.864 1.429 13.719 816 H HIS 115 H HIS 115 -10.203 1.653 9.587 817 HA HIS 115 HA HIS 115 -9.223 4.461 9.192 818 HB2 HIS 115 1HB HIS 115 -7.692 1.846 8.851 819 HB3 HIS 115 2HB HIS 115 -7.056 3.453 8.535 820 HD2 HIS 115 2HD HIS 115 -7.127 0.962 11.361 821 HE1 HIS 115 1HE HIS 115 -6.437 4.756 13.176 822 H THR 116 H THR 116 -8.089 4.713 7.030 823 HA THR 116 HA THR 116 -10.090 3.866 4.993 824 HB THR 116 HB THR 116 -7.926 6.015 4.954 825 HG1 THR 116 1HG THR 116 -10.724 6.402 4.742 826 HG21 THR 116 2HG3 THR 116 -10.020 5.292 2.868 827 HG22 THR 116 2HG1 THR 116 -8.917 6.686 2.800 828 HG23 THR 116 2HG2 THR 116 -8.267 5.031 2.713 829 H VAL 117 H VAL 117 -9.697 2.004 4.081 830 HA VAL 117 HA VAL 117 -6.963 1.071 3.496 831 HB VAL 117 HB VAL 117 -9.697 0.072 2.560 832 HG11 VAL 117 1HG1 VAL 117 -8.521 -1.997 1.994 833 HG12 VAL 117 1HG2 VAL 117 -7.913 -0.609 1.060 834 HG13 VAL 117 1HG3 VAL 117 -6.974 -1.238 2.434 835 HG21 VAL 117 2HG3 VAL 117 -9.423 -0.040 5.013 836 HG22 VAL 117 2HG1 VAL 117 -9.391 -1.667 4.294 837 HG23 VAL 117 2HG2 VAL 117 -7.873 -0.889 4.803 838 H PHE 118 H PHE 118 -5.776 1.261 1.788 839 HA PHE 118 HA PHE 118 -6.971 2.732 -0.539 840 HB2 PHE 118 1HB PHE 118 -5.028 4.154 -0.648 841 HB3 PHE 118 2HB PHE 118 -5.649 4.249 0.992 842 HD1 PHE 118 2HD PHE 118 -4.431 3.270 2.856 843 HD2 PHE 118 1HD PHE 118 -2.916 3.068 -1.133 844 HE1 PHE 118 2HE PHE 118 -2.206 2.650 3.735 845 HE2 PHE 118 1HE PHE 118 -0.689 2.445 -0.258 846 HZ PHE 118 HZ PHE 118 -0.335 2.236 2.177 847 H GLY 119 H GLY 119 -5.085 0.139 0.621 848 HA2 GLY 119 1HA GLY 119 -4.672 -0.778 -2.142 849 HA3 GLY 119 2HA GLY 119 -3.187 -0.481 -1.207 850 H GLN 120 H GLN 120 -3.191 -2.919 -1.910 851 HA GLN 120 HA GLN 120 -3.619 -4.406 0.567 852 HB2 GLN 120 1HB GLN 120 -5.880 -4.565 -0.492 853 HB3 GLN 120 2HB GLN 120 -5.143 -5.239 -1.938 854 HG2 GLN 120 1HG GLN 120 -4.349 -7.170 -0.644 855 HG3 GLN 120 2HG GLN 120 -5.117 -6.488 0.817 856 HE21 GLN 120 2HE2 GLN 120 -6.147 -8.704 0.697 857 HE22 GLN 120 2HE1 GLN 120 -7.623 -8.832 -0.201 858 H VAL 121 H VAL 121 -1.991 -5.695 0.863 859 HA VAL 121 HA VAL 121 -0.018 -6.265 -1.186 860 HB VAL 121 HB VAL 121 -0.605 -7.650 1.476 861 HG11 VAL 121 1HG1 VAL 121 1.686 -8.496 1.321 862 HG12 VAL 121 1HG2 VAL 121 0.668 -9.082 -0.015 863 HG13 VAL 121 1HG3 VAL 121 1.842 -7.775 -0.297 864 HG21 VAL 121 2HG3 VAL 121 -0.068 -5.252 1.721 865 HG22 VAL 121 2HG1 VAL 121 1.263 -6.267 2.325 866 HG23 VAL 121 2HG2 VAL 121 1.398 -5.478 0.736 867 H THR 122 H THR 122 0.273 -7.802 -2.576 868 HA THR 122 HA THR 122 -1.821 -9.952 -2.667 869 HB THR 122 HB THR 122 -1.530 -9.963 -5.119 870 HG1 THR 122 1HG THR 122 -0.253 -8.263 -6.049 871 HG21 THR 122 2HG3 THR 122 -2.065 -7.176 -4.022 872 HG22 THR 122 2HG1 THR 122 -2.562 -7.782 -5.619 873 HG23 THR 122 2HG2 THR 122 -3.257 -8.491 -4.142 874 H SER 123 H SER 123 1.547 -9.182 -2.613 875 HA SER 123 HA SER 123 2.205 -12.098 -2.398 876 HB2 SER 123 1HB SER 123 2.293 -11.774 -4.731 877 HB3 SER 123 2HB SER 123 3.375 -10.403 -4.538 878 HG SER 123 HG SER 123 4.461 -12.330 -4.940 879 H GLY 124 H GLY 124 3.840 -12.412 -0.998 880 HA2 GLY 124 1HA GLY 124 6.017 -11.943 -0.132 881 HA3 GLY 124 2HA GLY 124 5.808 -10.230 -0.566 882 H MET 125 H MET 125 2.975 -11.380 0.801 883 HA MET 125 HA MET 125 3.113 -9.776 3.141 884 HB2 MET 125 1HB MET 125 1.046 -10.781 2.028 885 HB3 MET 125 2HB MET 125 1.452 -12.296 2.821 886 HG2 MET 125 1HG MET 125 1.252 -11.214 5.020 887 HG3 MET 125 2HG MET 125 0.878 -9.677 4.238 888 HE1 MET 125 3HE MET 125 -0.433 -12.962 5.633 889 HE2 MET 125 1HE MET 125 -1.881 -13.328 4.664 890 HE3 MET 125 2HE MET 125 -0.262 -13.486 3.939 891 H ASP 126 H ASP 126 4.262 -13.022 2.544 892 HA ASP 126 HA ASP 126 4.533 -13.946 5.210 893 HB2 ASP 126 1HB ASP 126 6.248 -14.395 2.735 894 HB3 ASP 126 2HB ASP 126 6.543 -15.219 4.260 895 H VAL 127 H VAL 127 6.422 -11.589 3.426 896 HA VAL 127 HA VAL 127 8.687 -11.382 5.159 897 HB VAL 127 HB VAL 127 7.147 -9.225 3.635 898 HG11 VAL 127 1HG1 VAL 127 9.173 -7.869 3.842 899 HG12 VAL 127 1HG2 VAL 127 8.454 -8.238 5.426 900 HG13 VAL 127 1HG3 VAL 127 9.901 -9.117 4.881 901 HG21 VAL 127 2HG3 VAL 127 8.076 -11.013 2.205 902 HG22 VAL 127 2HG1 VAL 127 8.961 -9.487 1.971 903 HG23 VAL 127 2HG2 VAL 127 9.673 -10.786 2.955 904 H VAL 128 H VAL 128 5.432 -10.043 5.502 905 HA VAL 128 HA VAL 128 6.008 -8.394 7.798 906 HB VAL 128 HB VAL 128 3.447 -9.837 6.957 907 HG11 VAL 128 1HG1 VAL 128 2.287 -8.240 8.402 908 HG12 VAL 128 1HG2 VAL 128 3.401 -9.279 9.320 909 HG13 VAL 128 1HG3 VAL 128 3.852 -7.598 8.950 910 HG21 VAL 128 2HG3 VAL 128 4.285 -8.232 5.276 911 HG22 VAL 128 2HG1 VAL 128 2.804 -7.625 6.054 912 HG23 VAL 128 2HG2 VAL 128 4.390 -6.972 6.529 913 H ARG 129 H ARG 129 5.026 -11.793 7.541 914 HA ARG 129 HA ARG 129 4.655 -12.246 10.325 915 HB2 ARG 129 1HB ARG 129 4.050 -13.844 8.476 916 HB3 ARG 129 2HB ARG 129 5.759 -14.185 8.255 917 HG2 ARG 129 1HG ARG 129 5.860 -15.020 10.600 918 HG3 ARG 129 2HG ARG 129 4.101 -14.774 10.717 919 HD2 ARG 129 1HD ARG 129 5.477 -16.511 8.682 920 HD3 ARG 129 2HD ARG 129 4.729 -17.083 10.193 921 HE ARG 129 HE ARG 129 2.703 -15.717 9.018 922 HH11 ARG 129 1HH1 ARG 129 4.892 -18.204 7.849 923 HH12 ARG 129 1HH2 ARG 129 3.733 -18.871 6.722 924 HH21 ARG 129 2HH1 ARG 129 1.206 -16.592 7.551 925 HH22 ARG 129 2HH2 ARG 129 1.646 -17.960 6.553 926 H THR 130 H THR 130 7.598 -12.288 8.357 927 HA THR 130 HA THR 130 9.163 -12.858 10.848 928 HB THR 130 HB THR 130 11.015 -13.463 9.312 929 HG1 THR 130 1HG THR 130 10.503 -13.598 7.054 930 HG21 THR 130 2HG3 THR 130 8.397 -14.865 8.648 931 HG22 THR 130 2HG1 THR 130 10.029 -15.528 8.397 932 HG23 THR 130 2HG2 THR 130 9.437 -15.217 10.047 933 H MET 131 H MET 131 7.976 -10.250 9.670 934 HA MET 131 HA MET 131 10.288 -8.628 8.994 935 HB2 MET 131 1HB MET 131 7.928 -8.106 8.321 936 HB3 MET 131 2HB MET 131 7.553 -7.766 10.005 937 HG2 MET 131 1HG MET 131 9.196 -5.931 10.009 938 HG3 MET 131 2HG MET 131 9.590 -6.278 8.323 939 HE1 MET 131 3HE MET 131 7.040 -6.797 6.772 940 HE2 MET 131 1HE MET 131 6.491 -5.156 6.352 941 HE3 MET 131 2HE MET 131 8.225 -5.556 6.297 942 H LYS 132 H LYS 132 11.650 -7.503 10.169 943 HA LYS 132 HA LYS 132 11.625 -7.837 13.085 944 HB2 LYS 132 1HB LYS 132 13.751 -7.854 11.835 945 HB3 LYS 132 2HB LYS 132 13.439 -6.227 11.244 946 HG2 LYS 132 1HG LYS 132 13.582 -5.337 13.518 947 HG3 LYS 132 2HG LYS 132 13.811 -6.971 14.160 948 HD2 LYS 132 1HD LYS 132 15.896 -7.200 12.857 949 HD3 LYS 132 2HD LYS 132 15.665 -5.576 12.194 950 HE2 LYS 132 1HE LYS 132 15.794 -4.622 14.468 951 HE3 LYS 132 2HE LYS 132 16.006 -6.239 15.142 952 HZ1 LYS 132 3HZ LYS 132 17.845 -4.920 13.258 953 HZ2 LYS 132 1HZ LYS 132 18.093 -5.114 14.876 954 HZ3 LYS 132 2HZ LYS 132 18.042 -6.432 13.886 955 H ASN 133 H ASN 133 11.106 -6.447 14.632 956 HA ASN 133 HA ASN 133 9.477 -4.151 14.133 957 HB2 ASN 133 1HB ASN 133 9.649 -5.419 16.295 958 HB3 ASN 133 2HB ASN 133 11.219 -4.674 16.553 959 HD21 ASN 133 2HD2 ASN 133 8.955 -4.416 18.239 960 HD22 ASN 133 2HD1 ASN 133 8.500 -2.744 18.258 961 H GLY 134 H GLY 134 10.000 -2.444 13.030 962 HA2 GLY 134 1HA GLY 134 11.149 -0.402 12.708 963 HA3 GLY 134 2HA GLY 134 12.492 -1.007 13.707 964 H ASP 135 H ASP 135 11.272 -3.176 11.327 965 HA ASP 135 HA ASP 135 13.702 -3.323 9.834 966 HB2 ASP 135 1HB ASP 135 11.753 -5.016 9.925 967 HB3 ASP 135 2HB ASP 135 10.939 -3.985 8.756 968 H VAL 136 H VAL 136 14.496 -2.368 8.087 969 HA VAL 136 HA VAL 136 13.307 0.294 7.491 970 HB VAL 136 HB VAL 136 15.922 -1.009 6.592 971 HG11 VAL 136 1HG1 VAL 136 16.593 1.262 5.977 972 HG12 VAL 136 1HG2 VAL 136 15.167 0.718 5.062 973 HG13 VAL 136 1HG3 VAL 136 14.976 1.859 6.416 974 HG21 VAL 136 2HG3 VAL 136 15.828 -0.686 9.040 975 HG22 VAL 136 2HG1 VAL 136 16.972 0.452 8.291 976 HG23 VAL 136 2HG2 VAL 136 15.363 1.015 8.800 977 H MET 137 H MET 137 12.173 0.823 5.843 978 HA MET 137 HA MET 137 11.861 -1.025 3.572 979 HB2 MET 137 1HB MET 137 10.808 1.786 4.052 980 HB3 MET 137 2HB MET 137 10.375 0.763 2.691 981 HG2 MET 137 1HG MET 137 9.466 -0.915 4.335 982 HG3 MET 137 2HG MET 137 9.756 0.269 5.613 983 HE1 MET 137 3HE MET 137 8.973 3.024 4.687 984 HE2 MET 137 1HE MET 137 7.214 3.059 4.960 985 HE3 MET 137 2HE MET 137 8.282 2.265 6.142 986 H LYS 138 H LYS 138 13.598 -1.272 2.352 987 HA LYS 138 HA LYS 138 15.595 0.753 1.978 988 HB2 LYS 138 1HB LYS 138 16.024 -1.678 1.702 989 HB3 LYS 138 2HB LYS 138 14.981 -1.704 0.287 990 HG2 LYS 138 1HG LYS 138 16.503 -0.224 -0.914 991 HG3 LYS 138 2HG LYS 138 17.525 -0.071 0.523 992 HD2 LYS 138 1HD LYS 138 17.987 -2.495 0.467 993 HD3 LYS 138 2HD LYS 138 16.943 -2.667 -0.952 994 HE2 LYS 138 1HE LYS 138 18.424 -1.143 -2.224 995 HE3 LYS 138 2HE LYS 138 19.469 -0.980 -0.810 996 HZ1 LYS 138 3HZ LYS 138 18.922 -3.491 -2.247 997 HZ2 LYS 138 1HZ LYS 138 20.308 -2.602 -2.344 998 HZ3 LYS 138 2HZ LYS 138 19.898 -3.338 -0.925 999 H GLU 139 H GLU 139 12.889 -0.294 -0.087 1000 HA GLU 139 HA GLU 139 12.989 2.307 -1.490 1001 HB2 GLU 139 1HB GLU 139 14.593 0.966 -2.790 1002 HB3 GLU 139 2HB GLU 139 13.435 -0.350 -2.915 1003 HG2 GLU 139 1HG GLU 139 11.935 1.083 -4.234 1004 HG3 GLU 139 2HG GLU 139 13.083 2.414 -4.097 1005 H VAL 140 H VAL 140 11.002 2.955 -1.171 1006 HA VAL 140 HA VAL 140 8.767 1.069 -1.901 1007 HB VAL 140 HB VAL 140 8.679 3.722 -0.385 1008 HG11 VAL 140 1HG1 VAL 140 6.385 3.067 0.157 1009 HG12 VAL 140 1HG2 VAL 140 6.634 3.229 -1.597 1010 HG13 VAL 140 1HG3 VAL 140 6.560 1.614 -0.854 1011 HG21 VAL 140 2HG3 VAL 140 9.848 1.979 0.918 1012 HG22 VAL 140 2HG1 VAL 140 8.251 2.333 1.618 1013 HG23 VAL 140 2HG2 VAL 140 8.491 0.861 0.647 1014 H LYS 141 H LYS 141 7.955 1.197 -3.789 1015 HA LYS 141 HA LYS 141 7.935 3.867 -5.152 1016 HB2 LYS 141 1HB LYS 141 8.749 1.194 -6.362 1017 HB3 LYS 141 2HB LYS 141 8.470 2.666 -7.280 1018 HG2 LYS 141 1HG LYS 141 10.559 2.428 -5.097 1019 HG3 LYS 141 2HG LYS 141 10.876 2.138 -6.813 1020 HD2 LYS 141 1HD LYS 141 10.184 4.433 -7.354 1021 HD3 LYS 141 2HD LYS 141 9.786 4.730 -5.655 1022 HE2 LYS 141 1HE LYS 141 11.984 5.666 -6.201 1023 HE3 LYS 141 2HE LYS 141 12.144 4.356 -5.028 1024 HZ1 LYS 141 3HZ LYS 141 12.619 4.121 -7.925 1025 HZ2 LYS 141 1HZ LYS 141 13.780 4.197 -6.756 1026 HZ3 LYS 141 2HZ LYS 141 12.766 2.897 -6.828 1027 H VAL 142 H VAL 142 6.279 4.291 -6.542 1028 HA VAL 142 HA VAL 142 4.146 2.190 -6.819 1029 HB VAL 142 HB VAL 142 3.734 5.143 -6.146 1030 HG11 VAL 142 1HG1 VAL 142 1.351 4.593 -6.102 1031 HG12 VAL 142 1HG2 VAL 142 2.068 4.322 -7.709 1032 HG13 VAL 142 1HG3 VAL 142 1.724 2.939 -6.643 1033 HG21 VAL 142 2HG3 VAL 142 4.430 3.803 -4.190 1034 HG22 VAL 142 2HG1 VAL 142 2.722 4.284 -4.058 1035 HG23 VAL 142 2HG2 VAL 142 3.145 2.623 -4.540 1036 H PHE 143 H PHE 143 3.052 2.099 -8.659 1037 HA PHE 143 HA PHE 143 3.697 4.061 -10.792 1038 HB2 PHE 143 1HB PHE 143 4.428 2.275 -12.335 1039 HB3 PHE 143 2HB PHE 143 5.522 2.419 -10.968 1040 HD1 PHE 143 2HD PHE 143 5.518 0.714 -9.179 1041 HD2 PHE 143 1HD PHE 143 3.137 0.297 -12.702 1042 HE1 PHE 143 2HE PHE 143 5.245 -1.696 -8.706 1043 HE2 PHE 143 1HE PHE 143 2.859 -2.114 -12.229 1044 HZ PHE 143 HZ PHE 143 3.913 -3.111 -10.231 1045 H ASP 144 H ASP 144 2.508 3.642 -12.793 1046 HA ASP 144 HA ASP 144 -0.264 2.865 -12.109 1047 HB2 ASP 144 1HB ASP 144 1.007 4.133 -14.569 1048 HB3 ASP 144 2HB ASP 144 -0.692 3.691 -14.484 1049 H GLU 145 H GLU 145 -1.423 1.240 -12.923 1050 HA GLU 145 HA GLU 145 -0.393 -0.488 -15.045 1051 HB2 GLU 145 1HB GLU 145 0.953 -1.258 -13.079 1052 HB3 GLU 145 2HB GLU 145 -0.536 -1.564 -12.197 1053 HG2 GLU 145 1HG GLU 145 0.274 -3.637 -13.039 1054 HG3 GLU 145 2HG GLU 145 -1.185 -3.220 -13.935 1055 HA PRO 146 HA PRO 146 -5.001 -0.250 -14.730 1056 HB2 PRO 146 1HB PRO 146 -4.355 -0.740 -17.671 1057 HB3 PRO 146 2HB PRO 146 -5.592 0.320 -16.982 1058 HG2 PRO 146 1HG PRO 146 -3.381 1.432 -17.961 1059 HG3 PRO 146 2HG PRO 146 -4.023 2.022 -16.425 1060 HD2 PRO 146 1HD PRO 146 -1.703 0.125 -16.932 1061 HD3 PRO 146 2HD PRO 146 -1.838 1.466 -15.726 Start of MODEL 10 1 H MET 1 1H MET 1 -7.140 -0.323 -17.330 2 HA MET 1 HA MET 1 -4.838 0.772 -16.258 3 HB2 MET 1 1HB MET 1 -7.685 1.799 -16.543 4 HB3 MET 1 2HB MET 1 -6.291 2.796 -16.156 5 HG2 MET 1 1HG MET 1 -6.685 1.226 -18.719 6 HG3 MET 1 2HG MET 1 -6.903 2.966 -18.518 7 HE1 MET 1 3HE MET 1 -4.564 3.952 -16.750 8 HE2 MET 1 1HE MET 1 -3.305 4.286 -17.963 9 HE3 MET 1 2HE MET 1 -5.002 4.703 -18.304 10 H ALA 2 H ALA 2 -4.099 0.385 -14.316 11 HA ALA 2 HA ALA 2 -5.770 1.200 -12.045 12 HB1 ALA 2 3HB ALA 2 -4.636 -1.614 -12.216 13 HB2 ALA 2 1HB ALA 2 -5.395 -0.886 -10.782 14 HB3 ALA 2 2HB ALA 2 -6.360 -1.177 -12.250 15 H LYS 3 H LYS 3 -4.548 1.217 -9.996 16 HA LYS 3 HA LYS 3 -1.706 1.964 -10.562 17 HB2 LYS 3 1HB LYS 3 -3.483 2.639 -8.183 18 HB3 LYS 3 2HB LYS 3 -1.834 3.199 -8.428 19 HG2 LYS 3 1HG LYS 3 -4.160 3.844 -10.265 20 HG3 LYS 3 2HG LYS 3 -3.551 4.898 -8.980 21 HD2 LYS 3 1HD LYS 3 -1.301 4.872 -10.099 22 HD3 LYS 3 2HD LYS 3 -2.019 3.947 -11.427 23 HE2 LYS 3 1HE LYS 3 -3.656 5.807 -11.783 24 HE3 LYS 3 2HE LYS 3 -2.832 6.736 -10.528 25 HZ1 LYS 3 3HZ LYS 3 -1.606 5.784 -13.030 26 HZ2 LYS 3 1HZ LYS 3 -2.074 7.332 -12.709 27 HZ3 LYS 3 2HZ LYS 3 -0.837 6.651 -11.858 28 H LYS 4 H LYS 4 -0.037 0.954 -9.733 29 HA LYS 4 HA LYS 4 -0.485 -0.883 -7.419 30 HB2 LYS 4 1HB LYS 4 0.992 -1.576 -9.989 31 HB3 LYS 4 2HB LYS 4 1.071 -2.526 -8.511 32 HG2 LYS 4 1HG LYS 4 -1.381 -2.909 -8.649 33 HG3 LYS 4 2HG LYS 4 -1.412 -2.009 -10.173 34 HD2 LYS 4 1HD LYS 4 0.179 -3.633 -11.159 35 HD3 LYS 4 2HD LYS 4 0.191 -4.537 -9.637 36 HE2 LYS 4 1HE LYS 4 -2.223 -4.970 -9.857 37 HE3 LYS 4 2HE LYS 4 -2.269 -4.031 -11.352 38 HZ1 LYS 4 3HZ LYS 4 -0.720 -6.500 -10.932 39 HZ2 LYS 4 1HZ LYS 4 -2.127 -6.372 -11.784 40 HZ3 LYS 4 2HZ LYS 4 -0.762 -5.623 -12.328 41 H GLY 5 H GLY 5 1.513 -1.536 -6.352 42 HA2 GLY 5 1HA GLY 5 3.895 0.094 -6.866 43 HA3 GLY 5 2HA GLY 5 3.035 0.494 -5.361 44 H TYR 6 H TYR 6 5.578 -0.334 -5.111 45 HA TYR 6 HA TYR 6 5.201 -2.730 -3.467 46 HB2 TYR 6 1HB TYR 6 7.011 -4.029 -4.507 47 HB3 TYR 6 2HB TYR 6 5.673 -3.799 -5.624 48 HD1 TYR 6 2HD TYR 6 5.878 -2.317 -7.560 49 HD2 TYR 6 1HD TYR 6 9.165 -3.003 -4.889 50 HE1 TYR 6 2HE TYR 6 7.437 -1.391 -9.240 51 HE2 TYR 6 1HE TYR 6 10.724 -2.078 -6.569 52 HH TYR 6 HH TYR 6 9.542 -0.900 -9.722 53 H ILE 7 H ILE 7 7.064 -3.242 -2.158 54 HA ILE 7 HA ILE 7 9.042 -1.042 -1.855 55 HB ILE 7 HB ILE 7 7.016 -0.384 -0.471 56 HG12 ILE 7 1HG1 ILE 7 9.370 -1.167 1.254 57 HG13 ILE 7 1HG2 ILE 7 9.425 0.162 0.107 58 HG21 ILE 7 2HG1 ILE 7 6.506 -1.731 1.526 59 HG22 ILE 7 2HG2 ILE 7 6.221 -2.662 0.037 60 HG23 ILE 7 2HG3 ILE 7 7.684 -2.959 1.004 61 HD11 ILE 7 1HD3 ILE 7 7.508 -0.083 2.436 62 HD12 ILE 7 1HD1 ILE 7 8.946 0.960 2.352 63 HD13 ILE 7 1HD2 ILE 7 7.562 1.262 1.273 64 H LEU 8 H LEU 8 10.936 -1.622 -1.177 65 HA LEU 8 HA LEU 8 11.240 -4.515 -0.464 66 HB2 LEU 8 1HB LEU 8 12.969 -2.514 -1.924 67 HB3 LEU 8 2HB LEU 8 13.721 -3.885 -1.102 68 HG LEU 8 HG LEU 8 12.056 -5.330 -2.511 69 HD11 LEU 8 1HD1 LEU 8 11.463 -4.300 -4.658 70 HD12 LEU 8 1HD2 LEU 8 10.689 -3.463 -3.291 71 HD13 LEU 8 1HD3 LEU 8 12.109 -2.743 -4.088 72 HD21 LEU 8 2HD3 LEU 8 14.516 -5.290 -2.762 73 HD22 LEU 8 2HD1 LEU 8 13.710 -5.374 -4.347 74 HD23 LEU 8 2HD2 LEU 8 14.388 -3.831 -3.774 75 H MET 9 H MET 9 12.262 -5.178 1.303 76 HA MET 9 HA MET 9 12.928 -3.087 3.317 77 HB2 MET 9 1HB MET 9 12.601 -6.100 3.528 78 HB3 MET 9 2HB MET 9 13.051 -5.056 4.868 79 HG2 MET 9 1HG MET 9 10.919 -3.917 4.776 80 HG3 MET 9 2HG MET 9 10.470 -4.778 3.302 81 HE1 MET 9 3HE MET 9 10.703 -4.818 7.149 82 HE2 MET 9 1HE MET 9 10.653 -6.549 7.559 83 HE3 MET 9 2HE MET 9 12.096 -5.861 6.775 84 H GLU 10 H GLU 10 14.819 -3.304 4.647 85 HA GLU 10 HA GLU 10 17.207 -3.617 3.018 86 HB2 GLU 10 1HB GLU 10 16.739 -3.105 5.980 87 HB3 GLU 10 2HB GLU 10 18.349 -3.262 5.290 88 HG2 GLU 10 1HG GLU 10 16.325 -1.232 4.330 89 HG3 GLU 10 2HG GLU 10 17.494 -0.917 5.611 90 H ASN 11 H ASN 11 15.273 -5.821 4.700 91 HA ASN 11 HA ASN 11 17.473 -7.734 5.196 92 HB2 ASN 11 1HB ASN 11 14.465 -7.946 5.482 93 HB3 ASN 11 2HB ASN 11 15.587 -9.252 5.835 94 HD21 ASN 11 2HD2 ASN 11 13.814 -6.899 7.211 95 HD22 ASN 11 2HD1 ASN 11 14.744 -6.607 8.642 96 H GLY 12 H GLY 12 15.936 -6.672 2.492 97 HA2 GLY 12 1HA GLY 12 16.490 -7.522 0.346 98 HA3 GLY 12 2HA GLY 12 16.822 -9.113 1.068 99 H GLY 13 H GLY 13 14.002 -7.996 2.408 100 HA2 GLY 13 1HA GLY 13 12.372 -9.847 0.858 101 HA3 GLY 13 2HA GLY 13 11.834 -8.826 2.211 102 H LYS 14 H LYS 14 10.505 -9.349 -0.344 103 HA LYS 14 HA LYS 14 10.266 -6.504 -1.250 104 HB2 LYS 14 1HB LYS 14 11.537 -7.833 -2.944 105 HB3 LYS 14 2HB LYS 14 10.192 -8.961 -3.045 106 HG2 LYS 14 1HG LYS 14 8.736 -7.221 -3.927 107 HG3 LYS 14 2HG LYS 14 10.009 -6.010 -3.717 108 HD2 LYS 14 1HD LYS 14 11.449 -7.268 -5.304 109 HD3 LYS 14 2HD LYS 14 10.146 -8.444 -5.535 110 HE2 LYS 14 1HE LYS 14 8.679 -6.667 -6.405 111 HE3 LYS 14 2HE LYS 14 9.951 -5.470 -6.142 112 HZ1 LYS 14 3HZ LYS 14 10.126 -7.776 -7.966 113 HZ2 LYS 14 1HZ LYS 14 9.888 -6.206 -8.410 114 HZ3 LYS 14 2HZ LYS 14 11.314 -6.659 -7.718 115 H ILE 15 H ILE 15 8.351 -5.715 -0.971 116 HA ILE 15 HA ILE 15 6.019 -7.617 -0.887 117 HB ILE 15 HB ILE 15 6.353 -4.919 0.518 118 HG12 ILE 15 1HG1 ILE 15 6.085 -6.648 2.542 119 HG13 ILE 15 1HG2 ILE 15 6.885 -7.714 1.398 120 HG21 ILE 15 2HG1 ILE 15 4.252 -5.531 1.646 121 HG22 ILE 15 2HG2 ILE 15 4.029 -5.440 -0.116 122 HG23 ILE 15 2HG3 ILE 15 4.165 -7.024 0.682 123 HD11 ILE 15 1HD3 ILE 15 7.916 -5.025 2.325 124 HD12 ILE 15 1HD1 ILE 15 8.497 -6.621 2.853 125 HD13 ILE 15 1HD2 ILE 15 8.727 -6.104 1.165 126 H GLU 16 H GLU 16 4.757 -7.575 -2.509 127 HA GLU 16 HA GLU 16 4.515 -5.005 -4.039 128 HB2 GLU 16 1HB GLU 16 5.517 -6.949 -5.286 129 HB3 GLU 16 2HB GLU 16 4.039 -7.858 -4.999 130 HG2 GLU 16 1HG GLU 16 2.758 -6.191 -6.273 131 HG3 GLU 16 2HG GLU 16 4.233 -5.268 -6.551 132 H PHE 17 H PHE 17 2.633 -4.051 -4.292 133 HA PHE 17 HA PHE 17 0.183 -5.464 -3.339 134 HB2 PHE 17 1HB PHE 17 -0.378 -3.478 -1.930 135 HB3 PHE 17 2HB PHE 17 1.021 -4.360 -1.338 136 HD1 PHE 17 1HD PHE 17 -0.116 -1.284 -3.002 137 HD2 PHE 17 2HD PHE 17 3.215 -3.379 -1.339 138 HE1 PHE 17 1HE PHE 17 1.209 0.804 -3.030 139 HE2 PHE 17 2HE PHE 17 4.543 -1.294 -1.363 140 HZ PHE 17 HZ PHE 17 3.539 0.798 -2.210 141 H GLU 18 H GLU 18 -1.787 -4.477 -3.901 142 HA GLU 18 HA GLU 18 -1.543 -2.685 -6.287 143 HB2 GLU 18 1HB GLU 18 -3.850 -4.430 -5.325 144 HB3 GLU 18 2HB GLU 18 -3.889 -3.401 -6.750 145 HG2 GLU 18 1HG GLU 18 -2.043 -4.729 -7.733 146 HG3 GLU 18 2HG GLU 18 -2.070 -5.781 -6.320 147 H LEU 19 H LEU 19 -2.945 -0.932 -6.569 148 HA LEU 19 HA LEU 19 -3.912 0.212 -3.970 149 HB2 LEU 19 1HB LEU 19 -2.986 1.643 -6.495 150 HB3 LEU 19 2HB LEU 19 -3.562 2.425 -5.020 151 HG LEU 19 HG LEU 19 -1.057 0.712 -5.187 152 HD11 LEU 19 1HD1 LEU 19 0.148 2.848 -5.097 153 HD12 LEU 19 1HD2 LEU 19 -0.854 2.720 -6.562 154 HD13 LEU 19 1HD3 LEU 19 -1.398 3.724 -5.197 155 HD21 LEU 19 2HD3 LEU 19 -2.121 0.807 -2.958 156 HD22 LEU 19 2HD1 LEU 19 -0.596 1.724 -2.980 157 HD23 LEU 19 2HD2 LEU 19 -2.152 2.585 -3.047 158 H PHE 20 H PHE 20 -5.791 1.476 -3.959 159 HA PHE 20 HA PHE 20 -7.669 0.859 -6.211 160 HB2 PHE 20 1HB PHE 20 -8.322 0.631 -3.243 161 HB3 PHE 20 2HB PHE 20 -9.418 0.320 -4.580 162 HD1 PHE 20 2HD PHE 20 -8.754 -1.565 -6.226 163 HD2 PHE 20 1HD PHE 20 -7.069 -1.097 -2.328 164 HE1 PHE 20 2HE PHE 20 -8.066 -3.939 -6.241 165 HE2 PHE 20 1HE PHE 20 -6.378 -3.470 -2.340 166 HZ PHE 20 HZ PHE 20 -6.876 -4.891 -4.296 167 HA PRO 21 HA PRO 21 -7.774 5.395 -5.319 168 HB2 PRO 21 1HB PRO 21 -8.481 5.118 -8.266 169 HB3 PRO 21 2HB PRO 21 -7.432 6.317 -7.498 170 HG2 PRO 21 1HG PRO 21 -6.295 4.356 -8.889 171 HG3 PRO 21 2HG PRO 21 -5.594 4.812 -7.334 172 HD2 PRO 21 1HD PRO 21 -7.425 2.470 -7.999 173 HD3 PRO 21 2HD PRO 21 -5.949 2.501 -6.953 174 H ASN 22 H ASN 22 -9.855 3.056 -6.920 175 HA ASN 22 HA ASN 22 -12.207 4.713 -6.977 176 HB2 ASN 22 1HB ASN 22 -11.805 1.715 -6.972 177 HB3 ASN 22 2HB ASN 22 -13.391 2.467 -7.067 178 HD21 ASN 22 2HD2 ASN 22 -12.292 0.794 -9.038 179 HD22 ASN 22 2HD1 ASN 22 -12.071 1.728 -10.481 180 H GLU 23 H GLU 23 -10.707 2.796 -4.461 181 HA GLU 23 HA GLU 23 -13.075 3.063 -2.704 182 HB2 GLU 23 1HB GLU 23 -10.307 1.870 -2.245 183 HB3 GLU 23 2HB GLU 23 -11.604 1.866 -1.059 184 HG2 GLU 23 1HG GLU 23 -12.984 0.489 -2.532 185 HG3 GLU 23 2HG GLU 23 -11.735 0.537 -3.774 186 H ALA 24 H ALA 24 -9.774 4.342 -2.955 187 HA ALA 24 HA ALA 24 -10.643 6.618 -1.270 188 HB1 ALA 24 3HB ALA 24 -8.167 4.953 -0.690 189 HB2 ALA 24 1HB ALA 24 -8.603 6.478 0.113 190 HB3 ALA 24 2HB ALA 24 -9.630 5.038 0.318 191 HA PRO 25 HA PRO 25 -8.531 7.828 -5.141 192 HB2 PRO 25 1HB PRO 25 -10.023 10.351 -4.262 193 HB3 PRO 25 2HB PRO 25 -9.864 9.686 -5.893 194 HG2 PRO 25 1HG PRO 25 -12.167 9.330 -4.610 195 HG3 PRO 25 2HG PRO 25 -11.475 7.974 -5.504 196 HD2 PRO 25 1HD PRO 25 -11.456 8.515 -2.519 197 HD3 PRO 25 2HD PRO 25 -11.637 6.942 -3.397 198 H VAL 26 H VAL 26 -8.934 10.133 -2.421 199 HA VAL 26 HA VAL 26 -6.463 11.506 -3.203 200 HB VAL 26 HB VAL 26 -8.184 11.711 -0.684 201 HG11 VAL 26 1HG1 VAL 26 -7.086 13.872 -0.352 202 HG12 VAL 26 1HG2 VAL 26 -5.927 12.522 -0.312 203 HG13 VAL 26 1HG3 VAL 26 -6.041 13.556 -1.758 204 HG21 VAL 26 2HG3 VAL 26 -9.426 12.272 -2.746 205 HG22 VAL 26 2HG1 VAL 26 -9.116 13.729 -1.773 206 HG23 VAL 26 2HG2 VAL 26 -8.134 13.400 -3.219 207 H THR 27 H THR 27 -7.348 9.184 -0.691 208 HA THR 27 HA THR 27 -4.882 9.268 0.742 209 HB THR 27 HB THR 27 -6.746 6.899 0.271 210 HG1 THR 27 1HG THR 27 -7.872 8.519 1.298 211 HG21 THR 27 2HG3 THR 27 -4.649 7.407 2.415 212 HG22 THR 27 2HG1 THR 27 -5.755 6.016 2.346 213 HG23 THR 27 2HG2 THR 27 -4.514 6.230 1.089 214 H VAL 28 H VAL 28 -5.864 7.158 -1.969 215 HA VAL 28 HA VAL 28 -3.298 5.856 -2.238 216 HB VAL 28 HB VAL 28 -5.526 6.416 -4.255 217 HG11 VAL 28 1HG1 VAL 28 -4.488 4.691 -5.646 218 HG12 VAL 28 1HG2 VAL 28 -3.416 6.092 -5.409 219 HG13 VAL 28 1HG3 VAL 28 -3.129 4.588 -4.501 220 HG21 VAL 28 2HG3 VAL 28 -6.186 4.976 -2.359 221 HG22 VAL 28 2HG1 VAL 28 -6.092 4.039 -3.869 222 HG23 VAL 28 2HG2 VAL 28 -4.784 3.923 -2.668 223 H ALA 29 H ALA 29 -4.624 8.787 -3.734 224 HA ALA 29 HA ALA 29 -2.460 9.273 -5.492 225 HB1 ALA 29 3HB ALA 29 -4.203 11.277 -4.013 226 HB2 ALA 29 1HB ALA 29 -3.188 11.631 -5.430 227 HB3 ALA 29 2HB ALA 29 -4.573 10.523 -5.581 228 H ASN 30 H ASN 30 -2.932 10.400 -2.134 229 HA ASN 30 HA ASN 30 -0.456 11.879 -2.052 230 HB2 ASN 30 1HB ASN 30 -2.307 10.812 0.087 231 HB3 ASN 30 2HB ASN 30 -0.832 11.692 0.465 232 HD21 ASN 30 2HD2 ASN 30 -3.368 12.567 1.203 233 HD22 ASN 30 2HD1 ASN 30 -3.722 14.033 0.350 234 H PHE 31 H PHE 31 -1.336 8.619 -0.906 235 HA PHE 31 HA PHE 31 1.241 7.918 0.103 236 HB2 PHE 31 1HB PHE 31 -0.794 6.565 0.510 237 HB3 PHE 31 2HB PHE 31 -0.891 6.170 -1.199 238 HD1 PHE 31 1HD PHE 31 0.957 5.603 1.925 239 HD2 PHE 31 2HD PHE 31 0.577 4.541 -2.196 240 HE1 PHE 31 1HE PHE 31 2.397 3.629 2.302 241 HE2 PHE 31 2HE PHE 31 2.015 2.565 -1.822 242 HZ PHE 31 HZ PHE 31 2.926 2.109 0.429 243 H GLU 32 H GLU 32 -0.121 7.647 -3.169 244 HA GLU 32 HA GLU 32 2.143 6.263 -4.286 245 HB2 GLU 32 1HB GLU 32 -0.116 6.377 -5.359 246 HB3 GLU 32 2HB GLU 32 0.124 8.095 -5.650 247 HG2 GLU 32 1HG GLU 32 2.030 7.605 -7.106 248 HG3 GLU 32 2HG GLU 32 1.847 5.882 -6.785 249 H LYS 33 H LYS 33 1.338 9.710 -4.004 250 HA LYS 33 HA LYS 33 3.618 10.700 -5.425 251 HB2 LYS 33 1HB LYS 33 1.955 11.868 -3.165 252 HB3 LYS 33 2HB LYS 33 3.258 12.751 -3.950 253 HG2 LYS 33 1HG LYS 33 2.090 12.604 -6.104 254 HG3 LYS 33 2HG LYS 33 0.793 11.669 -5.346 255 HD2 LYS 33 1HD LYS 33 0.320 13.577 -3.829 256 HD3 LYS 33 2HD LYS 33 1.597 14.511 -4.621 257 HE2 LYS 33 1HE LYS 33 0.384 14.330 -6.775 258 HE3 LYS 33 2HE LYS 33 -0.895 13.414 -5.975 259 HZ1 LYS 33 3HZ LYS 33 -0.122 16.182 -5.336 260 HZ2 LYS 33 1HZ LYS 33 -1.460 15.722 -6.183 261 HZ3 LYS 33 2HZ LYS 33 -1.316 15.326 -4.588 262 H LEU 34 H LEU 34 3.167 10.014 -1.952 263 HA LEU 34 HA LEU 34 5.798 10.736 -1.135 264 HB2 LEU 34 1HB LEU 34 3.835 8.667 -0.076 265 HB3 LEU 34 2HB LEU 34 5.358 9.053 0.729 266 HG LEU 34 HG LEU 34 3.152 11.074 0.210 267 HD11 LEU 34 1HD1 LEU 34 2.627 10.808 2.593 268 HD12 LEU 34 1HD2 LEU 34 2.370 9.297 1.690 269 HD13 LEU 34 1HD3 LEU 34 3.817 9.491 2.708 270 HD21 LEU 34 2HD3 LEU 34 5.428 12.009 0.448 271 HD22 LEU 34 2HD1 LEU 34 4.422 12.403 1.863 272 HD23 LEU 34 2HD2 LEU 34 5.639 11.108 1.969 273 H ALA 35 H ALA 35 4.530 7.568 -2.178 274 HA ALA 35 HA ALA 35 7.017 6.194 -1.898 275 HB1 ALA 35 3HB ALA 35 4.691 5.631 -3.770 276 HB2 ALA 35 1HB ALA 35 6.002 4.495 -3.372 277 HB3 ALA 35 2HB ALA 35 4.867 5.026 -2.107 278 H ASN 36 H ASN 36 5.590 7.983 -4.606 279 HA ASN 36 HA ASN 36 7.646 7.275 -6.513 280 HB2 ASN 36 1HB ASN 36 5.365 8.166 -7.074 281 HB3 ASN 36 2HB ASN 36 5.883 9.738 -6.482 282 HD21 ASN 36 2HD2 ASN 36 6.591 11.083 -7.969 283 HD22 ASN 36 2HD1 ASN 36 7.313 10.645 -9.481 284 H GLU 37 H GLU 37 7.390 9.735 -4.029 285 HA GLU 37 HA GLU 37 9.806 11.137 -4.961 286 HB2 GLU 37 1HB GLU 37 8.118 11.349 -2.434 287 HB3 GLU 37 2HB GLU 37 9.544 12.331 -2.736 288 HG2 GLU 37 1HG GLU 37 8.509 13.376 -4.642 289 HG3 GLU 37 2HG GLU 37 7.135 12.275 -4.561 290 H GLY 38 H GLY 38 9.281 8.220 -3.484 291 HA2 GLY 38 1HA GLY 38 10.812 6.737 -2.556 292 HA3 GLY 38 2HA GLY 38 12.076 7.977 -2.732 293 H PHE 39 H PHE 39 9.075 8.688 -1.080 294 HA PHE 39 HA PHE 39 10.402 9.791 1.181 295 HB2 PHE 39 1HB PHE 39 8.103 10.413 0.580 296 HB3 PHE 39 2HB PHE 39 7.547 8.772 0.867 297 HD1 PHE 39 1HD PHE 39 9.151 11.665 2.585 298 HD2 PHE 39 2HD PHE 39 6.756 8.147 2.960 299 HE1 PHE 39 1HE PHE 39 8.683 12.237 4.945 300 HE2 PHE 39 2HE PHE 39 6.285 8.716 5.320 301 HZ PHE 39 HZ PHE 39 7.251 10.762 6.312 302 H TYR 40 H TYR 40 9.051 6.556 0.661 303 HA TYR 40 HA TYR 40 9.492 5.844 3.490 304 HB2 TYR 40 1HB TYR 40 8.508 4.211 1.118 305 HB3 TYR 40 2HB TYR 40 8.588 3.632 2.776 306 HD1 TYR 40 2HD TYR 40 7.152 4.688 4.536 307 HD2 TYR 40 1HD TYR 40 6.721 5.572 0.359 308 HE1 TYR 40 2HE TYR 40 4.892 5.591 4.961 309 HE2 TYR 40 1HE TYR 40 4.460 6.475 0.785 310 HH TYR 40 HH TYR 40 3.151 6.680 4.087 311 H ASN 41 H ASN 41 11.433 6.038 0.790 312 HA ASN 41 HA ASN 41 13.157 3.757 1.299 313 HB2 ASN 41 1HB ASN 41 13.117 5.016 -0.843 314 HB3 ASN 41 2HB ASN 41 13.797 6.411 -0.016 315 HD21 ASN 41 2HD2 ASN 41 14.848 4.761 -2.215 316 HD22 ASN 41 2HD1 ASN 41 16.398 4.202 -1.678 317 H GLY 42 H GLY 42 13.758 3.485 3.349 318 HA2 GLY 42 1HA GLY 42 15.806 3.843 4.645 319 HA3 GLY 42 2HA GLY 42 15.615 5.592 4.380 320 H LEU 43 H LEU 43 12.559 4.625 4.816 321 HA LEU 43 HA LEU 43 12.511 5.465 7.631 322 HB2 LEU 43 1HB LEU 43 10.298 4.521 5.762 323 HB3 LEU 43 2HB LEU 43 10.050 5.208 7.370 324 HG LEU 43 HG LEU 43 11.029 6.616 4.872 325 HD11 LEU 43 1HD1 LEU 43 9.079 8.038 5.323 326 HD12 LEU 43 1HD2 LEU 43 8.616 6.332 5.120 327 HD13 LEU 43 1HD3 LEU 43 8.687 7.048 6.748 328 HD21 LEU 43 2HD3 LEU 43 12.425 7.304 6.793 329 HD22 LEU 43 2HD1 LEU 43 11.318 8.609 6.305 330 HD23 LEU 43 2HD2 LEU 43 10.957 7.628 7.745 331 H THR 44 H THR 44 10.953 4.237 9.108 332 HA THR 44 HA THR 44 11.710 1.339 9.017 333 HB THR 44 HB THR 44 12.276 1.393 11.382 334 HG1 THR 44 1HG THR 44 11.645 4.178 11.248 335 HG21 THR 44 2HG3 THR 44 13.626 3.698 9.926 336 HG22 THR 44 2HG1 THR 44 14.266 2.845 11.351 337 HG23 THR 44 2HG2 THR 44 14.084 1.983 9.804 338 H PHE 45 H PHE 45 10.500 0.014 10.594 339 HA PHE 45 HA PHE 45 7.653 0.837 10.688 340 HB2 PHE 45 1HB PHE 45 9.108 -1.726 11.459 341 HB3 PHE 45 2HB PHE 45 7.385 -1.478 11.700 342 HD1 PHE 45 2HD PHE 45 5.866 -1.279 9.771 343 HD2 PHE 45 1HD PHE 45 10.020 -2.153 9.285 344 HE1 PHE 45 2HE PHE 45 5.430 -2.056 7.465 345 HE2 PHE 45 1HE PHE 45 9.589 -2.928 6.976 346 HZ PHE 45 HZ PHE 45 7.293 -2.879 6.067 347 H HIS 46 H HIS 46 6.402 0.910 12.548 348 HA HIS 46 HA HIS 46 7.995 1.946 14.853 349 HB2 HIS 46 1HB HIS 46 6.474 3.608 14.027 350 HB3 HIS 46 2HB HIS 46 5.162 2.447 13.877 351 HD2 HIS 46 2HD HIS 46 3.337 2.715 16.021 352 HE1 HIS 46 1HE HIS 46 6.159 4.233 18.811 353 H ARG 47 H ARG 47 5.361 -0.278 14.033 354 HA ARG 47 HA ARG 47 5.827 -1.774 16.522 355 HB2 ARG 47 1HB ARG 47 4.289 0.087 17.219 356 HB3 ARG 47 2HB ARG 47 3.137 -0.448 16.006 357 HG2 ARG 47 1HG ARG 47 2.783 -2.532 17.155 358 HG3 ARG 47 2HG ARG 47 4.100 -2.175 18.298 359 HD2 ARG 47 1HD ARG 47 2.880 -0.319 19.188 360 HD3 ARG 47 2HD ARG 47 1.600 -0.534 17.973 361 HE ARG 47 HE ARG 47 1.937 -2.949 19.419 362 HH11 ARG 47 1HH1 ARG 47 0.738 0.327 19.836 363 HH12 ARG 47 1HH2 ARG 47 -0.417 -0.119 21.071 364 HH21 ARG 47 2HH1 ARG 47 0.433 -3.516 21.024 365 HH22 ARG 47 2HH2 ARG 47 -0.590 -2.294 21.744 366 H VAL 48 H VAL 48 6.378 -3.405 15.076 367 HA VAL 48 HA VAL 48 4.239 -4.468 13.293 368 HB VAL 48 HB VAL 48 7.059 -5.469 13.921 369 HG11 VAL 48 1HG1 VAL 48 6.774 -6.885 11.946 370 HG12 VAL 48 1HG2 VAL 48 5.585 -7.263 13.214 371 HG13 VAL 48 1HG3 VAL 48 5.095 -6.322 11.785 372 HG21 VAL 48 2HG3 VAL 48 7.058 -3.280 12.775 373 HG22 VAL 48 2HG1 VAL 48 7.625 -4.567 11.687 374 HG23 VAL 48 2HG2 VAL 48 5.969 -3.932 11.527 375 H ILE 49 H ILE 49 2.871 -5.960 13.720 376 HA ILE 49 HA ILE 49 3.405 -7.750 16.076 377 HB ILE 49 HB ILE 49 0.699 -6.618 15.209 378 HG12 ILE 49 1HG1 ILE 49 2.313 -5.895 17.663 379 HG13 ILE 49 1HG2 ILE 49 2.214 -4.907 16.213 380 HG21 ILE 49 2HG1 ILE 49 -0.102 -7.640 17.300 381 HG22 ILE 49 2HG2 ILE 49 0.597 -8.865 16.217 382 HG23 ILE 49 2HG3 ILE 49 1.528 -8.281 17.616 383 HD11 ILE 49 1HD3 ILE 49 -0.116 -5.692 17.978 384 HD12 ILE 49 1HD1 ILE 49 0.687 -4.105 17.926 385 HD13 ILE 49 1HD2 ILE 49 -0.215 -4.693 16.509 386 HA PRO 50 HA PRO 50 3.165 -10.548 12.551 387 HB2 PRO 50 1HB PRO 50 4.090 -12.277 14.890 388 HB3 PRO 50 2HB PRO 50 4.703 -12.258 13.231 389 HG2 PRO 50 1HG PRO 50 6.162 -11.089 15.123 390 HG3 PRO 50 2HG PRO 50 5.969 -10.269 13.571 391 HD2 PRO 50 1HD PRO 50 4.541 -9.752 16.205 392 HD3 PRO 50 2HD PRO 50 5.176 -8.563 14.998 393 H GLY 51 H GLY 51 1.271 -11.162 12.015 394 HA2 GLY 51 1HA GLY 51 -0.425 -12.871 12.169 395 HA3 GLY 51 2HA GLY 51 -0.235 -12.870 13.938 396 H PHE 52 H PHE 52 -0.092 -9.760 13.550 397 HA PHE 52 HA PHE 52 -2.985 -9.258 12.983 398 HB2 PHE 52 1HB PHE 52 -1.419 -8.198 15.375 399 HB3 PHE 52 2HB PHE 52 -3.032 -7.677 14.913 400 HD1 PHE 52 2HD PHE 52 -4.920 -9.352 14.960 401 HD2 PHE 52 1HD PHE 52 -1.084 -10.135 16.669 402 HE1 PHE 52 2HE PHE 52 -5.900 -11.168 16.322 403 HE2 PHE 52 1HE PHE 52 -2.060 -11.953 18.031 404 HZ PHE 52 HZ PHE 52 -4.468 -12.470 17.857 405 H VAL 53 H VAL 53 -3.067 -6.590 13.497 406 HA VAL 53 HA VAL 53 -1.855 -5.537 11.063 407 HB VAL 53 HB VAL 53 -4.049 -4.773 12.210 408 HG11 VAL 53 1HG1 VAL 53 -3.824 -3.050 13.933 409 HG12 VAL 53 1HG2 VAL 53 -3.196 -4.624 14.478 410 HG13 VAL 53 1HG3 VAL 53 -2.068 -3.336 13.989 411 HG21 VAL 53 2HG3 VAL 53 -2.981 -3.540 10.354 412 HG22 VAL 53 2HG1 VAL 53 -3.691 -2.418 11.538 413 HG23 VAL 53 2HG2 VAL 53 -1.932 -2.692 11.517 414 H SER 54 H SER 54 -0.170 -4.327 10.670 415 HA SER 54 HA SER 54 1.729 -3.798 12.980 416 HB2 SER 54 1HB SER 54 2.370 -4.583 10.189 417 HB3 SER 54 2HB SER 54 3.510 -4.057 11.417 418 HG SER 54 HG SER 54 3.163 -6.344 11.197 419 H GLN 55 H GLN 55 2.582 -1.795 13.132 420 HA GLN 55 HA GLN 55 1.636 0.228 11.134 421 HB2 GLN 55 1HB GLN 55 0.830 0.521 13.493 422 HB3 GLN 55 2HB GLN 55 2.502 0.624 14.030 423 HG2 GLN 55 1HG GLN 55 2.845 2.655 12.770 424 HG3 GLN 55 2HG GLN 55 1.211 2.524 12.061 425 HE21 GLN 55 2HE2 GLN 55 1.888 4.841 13.309 426 HE22 GLN 55 2HE1 GLN 55 1.057 4.980 14.822 427 H GLY 56 H GLY 56 2.991 1.310 9.940 428 HA2 GLY 56 1HA GLY 56 5.808 1.590 10.814 429 HA3 GLY 56 2HA GLY 56 5.506 0.748 9.276 430 H GLY 57 H GLY 57 7.044 2.943 9.150 431 HA2 GLY 57 1HA GLY 57 6.869 4.446 7.221 432 HA3 GLY 57 2HA GLY 57 5.214 4.841 7.740 433 H CYS 58 H CYS 58 8.064 4.544 9.830 434 HA CYS 58 HA CYS 58 7.786 7.477 10.563 435 HB2 CYS 58 1HB CYS 58 8.534 5.196 12.328 436 HB3 CYS 58 2HB CYS 58 8.530 6.904 12.744 437 HG CYS 58 HG CYS 58 6.017 5.039 11.750 438 HA PRO 59 HA PRO 59 12.043 7.700 9.365 439 HB2 PRO 59 1HB PRO 59 12.629 10.155 10.422 440 HB3 PRO 59 2HB PRO 59 11.499 10.027 9.067 441 HG2 PRO 59 1HG PRO 59 10.894 10.272 12.045 442 HG3 PRO 59 2HG PRO 59 10.190 11.184 10.707 443 HD2 PRO 59 1HD PRO 59 8.920 9.018 11.777 444 HD3 PRO 59 2HD PRO 59 8.815 9.401 10.011 445 H ARG 60 H ARG 60 10.990 7.729 12.658 446 HA ARG 60 HA ARG 60 13.720 6.800 13.450 447 HB2 ARG 60 1HB ARG 60 11.986 8.775 14.986 448 HB3 ARG 60 2HB ARG 60 13.475 8.056 15.580 449 HG2 ARG 60 1HG ARG 60 13.323 9.799 13.111 450 HG3 ARG 60 2HG ARG 60 13.704 10.392 14.746 451 HD2 ARG 60 1HD ARG 60 15.606 8.853 14.828 452 HD3 ARG 60 2HD ARG 60 15.244 8.351 13.160 453 HE ARG 60 HE ARG 60 16.415 10.880 14.048 454 HH11 ARG 60 1HH1 ARG 60 14.965 9.045 11.426 455 HH12 ARG 60 1HH2 ARG 60 15.636 10.067 10.174 456 HH21 ARG 60 2HH1 ARG 60 17.280 12.198 12.413 457 HH22 ARG 60 2HH2 ARG 60 16.947 11.851 10.731 458 H GLY 61 H GLY 61 10.572 6.037 13.129 459 HA2 GLY 61 1HA GLY 61 9.309 4.295 13.993 460 HA3 GLY 61 2HA GLY 61 10.723 3.801 14.954 461 H ASN 62 H ASN 62 9.431 7.056 15.117 462 HA ASN 62 HA ASN 62 8.882 6.583 18.013 463 HB2 ASN 62 1HB ASN 62 9.069 8.984 18.256 464 HB3 ASN 62 2HB ASN 62 10.489 8.353 17.432 465 HD21 ASN 62 2HD2 ASN 62 10.240 10.903 17.136 466 HD22 ASN 62 2HD1 ASN 62 9.591 11.352 15.595 467 H GLY 63 H GLY 63 7.179 6.480 15.230 468 HA2 GLY 63 1HA GLY 63 4.864 6.221 15.041 469 HA3 GLY 63 2HA GLY 63 4.678 6.780 16.719 470 H THR 64 H THR 64 6.657 8.793 14.797 471 HA THR 64 HA THR 64 4.341 10.579 14.129 472 HB THR 64 HB THR 64 7.065 11.438 15.204 473 HG1 THR 64 1HG THR 64 5.756 12.164 16.977 474 HG21 THR 64 2HG3 THR 64 4.603 13.052 14.436 475 HG22 THR 64 2HG1 THR 64 6.090 13.700 15.166 476 HG23 THR 64 2HG2 THR 64 6.133 12.999 13.531 477 H GLY 65 H GLY 65 4.132 10.912 12.080 478 HA2 GLY 65 1HA GLY 65 6.255 10.207 10.214 479 HA3 GLY 65 2HA GLY 65 4.654 10.868 9.811 480 H ASP 66 H ASP 66 6.997 11.674 8.506 481 HA ASP 66 HA ASP 66 7.217 14.513 9.435 482 HB2 ASP 66 1HB ASP 66 9.585 14.525 8.877 483 HB3 ASP 66 2HB ASP 66 9.286 13.251 10.052 484 H ALA 67 H ALA 67 5.676 12.954 7.314 485 HA ALA 67 HA ALA 67 6.747 13.880 4.788 486 HB1 ALA 67 3HB ALA 67 3.939 12.992 5.541 487 HB2 ALA 67 1HB ALA 67 4.548 13.218 3.885 488 HB3 ALA 67 2HB ALA 67 5.238 11.946 4.922 489 H GLY 68 H GLY 68 4.108 15.022 6.908 490 HA2 GLY 68 1HA GLY 68 3.510 17.304 7.202 491 HA3 GLY 68 2HA GLY 68 4.425 17.726 5.736 492 H TYR 69 H TYR 69 2.892 15.093 4.738 493 HA TYR 69 HA TYR 69 0.793 16.578 3.346 494 HB2 TYR 69 1HB TYR 69 1.518 13.626 3.439 495 HB3 TYR 69 2HB TYR 69 0.219 14.283 2.453 496 HD1 TYR 69 1HD TYR 69 2.862 16.638 2.708 497 HD2 TYR 69 2HD TYR 69 1.666 13.050 0.681 498 HE1 TYR 69 1HE TYR 69 4.476 17.120 0.899 499 HE2 TYR 69 2HE TYR 69 3.280 13.533 -1.127 500 HH TYR 69 HH TYR 69 4.982 14.836 -1.774 501 H THR 70 H THR 70 -1.428 16.164 3.371 502 HA THR 70 HA THR 70 -2.414 14.952 5.935 503 HB THR 70 HB THR 70 -3.570 17.340 4.428 504 HG1 THR 70 1HG THR 70 -2.957 18.430 6.381 505 HG21 THR 70 2HG3 THR 70 -4.439 15.983 7.008 506 HG22 THR 70 2HG1 THR 70 -5.148 17.459 6.314 507 HG23 THR 70 2HG2 THR 70 -5.302 15.909 5.454 508 H ILE 71 H ILE 71 -3.468 13.173 5.655 509 HA ILE 71 HA ILE 71 -4.921 12.744 3.064 510 HB ILE 71 HB ILE 71 -3.975 10.790 5.220 511 HG12 ILE 71 1HG1 ILE 71 -3.084 11.104 2.344 512 HG13 ILE 71 1HG2 ILE 71 -2.205 11.706 3.741 513 HG21 ILE 71 2HG1 ILE 71 -4.812 9.029 3.717 514 HG22 ILE 71 2HG2 ILE 71 -6.132 10.094 4.253 515 HG23 ILE 71 2HG3 ILE 71 -5.457 10.269 2.616 516 HD11 ILE 71 1HD3 ILE 71 -2.858 8.804 3.180 517 HD12 ILE 71 1HD1 ILE 71 -1.280 9.596 2.963 518 HD13 ILE 71 1HD2 ILE 71 -1.968 9.414 4.595 519 HA PRO 72 HA PRO 72 -8.660 13.273 5.298 520 HB2 PRO 72 1HB PRO 72 -10.342 13.031 3.172 521 HB3 PRO 72 2HB PRO 72 -9.291 14.450 3.282 522 HG2 PRO 72 1HG PRO 72 -8.884 11.891 1.674 523 HG3 PRO 72 2HG PRO 72 -8.724 13.563 1.127 524 HD2 PRO 72 1HD PRO 72 -6.556 12.080 1.909 525 HD3 PRO 72 2HD PRO 72 -6.643 13.868 2.174 526 H CYS 73 H CYS 73 -10.309 12.079 6.077 527 HA CYS 73 HA CYS 73 -10.051 9.156 6.034 528 HB2 CYS 73 1HB CYS 73 -10.761 10.263 7.996 529 HB3 CYS 73 2HB CYS 73 -12.165 10.922 7.168 530 HG CYS 73 HG CYS 73 -12.887 9.049 8.768 531 H GLU 74 H GLU 74 -10.580 8.046 4.232 532 HA GLU 74 HA GLU 74 -13.064 8.871 2.757 533 HB2 GLU 74 1HB GLU 74 -10.498 7.595 1.717 534 HB3 GLU 74 2HB GLU 74 -11.970 7.763 0.769 535 HG2 GLU 74 1HG GLU 74 -11.835 10.193 0.928 536 HG3 GLU 74 2HG GLU 74 -10.409 10.067 1.956 537 H THR 75 H THR 75 -13.465 7.341 4.915 538 HA THR 75 HA THR 75 -13.626 4.528 3.953 539 HB THR 75 HB THR 75 -14.392 4.018 6.246 540 HG1 THR 75 1HG THR 75 -14.412 5.764 7.773 541 HG21 THR 75 2HG3 THR 75 -11.941 5.819 6.203 542 HG22 THR 75 2HG1 THR 75 -12.331 4.618 7.456 543 HG23 THR 75 2HG2 THR 75 -11.964 4.088 5.796 544 H ASP 76 H ASP 76 -15.371 7.234 3.496 545 HA ASP 76 HA ASP 76 -18.015 5.866 3.774 546 HB2 ASP 76 1HB ASP 76 -18.978 8.097 3.409 547 HB3 ASP 76 2HB ASP 76 -17.840 8.135 4.749 548 H ASN 77 H ASN 77 -15.831 5.445 1.671 549 HA ASN 77 HA ASN 77 -17.472 6.073 -0.748 550 HB2 ASN 77 1HB ASN 77 -14.613 5.116 -0.435 551 HB3 ASN 77 2HB ASN 77 -15.436 5.304 -1.977 552 HD21 ASN 77 2HD2 ASN 77 -13.075 6.654 -1.157 553 HD22 ASN 77 2HD1 ASN 77 -13.428 8.348 -1.115 554 H ASN 78 H ASN 78 -15.508 3.603 -1.545 555 HA ASN 78 HA ASN 78 -17.708 1.660 -1.582 556 HB2 ASN 78 1HB ASN 78 -14.817 1.538 -2.474 557 HB3 ASN 78 2HB ASN 78 -15.929 0.181 -2.596 558 HD21 ASN 78 2HD2 ASN 78 -14.629 1.419 -4.770 559 HD22 ASN 78 2HD1 ASN 78 -15.840 2.129 -5.785 560 HA PRO 79 HA PRO 79 -17.005 -0.594 2.118 561 HB2 PRO 79 1HB PRO 79 -17.105 -2.999 0.247 562 HB3 PRO 79 2HB PRO 79 -18.022 -2.728 1.735 563 HG2 PRO 79 1HG PRO 79 -19.284 -2.445 -0.590 564 HG3 PRO 79 2HG PRO 79 -19.567 -1.253 0.682 565 HD2 PRO 79 1HD PRO 79 -17.768 -1.058 -1.765 566 HD3 PRO 79 2HD PRO 79 -18.869 0.191 -1.055 567 H HIS 80 H HIS 80 -15.421 -1.537 3.223 568 HA HIS 80 HA HIS 80 -13.035 -2.489 1.726 569 HB2 HIS 80 1HB HIS 80 -11.518 -1.033 2.912 570 HB3 HIS 80 2HB HIS 80 -12.734 -0.019 2.148 571 HD2 HIS 80 2HD HIS 80 -11.480 -0.903 5.819 572 HE1 HIS 80 1HE HIS 80 -14.673 1.891 6.021 573 H ARG 81 H ARG 81 -11.515 -3.646 2.985 574 HA ARG 81 HA ARG 81 -12.566 -4.660 5.584 575 HB2 ARG 81 1HB ARG 81 -11.855 -6.397 3.188 576 HB3 ARG 81 2HB ARG 81 -12.163 -6.998 4.810 577 HG2 ARG 81 1HG ARG 81 -14.200 -5.470 3.173 578 HG3 ARG 81 2HG ARG 81 -14.068 -7.245 3.224 579 HD2 ARG 81 1HD ARG 81 -14.378 -7.146 5.664 580 HD3 ARG 81 2HD ARG 81 -14.640 -5.393 5.523 581 HE ARG 81 HE ARG 81 -16.461 -7.538 4.736 582 HH11 ARG 81 1HH1 ARG 81 -15.669 -4.120 4.542 583 HH12 ARG 81 1HH2 ARG 81 -17.294 -3.640 4.111 584 HH21 ARG 81 2HH1 ARG 81 -18.568 -6.901 4.176 585 HH22 ARG 81 2HH2 ARG 81 -18.936 -5.213 3.903 586 H HIS 82 H HIS 82 -11.068 -4.729 7.048 587 HA HIS 82 HA HIS 82 -8.219 -4.697 6.273 588 HB2 HIS 82 1HB HIS 82 -9.675 -4.618 8.944 589 HB3 HIS 82 2HB HIS 82 -7.926 -4.744 8.824 590 HD2 HIS 82 2HD HIS 82 -6.595 -2.230 8.480 591 HE1 HIS 82 1HE HIS 82 -10.150 -0.034 7.719 592 H VAL 83 H VAL 83 -8.351 -6.751 5.138 593 HA VAL 83 HA VAL 83 -8.120 -9.077 7.046 594 HB VAL 83 HB VAL 83 -8.629 -10.494 5.103 595 HG11 VAL 83 1HG1 VAL 83 -10.967 -9.874 4.731 596 HG12 VAL 83 1HG2 VAL 83 -10.502 -9.726 6.442 597 HG13 VAL 83 1HG3 VAL 83 -10.652 -8.268 5.430 598 HG21 VAL 83 2HG3 VAL 83 -7.614 -9.055 3.370 599 HG22 VAL 83 2HG1 VAL 83 -9.290 -9.476 2.946 600 HG23 VAL 83 2HG2 VAL 83 -8.916 -7.862 3.595 601 H THR 84 H THR 84 -6.845 -10.878 5.623 602 HA THR 84 HA THR 84 -4.133 -10.212 6.065 603 HB THR 84 HB THR 84 -5.248 -12.299 4.138 604 HG1 THR 84 1HG THR 84 -4.555 -12.445 6.908 605 HG21 THR 84 2HG3 THR 84 -2.557 -12.078 5.539 606 HG22 THR 84 2HG1 THR 84 -3.095 -13.433 4.520 607 HG23 THR 84 2HG2 THR 84 -2.847 -11.824 3.803 608 H GLY 85 H GLY 85 -2.908 -8.770 5.173 609 HA2 GLY 85 1HA GLY 85 -1.516 -8.206 3.293 610 HA3 GLY 85 2HA GLY 85 -2.831 -8.689 2.196 611 H ALA 86 H ALA 86 -4.655 -7.184 4.238 612 HA ALA 86 HA ALA 86 -5.073 -4.998 2.473 613 HB1 ALA 86 3HB ALA 86 -5.998 -5.349 5.348 614 HB2 ALA 86 1HB ALA 86 -6.661 -4.183 4.179 615 HB3 ALA 86 2HB ALA 86 -6.846 -5.932 3.896 616 H MET 87 H MET 87 -4.586 -2.877 2.486 617 HA MET 87 HA MET 87 -2.741 -1.926 4.654 618 HB2 MET 87 1HB MET 87 -2.555 -1.277 1.691 619 HB3 MET 87 2HB MET 87 -1.509 -0.653 2.958 620 HG2 MET 87 1HG MET 87 -0.672 -2.930 3.394 621 HG3 MET 87 2HG MET 87 -1.728 -3.562 2.129 622 HE1 MET 87 3HE MET 87 1.547 -1.714 3.017 623 HE2 MET 87 1HE MET 87 2.004 -0.921 1.491 624 HE3 MET 87 2HE MET 87 0.593 -0.339 2.409 625 H SER 88 H SER 88 -3.370 -0.220 5.696 626 HA SER 88 HA SER 88 -5.253 1.741 4.359 627 HB2 SER 88 1HB SER 88 -6.589 1.878 6.256 628 HB3 SER 88 2HB SER 88 -6.594 0.245 5.609 629 HG SER 88 HG SER 88 -6.361 0.124 7.769 630 H MET 89 H MET 89 -4.969 3.845 4.972 631 HA MET 89 HA MET 89 -2.365 4.462 6.214 632 HB2 MET 89 1HB MET 89 -4.510 6.225 4.979 633 HB3 MET 89 2HB MET 89 -2.969 6.808 5.590 634 HG2 MET 89 1HG MET 89 -3.421 4.947 3.246 635 HG3 MET 89 2HG MET 89 -2.829 6.610 3.205 636 HE1 MET 89 3HE MET 89 -0.710 6.912 5.398 637 HE2 MET 89 1HE MET 89 0.770 6.365 4.573 638 HE3 MET 89 2HE MET 89 -0.424 7.355 3.697 639 H ALA 90 H ALA 90 -1.969 5.583 8.037 640 HA ALA 90 HA ALA 90 -3.925 5.212 10.143 641 HB1 ALA 90 3HB ALA 90 -1.277 6.703 10.140 642 HB2 ALA 90 1HB ALA 90 -2.224 6.271 11.582 643 HB3 ALA 90 2HB ALA 90 -1.515 4.993 10.567 644 H HIS 91 H HIS 91 -5.503 6.484 10.762 645 HA HIS 91 HA HIS 91 -4.981 9.353 11.039 646 HB2 HIS 91 1HB HIS 91 -6.956 10.101 9.801 647 HB3 HIS 91 2HB HIS 91 -5.858 9.261 8.716 648 HD2 HIS 91 2HD HIS 91 -7.052 7.066 7.312 649 HE1 HIS 91 1HE HIS 91 -10.618 7.049 9.623 650 H ARG 92 H ARG 92 -7.101 10.441 11.878 651 HA ARG 92 HA ARG 92 -8.438 8.548 13.777 652 HB2 ARG 92 1HB ARG 92 -7.337 11.310 14.426 653 HB3 ARG 92 2HB ARG 92 -8.299 10.320 15.512 654 HG2 ARG 92 1HG ARG 92 -5.601 9.490 14.419 655 HG3 ARG 92 2HG ARG 92 -5.861 10.291 15.988 656 HD2 ARG 92 1HD ARG 92 -7.326 8.443 16.650 657 HD3 ARG 92 2HD ARG 92 -6.964 7.634 15.108 658 HE ARG 92 HE ARG 92 -5.213 7.912 17.430 659 HH11 ARG 92 1HH1 ARG 92 -5.487 7.103 14.023 660 HH12 ARG 92 1HH2 ARG 92 -4.009 6.168 13.996 661 HH21 ARG 92 2HH1 ARG 92 -3.297 6.695 17.384 662 HH22 ARG 92 2HH2 ARG 92 -2.768 5.936 15.900 663 H GLY 93 H GLY 93 -8.837 10.590 11.262 664 HA2 GLY 93 1HA GLY 93 -11.618 10.716 11.342 665 HA3 GLY 93 2HA GLY 93 -11.066 12.190 12.171 666 H ARG 94 H ARG 94 -12.207 13.237 10.347 667 HA ARG 94 HA ARG 94 -11.207 12.930 7.639 668 HB2 ARG 94 1HB ARG 94 -13.508 13.759 8.231 669 HB3 ARG 94 2HB ARG 94 -12.782 15.225 8.870 670 HG2 ARG 94 1HG ARG 94 -13.584 15.737 6.707 671 HG3 ARG 94 2HG ARG 94 -11.813 15.633 6.568 672 HD2 ARG 94 1HD ARG 94 -11.979 13.418 5.661 673 HD3 ARG 94 2HD ARG 94 -13.743 13.427 5.889 674 HE ARG 94 HE ARG 94 -13.107 15.660 4.329 675 HH11 ARG 94 1HH1 ARG 94 -12.901 12.161 4.099 676 HH12 ARG 94 1HH2 ARG 94 -13.069 12.140 2.358 677 HH21 ARG 94 2HH1 ARG 94 -13.323 15.620 2.069 678 HH22 ARG 94 2HH2 ARG 94 -13.308 14.098 1.208 679 H ASP 95 H ASP 95 -9.418 13.614 6.802 680 HA ASP 95 HA ASP 95 -7.562 14.943 6.367 681 HB2 ASP 95 1HB ASP 95 -9.285 17.037 7.757 682 HB3 ASP 95 2HB ASP 95 -7.745 17.391 6.986 683 H THR 96 H THR 96 -7.402 13.239 8.528 684 HA THR 96 HA THR 96 -5.449 14.795 10.184 685 HB THR 96 HB THR 96 -5.991 13.373 12.119 686 HG1 THR 96 1HG THR 96 -7.883 12.242 10.310 687 HG21 THR 96 2HG3 THR 96 -8.472 14.648 10.905 688 HG22 THR 96 2HG1 THR 96 -8.237 14.253 12.623 689 HG23 THR 96 2HG2 THR 96 -7.226 15.496 11.849 690 H GLY 97 H GLY 97 -5.719 12.632 7.805 691 HA2 GLY 97 1HA GLY 97 -4.275 10.364 8.890 692 HA3 GLY 97 2HA GLY 97 -4.662 10.662 7.178 693 H SER 98 H SER 98 -2.159 9.778 8.657 694 HA SER 98 HA SER 98 -0.242 11.953 7.769 695 HB2 SER 98 1HB SER 98 1.251 11.265 9.310 696 HB3 SER 98 2HB SER 98 -0.290 11.375 10.144 697 HG SER 98 HG SER 98 0.562 9.500 10.734 698 H CYS 99 H CYS 99 2.018 10.655 7.535 699 HA CYS 99 HA CYS 99 1.785 9.064 5.059 700 HB2 CYS 99 1HB CYS 99 4.143 9.041 5.058 701 HB3 CYS 99 2HB CYS 99 3.499 10.668 5.233 702 HG CYS 99 HG CYS 99 3.853 10.843 7.787 703 H GLN 100 H GLN 100 1.713 8.392 8.425 704 HA GLN 100 HA GLN 100 3.014 5.794 8.352 705 HB2 GLN 100 1HB GLN 100 0.992 6.972 10.307 706 HB3 GLN 100 2HB GLN 100 1.872 5.470 10.554 707 HG2 GLN 100 1HG GLN 100 4.001 6.718 10.515 708 HG3 GLN 100 2HG GLN 100 3.076 8.236 10.330 709 HE21 GLN 100 2HE2 GLN 100 2.498 9.291 12.118 710 HE22 GLN 100 2HE1 GLN 100 2.499 8.632 13.720 711 H PHE 101 H PHE 101 2.128 3.747 8.402 712 HA PHE 101 HA PHE 101 -0.629 3.527 7.277 713 HB2 PHE 101 1HB PHE 101 0.195 2.055 5.484 714 HB3 PHE 101 2HB PHE 101 0.895 3.660 5.337 715 HD1 PHE 101 1HD PHE 101 1.561 0.156 6.247 716 HD2 PHE 101 2HD PHE 101 3.248 4.032 5.620 717 HE1 PHE 101 1HE PHE 101 3.826 -0.835 6.221 718 HE2 PHE 101 2HE PHE 101 5.514 3.043 5.592 719 HZ PHE 101 HZ PHE 101 5.802 0.608 5.894 720 H PHE 102 H PHE 102 -1.544 1.444 7.346 721 HA PHE 102 HA PHE 102 -0.184 -0.389 9.299 722 HB2 PHE 102 1HB PHE 102 -3.141 0.187 8.849 723 HB3 PHE 102 2HB PHE 102 -2.556 -1.180 9.783 724 HD1 PHE 102 2HD PHE 102 -1.396 -0.830 11.925 725 HD2 PHE 102 1HD PHE 102 -3.072 2.421 9.718 726 HE1 PHE 102 2HE PHE 102 -1.274 0.597 13.939 727 HE2 PHE 102 1HE PHE 102 -2.948 3.853 11.730 728 HZ PHE 102 HZ PHE 102 -2.049 2.940 13.841 729 H ILE 103 H ILE 103 0.305 -2.349 8.685 730 HA ILE 103 HA ILE 103 -1.139 -3.487 6.302 731 HB ILE 103 HB ILE 103 1.611 -4.184 7.451 732 HG12 ILE 103 1HG1 ILE 103 0.904 -2.862 4.822 733 HG13 ILE 103 1HG2 ILE 103 1.524 -2.024 6.236 734 HG21 ILE 103 2HG1 ILE 103 1.798 -5.677 5.502 735 HG22 ILE 103 2HG2 ILE 103 0.430 -6.146 6.538 736 HG23 ILE 103 2HG3 ILE 103 0.134 -5.264 5.022 737 HD11 ILE 103 1HD3 ILE 103 2.958 -4.204 4.704 738 HD12 ILE 103 1HD1 ILE 103 3.294 -2.458 4.627 739 HD13 ILE 103 1HD2 ILE 103 3.586 -3.356 6.137 740 H VAL 104 H VAL 104 -2.503 -5.015 6.571 741 HA VAL 104 HA VAL 104 -2.762 -6.149 9.329 742 HB VAL 104 HB VAL 104 -4.642 -6.254 6.921 743 HG11 VAL 104 1HG1 VAL 104 -6.324 -6.976 8.544 744 HG12 VAL 104 1HG2 VAL 104 -4.958 -8.113 8.449 745 HG13 VAL 104 1HG3 VAL 104 -5.085 -6.987 9.822 746 HG21 VAL 104 2HG3 VAL 104 -4.331 -3.948 7.752 747 HG22 VAL 104 2HG1 VAL 104 -5.957 -4.555 8.147 748 HG23 VAL 104 2HG2 VAL 104 -4.701 -4.492 9.406 749 H HIS 105 H HIS 105 -2.470 -8.138 9.892 750 HA HIS 105 HA HIS 105 -1.643 -10.060 7.763 751 HB2 HIS 105 1HB HIS 105 -1.369 -10.199 10.797 752 HB3 HIS 105 2HB HIS 105 -0.800 -11.423 9.672 753 HD2 HIS 105 2HD HIS 105 0.216 -8.386 7.876 754 HE1 HIS 105 1HE HIS 105 3.322 -8.965 10.737 755 H GLU 106 H GLU 106 -4.160 -9.409 10.079 756 HA GLU 106 HA GLU 106 -5.475 -11.988 9.330 757 HB2 GLU 106 1HB GLU 106 -4.345 -12.325 11.512 758 HB3 GLU 106 2HB GLU 106 -5.142 -10.897 12.156 759 HG2 GLU 106 1HG GLU 106 -7.334 -11.987 11.851 760 HG3 GLU 106 2HG GLU 106 -6.525 -13.422 11.225 761 HA PRO 107 HA PRO 107 -9.063 -9.524 8.549 762 HB2 PRO 107 1HB PRO 107 -10.303 -12.054 9.742 763 HB3 PRO 107 2HB PRO 107 -10.799 -11.172 8.292 764 HG2 PRO 107 1HG PRO 107 -9.440 -13.432 7.973 765 HG3 PRO 107 2HG PRO 107 -9.006 -12.037 6.980 766 HD2 PRO 107 1HD PRO 107 -7.629 -13.137 9.453 767 HD3 PRO 107 2HD PRO 107 -6.899 -12.443 7.950 768 H GLN 108 H GLN 108 -9.506 -7.931 9.779 769 HA GLN 108 HA GLN 108 -10.563 -8.511 12.504 770 HB2 GLN 108 1HB GLN 108 -8.341 -6.550 11.818 771 HB3 GLN 108 2HB GLN 108 -9.290 -6.433 13.293 772 HG2 GLN 108 1HG GLN 108 -7.662 -8.856 12.499 773 HG3 GLN 108 2HG GLN 108 -7.111 -7.557 13.594 774 HE21 GLN 108 2HE2 GLN 108 -7.692 -10.542 13.917 775 HE22 GLN 108 2HE1 GLN 108 -8.722 -10.617 15.307 776 HA PRO 109 HA PRO 109 -13.514 -5.867 10.251 777 HB2 PRO 109 1HB PRO 109 -15.118 -7.010 12.574 778 HB3 PRO 109 2HB PRO 109 -15.598 -6.859 10.879 779 HG2 PRO 109 1HG PRO 109 -14.934 -9.270 11.792 780 HG3 PRO 109 2HG PRO 109 -14.343 -8.767 10.206 781 HD2 PRO 109 1HD PRO 109 -12.884 -8.793 12.877 782 HD3 PRO 109 2HD PRO 109 -12.283 -9.288 11.244 783 H HIS 110 H HIS 110 -12.486 -6.098 13.574 784 HA HIS 110 HA HIS 110 -13.863 -3.778 14.552 785 HB2 HIS 110 1HB HIS 110 -11.225 -5.036 15.423 786 HB3 HIS 110 2HB HIS 110 -12.070 -3.777 16.313 787 HD2 HIS 110 2HD HIS 110 -11.891 -7.536 16.259 788 HE1 HIS 110 1HE HIS 110 -15.651 -6.587 18.025 789 H LEU 111 H LEU 111 -11.143 -4.133 12.463 790 HA LEU 111 HA LEU 111 -10.175 -1.388 12.982 791 HB2 LEU 111 1HB LEU 111 -9.340 -3.507 10.959 792 HB3 LEU 111 2HB LEU 111 -8.543 -1.945 11.170 793 HG LEU 111 HG LEU 111 -8.681 -4.152 13.255 794 HD11 LEU 111 1HD1 LEU 111 -6.286 -4.401 12.778 795 HD12 LEU 111 1HD2 LEU 111 -7.281 -4.735 11.341 796 HD13 LEU 111 1HD3 LEU 111 -6.417 -3.186 11.485 797 HD21 LEU 111 2HD3 LEU 111 -8.617 -1.877 14.222 798 HD22 LEU 111 2HD1 LEU 111 -7.071 -2.723 14.472 799 HD23 LEU 111 2HD2 LEU 111 -7.213 -1.483 13.202 800 H ASP 112 H ASP 112 -12.475 -2.936 10.995 801 HA ASP 112 HA ASP 112 -12.329 -1.206 8.692 802 HB2 ASP 112 1HB ASP 112 -14.590 -2.870 9.873 803 HB3 ASP 112 2HB ASP 112 -14.740 -1.973 8.369 804 H GLY 113 H GLY 113 -12.932 0.776 8.339 805 HA2 GLY 113 1HA GLY 113 -14.274 2.705 8.550 806 HA3 GLY 113 2HA GLY 113 -15.041 2.006 9.996 807 H VAL 114 H VAL 114 -11.951 1.405 10.612 808 HA VAL 114 HA VAL 114 -11.624 3.871 12.263 809 HB VAL 114 HB VAL 114 -10.006 1.279 12.157 810 HG11 VAL 114 1HG1 VAL 114 -9.072 2.032 14.291 811 HG12 VAL 114 1HG2 VAL 114 -8.710 3.166 12.967 812 HG13 VAL 114 1HG3 VAL 114 -9.982 3.554 14.151 813 HG21 VAL 114 2HG3 VAL 114 -12.326 0.896 12.917 814 HG22 VAL 114 2HG1 VAL 114 -11.178 0.718 14.264 815 HG23 VAL 114 2HG2 VAL 114 -12.152 2.200 14.115 816 H HIS 115 H HIS 115 -9.878 2.055 9.759 817 HA HIS 115 HA HIS 115 -8.434 4.616 9.175 818 HB2 HIS 115 1HB HIS 115 -7.306 1.786 9.036 819 HB3 HIS 115 2HB HIS 115 -6.482 3.230 8.465 820 HD2 HIS 115 2HD HIS 115 -6.652 1.141 11.596 821 HE1 HIS 115 1HE HIS 115 -5.294 4.984 12.840 822 H THR 116 H THR 116 -7.716 4.881 6.997 823 HA THR 116 HA THR 116 -9.857 3.931 5.173 824 HB THR 116 HB THR 116 -7.707 6.070 4.833 825 HG1 THR 116 1HG THR 116 -9.438 6.544 6.324 826 HG21 THR 116 2HG3 THR 116 -10.070 5.328 3.065 827 HG22 THR 116 2HG1 THR 116 -8.974 6.707 2.818 828 HG23 THR 116 2HG2 THR 116 -8.357 5.045 2.680 829 H VAL 117 H VAL 117 -9.540 2.042 4.282 830 HA VAL 117 HA VAL 117 -6.930 0.994 3.525 831 HB VAL 117 HB VAL 117 -9.749 0.286 2.575 832 HG11 VAL 117 1HG1 VAL 117 -8.763 -1.824 1.825 833 HG12 VAL 117 1HG2 VAL 117 -8.067 -0.424 0.974 834 HG13 VAL 117 1HG3 VAL 117 -7.147 -1.226 2.270 835 HG21 VAL 117 2HG3 VAL 117 -9.423 -0.028 5.004 836 HG22 VAL 117 2HG1 VAL 117 -9.544 -1.596 4.169 837 HG23 VAL 117 2HG2 VAL 117 -7.955 -0.983 4.685 838 H PHE 118 H PHE 118 -5.752 1.114 1.796 839 HA PHE 118 HA PHE 118 -6.808 2.799 -0.449 840 HB2 PHE 118 1HB PHE 118 -4.740 4.023 -0.534 841 HB3 PHE 118 2HB PHE 118 -5.311 4.101 1.125 842 HD1 PHE 118 2HD PHE 118 -4.179 2.857 2.902 843 HD2 PHE 118 1HD PHE 118 -2.741 2.810 -1.120 844 HE1 PHE 118 2HE PHE 118 -2.009 1.972 3.691 845 HE2 PHE 118 1HE PHE 118 -0.570 1.922 -0.335 846 HZ PHE 118 HZ PHE 118 -0.205 1.503 2.070 847 H GLY 119 H GLY 119 -5.137 0.003 0.597 848 HA2 GLY 119 1HA GLY 119 -4.903 -0.981 -2.124 849 HA3 GLY 119 2HA GLY 119 -3.324 -0.562 -1.417 850 H GLN 120 H GLN 120 -3.253 -3.022 -1.965 851 HA GLN 120 HA GLN 120 -3.367 -4.411 0.605 852 HB2 GLN 120 1HB GLN 120 -5.696 -4.742 -0.224 853 HB3 GLN 120 2HB GLN 120 -5.066 -5.415 -1.719 854 HG2 GLN 120 1HG GLN 120 -4.077 -7.281 -0.506 855 HG3 GLN 120 2HG GLN 120 -4.643 -6.585 1.038 856 HE21 GLN 120 2HE2 GLN 120 -5.610 -8.824 1.136 857 HE22 GLN 120 2HE1 GLN 120 -7.194 -9.027 0.466 858 H VAL 121 H VAL 121 -1.714 -5.697 0.812 859 HA VAL 121 HA VAL 121 0.148 -6.197 -1.361 860 HB VAL 121 HB VAL 121 -0.186 -7.605 1.331 861 HG11 VAL 121 1HG1 VAL 121 2.148 -8.277 1.035 862 HG12 VAL 121 1HG2 VAL 121 1.100 -8.927 -0.247 863 HG13 VAL 121 1HG3 VAL 121 2.156 -7.534 -0.582 864 HG21 VAL 121 2HG3 VAL 121 0.186 -5.174 1.572 865 HG22 VAL 121 2HG1 VAL 121 1.621 -6.092 2.086 866 HG23 VAL 121 2HG2 VAL 121 1.604 -5.283 0.501 867 H THR 122 H THR 122 0.349 -7.687 -2.800 868 HA THR 122 HA THR 122 -1.607 -9.962 -2.689 869 HB THR 122 HB THR 122 -1.560 -9.965 -5.155 870 HG1 THR 122 1HG THR 122 -0.466 -8.210 -6.206 871 HG21 THR 122 2HG3 THR 122 -2.125 -7.202 -4.014 872 HG22 THR 122 2HG1 THR 122 -2.744 -7.843 -5.553 873 HG23 THR 122 2HG2 THR 122 -3.255 -8.577 -4.015 874 H SER 123 H SER 123 1.706 -8.972 -3.145 875 HA SER 123 HA SER 123 2.520 -11.889 -3.079 876 HB2 SER 123 1HB SER 123 3.614 -9.837 -4.927 877 HB3 SER 123 2HB SER 123 4.292 -11.425 -4.608 878 HG SER 123 HG SER 123 2.937 -11.395 -6.401 879 H GLY 124 H GLY 124 4.386 -12.291 -1.945 880 HA2 GLY 124 1HA GLY 124 6.380 -11.743 -0.785 881 HA3 GLY 124 2HA GLY 124 5.942 -10.020 -0.861 882 H MET 125 H MET 125 3.356 -12.049 0.044 883 HA MET 125 HA MET 125 3.074 -10.935 2.662 884 HB2 MET 125 1HB MET 125 1.936 -13.423 1.352 885 HB3 MET 125 2HB MET 125 1.515 -12.939 2.989 886 HG2 MET 125 1HG MET 125 1.024 -11.342 0.462 887 HG3 MET 125 2HG MET 125 -0.181 -12.200 1.424 888 HE1 MET 125 3HE MET 125 1.080 -11.506 4.383 889 HE2 MET 125 1HE MET 125 0.044 -10.126 4.820 890 HE3 MET 125 2HE MET 125 -0.664 -11.558 4.032 891 H ASP 126 H ASP 126 4.841 -13.733 1.500 892 HA ASP 126 HA ASP 126 5.391 -14.976 4.004 893 HB2 ASP 126 1HB ASP 126 7.042 -14.717 1.460 894 HB3 ASP 126 2HB ASP 126 7.560 -15.675 2.840 895 H VAL 127 H VAL 127 6.780 -12.111 2.493 896 HA VAL 127 HA VAL 127 8.757 -11.753 4.670 897 HB VAL 127 HB VAL 127 7.799 -9.888 2.445 898 HG11 VAL 127 1HG1 VAL 127 9.794 -8.571 2.960 899 HG12 VAL 127 1HG2 VAL 127 8.677 -8.654 4.342 900 HG13 VAL 127 1HG3 VAL 127 10.153 -9.649 4.328 901 HG21 VAL 127 2HG3 VAL 127 8.934 -11.911 1.593 902 HG22 VAL 127 2HG1 VAL 127 9.949 -10.467 1.367 903 HG23 VAL 127 2HG2 VAL 127 10.303 -11.606 2.687 904 H VAL 128 H VAL 128 5.659 -10.298 3.717 905 HA VAL 128 HA VAL 128 5.561 -8.282 5.731 906 HB VAL 128 HB VAL 128 3.324 -9.965 4.504 907 HG11 VAL 128 1HG1 VAL 128 1.810 -8.191 5.243 908 HG12 VAL 128 1HG2 VAL 128 2.605 -9.000 6.612 909 HG13 VAL 128 1HG3 VAL 128 3.158 -7.392 6.086 910 HG21 VAL 128 2HG3 VAL 128 4.621 -8.647 2.866 911 HG22 VAL 128 2HG1 VAL 128 2.984 -7.979 3.068 912 HG23 VAL 128 2HG2 VAL 128 4.373 -7.182 3.845 913 H ARG 129 H ARG 129 4.653 -11.705 5.933 914 HA ARG 129 HA ARG 129 3.529 -11.322 8.613 915 HB2 ARG 129 1HB ARG 129 4.139 -13.819 6.982 916 HB3 ARG 129 2HB ARG 129 3.341 -13.830 8.548 917 HG2 ARG 129 1HG ARG 129 1.474 -12.533 7.622 918 HG3 ARG 129 2HG ARG 129 2.284 -12.503 6.037 919 HD2 ARG 129 1HD ARG 129 1.520 -15.010 7.512 920 HD3 ARG 129 2HD ARG 129 0.527 -14.225 6.262 921 HE ARG 129 HE ARG 129 3.086 -14.602 5.182 922 HH11 ARG 129 1HH1 ARG 129 0.409 -16.551 6.357 923 HH12 ARG 129 1HH2 ARG 129 0.758 -17.897 5.295 924 HH21 ARG 129 2HH1 ARG 129 3.530 -16.355 3.809 925 HH22 ARG 129 2HH2 ARG 129 2.525 -17.786 3.852 926 H THR 130 H THR 130 6.649 -11.635 7.407 927 HA THR 130 HA THR 130 7.611 -12.710 10.039 928 HB THR 130 HB THR 130 9.698 -13.325 8.838 929 HG1 THR 130 1HG THR 130 8.471 -12.969 6.350 930 HG21 THR 130 2HG3 THR 130 7.179 -14.415 7.526 931 HG22 THR 130 2HG1 THR 130 8.778 -15.194 7.525 932 HG23 THR 130 2HG2 THR 130 7.888 -14.992 9.052 933 H MET 131 H MET 131 6.910 -9.888 8.905 934 HA MET 131 HA MET 131 9.353 -8.373 9.127 935 HB2 MET 131 1HB MET 131 6.430 -7.670 9.526 936 HB3 MET 131 2HB MET 131 7.719 -6.490 9.704 937 HG2 MET 131 1HG MET 131 8.403 -6.891 7.362 938 HG3 MET 131 2HG MET 131 7.090 -8.058 7.187 939 HE1 MET 131 3HE MET 131 6.382 -6.608 5.014 940 HE2 MET 131 1HE MET 131 5.983 -4.876 5.092 941 HE3 MET 131 2HE MET 131 7.659 -5.416 5.360 942 H LYS 132 H LYS 132 10.096 -7.047 10.799 943 HA LYS 132 HA LYS 132 9.220 -7.903 13.538 944 HB2 LYS 132 1HB LYS 132 12.064 -7.451 12.552 945 HB3 LYS 132 2HB LYS 132 11.612 -7.673 14.236 946 HG2 LYS 132 1HG LYS 132 10.768 -9.936 13.711 947 HG3 LYS 132 2HG LYS 132 11.239 -9.710 12.020 948 HD2 LYS 132 1HD LYS 132 13.596 -9.393 12.727 949 HD3 LYS 132 2HD LYS 132 13.118 -9.647 14.412 950 HE2 LYS 132 1HE LYS 132 12.322 -11.919 13.844 951 HE3 LYS 132 2HE LYS 132 12.792 -11.667 12.161 952 HZ1 LYS 132 3HZ LYS 132 14.625 -11.653 14.466 953 HZ2 LYS 132 1HZ LYS 132 14.457 -12.874 13.371 954 HZ3 LYS 132 2HZ LYS 132 15.064 -11.416 12.894 955 H ASN 133 H ASN 133 9.556 -6.407 15.223 956 HA ASN 133 HA ASN 133 8.701 -3.761 14.425 957 HB2 ASN 133 1HB ASN 133 8.034 -4.898 16.545 958 HB3 ASN 133 2HB ASN 133 9.681 -4.715 17.130 959 HD21 ASN 133 2HD2 ASN 133 7.331 -3.650 18.329 960 HD22 ASN 133 2HD1 ASN 133 7.479 -1.923 18.320 961 H GLY 134 H GLY 134 9.961 -2.416 13.396 962 HA2 GLY 134 1HA GLY 134 11.501 -0.579 13.836 963 HA3 GLY 134 2HA GLY 134 12.516 -1.703 14.769 964 H ASP 135 H ASP 135 11.362 -3.326 12.101 965 HA ASP 135 HA ASP 135 13.871 -3.469 10.737 966 HB2 ASP 135 1HB ASP 135 11.016 -4.120 9.937 967 HB3 ASP 135 2HB ASP 135 12.343 -4.290 8.797 968 H VAL 136 H VAL 136 14.562 -2.680 8.756 969 HA VAL 136 HA VAL 136 13.550 0.103 8.228 970 HB VAL 136 HB VAL 136 16.188 -1.217 7.436 971 HG11 VAL 136 1HG1 VAL 136 16.913 1.070 6.957 972 HG12 VAL 136 1HG2 VAL 136 15.518 0.591 5.963 973 HG13 VAL 136 1HG3 VAL 136 15.288 1.669 7.361 974 HG21 VAL 136 2HG3 VAL 136 16.001 -1.009 9.891 975 HG22 VAL 136 2HG1 VAL 136 17.190 0.146 9.243 976 HG23 VAL 136 2HG2 VAL 136 15.569 0.709 9.715 977 H MET 137 H MET 137 12.655 0.699 6.449 978 HA MET 137 HA MET 137 12.315 -1.309 4.294 979 HB2 MET 137 1HB MET 137 11.169 1.470 4.734 980 HB3 MET 137 2HB MET 137 10.835 0.485 3.316 981 HG2 MET 137 1HG MET 137 9.733 -1.193 4.661 982 HG3 MET 137 2HG MET 137 10.215 -0.381 6.152 983 HE1 MET 137 3HE MET 137 9.614 2.465 6.238 984 HE2 MET 137 1HE MET 137 7.861 2.557 6.530 985 HE3 MET 137 2HE MET 137 8.835 1.313 7.351 986 H LYS 138 H LYS 138 13.651 -1.510 2.690 987 HA LYS 138 HA LYS 138 15.941 0.218 2.481 988 HB2 LYS 138 1HB LYS 138 16.024 -2.170 1.874 989 HB3 LYS 138 2HB LYS 138 14.874 -1.899 0.571 990 HG2 LYS 138 1HG LYS 138 16.485 -0.477 -0.599 991 HG3 LYS 138 2HG LYS 138 17.636 -0.660 0.731 992 HD2 LYS 138 1HD LYS 138 17.747 -3.083 0.335 993 HD3 LYS 138 2HD LYS 138 16.540 -2.944 -0.951 994 HE2 LYS 138 1HE LYS 138 18.070 -1.495 -2.238 995 HE3 LYS 138 2HE LYS 138 19.272 -1.607 -0.951 996 HZ1 LYS 138 3HZ LYS 138 18.257 -3.868 -2.540 997 HZ2 LYS 138 1HZ LYS 138 19.726 -3.143 -2.718 998 HZ3 LYS 138 2HZ LYS 138 19.379 -3.973 -1.337 999 H GLU 139 H GLU 139 13.091 -0.188 0.368 1000 HA GLU 139 HA GLU 139 13.269 2.537 -0.616 1001 HB2 GLU 139 1HB GLU 139 13.917 2.043 -2.916 1002 HB3 GLU 139 2HB GLU 139 15.208 1.550 -1.830 1003 HG2 GLU 139 1HG GLU 139 14.356 -0.798 -1.973 1004 HG3 GLU 139 2HG GLU 139 13.189 -0.254 -3.176 1005 H VAL 140 H VAL 140 11.705 3.021 -2.269 1006 HA VAL 140 HA VAL 140 9.512 1.004 -2.556 1007 HB VAL 140 HB VAL 140 9.098 2.427 -0.470 1008 HG11 VAL 140 1HG1 VAL 140 8.466 4.768 -0.798 1009 HG12 VAL 140 1HG2 VAL 140 10.168 4.471 -1.227 1010 HG13 VAL 140 1HG3 VAL 140 8.946 4.657 -2.508 1011 HG21 VAL 140 2HG3 VAL 140 7.255 1.393 -1.751 1012 HG22 VAL 140 2HG1 VAL 140 6.773 2.982 -1.110 1013 HG23 VAL 140 2HG2 VAL 140 7.207 2.810 -2.828 1014 H LYS 141 H LYS 141 8.373 1.092 -4.336 1015 HA LYS 141 HA LYS 141 8.600 3.483 -6.083 1016 HB2 LYS 141 1HB LYS 141 9.477 0.687 -6.907 1017 HB3 LYS 141 2HB LYS 141 9.163 1.995 -8.038 1018 HG2 LYS 141 1HG LYS 141 10.961 3.331 -6.967 1019 HG3 LYS 141 2HG LYS 141 11.296 1.973 -5.884 1020 HD2 LYS 141 1HD LYS 141 11.797 0.538 -7.837 1021 HD3 LYS 141 2HD LYS 141 11.462 1.896 -8.921 1022 HE2 LYS 141 1HE LYS 141 13.301 3.181 -7.890 1023 HE3 LYS 141 2HE LYS 141 13.630 1.843 -6.788 1024 HZ1 LYS 141 3HZ LYS 141 13.839 1.730 -9.723 1025 HZ2 LYS 141 1HZ LYS 141 15.101 1.822 -8.666 1026 HZ3 LYS 141 2HZ LYS 141 14.146 0.478 -8.694 1027 H VAL 142 H VAL 142 7.010 3.699 -7.615 1028 HA VAL 142 HA VAL 142 4.794 1.662 -7.529 1029 HB VAL 142 HB VAL 142 3.185 3.543 -7.619 1030 HG11 VAL 142 1HG1 VAL 142 3.387 4.322 -5.308 1031 HG12 VAL 142 1HG2 VAL 142 3.701 2.576 -5.453 1032 HG13 VAL 142 1HG3 VAL 142 5.058 3.710 -5.250 1033 HG21 VAL 142 2HG3 VAL 142 4.680 5.204 -8.672 1034 HG22 VAL 142 2HG1 VAL 142 3.964 5.850 -7.176 1035 HG23 VAL 142 2HG2 VAL 142 5.650 5.279 -7.181 1036 H PHE 143 H PHE 143 3.278 1.836 -9.294 1037 HA PHE 143 HA PHE 143 4.193 3.128 -11.755 1038 HB2 PHE 143 1HB PHE 143 4.625 1.104 -13.022 1039 HB3 PHE 143 2HB PHE 143 5.698 1.123 -11.632 1040 HD1 PHE 143 2HD PHE 143 5.295 -0.381 -9.719 1041 HD2 PHE 143 1HD PHE 143 2.928 -0.566 -13.270 1042 HE1 PHE 143 2HE PHE 143 4.489 -2.625 -9.062 1043 HE2 PHE 143 1HE PHE 143 2.118 -2.808 -12.615 1044 HZ PHE 143 HZ PHE 143 2.899 -3.837 -10.511 1045 H ASP 144 H ASP 144 2.738 2.998 -13.462 1046 HA ASP 144 HA ASP 144 -0.024 2.345 -12.591 1047 HB2 ASP 144 1HB ASP 144 0.549 4.527 -13.754 1048 HB3 ASP 144 2HB ASP 144 0.945 3.599 -15.194 1049 H GLU 145 H GLU 145 -0.891 0.471 -12.921 1050 HA GLU 145 HA GLU 145 0.206 -1.390 -14.916 1051 HB2 GLU 145 1HB GLU 145 -0.632 -2.225 -12.744 1052 HB3 GLU 145 2HB GLU 145 -2.227 -1.566 -13.086 1053 HG2 GLU 145 1HG GLU 145 -2.390 -3.854 -13.539 1054 HG3 GLU 145 2HG GLU 145 -2.290 -3.082 -15.120 1055 HA PRO 146 HA PRO 146 -2.515 0.143 -18.075 1056 HB2 PRO 146 1HB PRO 146 -1.426 -1.322 -20.110 1057 HB3 PRO 146 2HB PRO 146 -0.532 0.049 -19.439 1058 HG2 PRO 146 1HG PRO 146 -0.237 -2.919 -18.806 1059 HG3 PRO 146 2HG PRO 146 1.032 -1.750 -19.185 1060 HD2 PRO 146 1HD PRO 146 0.429 -2.409 -16.607 1061 HD3 PRO 146 2HD PRO 146 0.946 -0.735 -17.061 Start of MODEL 11 1 H MET 1 1H MET 1 -8.147 3.759 -15.342 2 HA MET 1 HA MET 1 -5.440 4.163 -14.946 3 HB2 MET 1 1HB MET 1 -7.970 5.362 -13.774 4 HB3 MET 1 2HB MET 1 -6.360 5.985 -13.441 5 HG2 MET 1 1HG MET 1 -6.036 6.461 -15.831 6 HG3 MET 1 2HG MET 1 -7.636 5.805 -16.186 7 HE1 MET 1 3HE MET 1 -5.569 8.729 -14.646 8 HE2 MET 1 1HE MET 1 -6.815 9.692 -13.816 9 HE3 MET 1 2HE MET 1 -6.368 8.085 -13.191 10 H ALA 2 H ALA 2 -5.659 1.654 -14.014 11 HA ALA 2 HA ALA 2 -5.926 1.672 -11.110 12 HB1 ALA 2 3HB ALA 2 -4.700 -0.380 -12.988 13 HB2 ALA 2 1HB ALA 2 -5.047 -0.629 -11.261 14 HB3 ALA 2 2HB ALA 2 -6.382 -0.364 -12.408 15 H LYS 3 H LYS 3 -4.155 0.955 -9.682 16 HA LYS 3 HA LYS 3 -1.447 1.793 -10.602 17 HB2 LYS 3 1HB LYS 3 -2.854 2.863 -8.124 18 HB3 LYS 3 2HB LYS 3 -1.138 3.052 -8.455 19 HG2 LYS 3 1HG LYS 3 -1.659 4.349 -10.482 20 HG3 LYS 3 2HG LYS 3 -3.387 4.145 -10.170 21 HD2 LYS 3 1HD LYS 3 -3.073 5.282 -7.956 22 HD3 LYS 3 2HD LYS 3 -1.382 5.577 -8.389 23 HE2 LYS 3 1HE LYS 3 -3.679 6.491 -10.142 24 HE3 LYS 3 2HE LYS 3 -3.048 7.481 -8.824 25 HZ1 LYS 3 3HZ LYS 3 -1.482 6.484 -11.109 26 HZ2 LYS 3 1HZ LYS 3 -2.022 8.028 -10.907 27 HZ3 LYS 3 2HZ LYS 3 -0.893 7.408 -9.876 28 H LYS 4 H LYS 4 0.254 0.824 -9.612 29 HA LYS 4 HA LYS 4 -0.386 -1.067 -7.378 30 HB2 LYS 4 1HB LYS 4 1.441 -1.617 -9.750 31 HB3 LYS 4 2HB LYS 4 1.263 -2.654 -8.342 32 HG2 LYS 4 1HG LYS 4 -1.151 -2.952 -8.915 33 HG3 LYS 4 2HG LYS 4 -0.877 -2.007 -10.386 34 HD2 LYS 4 1HD LYS 4 0.818 -3.646 -11.129 35 HD3 LYS 4 2HD LYS 4 0.557 -4.587 -9.654 36 HE2 LYS 4 1HE LYS 4 -1.858 -4.839 -10.319 37 HE3 LYS 4 2HE LYS 4 -1.474 -4.044 -11.848 38 HZ1 LYS 4 3HZ LYS 4 -0.271 -6.550 -10.877 39 HZ2 LYS 4 1HZ LYS 4 -1.422 -6.420 -12.051 40 HZ3 LYS 4 2HZ LYS 4 0.089 -5.807 -12.304 41 H GLY 5 H GLY 5 1.667 -1.842 -6.302 42 HA2 GLY 5 1HA GLY 5 3.824 0.178 -6.311 43 HA3 GLY 5 2HA GLY 5 2.884 0.017 -4.809 44 H TYR 6 H TYR 6 5.682 -0.472 -5.061 45 HA TYR 6 HA TYR 6 5.689 -3.247 -4.005 46 HB2 TYR 6 1HB TYR 6 6.323 -3.589 -6.332 47 HB3 TYR 6 2HB TYR 6 7.496 -2.282 -6.252 48 HD1 TYR 6 1HD TYR 6 6.682 -5.598 -4.739 49 HD2 TYR 6 2HD TYR 6 9.710 -2.707 -5.680 50 HE1 TYR 6 1HE TYR 6 8.429 -7.205 -4.053 51 HE2 TYR 6 2HE TYR 6 11.457 -4.314 -4.993 52 HH TYR 6 HH TYR 6 11.888 -6.346 -4.222 53 H ILE 7 H ILE 7 6.714 -3.380 -2.177 54 HA ILE 7 HA ILE 7 8.819 -1.316 -1.571 55 HB ILE 7 HB ILE 7 6.950 -2.863 0.292 56 HG12 ILE 7 1HG1 ILE 7 7.202 0.127 -0.045 57 HG13 ILE 7 1HG2 ILE 7 6.057 -0.840 -0.962 58 HG21 ILE 7 2HG1 ILE 7 8.064 -1.639 2.115 59 HG22 ILE 7 2HG2 ILE 7 9.215 -2.679 1.246 60 HG23 ILE 7 2HG3 ILE 7 9.200 -0.925 0.947 61 HD11 ILE 7 1HD3 ILE 7 6.171 -0.627 2.054 62 HD12 ILE 7 1HD1 ILE 7 4.996 0.167 0.980 63 HD13 ILE 7 1HD2 ILE 7 5.013 -1.607 1.125 64 H LEU 8 H LEU 8 10.767 -1.986 -1.764 65 HA LEU 8 HA LEU 8 11.408 -4.774 -0.918 66 HB2 LEU 8 1HB LEU 8 12.390 -4.035 -3.043 67 HB3 LEU 8 2HB LEU 8 13.062 -2.599 -2.266 68 HG LEU 8 HG LEU 8 14.491 -4.136 -0.856 69 HD11 LEU 8 1HD1 LEU 8 14.761 -6.447 -1.639 70 HD12 LEU 8 1HD2 LEU 8 13.109 -6.138 -1.056 71 HD13 LEU 8 1HD3 LEU 8 13.438 -6.207 -2.804 72 HD21 LEU 8 2HD3 LEU 8 15.336 -2.975 -2.868 73 HD22 LEU 8 2HD1 LEU 8 16.071 -4.588 -2.702 74 HD23 LEU 8 2HD2 LEU 8 14.766 -4.321 -3.883 75 H MET 9 H MET 9 12.341 -5.286 0.906 76 HA MET 9 HA MET 9 12.869 -3.042 2.806 77 HB2 MET 9 1HB MET 9 12.421 -6.011 3.282 78 HB3 MET 9 2HB MET 9 12.708 -4.816 4.539 79 HG2 MET 9 1HG MET 9 10.351 -4.763 2.632 80 HG3 MET 9 2HG MET 9 10.318 -5.444 4.261 81 HE1 MET 9 3HE MET 9 8.408 -3.999 5.191 82 HE2 MET 9 1HE MET 9 8.257 -2.247 4.919 83 HE3 MET 9 2HE MET 9 8.173 -3.372 3.541 84 H GLU 10 H GLU 10 14.675 -2.962 4.117 85 HA GLU 10 HA GLU 10 17.154 -3.765 2.868 86 HB2 GLU 10 1HB GLU 10 16.484 -2.713 5.646 87 HB3 GLU 10 2HB GLU 10 18.127 -3.046 5.116 88 HG2 GLU 10 1HG GLU 10 17.853 -1.405 3.283 89 HG3 GLU 10 2HG GLU 10 16.227 -1.052 3.863 90 H ASN 11 H ASN 11 14.949 -5.392 4.938 91 HA ASN 11 HA ASN 11 16.994 -7.323 5.875 92 HB2 ASN 11 1HB ASN 11 14.005 -7.119 6.328 93 HB3 ASN 11 2HB ASN 11 15.018 -8.404 6.971 94 HD21 ASN 11 2HD2 ASN 11 13.635 -5.498 7.655 95 HD22 ASN 11 2HD1 ASN 11 14.663 -4.983 8.949 96 H GLY 12 H GLY 12 15.440 -6.843 3.036 97 HA2 GLY 12 1HA GLY 12 15.845 -8.327 1.205 98 HA3 GLY 12 2HA GLY 12 15.882 -9.698 2.339 99 H GLY 13 H GLY 13 13.358 -7.835 3.316 100 HA2 GLY 13 1HA GLY 13 11.366 -9.691 2.424 101 HA3 GLY 13 2HA GLY 13 11.066 -8.123 3.208 102 H LYS 14 H LYS 14 9.828 -9.585 0.846 103 HA LYS 14 HA LYS 14 10.015 -7.297 -1.083 104 HB2 LYS 14 1HB LYS 14 9.832 -10.260 -1.754 105 HB3 LYS 14 2HB LYS 14 9.679 -8.952 -2.918 106 HG2 LYS 14 1HG LYS 14 12.004 -8.230 -2.348 107 HG3 LYS 14 2HG LYS 14 12.142 -9.642 -1.292 108 HD2 LYS 14 1HD LYS 14 11.702 -11.130 -3.219 109 HD3 LYS 14 2HD LYS 14 11.561 -9.718 -4.276 110 HE2 LYS 14 1HE LYS 14 13.891 -9.100 -3.798 111 HE3 LYS 14 2HE LYS 14 14.042 -10.459 -2.682 112 HZ1 LYS 14 3HZ LYS 14 13.512 -10.673 -5.570 113 HZ2 LYS 14 1HZ LYS 14 14.953 -10.973 -4.826 114 HZ3 LYS 14 2HZ LYS 14 13.652 -11.943 -4.528 115 H ILE 15 H ILE 15 8.208 -6.224 -0.872 116 HA ILE 15 HA ILE 15 5.655 -7.794 -0.597 117 HB ILE 15 HB ILE 15 6.335 -5.006 0.469 118 HG12 ILE 15 1HG1 ILE 15 5.845 -7.547 2.037 119 HG13 ILE 15 1HG2 ILE 15 7.441 -6.907 1.672 120 HG21 ILE 15 2HG1 ILE 15 4.133 -5.149 1.562 121 HG22 ILE 15 2HG2 ILE 15 3.976 -5.251 -0.208 122 HG23 ILE 15 2HG3 ILE 15 3.844 -6.723 0.783 123 HD11 ILE 15 1HD3 ILE 15 5.288 -5.487 3.255 124 HD12 ILE 15 1HD1 ILE 15 6.737 -6.282 3.914 125 HD13 ILE 15 1HD2 ILE 15 6.902 -4.838 2.885 126 H GLU 16 H GLU 16 4.722 -7.933 -2.450 127 HA GLU 16 HA GLU 16 4.496 -5.424 -4.078 128 HB2 GLU 16 1HB GLU 16 5.498 -7.460 -5.192 129 HB3 GLU 16 2HB GLU 16 3.983 -8.308 -4.918 130 HG2 GLU 16 1HG GLU 16 2.798 -6.684 -6.316 131 HG3 GLU 16 2HG GLU 16 4.295 -5.789 -6.563 132 H PHE 17 H PHE 17 2.612 -4.501 -4.494 133 HA PHE 17 HA PHE 17 0.114 -5.795 -3.557 134 HB2 PHE 17 1HB PHE 17 -0.389 -3.840 -2.072 135 HB3 PHE 17 2HB PHE 17 0.932 -4.837 -1.481 136 HD1 PHE 17 2HD PHE 17 3.277 -4.047 -1.684 137 HD2 PHE 17 1HD PHE 17 -0.052 -1.566 -2.697 138 HE1 PHE 17 2HE PHE 17 4.729 -2.049 -1.557 139 HE2 PHE 17 1HE PHE 17 1.398 0.432 -2.574 140 HZ PHE 17 HZ PHE 17 3.789 0.191 -2.005 141 H GLU 18 H GLU 18 -1.792 -4.447 -3.920 142 HA GLU 18 HA GLU 18 -1.378 -2.697 -6.326 143 HB2 GLU 18 1HB GLU 18 -3.717 -4.527 -5.642 144 HB3 GLU 18 2HB GLU 18 -3.668 -3.425 -7.010 145 HG2 GLU 18 1HG GLU 18 -1.713 -4.663 -7.905 146 HG3 GLU 18 2HG GLU 18 -1.841 -5.795 -6.559 147 H LEU 19 H LEU 19 -2.571 -0.862 -6.571 148 HA LEU 19 HA LEU 19 -3.727 0.165 -4.010 149 HB2 LEU 19 1HB LEU 19 -2.774 1.676 -6.477 150 HB3 LEU 19 2HB LEU 19 -3.327 2.397 -4.962 151 HG LEU 19 HG LEU 19 -0.830 0.693 -5.273 152 HD11 LEU 19 1HD1 LEU 19 0.365 2.820 -5.000 153 HD12 LEU 19 1HD2 LEU 19 -0.654 2.821 -6.460 154 HD13 LEU 19 1HD3 LEU 19 -1.186 3.692 -5.002 155 HD21 LEU 19 2HD3 LEU 19 -1.869 0.577 -3.033 156 HD22 LEU 19 2HD1 LEU 19 -0.349 1.501 -2.988 157 HD23 LEU 19 2HD2 LEU 19 -1.911 2.355 -2.960 158 H PHE 20 H PHE 20 -5.620 1.391 -3.991 159 HA PHE 20 HA PHE 20 -7.459 0.777 -6.276 160 HB2 PHE 20 1HB PHE 20 -8.084 0.386 -3.319 161 HB3 PHE 20 2HB PHE 20 -9.197 0.131 -4.653 162 HD1 PHE 20 2HD PHE 20 -8.657 -1.686 -6.350 163 HD2 PHE 20 1HD PHE 20 -6.646 -1.319 -2.598 164 HE1 PHE 20 2HE PHE 20 -7.920 -4.040 -6.516 165 HE2 PHE 20 1HE PHE 20 -5.906 -3.672 -2.763 166 HZ PHE 20 HZ PHE 20 -6.543 -5.032 -4.722 167 HA PRO 21 HA PRO 21 -7.858 5.272 -5.327 168 HB2 PRO 21 1HB PRO 21 -8.738 4.921 -8.219 169 HB3 PRO 21 2HB PRO 21 -7.735 6.201 -7.525 170 HG2 PRO 21 1HG PRO 21 -6.547 4.322 -8.988 171 HG3 PRO 21 2HG PRO 21 -5.779 4.843 -7.485 172 HD2 PRO 21 1HD PRO 21 -7.468 2.364 -8.018 173 HD3 PRO 21 2HD PRO 21 -5.928 2.514 -7.079 174 H ASN 22 H ASN 22 -9.842 2.747 -6.742 175 HA ASN 22 HA ASN 22 -12.333 4.209 -6.557 176 HB2 ASN 22 1HB ASN 22 -11.676 1.260 -6.719 177 HB3 ASN 22 2HB ASN 22 -13.322 1.873 -6.643 178 HD21 ASN 22 2HD2 ASN 22 -12.273 0.372 -8.772 179 HD22 ASN 22 2HD1 ASN 22 -12.262 1.371 -10.187 180 H GLU 23 H GLU 23 -10.429 2.364 -4.273 181 HA GLU 23 HA GLU 23 -12.572 2.415 -2.245 182 HB2 GLU 23 1HB GLU 23 -9.636 1.605 -2.141 183 HB3 GLU 23 2HB GLU 23 -10.722 1.530 -0.761 184 HG2 GLU 23 1HG GLU 23 -12.143 -0.078 -1.948 185 HG3 GLU 23 2HG GLU 23 -11.089 0.017 -3.357 186 H ALA 24 H ALA 24 -9.567 4.156 -2.955 187 HA ALA 24 HA ALA 24 -10.513 6.382 -1.287 188 HB1 ALA 24 3HB ALA 24 -7.919 4.931 -0.649 189 HB2 ALA 24 1HB ALA 24 -8.457 6.464 0.076 190 HB3 ALA 24 2HB ALA 24 -9.375 4.969 0.371 191 HA PRO 25 HA PRO 25 -8.538 7.636 -5.206 192 HB2 PRO 25 1HB PRO 25 -10.142 10.087 -4.334 193 HB3 PRO 25 2HB PRO 25 -9.996 9.394 -5.954 194 HG2 PRO 25 1HG PRO 25 -12.239 8.952 -4.597 195 HG3 PRO 25 2HG PRO 25 -11.504 7.612 -5.483 196 HD2 PRO 25 1HD PRO 25 -11.414 8.227 -2.511 197 HD3 PRO 25 2HD PRO 25 -11.566 6.629 -3.344 198 H VAL 26 H VAL 26 -9.028 9.962 -2.521 199 HA VAL 26 HA VAL 26 -6.661 11.472 -3.300 200 HB VAL 26 HB VAL 26 -8.299 11.435 -0.718 201 HG11 VAL 26 1HG1 VAL 26 -7.256 13.595 -0.237 202 HG12 VAL 26 1HG2 VAL 26 -6.059 12.282 -0.319 203 HG13 VAL 26 1HG3 VAL 26 -6.227 13.419 -1.677 204 HG21 VAL 26 2HG3 VAL 26 -9.590 12.116 -2.711 205 HG22 VAL 26 2HG1 VAL 26 -9.305 13.502 -1.633 206 HG23 VAL 26 2HG2 VAL 26 -8.338 13.315 -3.116 207 H THR 27 H THR 27 -7.277 8.986 -0.862 208 HA THR 27 HA THR 27 -4.765 9.262 0.487 209 HB THR 27 HB THR 27 -6.484 6.764 0.149 210 HG1 THR 27 1HG THR 27 -7.682 8.401 1.119 211 HG21 THR 27 2HG3 THR 27 -4.396 7.515 2.229 212 HG22 THR 27 2HG1 THR 27 -5.394 6.044 2.237 213 HG23 THR 27 2HG2 THR 27 -4.193 6.298 0.948 214 H VAL 28 H VAL 28 -5.743 7.165 -2.222 215 HA VAL 28 HA VAL 28 -3.147 5.922 -2.554 216 HB VAL 28 HB VAL 28 -5.442 6.437 -4.504 217 HG11 VAL 28 1HG1 VAL 28 -4.384 4.773 -5.952 218 HG12 VAL 28 1HG2 VAL 28 -3.355 6.208 -5.722 219 HG13 VAL 28 1HG3 VAL 28 -2.990 4.700 -4.847 220 HG21 VAL 28 2HG3 VAL 28 -5.999 4.942 -2.616 221 HG22 VAL 28 2HG1 VAL 28 -5.914 4.035 -4.144 222 HG23 VAL 28 2HG2 VAL 28 -4.569 3.947 -2.982 223 H ALA 29 H ALA 29 -4.604 8.809 -4.027 224 HA ALA 29 HA ALA 29 -2.400 9.469 -5.685 225 HB1 ALA 29 3HB ALA 29 -4.319 11.319 -4.223 226 HB2 ALA 29 1HB ALA 29 -3.267 11.778 -5.581 227 HB3 ALA 29 2HB ALA 29 -4.578 10.600 -5.829 228 H ASN 30 H ASN 30 -3.029 10.249 -2.272 229 HA ASN 30 HA ASN 30 -0.631 11.830 -1.932 230 HB2 ASN 30 1HB ASN 30 -2.472 10.408 -0.000 231 HB3 ASN 30 2HB ASN 30 -1.051 11.300 0.526 232 HD21 ASN 30 2HD2 ASN 30 -3.638 11.951 1.310 233 HD22 ASN 30 2HD1 ASN 30 -4.052 13.495 0.644 234 H PHE 31 H PHE 31 -1.363 8.390 -1.524 235 HA PHE 31 HA PHE 31 1.101 7.571 -0.375 236 HB2 PHE 31 1HB PHE 31 -0.826 6.051 -0.660 237 HB3 PHE 31 2HB PHE 31 -0.669 6.145 -2.407 238 HD1 PHE 31 1HD PHE 31 0.856 4.856 0.686 239 HD2 PHE 31 2HD PHE 31 1.005 4.899 -3.584 240 HE1 PHE 31 1HE PHE 31 2.405 2.929 0.722 241 HE2 PHE 31 2HE PHE 31 2.552 2.970 -3.552 242 HZ PHE 31 HZ PHE 31 3.253 1.987 -1.398 243 H GLU 32 H GLU 32 0.238 7.824 -3.836 244 HA GLU 32 HA GLU 32 2.825 7.136 -4.831 245 HB2 GLU 32 1HB GLU 32 0.767 7.241 -6.232 246 HB3 GLU 32 2HB GLU 32 0.724 8.987 -6.035 247 HG2 GLU 32 1HG GLU 32 2.819 9.224 -7.236 248 HG3 GLU 32 2HG GLU 32 2.996 7.473 -7.337 249 H LYS 33 H LYS 33 1.420 10.329 -4.089 250 HA LYS 33 HA LYS 33 3.680 11.893 -4.801 251 HB2 LYS 33 1HB LYS 33 1.456 12.833 -4.212 252 HB3 LYS 33 2HB LYS 33 1.691 12.344 -2.539 253 HG2 LYS 33 1HG LYS 33 3.585 13.873 -2.321 254 HG3 LYS 33 2HG LYS 33 3.446 14.320 -4.027 255 HD2 LYS 33 1HD LYS 33 1.192 15.223 -3.629 256 HD3 LYS 33 2HD LYS 33 1.282 14.733 -1.930 257 HE2 LYS 33 1HE LYS 33 3.199 16.240 -1.582 258 HE3 LYS 33 2HE LYS 33 3.156 16.709 -3.284 259 HZ1 LYS 33 3HZ LYS 33 0.999 17.166 -1.333 260 HZ2 LYS 33 1HZ LYS 33 2.047 18.305 -1.902 261 HZ3 LYS 33 2HZ LYS 33 0.958 17.603 -2.923 262 H LEU 34 H LEU 34 2.904 10.339 -1.688 263 HA LEU 34 HA LEU 34 5.177 11.292 -0.269 264 HB2 LEU 34 1HB LEU 34 3.521 8.754 -0.037 265 HB3 LEU 34 2HB LEU 34 4.844 9.124 1.073 266 HG LEU 34 HG LEU 34 2.430 10.923 0.678 267 HD11 LEU 34 1HD1 LEU 34 1.613 9.971 2.788 268 HD12 LEU 34 1HD2 LEU 34 1.730 8.737 1.512 269 HD13 LEU 34 1HD3 LEU 34 2.966 8.816 2.791 270 HD21 LEU 34 2HD3 LEU 34 4.473 12.013 1.545 271 HD22 LEU 34 2HD1 LEU 34 3.223 11.897 2.807 272 HD23 LEU 34 2HD2 LEU 34 4.600 10.768 2.810 273 H ALA 35 H ALA 35 4.774 8.286 -2.147 274 HA ALA 35 HA ALA 35 7.412 7.317 -1.709 275 HB1 ALA 35 3HB ALA 35 5.588 6.920 -4.108 276 HB2 ALA 35 1HB ALA 35 7.021 5.940 -3.720 277 HB3 ALA 35 2HB ALA 35 5.611 5.925 -2.634 278 H ASN 36 H ASN 36 6.109 9.512 -4.171 279 HA ASN 36 HA ASN 36 8.527 9.713 -5.718 280 HB2 ASN 36 1HB ASN 36 6.142 11.540 -5.369 281 HB3 ASN 36 2HB ASN 36 7.491 11.931 -6.428 282 HD21 ASN 36 2HD2 ASN 36 4.841 11.594 -7.285 283 HD22 ASN 36 2HD1 ASN 36 4.779 10.214 -8.331 284 H GLU 37 H GLU 37 7.417 11.321 -2.794 285 HA GLU 37 HA GLU 37 9.652 13.239 -2.839 286 HB2 GLU 37 1HB GLU 37 7.548 12.555 -0.745 287 HB3 GLU 37 2HB GLU 37 8.781 13.788 -0.526 288 HG2 GLU 37 1HG GLU 37 7.894 14.999 -2.496 289 HG3 GLU 37 2HG GLU 37 6.629 13.782 -2.652 290 H GLY 38 H GLY 38 9.392 9.993 -2.158 291 HA2 GLY 38 1HA GLY 38 11.129 8.595 -1.446 292 HA3 GLY 38 2HA GLY 38 12.052 10.026 -0.929 293 H PHE 39 H PHE 39 8.765 9.801 0.110 294 HA PHE 39 HA PHE 39 9.450 9.766 2.903 295 HB2 PHE 39 1HB PHE 39 7.338 10.726 2.191 296 HB3 PHE 39 2HB PHE 39 6.850 9.228 1.415 297 HD1 PHE 39 1HD PHE 39 7.837 10.544 4.773 298 HD2 PHE 39 2HD PHE 39 5.465 7.772 2.549 299 HE1 PHE 39 1HE PHE 39 6.719 9.827 6.858 300 HE2 PHE 39 2HE PHE 39 4.345 7.055 4.632 301 HZ PHE 39 HZ PHE 39 4.974 8.082 6.788 302 H TYR 40 H TYR 40 8.014 7.219 0.840 303 HA TYR 40 HA TYR 40 8.146 5.269 3.008 304 HB2 TYR 40 1HB TYR 40 7.497 5.082 0.048 305 HB3 TYR 40 2HB TYR 40 7.558 3.669 1.092 306 HD1 TYR 40 2HD TYR 40 6.069 3.695 3.209 307 HD2 TYR 40 1HD TYR 40 5.547 6.338 -0.130 308 HE1 TYR 40 2HE TYR 40 3.729 4.100 3.895 309 HE2 TYR 40 1HE TYR 40 3.209 6.744 0.556 310 HH TYR 40 HH TYR 40 1.838 5.162 3.446 311 H ASN 41 H ASN 41 10.252 6.256 0.411 312 HA ASN 41 HA ASN 41 11.931 3.887 0.461 313 HB2 ASN 41 1HB ASN 41 11.809 5.521 -1.432 314 HB3 ASN 41 2HB ASN 41 12.633 6.699 -0.420 315 HD21 ASN 41 2HD2 ASN 41 13.473 5.497 -2.936 316 HD22 ASN 41 2HD1 ASN 41 14.994 4.728 -2.621 317 H GLY 42 H GLY 42 12.715 3.243 2.337 318 HA2 GLY 42 1HA GLY 42 14.542 3.355 3.883 319 HA3 GLY 42 2HA GLY 42 14.538 5.128 3.742 320 H LEU 43 H LEU 43 11.383 3.999 3.934 321 HA LEU 43 HA LEU 43 11.047 5.289 6.524 322 HB2 LEU 43 1HB LEU 43 9.408 5.216 4.502 323 HB3 LEU 43 2HB LEU 43 8.981 3.602 5.080 324 HG LEU 43 HG LEU 43 8.272 4.592 7.251 325 HD11 LEU 43 1HD1 LEU 43 8.056 7.031 7.427 326 HD12 LEU 43 1HD2 LEU 43 9.754 6.533 7.240 327 HD13 LEU 43 1HD3 LEU 43 8.870 7.217 5.855 328 HD21 LEU 43 2HD3 LEU 43 6.659 4.223 5.413 329 HD22 LEU 43 2HD1 LEU 43 6.238 5.673 6.355 330 HD23 LEU 43 2HD2 LEU 43 7.024 5.840 4.767 331 H THR 44 H THR 44 10.321 4.454 8.448 332 HA THR 44 HA THR 44 11.031 1.557 8.792 333 HB THR 44 HB THR 44 11.594 3.842 10.733 334 HG1 THR 44 1HG THR 44 13.789 3.407 10.117 335 HG21 THR 44 2HG3 THR 44 12.400 0.907 10.749 336 HG22 THR 44 2HG1 THR 44 12.894 2.131 11.941 337 HG23 THR 44 2HG2 THR 44 11.184 1.657 11.811 338 H PHE 45 H PHE 45 9.880 0.318 10.163 339 HA PHE 45 HA PHE 45 7.311 1.447 11.138 340 HB2 PHE 45 1HB PHE 45 8.452 -1.378 11.112 341 HB3 PHE 45 2HB PHE 45 6.893 -0.957 11.803 342 HD1 PHE 45 1HD PHE 45 8.819 -0.662 8.614 343 HD2 PHE 45 2HD PHE 45 5.000 -1.068 10.485 344 HE1 PHE 45 1HE PHE 45 7.763 -0.938 6.395 345 HE2 PHE 45 2HE PHE 45 3.941 -1.347 8.268 346 HZ PHE 45 HZ PHE 45 5.324 -1.281 6.223 347 H HIS 46 H HIS 46 6.564 1.102 13.289 348 HA HIS 46 HA HIS 46 8.797 1.213 15.279 349 HB2 HIS 46 1HB HIS 46 7.755 3.181 16.324 350 HB3 HIS 46 2HB HIS 46 8.217 3.539 14.666 351 HD2 HIS 46 2HD HIS 46 5.103 3.621 16.901 352 HE1 HIS 46 1HE HIS 46 3.787 4.245 12.896 353 H ARG 47 H ARG 47 5.647 0.199 14.406 354 HA ARG 47 HA ARG 47 5.561 -1.302 16.980 355 HB2 ARG 47 1HB ARG 47 3.241 0.239 15.754 356 HB3 ARG 47 2HB ARG 47 3.062 -0.971 17.016 357 HG2 ARG 47 1HG ARG 47 4.719 1.543 17.317 358 HG3 ARG 47 2HG ARG 47 3.021 1.378 17.827 359 HD2 ARG 47 1HD ARG 47 3.727 -0.548 19.235 360 HD3 ARG 47 2HD ARG 47 5.412 -0.135 18.841 361 HE ARG 47 HE ARG 47 3.588 1.309 20.604 362 HH11 ARG 47 1HH1 ARG 47 6.592 1.376 18.783 363 HH12 ARG 47 1HH2 ARG 47 7.291 2.662 19.741 364 HH21 ARG 47 2HH1 ARG 47 4.506 2.978 21.840 365 HH22 ARG 47 2HH2 ARG 47 6.110 3.570 21.472 366 H VAL 48 H VAL 48 6.500 -2.885 15.515 367 HA VAL 48 HA VAL 48 4.579 -4.102 13.578 368 HB VAL 48 HB VAL 48 7.416 -4.891 14.402 369 HG11 VAL 48 1HG1 VAL 48 7.367 -6.326 12.420 370 HG12 VAL 48 1HG2 VAL 48 6.123 -6.786 13.607 371 HG13 VAL 48 1HG3 VAL 48 5.667 -5.883 12.142 372 HG21 VAL 48 2HG3 VAL 48 7.338 -2.709 13.246 373 HG22 VAL 48 2HG1 VAL 48 8.067 -3.955 12.206 374 HG23 VAL 48 2HG2 VAL 48 6.386 -3.438 11.930 375 H ILE 49 H ILE 49 3.209 -5.573 14.029 376 HA ILE 49 HA ILE 49 3.805 -7.430 16.317 377 HB ILE 49 HB ILE 49 1.043 -6.376 15.541 378 HG12 ILE 49 1HG1 ILE 49 2.726 -5.532 17.910 379 HG13 ILE 49 1HG2 ILE 49 2.496 -4.574 16.456 380 HG21 ILE 49 2HG1 ILE 49 0.369 -7.397 17.678 381 HG22 ILE 49 2HG2 ILE 49 1.085 -8.608 16.588 382 HG23 ILE 49 2HG3 ILE 49 2.038 -7.956 17.942 383 HD11 ILE 49 1HD3 ILE 49 0.310 -5.461 18.351 384 HD12 ILE 49 1HD1 ILE 49 1.018 -3.832 18.238 385 HD13 ILE 49 1HD2 ILE 49 0.077 -4.491 16.877 386 HA PRO 50 HA PRO 50 3.552 -9.981 12.617 387 HB2 PRO 50 1HB PRO 50 4.707 -11.845 14.737 388 HB3 PRO 50 2HB PRO 50 5.234 -11.629 13.064 389 HG2 PRO 50 1HG PRO 50 6.704 -10.541 14.996 390 HG3 PRO 50 2HG PRO 50 6.382 -9.597 13.538 391 HD2 PRO 50 1HD PRO 50 5.049 -9.427 16.267 392 HD3 PRO 50 2HD PRO 50 5.550 -8.089 15.155 393 H GLY 51 H GLY 51 1.913 -11.089 11.997 394 HA2 GLY 51 1HA GLY 51 0.308 -12.815 12.129 395 HA3 GLY 51 2HA GLY 51 0.590 -12.935 13.882 396 H PHE 52 H PHE 52 0.367 -9.737 13.423 397 HA PHE 52 HA PHE 52 -2.627 -9.672 13.560 398 HB2 PHE 52 1HB PHE 52 -0.627 -8.252 15.366 399 HB3 PHE 52 2HB PHE 52 -2.330 -7.835 15.280 400 HD1 PHE 52 1HD PHE 52 0.105 -10.351 16.373 401 HD2 PHE 52 2HD PHE 52 -4.026 -9.271 16.235 402 HE1 PHE 52 1HE PHE 52 -0.400 -12.075 18.071 403 HE2 PHE 52 2HE PHE 52 -4.535 -10.992 17.936 404 HZ PHE 52 HZ PHE 52 -2.720 -12.395 18.852 405 H VAL 53 H VAL 53 -0.316 -7.034 13.948 406 HA VAL 53 HA VAL 53 -0.627 -6.048 11.206 407 HB VAL 53 HB VAL 53 -2.864 -5.458 12.231 408 HG11 VAL 53 1HG1 VAL 53 -2.944 -3.779 14.009 409 HG12 VAL 53 1HG2 VAL 53 -2.162 -5.283 14.548 410 HG13 VAL 53 1HG3 VAL 53 -1.173 -3.855 14.159 411 HG21 VAL 53 2HG3 VAL 53 -1.852 -4.047 10.473 412 HG22 VAL 53 2HG1 VAL 53 -2.757 -3.057 11.643 413 HG23 VAL 53 2HG2 VAL 53 -0.980 -3.119 11.717 414 H SER 54 H SER 54 0.859 -4.664 10.629 415 HA SER 54 HA SER 54 2.801 -3.727 12.753 416 HB2 SER 54 1HB SER 54 4.327 -3.431 10.916 417 HB3 SER 54 2HB SER 54 3.869 -5.092 11.261 418 HG SER 54 HG SER 54 2.628 -3.483 9.318 419 H GLN 55 H GLN 55 3.008 -1.612 13.136 420 HA GLN 55 HA GLN 55 1.745 0.306 11.205 421 HB2 GLN 55 1HB GLN 55 0.671 0.207 13.482 422 HB3 GLN 55 2HB GLN 55 2.211 0.664 14.196 423 HG2 GLN 55 1HG GLN 55 2.158 2.787 12.940 424 HG3 GLN 55 2HG GLN 55 0.565 2.324 12.276 425 HE21 GLN 55 2HE2 GLN 55 0.417 4.615 13.452 426 HE22 GLN 55 2HE1 GLN 55 -0.230 4.529 15.057 427 H GLY 56 H GLY 56 2.918 1.793 10.272 428 HA2 GLY 56 1HA GLY 56 5.619 2.382 11.384 429 HA3 GLY 56 2HA GLY 56 5.464 1.843 9.696 430 H GLY 57 H GLY 57 6.652 4.112 9.761 431 HA2 GLY 57 1HA GLY 57 5.679 5.923 8.170 432 HA3 GLY 57 2HA GLY 57 4.610 6.276 9.548 433 H CYS 58 H CYS 58 7.771 5.172 10.340 434 HA CYS 58 HA CYS 58 8.491 7.951 11.308 435 HB2 CYS 58 1HB CYS 58 9.252 5.315 12.468 436 HB3 CYS 58 2HB CYS 58 9.733 6.911 13.027 437 HG CYS 58 HG CYS 58 6.638 5.889 12.668 438 HA PRO 59 HA PRO 59 12.160 7.506 8.837 439 HB2 PRO 59 1HB PRO 59 13.621 9.556 9.850 440 HB3 PRO 59 2HB PRO 59 12.108 9.921 9.012 441 HG2 PRO 59 1HG PRO 59 12.632 9.711 12.007 442 HG3 PRO 59 2HG PRO 59 11.768 10.979 11.133 443 HD2 PRO 59 1HD PRO 59 10.471 8.887 12.367 444 HD3 PRO 59 2HD PRO 59 9.825 9.694 10.882 445 H ARG 60 H ARG 60 12.159 7.213 12.293 446 HA ARG 60 HA ARG 60 14.740 5.697 12.071 447 HB2 ARG 60 1HB ARG 60 13.750 7.378 14.408 448 HB3 ARG 60 2HB ARG 60 15.203 6.389 14.409 449 HG2 ARG 60 1HG ARG 60 16.161 7.806 12.628 450 HG3 ARG 60 2HG ARG 60 14.699 8.820 12.674 451 HD2 ARG 60 1HD ARG 60 15.139 9.309 15.025 452 HD3 ARG 60 2HD ARG 60 16.625 8.337 14.935 453 HE ARG 60 HE ARG 60 16.702 10.264 12.880 454 HH11 ARG 60 1HH1 ARG 60 16.784 10.089 16.387 455 HH12 ARG 60 1HH2 ARG 60 17.742 11.542 16.562 456 HH21 ARG 60 2HH1 ARG 60 17.945 12.149 13.119 457 HH22 ARG 60 2HH2 ARG 60 18.400 12.709 14.713 458 H GLY 61 H GLY 61 11.445 5.731 13.003 459 HA2 GLY 61 1HA GLY 61 10.177 3.854 13.661 460 HA3 GLY 61 2HA GLY 61 11.680 2.968 14.012 461 H ASN 62 H ASN 62 11.287 6.213 15.211 462 HA ASN 62 HA ASN 62 11.396 5.113 17.979 463 HB2 ASN 62 1HB ASN 62 12.182 7.298 18.628 464 HB3 ASN 62 2HB ASN 62 13.138 6.714 17.272 465 HD21 ASN 62 2HD2 ASN 62 13.395 9.253 17.602 466 HD22 ASN 62 2HD1 ASN 62 12.449 10.189 16.493 467 H GLY 63 H GLY 63 9.020 5.904 15.921 468 HA2 GLY 63 1HA GLY 63 6.750 5.777 16.673 469 HA3 GLY 63 2HA GLY 63 7.240 6.481 18.231 470 H THR 64 H THR 64 8.909 8.311 16.188 471 HA THR 64 HA THR 64 6.763 10.375 16.019 472 HB THR 64 HB THR 64 9.786 10.603 15.664 473 HG1 THR 64 1HG THR 64 9.591 11.698 17.700 474 HG21 THR 64 2HG3 THR 64 7.619 12.733 15.798 475 HG22 THR 64 2HG1 THR 64 9.371 13.030 15.718 476 HG23 THR 64 2HG2 THR 64 8.532 12.272 14.343 477 H GLY 65 H GLY 65 5.736 10.790 14.248 478 HA2 GLY 65 1HA GLY 65 6.277 9.387 11.812 479 HA3 GLY 65 2HA GLY 65 5.140 10.740 12.014 480 H ASP 66 H ASP 66 7.188 10.009 9.897 481 HA ASP 66 HA ASP 66 9.244 12.085 10.070 482 HB2 ASP 66 1HB ASP 66 9.614 9.936 8.855 483 HB3 ASP 66 2HB ASP 66 8.341 10.363 7.721 484 H ALA 67 H ALA 67 6.686 11.574 7.619 485 HA ALA 67 HA ALA 67 7.060 14.242 6.603 486 HB1 ALA 67 3HB ALA 67 4.787 12.273 6.164 487 HB2 ALA 67 1HB ALA 67 5.094 13.736 5.200 488 HB3 ALA 67 2HB ALA 67 6.267 12.398 5.186 489 H GLY 68 H GLY 68 4.442 12.747 8.520 490 HA2 GLY 68 1HA GLY 68 3.054 13.739 10.103 491 HA3 GLY 68 2HA GLY 68 3.968 15.253 9.917 492 H TYR 69 H TYR 69 2.787 13.770 7.033 493 HA TYR 69 HA TYR 69 1.151 16.076 6.387 494 HB2 TYR 69 1HB TYR 69 1.453 13.351 5.069 495 HB3 TYR 69 2HB TYR 69 0.482 14.658 4.407 496 HD1 TYR 69 1HD TYR 69 3.087 16.293 5.974 497 HD2 TYR 69 2HD TYR 69 2.303 13.813 2.562 498 HE1 TYR 69 1HE TYR 69 5.088 17.209 4.848 499 HE2 TYR 69 2HE TYR 69 4.304 14.730 1.435 500 HH TYR 69 HH TYR 69 6.092 16.036 1.638 501 H THR 70 H THR 70 -1.044 16.248 6.072 502 HA THR 70 HA THR 70 -2.618 14.582 7.963 503 HB THR 70 HB THR 70 -3.370 17.101 6.413 504 HG1 THR 70 1HG THR 70 -3.162 18.044 8.522 505 HG21 THR 70 2HG3 THR 70 -4.800 15.619 8.652 506 HG22 THR 70 2HG1 THR 70 -5.312 17.162 7.928 507 HG23 THR 70 2HG2 THR 70 -5.315 15.675 6.950 508 H ILE 71 H ILE 71 -3.829 12.972 7.406 509 HA ILE 71 HA ILE 71 -4.610 12.712 4.512 510 HB ILE 71 HB ILE 71 -4.303 10.537 6.642 511 HG12 ILE 71 1HG1 ILE 71 -2.130 11.466 6.067 512 HG13 ILE 71 1HG2 ILE 71 -2.308 9.833 5.445 513 HG21 ILE 71 2HG1 ILE 71 -4.553 8.995 4.739 514 HG22 ILE 71 2HG2 ILE 71 -5.989 10.031 4.916 515 HG23 ILE 71 2HG3 ILE 71 -4.793 10.378 3.645 516 HD11 ILE 71 1HD3 ILE 71 -2.607 12.378 3.836 517 HD12 ILE 71 1HD1 ILE 71 -1.212 11.276 3.823 518 HD13 ILE 71 1HD2 ILE 71 -2.788 10.724 3.206 519 HA PRO 72 HA PRO 72 -8.742 13.133 5.939 520 HB2 PRO 72 1HB PRO 72 -9.936 13.102 3.500 521 HB3 PRO 72 2HB PRO 72 -8.917 14.481 3.936 522 HG2 PRO 72 1HG PRO 72 -8.209 12.039 2.252 523 HG3 PRO 72 2HG PRO 72 -7.925 13.742 1.880 524 HD2 PRO 72 1HD PRO 72 -5.983 12.147 2.981 525 HD3 PRO 72 2HD PRO 72 -6.099 13.916 3.345 526 H CYS 73 H CYS 73 -10.527 11.909 6.230 527 HA CYS 73 HA CYS 73 -10.190 8.976 5.899 528 HB2 CYS 73 1HB CYS 73 -11.018 9.812 7.953 529 HB3 CYS 73 2HB CYS 73 -12.373 10.580 7.138 530 HG CYS 73 HG CYS 73 -13.178 8.505 8.419 531 H GLU 74 H GLU 74 -10.843 7.922 4.137 532 HA GLU 74 HA GLU 74 -13.121 9.068 2.549 533 HB2 GLU 74 1HB GLU 74 -10.682 7.500 1.613 534 HB3 GLU 74 2HB GLU 74 -12.076 7.845 0.599 535 HG2 GLU 74 1HG GLU 74 -11.662 10.264 0.865 536 HG3 GLU 74 2HG GLU 74 -10.250 9.905 1.857 537 H THR 75 H THR 75 -14.827 7.874 2.164 538 HA THR 75 HA THR 75 -14.681 4.970 2.913 539 HB THR 75 HB THR 75 -17.029 5.134 3.653 540 HG1 THR 75 1HG THR 75 -17.959 7.255 3.797 541 HG21 THR 75 2HG3 THR 75 -15.260 7.253 4.935 542 HG22 THR 75 2HG1 THR 75 -16.685 6.492 5.680 543 HG23 THR 75 2HG2 THR 75 -15.243 5.515 5.317 544 H ASP 76 H ASP 76 -15.225 7.224 0.471 545 HA ASP 76 HA ASP 76 -16.816 5.223 -1.100 546 HB2 ASP 76 1HB ASP 76 -16.509 8.235 -1.444 547 HB3 ASP 76 2HB ASP 76 -17.340 7.189 -2.586 548 H ASN 77 H ASN 77 -14.593 4.881 -3.740 549 HA ASN 77 HA ASN 77 -17.410 5.160 -2.787 550 HB2 ASN 77 1HB ASN 77 -16.213 4.150 -5.379 551 HB3 ASN 77 2HB ASN 77 -17.920 4.018 -4.977 552 HD21 ASN 77 2HD2 ASN 77 -15.566 5.919 -6.396 553 HD22 ASN 77 2HD1 ASN 77 -16.450 7.404 -6.498 554 H ASN 78 H ASN 78 -14.815 2.839 -3.162 555 HA ASN 78 HA ASN 78 -16.617 0.583 -2.483 556 HB2 ASN 78 1HB ASN 78 -13.669 0.766 -3.145 557 HB3 ASN 78 2HB ASN 78 -14.448 -0.719 -2.617 558 HD21 ASN 78 2HD2 ASN 78 -13.169 -0.413 -5.084 559 HD22 ASN 78 2HD1 ASN 78 -14.353 -0.552 -6.339 560 HA PRO 79 HA PRO 79 -15.799 0.719 1.802 561 HB2 PRO 79 1HB PRO 79 -16.398 -1.867 2.470 562 HB3 PRO 79 2HB PRO 79 -17.676 -0.785 1.903 563 HG2 PRO 79 1HG PRO 79 -16.093 -2.862 0.328 564 HG3 PRO 79 2HG PRO 79 -17.843 -2.621 0.368 565 HD2 PRO 79 1HD PRO 79 -16.321 -1.578 -1.635 566 HD3 PRO 79 2HD PRO 79 -17.765 -0.696 -0.992 567 H HIS 80 H HIS 80 -14.651 -0.527 3.548 568 HA HIS 80 HA HIS 80 -11.965 -1.249 2.423 569 HB2 HIS 80 1HB HIS 80 -12.568 0.236 5.017 570 HB3 HIS 80 2HB HIS 80 -10.973 -0.152 4.386 571 HD2 HIS 80 2HD HIS 80 -13.603 2.626 4.133 572 HE1 HIS 80 1HE HIS 80 -10.684 3.386 1.122 573 H ARG 81 H ARG 81 -10.779 -2.834 3.346 574 HA ARG 81 HA ARG 81 -12.012 -4.328 5.618 575 HB2 ARG 81 1HB ARG 81 -11.092 -5.544 2.983 576 HB3 ARG 81 2HB ARG 81 -11.491 -6.466 4.424 577 HG2 ARG 81 1HG ARG 81 -13.453 -4.656 2.999 578 HG3 ARG 81 2HG ARG 81 -13.283 -6.402 2.694 579 HD2 ARG 81 1HD ARG 81 -13.754 -6.815 5.073 580 HD3 ARG 81 2HD ARG 81 -14.041 -5.072 5.284 581 HE ARG 81 HE ARG 81 -15.761 -7.014 3.932 582 HH11 ARG 81 1HH1 ARG 81 -15.038 -3.633 4.557 583 HH12 ARG 81 1HH2 ARG 81 -16.646 -3.083 4.140 584 HH21 ARG 81 2HH1 ARG 81 -17.843 -6.287 3.393 585 HH22 ARG 81 2HH2 ARG 81 -18.234 -4.585 3.480 586 H HIS 82 H HIS 82 -10.650 -4.846 7.133 587 HA HIS 82 HA HIS 82 -7.729 -4.635 6.518 588 HB2 HIS 82 1HB HIS 82 -9.327 -4.385 9.093 589 HB3 HIS 82 2HB HIS 82 -7.582 -4.602 9.093 590 HD2 HIS 82 2HD HIS 82 -6.200 -2.258 8.968 591 HE1 HIS 82 1HE HIS 82 -9.355 0.193 7.483 592 H VAL 83 H VAL 83 -7.660 -6.688 5.508 593 HA VAL 83 HA VAL 83 -7.487 -8.908 7.541 594 HB VAL 83 HB VAL 83 -8.164 -10.468 5.762 595 HG11 VAL 83 1HG1 VAL 83 -10.523 -9.856 5.547 596 HG12 VAL 83 1HG2 VAL 83 -9.911 -9.581 7.195 597 HG13 VAL 83 1HG3 VAL 83 -10.142 -8.205 6.090 598 HG21 VAL 83 2HG3 VAL 83 -7.298 -9.176 3.843 599 HG22 VAL 83 2HG1 VAL 83 -9.005 -9.612 3.599 600 HG23 VAL 83 2HG2 VAL 83 -8.572 -7.957 4.087 601 H THR 84 H THR 84 -6.243 -10.804 6.479 602 HA THR 84 HA THR 84 -3.538 -10.134 6.400 603 HB THR 84 HB THR 84 -4.879 -12.406 4.866 604 HG1 THR 84 1HG THR 84 -3.744 -12.388 7.486 605 HG21 THR 84 2HG3 THR 84 -2.032 -12.062 5.884 606 HG22 THR 84 2HG1 THR 84 -2.690 -13.513 5.093 607 HG23 THR 84 2HG2 THR 84 -2.541 -11.993 4.180 608 H GLY 85 H GLY 85 -2.552 -8.687 5.242 609 HA2 GLY 85 1HA GLY 85 -1.498 -7.955 3.269 610 HA3 GLY 85 2HA GLY 85 -2.588 -8.985 2.312 611 H ALA 86 H ALA 86 -3.032 -6.306 4.660 612 HA ALA 86 HA ALA 86 -4.350 -4.754 2.485 613 HB1 ALA 86 3HB ALA 86 -5.398 -5.070 5.320 614 HB2 ALA 86 1HB ALA 86 -6.065 -3.980 4.082 615 HB3 ALA 86 2HB ALA 86 -6.138 -5.743 3.850 616 H MET 87 H MET 87 -4.161 -2.541 2.581 617 HA MET 87 HA MET 87 -2.248 -1.503 4.645 618 HB2 MET 87 1HB MET 87 -2.173 -0.878 1.672 619 HB3 MET 87 2HB MET 87 -1.091 -0.243 2.903 620 HG2 MET 87 1HG MET 87 -0.166 -2.471 3.288 621 HG3 MET 87 2HG MET 87 -1.307 -3.168 2.136 622 HE1 MET 87 3HE MET 87 1.900 -1.018 2.665 623 HE2 MET 87 1HE MET 87 2.191 -0.349 1.041 624 HE3 MET 87 2HE MET 87 0.790 0.201 1.992 625 H SER 88 H SER 88 -2.969 0.144 5.713 626 HA SER 88 HA SER 88 -4.983 2.001 4.417 627 HB2 SER 88 1HB SER 88 -6.334 2.008 6.280 628 HB3 SER 88 2HB SER 88 -6.168 0.362 5.690 629 HG SER 88 HG SER 88 -4.699 1.515 7.796 630 H MET 89 H MET 89 -5.027 4.089 5.314 631 HA MET 89 HA MET 89 -2.546 4.880 6.765 632 HB2 MET 89 1HB MET 89 -4.707 6.527 5.401 633 HB3 MET 89 2HB MET 89 -3.294 7.192 6.208 634 HG2 MET 89 1HG MET 89 -3.269 5.394 3.768 635 HG3 MET 89 2HG MET 89 -2.993 7.137 3.789 636 HE1 MET 89 3HE MET 89 -1.208 7.650 6.303 637 HE2 MET 89 1HE MET 89 0.425 7.476 5.616 638 HE3 MET 89 2HE MET 89 -0.846 8.308 4.688 639 H ALA 90 H ALA 90 -2.475 5.822 8.712 640 HA ALA 90 HA ALA 90 -4.724 5.142 10.451 641 HB1 ALA 90 3HB ALA 90 -2.066 6.484 11.056 642 HB2 ALA 90 1HB ALA 90 -3.230 5.896 12.264 643 HB3 ALA 90 2HB ALA 90 -2.413 4.744 11.182 644 H HIS 91 H HIS 91 -6.245 6.400 11.251 645 HA HIS 91 HA HIS 91 -5.778 9.274 11.617 646 HB2 HIS 91 1HB HIS 91 -7.625 10.047 10.262 647 HB3 HIS 91 2HB HIS 91 -6.553 9.116 9.225 648 HD2 HIS 91 2HD HIS 91 -7.746 6.994 7.933 649 HE1 HIS 91 1HE HIS 91 -11.463 7.144 10.011 650 H ARG 92 H ARG 92 -7.968 10.308 12.355 651 HA ARG 92 HA ARG 92 -9.438 8.355 14.078 652 HB2 ARG 92 1HB ARG 92 -8.324 11.045 14.968 653 HB3 ARG 92 2HB ARG 92 -9.381 10.016 15.923 654 HG2 ARG 92 1HG ARG 92 -6.638 9.171 14.965 655 HG3 ARG 92 2HG ARG 92 -6.974 9.906 16.551 656 HD2 ARG 92 1HD ARG 92 -8.549 8.071 17.010 657 HD3 ARG 92 2HD ARG 92 -8.061 7.317 15.476 658 HE ARG 92 HE ARG 92 -6.538 7.451 17.957 659 HH11 ARG 92 1HH1 ARG 92 -6.463 6.859 14.496 660 HH12 ARG 92 1HH2 ARG 92 -4.991 5.916 14.563 661 HH21 ARG 92 2HH1 ARG 92 -4.627 6.225 18.031 662 HH22 ARG 92 2HH2 ARG 92 -3.952 5.557 16.563 663 H GLY 93 H GLY 93 -10.174 9.510 11.558 664 HA2 GLY 93 1HA GLY 93 -12.683 10.118 11.430 665 HA3 GLY 93 2HA GLY 93 -12.201 11.545 12.374 666 H ARG 94 H ARG 94 -13.282 12.479 10.342 667 HA ARG 94 HA ARG 94 -11.814 12.386 7.839 668 HB2 ARG 94 1HB ARG 94 -14.250 12.928 8.011 669 HB3 ARG 94 2HB ARG 94 -13.843 14.421 8.842 670 HG2 ARG 94 1HG ARG 94 -12.711 15.265 6.863 671 HG3 ARG 94 2HG ARG 94 -13.001 13.726 6.016 672 HD2 ARG 94 1HD ARG 94 -15.413 14.085 6.262 673 HD3 ARG 94 2HD ARG 94 -15.076 15.662 7.014 674 HE ARG 94 HE ARG 94 -14.810 14.938 4.193 675 HH11 ARG 94 1HH1 ARG 94 -14.130 17.274 6.727 676 HH12 ARG 94 1HH2 ARG 94 -13.874 18.597 5.612 677 HH21 ARG 94 2HH1 ARG 94 -14.476 16.663 2.755 678 HH22 ARG 94 2HH2 ARG 94 -14.069 18.252 3.363 679 H ASP 95 H ASP 95 -9.965 13.255 7.384 680 HA ASP 95 HA ASP 95 -8.317 14.882 7.169 681 HB2 ASP 95 1HB ASP 95 -10.503 16.354 6.974 682 HB3 ASP 95 2HB ASP 95 -10.081 16.878 8.598 683 H THR 96 H THR 96 -8.299 13.129 9.364 684 HA THR 96 HA THR 96 -6.791 14.846 11.300 685 HB THR 96 HB THR 96 -7.561 13.404 13.147 686 HG1 THR 96 1HG THR 96 -9.108 12.164 11.090 687 HG21 THR 96 2HG3 THR 96 -9.870 14.512 11.503 688 HG22 THR 96 2HG1 THR 96 -9.909 14.147 13.243 689 HG23 THR 96 2HG2 THR 96 -8.855 15.444 12.630 690 H GLY 97 H GLY 97 -6.451 12.690 8.955 691 HA2 GLY 97 1HA GLY 97 -5.074 10.514 10.267 692 HA3 GLY 97 2HA GLY 97 -5.096 10.859 8.522 693 H SER 98 H SER 98 -2.817 9.929 9.874 694 HA SER 98 HA SER 98 -0.969 12.334 9.707 695 HB2 SER 98 1HB SER 98 0.445 11.394 11.215 696 HB3 SER 98 2HB SER 98 -1.163 11.363 11.922 697 HG SER 98 HG SER 98 -1.334 9.218 11.351 698 H CYS 99 H CYS 99 1.377 11.212 9.447 699 HA CYS 99 HA CYS 99 1.477 9.953 6.781 700 HB2 CYS 99 1HB CYS 99 3.751 10.114 6.908 701 HB3 CYS 99 2HB CYS 99 3.086 11.609 7.549 702 HG CYS 99 HG CYS 99 3.334 10.959 10.054 703 H GLN 100 H GLN 100 1.049 8.834 9.995 704 HA GLN 100 HA GLN 100 2.488 6.307 9.696 705 HB2 GLN 100 1HB GLN 100 0.395 7.261 11.696 706 HB3 GLN 100 2HB GLN 100 1.195 5.698 11.784 707 HG2 GLN 100 1HG GLN 100 3.364 6.798 12.039 708 HG3 GLN 100 2HG GLN 100 2.566 8.392 11.922 709 HE21 GLN 100 2HE2 GLN 100 4.016 8.136 14.091 710 HE22 GLN 100 2HE1 GLN 100 3.058 7.812 15.498 711 H PHE 101 H PHE 101 1.611 4.231 9.570 712 HA PHE 101 HA PHE 101 -1.109 3.992 8.423 713 HB2 PHE 101 1HB PHE 101 -0.327 3.012 6.334 714 HB3 PHE 101 2HB PHE 101 0.333 4.632 6.487 715 HD1 PHE 101 2HD PHE 101 2.724 4.945 7.120 716 HD2 PHE 101 1HD PHE 101 1.081 1.102 6.234 717 HE1 PHE 101 2HE PHE 101 5.003 4.050 6.782 718 HE2 PHE 101 1HE PHE 101 3.359 0.203 5.898 719 HZ PHE 101 HZ PHE 101 5.320 1.679 6.172 720 H PHE 102 H PHE 102 -1.792 1.823 8.082 721 HA PHE 102 HA PHE 102 -0.230 -0.136 9.736 722 HB2 PHE 102 1HB PHE 102 -3.221 0.061 9.184 723 HB3 PHE 102 2HB PHE 102 -2.456 -1.296 9.995 724 HD1 PHE 102 2HD PHE 102 -1.510 -1.046 12.240 725 HD2 PHE 102 1HD PHE 102 -3.524 2.179 10.293 726 HE1 PHE 102 2HE PHE 102 -1.718 0.128 14.406 727 HE2 PHE 102 1HE PHE 102 -3.732 3.357 12.456 728 HZ PHE 102 HZ PHE 102 -2.829 2.332 14.512 729 H ILE 103 H ILE 103 0.489 -1.951 8.859 730 HA ILE 103 HA ILE 103 -0.948 -2.948 6.409 731 HB ILE 103 HB ILE 103 1.904 -3.532 7.354 732 HG12 ILE 103 1HG1 ILE 103 0.905 -1.948 4.975 733 HG13 ILE 103 1HG2 ILE 103 1.699 -1.296 6.401 734 HG21 ILE 103 2HG1 ILE 103 2.095 -4.804 5.255 735 HG22 ILE 103 2HG2 ILE 103 0.823 -5.480 6.299 736 HG23 ILE 103 2HG3 ILE 103 0.383 -4.477 4.896 737 HD11 ILE 103 1HD3 ILE 103 2.936 -3.210 4.410 738 HD12 ILE 103 1HD1 ILE 103 3.248 -1.463 4.534 739 HD13 ILE 103 1HD2 ILE 103 3.739 -2.551 5.855 740 H VAL 104 H VAL 104 -2.229 -4.561 6.646 741 HA VAL 104 HA VAL 104 -2.366 -5.744 9.375 742 HB VAL 104 HB VAL 104 -4.223 -6.019 6.962 743 HG11 VAL 104 1HG1 VAL 104 -5.859 -6.823 8.593 744 HG12 VAL 104 1HG2 VAL 104 -4.418 -7.866 8.524 745 HG13 VAL 104 1HG3 VAL 104 -4.628 -6.725 9.875 746 HG21 VAL 104 2HG3 VAL 104 -4.074 -3.682 7.750 747 HG22 VAL 104 2HG1 VAL 104 -5.657 -4.390 8.150 748 HG23 VAL 104 2HG2 VAL 104 -4.414 -4.219 9.413 749 H HIS 105 H HIS 105 -1.856 -7.665 9.973 750 HA HIS 105 HA HIS 105 -0.723 -9.479 7.904 751 HB2 HIS 105 1HB HIS 105 -0.642 -9.707 10.942 752 HB3 HIS 105 2HB HIS 105 0.267 -10.680 9.795 753 HD2 HIS 105 2HD HIS 105 0.740 -7.352 8.319 754 HE1 HIS 105 1HE HIS 105 3.660 -7.515 11.419 755 H GLU 106 H GLU 106 -3.202 -9.413 10.440 756 HA GLU 106 HA GLU 106 -4.635 -11.505 8.878 757 HB2 GLU 106 1HB GLU 106 -4.082 -11.628 11.873 758 HB3 GLU 106 2HB GLU 106 -5.296 -12.605 11.059 759 HG2 GLU 106 1HG GLU 106 -3.509 -13.606 9.655 760 HG3 GLU 106 2HG GLU 106 -2.314 -12.672 10.553 761 HA PRO 107 HA PRO 107 -8.278 -9.169 9.247 762 HB2 PRO 107 1HB PRO 107 -9.377 -11.650 10.675 763 HB3 PRO 107 2HB PRO 107 -10.147 -10.693 9.403 764 HG2 PRO 107 1HG PRO 107 -9.034 -13.016 8.733 765 HG3 PRO 107 2HG PRO 107 -8.781 -11.618 7.685 766 HD2 PRO 107 1HD PRO 107 -6.897 -12.878 9.692 767 HD3 PRO 107 2HD PRO 107 -6.525 -12.101 8.101 768 H GLN 108 H GLN 108 -8.510 -7.581 10.535 769 HA GLN 108 HA GLN 108 -8.558 -8.121 13.478 770 HB2 GLN 108 1HB GLN 108 -6.315 -7.251 12.845 771 HB3 GLN 108 2HB GLN 108 -7.068 -5.866 12.067 772 HG2 GLN 108 1HG GLN 108 -6.132 -5.422 14.332 773 HG3 GLN 108 2HG GLN 108 -7.860 -5.012 14.151 774 HE21 GLN 108 2HE2 GLN 108 -5.579 -7.425 15.425 775 HE22 GLN 108 2HE1 GLN 108 -6.643 -8.058 16.638 776 HA PRO 109 HA PRO 109 -12.426 -5.974 12.533 777 HB2 PRO 109 1HB PRO 109 -12.726 -6.839 15.441 778 HB3 PRO 109 2HB PRO 109 -13.905 -6.974 14.130 779 HG2 PRO 109 1HG PRO 109 -12.631 -9.177 14.907 780 HG3 PRO 109 2HG PRO 109 -12.842 -8.881 13.178 781 HD2 PRO 109 1HD PRO 109 -10.386 -8.430 14.916 782 HD3 PRO 109 2HD PRO 109 -10.491 -9.110 13.243 783 H HIS 110 H HIS 110 -10.158 -5.643 15.190 784 HA HIS 110 HA HIS 110 -11.242 -3.284 16.356 785 HB2 HIS 110 1HB HIS 110 -9.408 -4.620 17.381 786 HB3 HIS 110 2HB HIS 110 -8.324 -4.126 16.089 787 HD2 HIS 110 2HD HIS 110 -6.841 -1.791 16.736 788 HE1 HIS 110 1HE HIS 110 -9.451 -0.485 19.824 789 H LEU 111 H LEU 111 -9.226 -3.731 13.500 790 HA LEU 111 HA LEU 111 -9.108 -0.761 13.174 791 HB2 LEU 111 1HB LEU 111 -7.546 -2.971 11.776 792 HB3 LEU 111 2HB LEU 111 -7.320 -1.236 11.535 793 HG LEU 111 HG LEU 111 -6.766 -2.749 14.112 794 HD11 LEU 111 1HD1 LEU 111 -4.416 -2.298 13.567 795 HD12 LEU 111 1HD2 LEU 111 -5.199 -3.298 12.322 796 HD13 LEU 111 1HD3 LEU 111 -4.914 -1.567 12.024 797 HD21 LEU 111 2HD3 LEU 111 -7.503 -0.416 14.477 798 HD22 LEU 111 2HD1 LEU 111 -5.770 -0.606 14.835 799 HD23 LEU 111 2HD2 LEU 111 -6.286 0.150 13.309 800 H ASP 112 H ASP 112 -10.522 -3.638 11.903 801 HA ASP 112 HA ASP 112 -10.991 -2.752 9.211 802 HB2 ASP 112 1HB ASP 112 -11.255 -5.125 10.153 803 HB3 ASP 112 2HB ASP 112 -12.778 -4.589 10.850 804 H GLY 113 H GLY 113 -12.098 -1.136 8.488 805 HA2 GLY 113 1HA GLY 113 -14.055 0.116 8.126 806 HA3 GLY 113 2HA GLY 113 -14.779 -0.608 9.581 807 H VAL 114 H VAL 114 -11.672 0.395 10.299 808 HA VAL 114 HA VAL 114 -12.710 2.922 11.564 809 HB VAL 114 HB VAL 114 -10.276 1.186 12.206 810 HG11 VAL 114 1HG1 VAL 114 -10.009 2.624 14.167 811 HG12 VAL 114 1HG2 VAL 114 -9.846 3.533 12.646 812 HG13 VAL 114 1HG3 VAL 114 -11.347 3.649 13.596 813 HG21 VAL 114 2HG3 VAL 114 -12.418 0.131 12.845 814 HG22 VAL 114 2HG1 VAL 114 -11.510 0.652 14.284 815 HG23 VAL 114 2HG2 VAL 114 -12.893 1.614 13.707 816 H HIS 115 H HIS 115 -10.070 1.609 9.609 817 HA HIS 115 HA HIS 115 -9.201 4.439 9.125 818 HB2 HIS 115 1HB HIS 115 -7.588 1.861 8.891 819 HB3 HIS 115 2HB HIS 115 -6.990 3.479 8.547 820 HD2 HIS 115 2HD HIS 115 -7.279 1.077 11.499 821 HE1 HIS 115 1HE HIS 115 -6.366 4.911 13.120 822 H THR 116 H THR 116 -8.032 4.687 6.988 823 HA THR 116 HA THR 116 -9.951 3.705 4.927 824 HB THR 116 HB THR 116 -7.934 5.993 4.876 825 HG1 THR 116 1HG THR 116 -9.828 6.349 6.157 826 HG21 THR 116 2HG3 THR 116 -10.016 5.134 2.830 827 HG22 THR 116 2HG1 THR 116 -9.001 6.591 2.737 828 HG23 THR 116 2HG2 THR 116 -8.253 4.979 2.646 829 H VAL 117 H VAL 117 -9.416 1.894 3.994 830 HA VAL 117 HA VAL 117 -6.602 1.150 3.497 831 HB VAL 117 HB VAL 117 -9.243 -0.061 2.540 832 HG11 VAL 117 1HG1 VAL 117 -7.911 -2.036 1.983 833 HG12 VAL 117 1HG2 VAL 117 -7.410 -0.609 1.046 834 HG13 VAL 117 1HG3 VAL 117 -6.426 -1.159 2.424 835 HG21 VAL 117 2HG3 VAL 117 -8.965 -0.144 4.995 836 HG22 VAL 117 2HG1 VAL 117 -8.808 -1.766 4.280 837 HG23 VAL 117 2HG2 VAL 117 -7.355 -0.872 4.790 838 H PHE 118 H PHE 118 -5.413 1.328 1.782 839 HA PHE 118 HA PHE 118 -6.655 2.722 -0.571 840 HB2 PHE 118 1HB PHE 118 -4.602 4.021 -0.802 841 HB3 PHE 118 2HB PHE 118 -5.275 4.279 0.800 842 HD1 PHE 118 1HD PHE 118 -2.581 2.638 -1.102 843 HD2 PHE 118 2HD PHE 118 -4.118 3.570 2.773 844 HE1 PHE 118 1HE PHE 118 -0.420 1.991 -0.093 845 HE2 PHE 118 2HE PHE 118 -1.956 2.927 3.787 846 HZ PHE 118 HZ PHE 118 -0.108 2.136 2.353 847 H GLY 119 H GLY 119 -4.859 0.079 0.583 848 HA2 GLY 119 1HA GLY 119 -4.582 -0.959 -2.135 849 HA3 GLY 119 2HA GLY 119 -3.030 -0.589 -1.347 850 H GLN 120 H GLN 120 -3.581 -3.162 -2.117 851 HA GLN 120 HA GLN 120 -3.558 -4.481 0.548 852 HB2 GLN 120 1HB GLN 120 -5.273 -5.356 -1.814 853 HB3 GLN 120 2HB GLN 120 -4.914 -6.380 -0.431 854 HG2 GLN 120 1HG GLN 120 -6.002 -4.730 1.055 855 HG3 GLN 120 2HG GLN 120 -6.423 -3.760 -0.384 856 HE21 GLN 120 2HE2 GLN 120 -6.415 -7.100 -1.022 857 HE22 GLN 120 2HE1 GLN 120 -8.121 -7.382 -0.905 858 H VAL 121 H VAL 121 -2.238 -6.196 0.751 859 HA VAL 121 HA VAL 121 -0.125 -6.423 -1.296 860 HB VAL 121 HB VAL 121 -0.585 -7.960 1.305 861 HG11 VAL 121 1HG1 VAL 121 1.785 -8.537 1.133 862 HG12 VAL 121 1HG2 VAL 121 0.847 -9.157 -0.247 863 HG13 VAL 121 1HG3 VAL 121 1.870 -7.714 -0.442 864 HG21 VAL 121 2HG3 VAL 121 -0.320 -5.534 1.687 865 HG22 VAL 121 2HG1 VAL 121 1.111 -6.428 2.251 866 HG23 VAL 121 2HG2 VAL 121 1.167 -5.541 0.709 867 H THR 122 H THR 122 0.264 -7.912 -2.720 868 HA THR 122 HA THR 122 -1.791 -10.091 -2.940 869 HB THR 122 HB THR 122 -1.534 -9.937 -5.382 870 HG1 THR 122 1HG THR 122 -0.256 -8.194 -6.224 871 HG21 THR 122 2HG3 THR 122 -2.041 -7.217 -4.118 872 HG22 THR 122 2HG1 THR 122 -2.558 -7.726 -5.741 873 HG23 THR 122 2HG2 THR 122 -3.242 -8.516 -4.301 874 H SER 123 H SER 123 1.579 -9.246 -2.952 875 HA SER 123 HA SER 123 2.265 -12.186 -2.960 876 HB2 SER 123 1HB SER 123 2.505 -11.514 -5.216 877 HB3 SER 123 2HB SER 123 3.560 -10.192 -4.740 878 HG SER 123 HG SER 123 4.687 -12.042 -5.341 879 H GLY 124 H GLY 124 3.948 -12.677 -1.624 880 HA2 GLY 124 1HA GLY 124 5.654 -12.275 -0.049 881 HA3 GLY 124 2HA GLY 124 5.472 -10.524 -0.308 882 H MET 125 H MET 125 2.596 -12.386 0.185 883 HA MET 125 HA MET 125 1.768 -10.766 2.400 884 HB2 MET 125 1HB MET 125 0.754 -13.438 1.370 885 HB3 MET 125 2HB MET 125 -0.045 -12.505 2.627 886 HG2 MET 125 1HG MET 125 -0.523 -10.710 1.103 887 HG3 MET 125 2HG MET 125 0.493 -11.426 -0.152 888 HE1 MET 125 3HE MET 125 -2.907 -11.488 1.730 889 HE2 MET 125 1HE MET 125 -3.609 -13.046 1.232 890 HE3 MET 125 2HE MET 125 -2.194 -13.012 2.313 891 H ASP 126 H ASP 126 3.333 -13.930 2.244 892 HA ASP 126 HA ASP 126 3.163 -14.498 5.063 893 HB2 ASP 126 1HB ASP 126 5.108 -15.369 2.891 894 HB3 ASP 126 2HB ASP 126 5.217 -15.941 4.550 895 H VAL 127 H VAL 127 5.654 -12.871 3.103 896 HA VAL 127 HA VAL 127 7.447 -12.270 5.272 897 HB VAL 127 HB VAL 127 6.827 -10.744 2.697 898 HG11 VAL 127 1HG1 VAL 127 8.983 -9.637 3.036 899 HG12 VAL 127 1HG2 VAL 127 7.834 -9.274 4.345 900 HG13 VAL 127 1HG3 VAL 127 9.148 -10.444 4.613 901 HG21 VAL 127 2HG3 VAL 127 7.674 -13.037 2.336 902 HG22 VAL 127 2HG1 VAL 127 8.894 -11.827 1.874 903 HG23 VAL 127 2HG2 VAL 127 9.048 -12.702 3.416 904 H VAL 128 H VAL 128 4.627 -10.507 4.036 905 HA VAL 128 HA VAL 128 4.832 -8.293 5.882 906 HB VAL 128 HB VAL 128 2.422 -9.616 4.545 907 HG11 VAL 128 1HG1 VAL 128 1.196 -7.570 5.092 908 HG12 VAL 128 1HG2 VAL 128 1.727 -8.438 6.551 909 HG13 VAL 128 1HG3 VAL 128 2.596 -6.980 6.018 910 HG21 VAL 128 2HG3 VAL 128 4.057 -8.626 2.978 911 HG22 VAL 128 2HG1 VAL 128 2.554 -7.673 3.017 912 HG23 VAL 128 2HG2 VAL 128 3.998 -7.094 3.882 913 H ARG 129 H ARG 129 3.020 -11.354 6.131 914 HA ARG 129 HA ARG 129 1.787 -10.752 8.616 915 HB2 ARG 129 1HB ARG 129 1.167 -12.678 7.166 916 HB3 ARG 129 2HB ARG 129 2.695 -13.456 7.549 917 HG2 ARG 129 1HG ARG 129 2.056 -13.706 9.867 918 HG3 ARG 129 2HG ARG 129 0.566 -12.772 9.591 919 HD2 ARG 129 1HD ARG 129 -0.195 -14.468 8.022 920 HD3 ARG 129 2HD ARG 129 1.287 -15.405 8.323 921 HE ARG 129 HE ARG 129 -1.027 -15.116 10.080 922 HH11 ARG 129 1HH1 ARG 129 2.327 -16.114 9.762 923 HH12 ARG 129 1HH2 ARG 129 2.278 -17.161 11.162 924 HH21 ARG 129 2HH1 ARG 129 -1.077 -16.479 11.895 925 HH22 ARG 129 2HH2 ARG 129 0.352 -17.369 12.370 926 H THR 130 H THR 130 4.957 -12.182 7.927 927 HA THR 130 HA THR 130 5.543 -12.067 10.865 928 HB THR 130 HB THR 130 7.480 -13.563 10.292 929 HG1 THR 130 1HG THR 130 7.405 -14.537 8.189 930 HG21 THR 130 2HG3 THR 130 4.751 -14.594 9.427 931 HG22 THR 130 2HG1 THR 130 6.135 -15.595 9.927 932 HG23 THR 130 2HG2 THR 130 5.348 -14.515 11.101 933 H MET 131 H MET 131 5.471 -9.685 9.366 934 HA MET 131 HA MET 131 8.024 -8.774 8.514 935 HB2 MET 131 1HB MET 131 5.849 -7.529 8.300 936 HB3 MET 131 2HB MET 131 5.909 -7.196 10.025 937 HG2 MET 131 1HG MET 131 8.009 -5.948 9.719 938 HG3 MET 131 2HG MET 131 7.966 -6.293 7.988 939 HE1 MET 131 3HE MET 131 5.048 -5.967 7.064 940 HE2 MET 131 1HE MET 131 4.964 -4.227 6.699 941 HE3 MET 131 2HE MET 131 6.420 -5.158 6.271 942 H LYS 132 H LYS 132 9.783 -7.940 9.449 943 HA LYS 132 HA LYS 132 10.311 -8.881 12.170 944 HB2 LYS 132 1HB LYS 132 11.982 -7.309 10.171 945 HB3 LYS 132 2HB LYS 132 12.566 -7.821 11.749 946 HG2 LYS 132 1HG LYS 132 12.168 -10.191 11.098 947 HG3 LYS 132 2HG LYS 132 11.670 -9.638 9.493 948 HD2 LYS 132 1HD LYS 132 13.884 -8.611 9.144 949 HD3 LYS 132 2HD LYS 132 14.385 -9.125 10.762 950 HE2 LYS 132 1HE LYS 132 14.041 -11.494 10.103 951 HE3 LYS 132 2HE LYS 132 13.578 -10.969 8.483 952 HZ1 LYS 132 3HZ LYS 132 16.198 -10.506 9.744 953 HZ2 LYS 132 1HZ LYS 132 15.870 -11.624 8.577 954 HZ3 LYS 132 2HZ LYS 132 15.765 -10.014 8.231 955 H ASN 133 H ASN 133 10.940 -7.687 13.949 956 HA ASN 133 HA ASN 133 9.292 -5.352 14.390 957 HB2 ASN 133 1HB ASN 133 9.962 -7.020 16.140 958 HB3 ASN 133 2HB ASN 133 11.596 -6.375 16.070 959 HD21 ASN 133 2HD2 ASN 133 9.818 -6.420 18.324 960 HD22 ASN 133 2HD1 ASN 133 9.553 -4.773 18.793 961 H GLY 134 H GLY 134 9.595 -3.417 13.663 962 HA2 GLY 134 1HA GLY 134 10.694 -1.370 13.394 963 HA3 GLY 134 2HA GLY 134 12.196 -2.113 13.989 964 H ASP 135 H ASP 135 10.421 -3.710 11.467 965 HA ASP 135 HA ASP 135 12.503 -3.944 9.635 966 HB2 ASP 135 1HB ASP 135 10.139 -4.972 9.538 967 HB3 ASP 135 2HB ASP 135 9.621 -3.466 8.793 968 H VAL 136 H VAL 136 13.572 -2.761 8.250 969 HA VAL 136 HA VAL 136 12.613 0.059 7.769 970 HB VAL 136 HB VAL 136 15.443 -1.087 7.638 971 HG11 VAL 136 1HG1 VAL 136 16.135 1.252 7.433 972 HG12 VAL 136 1HG2 VAL 136 15.080 0.748 6.091 973 HG13 VAL 136 1HG3 VAL 136 14.429 1.753 7.407 974 HG21 VAL 136 2HG3 VAL 136 14.604 -0.992 9.960 975 HG22 VAL 136 2HG1 VAL 136 15.852 0.245 9.683 976 HG23 VAL 136 2HG2 VAL 136 14.135 0.709 9.723 977 H MET 137 H MET 137 12.134 0.723 5.863 978 HA MET 137 HA MET 137 12.195 -1.133 3.613 979 HB2 MET 137 1HB MET 137 11.525 1.827 3.783 980 HB3 MET 137 2HB MET 137 11.317 0.836 2.347 981 HG2 MET 137 1HG MET 137 9.715 -0.596 3.595 982 HG3 MET 137 2HG MET 137 9.896 0.460 4.999 983 HE1 MET 137 3HE MET 137 7.433 1.120 5.275 984 HE2 MET 137 1HE MET 137 6.358 1.552 3.923 985 HE3 MET 137 2HE MET 137 7.049 -0.087 4.023 986 H LYS 138 H LYS 138 13.340 -1.058 1.737 987 HA LYS 138 HA LYS 138 15.914 0.464 1.919 988 HB2 LYS 138 1HB LYS 138 16.098 -2.017 1.766 989 HB3 LYS 138 2HB LYS 138 15.196 -1.985 0.257 990 HG2 LYS 138 1HG LYS 138 16.983 -0.668 -0.804 991 HG3 LYS 138 2HG LYS 138 17.887 -0.665 0.717 992 HD2 LYS 138 1HD LYS 138 17.963 -3.154 0.652 993 HD3 LYS 138 2HD LYS 138 17.119 -3.120 -0.904 994 HE2 LYS 138 1HE LYS 138 18.968 -1.843 -1.903 995 HE3 LYS 138 2HE LYS 138 19.803 -1.804 -0.348 996 HZ1 LYS 138 3HZ LYS 138 19.166 -4.235 -1.881 997 HZ2 LYS 138 1HZ LYS 138 20.652 -3.528 -1.760 998 HZ3 LYS 138 2HZ LYS 138 19.945 -4.198 -0.428 999 H GLU 139 H GLU 139 13.349 -0.465 -0.378 1000 HA GLU 139 HA GLU 139 13.581 2.135 -1.715 1001 HB2 GLU 139 1HB GLU 139 15.441 0.766 -2.745 1002 HB3 GLU 139 2HB GLU 139 14.236 -0.402 -3.270 1003 HG2 GLU 139 1HG GLU 139 13.162 1.279 -4.669 1004 HG3 GLU 139 2HG GLU 139 14.279 2.511 -4.087 1005 H VAL 140 H VAL 140 11.723 2.776 -2.492 1006 HA VAL 140 HA VAL 140 9.549 0.713 -2.831 1007 HB VAL 140 HB VAL 140 9.311 3.496 -1.591 1008 HG11 VAL 140 1HG1 VAL 140 7.013 2.825 -1.083 1009 HG12 VAL 140 1HG2 VAL 140 7.335 2.831 -2.833 1010 HG13 VAL 140 1HG3 VAL 140 7.272 1.291 -1.945 1011 HG21 VAL 140 2HG3 VAL 140 10.469 1.919 -0.082 1012 HG22 VAL 140 2HG1 VAL 140 8.833 2.288 0.514 1013 HG23 VAL 140 2HG2 VAL 140 9.155 0.740 -0.303 1014 H LYS 141 H LYS 141 8.444 0.736 -4.588 1015 HA LYS 141 HA LYS 141 8.697 3.150 -6.355 1016 HB2 LYS 141 1HB LYS 141 8.765 0.211 -7.146 1017 HB3 LYS 141 2HB LYS 141 8.653 1.550 -8.281 1018 HG2 LYS 141 1HG LYS 141 10.848 2.390 -7.485 1019 HG3 LYS 141 2HG LYS 141 10.962 1.002 -6.393 1020 HD2 LYS 141 1HD LYS 141 10.838 -0.533 -8.332 1021 HD3 LYS 141 2HD LYS 141 10.727 0.856 -9.423 1022 HE2 LYS 141 1HE LYS 141 12.944 1.642 -8.634 1023 HE3 LYS 141 2HE LYS 141 13.057 0.238 -7.569 1024 HZ1 LYS 141 3HZ LYS 141 12.862 0.143 -10.505 1025 HZ2 LYS 141 1HZ LYS 141 14.228 -0.111 -9.617 1026 HZ3 LYS 141 2HZ LYS 141 12.967 -1.169 -9.511 1027 H VAL 142 H VAL 142 6.976 3.741 -7.591 1028 HA VAL 142 HA VAL 142 4.421 2.197 -7.162 1029 HB VAL 142 HB VAL 142 4.781 5.215 -7.483 1030 HG11 VAL 142 1HG1 VAL 142 2.374 5.328 -7.054 1031 HG12 VAL 142 1HG2 VAL 142 2.746 4.395 -8.523 1032 HG13 VAL 142 1HG3 VAL 142 2.298 3.550 -7.022 1033 HG21 VAL 142 2HG3 VAL 142 5.490 4.426 -5.252 1034 HG22 VAL 142 2HG1 VAL 142 3.966 5.339 -5.150 1035 HG23 VAL 142 2HG2 VAL 142 3.945 3.562 -5.065 1036 H PHE 143 H PHE 143 3.128 1.801 -8.815 1037 HA PHE 143 HA PHE 143 4.271 2.487 -11.505 1038 HB2 PHE 143 1HB PHE 143 3.110 -0.202 -10.669 1039 HB3 PHE 143 2HB PHE 143 3.799 0.202 -12.233 1040 HD1 PHE 143 2HD PHE 143 6.215 0.460 -12.513 1041 HD2 PHE 143 1HD PHE 143 4.510 -0.663 -8.760 1042 HE1 PHE 143 2HE PHE 143 8.437 -0.290 -11.731 1043 HE2 PHE 143 1HE PHE 143 6.731 -1.412 -7.974 1044 HZ PHE 143 HZ PHE 143 8.694 -1.226 -9.459 1045 H ASP 144 H ASP 144 2.898 3.812 -12.407 1046 HA ASP 144 HA ASP 144 0.002 3.554 -11.979 1047 HB2 ASP 144 1HB ASP 144 1.121 5.777 -12.282 1048 HB3 ASP 144 2HB ASP 144 1.575 5.309 -13.915 1049 H GLU 145 H GLU 145 -1.442 2.546 -13.142 1050 HA GLU 145 HA GLU 145 -0.475 1.199 -15.644 1051 HB2 GLU 145 1HB GLU 145 -2.703 0.336 -13.753 1052 HB3 GLU 145 2HB GLU 145 -2.135 -0.544 -15.166 1053 HG2 GLU 145 1HG GLU 145 -0.531 0.016 -12.661 1054 HG3 GLU 145 2HG GLU 145 -1.301 -1.511 -13.086 1055 HA PRO 146 HA PRO 146 -3.610 3.298 -17.851 1056 HB2 PRO 146 1HB PRO 146 -3.849 1.680 -20.028 1057 HB3 PRO 146 2HB PRO 146 -2.318 2.515 -19.736 1058 HG2 PRO 146 1HG PRO 146 -3.085 -0.358 -19.068 1059 HG3 PRO 146 2HG PRO 146 -1.623 0.226 -19.869 1060 HD2 PRO 146 1HD PRO 146 -1.688 -0.327 -17.184 1061 HD3 PRO 146 2HD PRO 146 -0.647 0.984 -17.872 Start of MODEL 12 1 H MET 1 1H MET 1 -9.940 3.288 -13.445 2 HA MET 1 HA MET 1 -7.474 2.150 -13.966 3 HB2 MET 1 1HB MET 1 -8.304 4.728 -12.586 4 HB3 MET 1 2HB MET 1 -6.684 4.366 -13.162 5 HG2 MET 1 1HG MET 1 -9.160 4.587 -14.900 6 HG3 MET 1 2HG MET 1 -7.919 5.827 -14.702 7 HE1 MET 1 3HE MET 1 -5.197 4.350 -14.708 8 HE2 MET 1 1HE MET 1 -4.813 4.301 -16.446 9 HE3 MET 1 2HE MET 1 -5.550 5.760 -15.737 10 H ALA 2 H ALA 2 -5.918 1.323 -12.790 11 HA ALA 2 HA ALA 2 -6.154 1.481 -9.827 12 HB1 ALA 2 3HB ALA 2 -5.642 -1.063 -11.409 13 HB2 ALA 2 1HB ALA 2 -5.566 -0.908 -9.639 14 HB3 ALA 2 2HB ALA 2 -7.114 -0.682 -10.487 15 H LYS 3 H LYS 3 -4.152 0.761 -8.717 16 HA LYS 3 HA LYS 3 -1.723 1.335 -10.376 17 HB2 LYS 3 1HB LYS 3 -2.376 2.494 -7.637 18 HB3 LYS 3 2HB LYS 3 -0.831 2.656 -8.463 19 HG2 LYS 3 1HG LYS 3 -1.865 3.953 -10.245 20 HG3 LYS 3 2HG LYS 3 -3.466 3.704 -9.536 21 HD2 LYS 3 1HD LYS 3 -2.589 4.831 -7.429 22 HD3 LYS 3 2HD LYS 3 -1.144 5.261 -8.354 23 HE2 LYS 3 1HE LYS 3 -3.868 5.933 -9.452 24 HE3 LYS 3 2HE LYS 3 -3.159 6.946 -8.192 25 HZ1 LYS 3 3HZ LYS 3 -1.911 6.322 -10.784 26 HZ2 LYS 3 1HZ LYS 3 -2.627 7.750 -10.374 27 HZ3 LYS 3 2HZ LYS 3 -1.248 7.267 -9.607 28 H LYS 4 H LYS 4 0.248 0.537 -9.582 29 HA LYS 4 HA LYS 4 0.044 -1.490 -7.402 30 HB2 LYS 4 1HB LYS 4 -0.287 -2.681 -9.572 31 HB3 LYS 4 2HB LYS 4 1.244 -2.035 -10.147 32 HG2 LYS 4 1HG LYS 4 2.450 -3.252 -8.397 33 HG3 LYS 4 2HG LYS 4 0.921 -3.857 -7.744 34 HD2 LYS 4 1HD LYS 4 0.459 -5.006 -9.886 35 HD3 LYS 4 2HD LYS 4 1.986 -4.397 -10.542 36 HE2 LYS 4 1HE LYS 4 3.229 -5.612 -8.786 37 HE3 LYS 4 2HE LYS 4 1.711 -6.211 -8.116 38 HZ1 LYS 4 3HZ LYS 4 2.726 -6.783 -10.820 39 HZ2 LYS 4 1HZ LYS 4 2.742 -7.822 -9.540 40 HZ3 LYS 4 2HZ LYS 4 1.306 -7.341 -10.194 41 H GLY 5 H GLY 5 1.797 -1.749 -6.172 42 HA2 GLY 5 1HA GLY 5 4.285 -0.327 -6.975 43 HA3 GLY 5 2HA GLY 5 3.503 0.103 -5.436 44 H TYR 6 H TYR 6 5.941 -0.662 -5.046 45 HA TYR 6 HA TYR 6 5.661 -3.313 -3.763 46 HB2 TYR 6 1HB TYR 6 7.710 -4.206 -4.722 47 HB3 TYR 6 2HB TYR 6 6.569 -3.845 -6.010 48 HD1 TYR 6 1HD TYR 6 9.698 -2.793 -4.367 49 HD2 TYR 6 2HD TYR 6 7.008 -2.144 -7.646 50 HE1 TYR 6 1HE TYR 6 11.409 -1.415 -5.498 51 HE2 TYR 6 2HE TYR 6 8.719 -0.766 -8.777 52 HH TYR 6 HH TYR 6 11.731 0.098 -7.187 53 H ILE 7 H ILE 7 6.974 -3.653 -2.026 54 HA ILE 7 HA ILE 7 8.825 -1.389 -1.309 55 HB ILE 7 HB ILE 7 7.257 -3.272 0.526 56 HG12 ILE 7 1HG1 ILE 7 6.957 -0.291 0.092 57 HG13 ILE 7 1HG2 ILE 7 5.873 -1.523 -0.535 58 HG21 ILE 7 2HG1 ILE 7 8.203 -1.918 2.351 59 HG22 ILE 7 2HG2 ILE 7 9.488 -2.713 1.414 60 HG23 ILE 7 2HG3 ILE 7 9.152 -0.983 1.172 61 HD11 ILE 7 1HD3 ILE 7 6.416 -0.969 2.392 62 HD12 ILE 7 1HD1 ILE 7 4.966 -0.496 1.474 63 HD13 ILE 7 1HD2 ILE 7 5.319 -2.219 1.756 64 H LEU 8 H LEU 8 10.793 -1.888 -1.779 65 HA LEU 8 HA LEU 8 11.807 -4.595 -1.113 66 HB2 LEU 8 1HB LEU 8 12.628 -3.497 -3.162 67 HB3 LEU 8 2HB LEU 8 13.166 -2.102 -2.220 68 HG LEU 8 HG LEU 8 14.793 -3.619 -1.036 69 HD11 LEU 8 1HD1 LEU 8 15.267 -5.799 -2.061 70 HD12 LEU 8 1HD2 LEU 8 13.613 -5.724 -1.411 71 HD13 LEU 8 1HD3 LEU 8 13.887 -5.581 -3.163 72 HD21 LEU 8 2HD3 LEU 8 15.447 -2.180 -2.938 73 HD22 LEU 8 2HD1 LEU 8 16.346 -3.716 -2.957 74 HD23 LEU 8 2HD2 LEU 8 14.981 -3.468 -4.074 75 H MET 9 H MET 9 12.543 -5.151 0.763 76 HA MET 9 HA MET 9 13.042 -3.045 2.796 77 HB2 MET 9 1HB MET 9 13.079 -6.063 3.120 78 HB3 MET 9 2HB MET 9 13.009 -4.857 4.397 79 HG2 MET 9 1HG MET 9 10.840 -5.450 2.364 80 HG3 MET 9 2HG MET 9 10.835 -5.882 4.076 81 HE1 MET 9 3HE MET 9 11.871 -3.431 5.632 82 HE2 MET 9 1HE MET 9 10.377 -2.496 5.888 83 HE3 MET 9 2HE MET 9 10.353 -4.271 6.029 84 H GLU 10 H GLU 10 14.892 -2.878 4.029 85 HA GLU 10 HA GLU 10 17.357 -3.125 2.599 86 HB2 GLU 10 1HB GLU 10 16.698 -2.696 5.534 87 HB3 GLU 10 2HB GLU 10 18.355 -2.769 4.951 88 HG2 GLU 10 1HG GLU 10 16.311 -0.825 3.867 89 HG3 GLU 10 2HG GLU 10 17.352 -0.470 5.243 90 H ASN 11 H ASN 11 15.606 -5.382 4.572 91 HA ASN 11 HA ASN 11 18.000 -7.127 4.852 92 HB2 ASN 11 1HB ASN 11 15.193 -7.257 5.977 93 HB3 ASN 11 2HB ASN 11 16.360 -8.562 6.149 94 HD21 ASN 11 2HD2 ASN 11 15.172 -5.737 7.484 95 HD22 ASN 11 2HD1 ASN 11 16.438 -5.428 8.624 96 H GLY 12 H GLY 12 16.178 -6.498 2.349 97 HA2 GLY 12 1HA GLY 12 16.419 -7.730 0.350 98 HA3 GLY 12 2HA GLY 12 16.776 -9.191 1.301 99 H GLY 13 H GLY 13 14.138 -7.689 2.667 100 HA2 GLY 13 1HA GLY 13 12.282 -9.702 1.746 101 HA3 GLY 13 2HA GLY 13 11.902 -8.296 2.767 102 H LYS 14 H LYS 14 10.384 -9.436 0.528 103 HA LYS 14 HA LYS 14 10.183 -6.932 -1.092 104 HB2 LYS 14 1HB LYS 14 11.413 -8.672 -2.416 105 HB3 LYS 14 2HB LYS 14 10.039 -9.753 -2.228 106 HG2 LYS 14 1HG LYS 14 9.892 -8.768 -4.391 107 HG3 LYS 14 2HG LYS 14 8.616 -8.044 -3.402 108 HD2 LYS 14 1HD LYS 14 9.965 -6.044 -3.041 109 HD3 LYS 14 2HD LYS 14 11.335 -6.775 -3.891 110 HE2 LYS 14 1HE LYS 14 8.627 -6.249 -5.165 111 HE3 LYS 14 2HE LYS 14 10.005 -5.151 -5.276 112 HZ1 LYS 14 3HZ LYS 14 9.956 -7.933 -6.241 113 HZ2 LYS 14 1HZ LYS 14 9.861 -6.580 -7.180 114 HZ3 LYS 14 2HZ LYS 14 11.245 -6.907 -6.343 115 H ILE 15 H ILE 15 8.295 -6.067 -0.868 116 HA ILE 15 HA ILE 15 5.908 -7.880 -0.623 117 HB ILE 15 HB ILE 15 6.381 -5.208 0.794 118 HG12 ILE 15 1HG1 ILE 15 6.113 -7.963 2.015 119 HG13 ILE 15 1HG2 ILE 15 7.649 -7.160 1.726 120 HG21 ILE 15 2HG1 ILE 15 4.215 -5.666 1.871 121 HG22 ILE 15 2HG2 ILE 15 4.037 -5.545 0.105 122 HG23 ILE 15 2HG3 ILE 15 4.035 -7.141 0.893 123 HD11 ILE 15 1HD3 ILE 15 5.422 -6.130 3.499 124 HD12 ILE 15 1HD1 ILE 15 6.939 -6.890 4.036 125 HD13 ILE 15 1HD2 ILE 15 6.977 -5.316 3.205 126 H GLU 16 H GLU 16 5.124 -7.870 -2.580 127 HA GLU 16 HA GLU 16 4.722 -5.267 -3.957 128 HB2 GLU 16 1HB GLU 16 4.083 -8.126 -4.803 129 HB3 GLU 16 2HB GLU 16 3.845 -6.699 -5.802 130 HG2 GLU 16 1HG GLU 16 6.275 -6.261 -5.739 131 HG3 GLU 16 2HG GLU 16 6.500 -7.712 -4.765 132 H PHE 17 H PHE 17 2.821 -4.311 -4.370 133 HA PHE 17 HA PHE 17 0.369 -5.461 -3.149 134 HB2 PHE 17 1HB PHE 17 -0.002 -3.495 -1.746 135 HB3 PHE 17 2HB PHE 17 1.514 -4.258 -1.295 136 HD1 PHE 17 1HD PHE 17 -0.038 -1.334 -2.866 137 HD2 PHE 17 2HD PHE 17 3.642 -3.178 -1.722 138 HE1 PHE 17 1HE PHE 17 1.134 0.819 -3.173 139 HE2 PHE 17 2HE PHE 17 4.818 -1.025 -2.027 140 HZ PHE 17 HZ PHE 17 3.563 0.974 -2.754 141 H GLU 18 H GLU 18 -1.556 -4.304 -3.627 142 HA GLU 18 HA GLU 18 -1.281 -2.573 -6.067 143 HB2 GLU 18 1HB GLU 18 -2.263 -4.799 -6.583 144 HB3 GLU 18 2HB GLU 18 -3.497 -4.543 -5.358 145 HG2 GLU 18 1HG GLU 18 -4.393 -2.650 -6.617 146 HG3 GLU 18 2HG GLU 18 -3.123 -2.832 -7.826 147 H LEU 19 H LEU 19 -2.284 -0.693 -6.153 148 HA LEU 19 HA LEU 19 -3.821 0.106 -3.714 149 HB2 LEU 19 1HB LEU 19 -2.456 1.813 -5.836 150 HB3 LEU 19 2HB LEU 19 -3.286 2.420 -4.400 151 HG LEU 19 HG LEU 19 -0.728 0.782 -4.435 152 HD11 LEU 19 1HD1 LEU 19 0.280 2.858 -3.598 153 HD12 LEU 19 1HD2 LEU 19 -0.450 3.083 -5.205 154 HD13 LEU 19 1HD3 LEU 19 -1.289 3.682 -3.754 155 HD21 LEU 19 2HD3 LEU 19 -2.155 0.265 -2.485 156 HD22 LEU 19 2HD1 LEU 19 -0.721 1.201 -2.000 157 HD23 LEU 19 2HD2 LEU 19 -2.304 2.003 -2.133 158 H PHE 20 H PHE 20 -5.751 1.171 -3.828 159 HA PHE 20 HA PHE 20 -7.163 0.850 -6.458 160 HB2 PHE 20 1HB PHE 20 -8.290 0.302 -3.681 161 HB3 PHE 20 2HB PHE 20 -9.153 0.139 -5.201 162 HD1 PHE 20 2HD PHE 20 -8.624 -1.691 -6.754 163 HD2 PHE 20 1HD PHE 20 -6.728 -1.366 -2.940 164 HE1 PHE 20 2HE PHE 20 -7.888 -4.045 -6.921 165 HE2 PHE 20 1HE PHE 20 -5.988 -3.719 -3.105 166 HZ PHE 20 HZ PHE 20 -6.569 -5.058 -5.096 167 HA PRO 21 HA PRO 21 -7.578 5.268 -5.485 168 HB2 PRO 21 1HB PRO 21 -8.642 4.968 -8.328 169 HB3 PRO 21 2HB PRO 21 -7.566 6.215 -7.686 170 HG2 PRO 21 1HG PRO 21 -6.510 4.301 -9.204 171 HG3 PRO 21 2HG PRO 21 -5.654 4.794 -7.740 172 HD2 PRO 21 1HD PRO 21 -7.421 2.361 -8.205 173 HD3 PRO 21 2HD PRO 21 -5.858 2.482 -7.300 174 H ASN 22 H ASN 22 -9.812 2.905 -6.821 175 HA ASN 22 HA ASN 22 -12.201 4.458 -6.490 176 HB2 ASN 22 1HB ASN 22 -11.675 1.480 -6.492 177 HB3 ASN 22 2HB ASN 22 -13.287 2.162 -6.322 178 HD21 ASN 22 2HD2 ASN 22 -12.489 0.486 -8.423 179 HD22 ASN 22 2HD1 ASN 22 -12.560 1.390 -9.899 180 H GLU 23 H GLU 23 -10.331 2.483 -4.239 181 HA GLU 23 HA GLU 23 -12.312 2.620 -2.115 182 HB2 GLU 23 1HB GLU 23 -9.338 1.967 -2.144 183 HB3 GLU 23 2HB GLU 23 -10.322 1.916 -0.687 184 HG2 GLU 23 1HG GLU 23 -11.729 0.178 -1.652 185 HG3 GLU 23 2HG GLU 23 -10.840 0.269 -3.172 186 H ALA 24 H ALA 24 -9.367 4.461 -2.883 187 HA ALA 24 HA ALA 24 -10.488 6.783 -1.519 188 HB1 ALA 24 3HB ALA 24 -7.975 5.471 -0.423 189 HB2 ALA 24 1HB ALA 24 -8.614 7.057 0.065 190 HB3 ALA 24 2HB ALA 24 -9.545 5.578 0.405 191 HA PRO 25 HA PRO 25 -8.090 7.846 -5.237 192 HB2 PRO 25 1HB PRO 25 -9.717 10.354 -4.623 193 HB3 PRO 25 2HB PRO 25 -9.445 9.581 -6.189 194 HG2 PRO 25 1HG PRO 25 -11.811 9.251 -5.025 195 HG3 PRO 25 2HG PRO 25 -11.032 7.854 -5.771 196 HD2 PRO 25 1HD PRO 25 -11.175 8.631 -2.835 197 HD3 PRO 25 2HD PRO 25 -11.334 6.995 -3.593 198 H VAL 26 H VAL 26 -8.724 9.963 -2.435 199 HA VAL 26 HA VAL 26 -6.382 11.623 -2.993 200 HB VAL 26 HB VAL 26 -8.089 11.282 -0.479 201 HG11 VAL 26 1HG1 VAL 26 -7.127 13.415 0.238 202 HG12 VAL 26 1HG2 VAL 26 -5.887 12.152 0.059 203 HG13 VAL 26 1HG3 VAL 26 -6.061 13.412 -1.186 204 HG21 VAL 26 2HG3 VAL 26 -9.356 12.118 -2.429 205 HG22 VAL 26 2HG1 VAL 26 -9.139 13.399 -1.213 206 HG23 VAL 26 2HG2 VAL 26 -8.135 13.386 -2.682 207 H THR 27 H THR 27 -7.046 9.015 -0.668 208 HA THR 27 HA THR 27 -4.500 9.227 0.645 209 HB THR 27 HB THR 27 -6.343 6.810 0.379 210 HG1 THR 27 1HG THR 27 -7.315 8.666 1.366 211 HG21 THR 27 2HG3 THR 27 -4.139 7.450 2.375 212 HG22 THR 27 2HG1 THR 27 -5.216 6.035 2.427 213 HG23 THR 27 2HG2 THR 27 -4.053 6.221 1.092 214 H VAL 28 H VAL 28 -5.616 7.158 -2.029 215 HA VAL 28 HA VAL 28 -3.103 5.773 -2.395 216 HB VAL 28 HB VAL 28 -5.369 6.448 -4.333 217 HG11 VAL 28 1HG1 VAL 28 -4.425 4.727 -5.793 218 HG12 VAL 28 1HG2 VAL 28 -3.304 6.089 -5.558 219 HG13 VAL 28 1HG3 VAL 28 -3.037 4.557 -4.693 220 HG21 VAL 28 2HG3 VAL 28 -6.016 4.983 -2.452 221 HG22 VAL 28 2HG1 VAL 28 -5.996 4.079 -3.985 222 HG23 VAL 28 2HG2 VAL 28 -4.657 3.897 -2.827 223 H ALA 29 H ALA 29 -4.397 8.732 -3.885 224 HA ALA 29 HA ALA 29 -2.206 9.154 -5.638 225 HB1 ALA 29 3HB ALA 29 -3.987 11.199 -4.267 226 HB2 ALA 29 1HB ALA 29 -2.946 11.508 -5.676 227 HB3 ALA 29 2HB ALA 29 -4.323 10.388 -5.815 228 H ASN 30 H ASN 30 -2.726 10.275 -2.296 229 HA ASN 30 HA ASN 30 -0.275 11.793 -2.164 230 HB2 ASN 30 1HB ASN 30 -2.097 10.631 -0.047 231 HB3 ASN 30 2HB ASN 30 -0.657 11.564 0.338 232 HD21 ASN 30 2HD2 ASN 30 -3.181 12.355 1.127 233 HD22 ASN 30 2HD1 ASN 30 -3.615 13.805 0.285 234 H PHE 31 H PHE 31 -1.108 8.475 -1.187 235 HA PHE 31 HA PHE 31 1.422 7.805 -0.053 236 HB2 PHE 31 1HB PHE 31 -0.671 6.414 0.108 237 HB3 PHE 31 2HB PHE 31 -0.490 5.994 -1.588 238 HD1 PHE 31 1HD PHE 31 0.868 5.542 1.792 239 HD2 PHE 31 2HD PHE 31 1.210 4.443 -2.323 240 HE1 PHE 31 1HE PHE 31 2.325 3.647 2.421 241 HE2 PHE 31 2HE PHE 31 2.666 2.546 -1.697 242 HZ PHE 31 HZ PHE 31 3.225 2.148 0.676 243 H GLU 32 H GLU 32 0.244 7.395 -3.399 244 HA GLU 32 HA GLU 32 2.672 6.325 -4.452 245 HB2 GLU 32 1HB GLU 32 0.599 6.252 -5.737 246 HB3 GLU 32 2HB GLU 32 0.485 8.006 -5.743 247 HG2 GLU 32 1HG GLU 32 2.456 8.179 -7.147 248 HG3 GLU 32 2HG GLU 32 2.710 6.437 -7.060 249 H LYS 33 H LYS 33 1.535 9.709 -4.325 250 HA LYS 33 HA LYS 33 3.754 10.927 -5.558 251 HB2 LYS 33 1HB LYS 33 1.822 12.251 -5.001 252 HB3 LYS 33 2HB LYS 33 1.962 11.863 -3.291 253 HG2 LYS 33 1HG LYS 33 2.715 14.110 -3.617 254 HG3 LYS 33 2HG LYS 33 4.127 13.118 -3.233 255 HD2 LYS 33 1HD LYS 33 4.807 13.051 -5.548 256 HD3 LYS 33 2HD LYS 33 3.290 13.798 -6.071 257 HE2 LYS 33 1HE LYS 33 3.874 15.873 -4.904 258 HE3 LYS 33 2HE LYS 33 5.352 15.135 -4.280 259 HZ1 LYS 33 3HZ LYS 33 4.740 15.594 -7.124 260 HZ2 LYS 33 1HZ LYS 33 5.780 16.481 -6.201 261 HZ3 LYS 33 2HZ LYS 33 6.120 14.904 -6.542 262 H LEU 34 H LEU 34 3.338 10.267 -2.067 263 HA LEU 34 HA LEU 34 5.896 11.266 -1.300 264 HB2 LEU 34 1HB LEU 34 4.120 9.119 -0.071 265 HB3 LEU 34 2HB LEU 34 5.570 9.759 0.710 266 HG LEU 34 HG LEU 34 3.155 11.444 -0.038 267 HD11 LEU 34 1HD1 LEU 34 2.617 11.363 2.356 268 HD12 LEU 34 1HD2 LEU 34 2.559 9.746 1.614 269 HD13 LEU 34 1HD3 LEU 34 3.952 10.216 2.617 270 HD21 LEU 34 2HD3 LEU 34 5.301 12.662 0.119 271 HD22 LEU 34 2HD1 LEU 34 4.227 13.077 1.477 272 HD23 LEU 34 2HD2 LEU 34 5.586 11.954 1.727 273 H ALA 35 H ALA 35 4.885 7.935 -2.082 274 HA ALA 35 HA ALA 35 7.384 6.720 -1.545 275 HB1 ALA 35 3HB ALA 35 5.286 5.940 -3.601 276 HB2 ALA 35 1HB ALA 35 6.592 4.893 -3.003 277 HB3 ALA 35 2HB ALA 35 5.314 5.442 -1.894 278 H ASN 36 H ASN 36 6.153 8.205 -4.532 279 HA ASN 36 HA ASN 36 8.526 7.358 -6.046 280 HB2 ASN 36 1HB ASN 36 6.128 9.076 -6.720 281 HB3 ASN 36 2HB ASN 36 7.455 8.795 -7.838 282 HD21 ASN 36 2HD2 ASN 36 4.828 8.073 -8.384 283 HD22 ASN 36 2HD1 ASN 36 4.726 6.346 -8.459 284 H GLU 37 H GLU 37 7.933 9.805 -3.853 285 HA GLU 37 HA GLU 37 10.067 11.518 -5.059 286 HB2 GLU 37 1HB GLU 37 8.209 11.949 -2.682 287 HB3 GLU 37 2HB GLU 37 9.491 13.058 -3.146 288 HG2 GLU 37 1HG GLU 37 7.186 12.285 -4.948 289 HG3 GLU 37 2HG GLU 37 7.201 13.703 -3.901 290 H GLY 38 H GLY 38 9.847 8.830 -3.189 291 HA2 GLY 38 1HA GLY 38 11.635 7.727 -2.158 292 HA3 GLY 38 2HA GLY 38 12.606 9.213 -2.285 293 H PHE 39 H PHE 39 9.431 9.504 -0.953 294 HA PHE 39 HA PHE 39 10.454 10.410 1.609 295 HB2 PHE 39 1HB PHE 39 8.369 11.321 0.670 296 HB3 PHE 39 2HB PHE 39 7.636 9.725 0.673 297 HD1 PHE 39 1HD PHE 39 8.957 12.404 2.868 298 HD2 PHE 39 2HD PHE 39 6.589 8.859 2.600 299 HE1 PHE 39 1HE PHE 39 8.109 12.799 5.157 300 HE2 PHE 39 2HE PHE 39 5.735 9.251 4.886 301 HZ PHE 39 HZ PHE 39 6.498 11.223 6.165 302 H TYR 40 H TYR 40 8.553 7.536 0.653 303 HA TYR 40 HA TYR 40 8.706 6.385 3.319 304 HB2 TYR 40 1HB TYR 40 7.822 5.370 0.607 305 HB3 TYR 40 2HB TYR 40 7.952 4.284 1.983 306 HD1 TYR 40 2HD TYR 40 6.703 5.012 4.159 307 HD2 TYR 40 1HD TYR 40 5.863 6.552 0.243 308 HE1 TYR 40 2HE TYR 40 4.449 5.693 4.910 309 HE2 TYR 40 1HE TYR 40 3.609 7.233 0.996 310 HH TYR 40 HH TYR 40 2.571 6.751 4.369 311 H ASN 41 H ASN 41 10.748 6.305 0.495 312 HA ASN 41 HA ASN 41 12.434 4.121 1.283 313 HB2 ASN 41 1HB ASN 41 12.533 5.240 -0.926 314 HB3 ASN 41 2HB ASN 41 13.173 6.685 -0.155 315 HD21 ASN 41 2HD2 ASN 41 14.428 5.132 -2.192 316 HD22 ASN 41 2HD1 ASN 41 15.909 4.519 -1.535 317 H GLY 42 H GLY 42 13.237 3.850 3.209 318 HA2 GLY 42 1HA GLY 42 15.169 4.431 4.599 319 HA3 GLY 42 2HA GLY 42 14.747 6.146 4.387 320 H LEU 43 H LEU 43 11.826 4.867 4.661 321 HA LEU 43 HA LEU 43 11.690 5.349 7.585 322 HB2 LEU 43 1HB LEU 43 9.440 4.746 5.629 323 HB3 LEU 43 2HB LEU 43 9.289 5.415 7.258 324 HG LEU 43 HG LEU 43 10.318 6.788 4.763 325 HD11 LEU 43 1HD1 LEU 43 8.523 8.370 5.308 326 HD12 LEU 43 1HD2 LEU 43 7.900 6.718 5.088 327 HD13 LEU 43 1HD3 LEU 43 8.089 7.387 6.727 328 HD21 LEU 43 2HD3 LEU 43 11.834 7.304 6.647 329 HD22 LEU 43 2HD1 LEU 43 10.835 8.714 6.223 330 HD23 LEU 43 2HD2 LEU 43 10.433 7.737 7.655 331 H THR 44 H THR 44 10.310 3.960 8.925 332 HA THR 44 HA THR 44 11.017 1.108 8.308 333 HB THR 44 HB THR 44 11.638 0.789 10.626 334 HG1 THR 44 1HG THR 44 10.103 2.266 11.529 335 HG21 THR 44 2HG3 THR 44 12.860 3.377 9.591 336 HG22 THR 44 2HG1 THR 44 13.560 2.316 10.836 337 HG23 THR 44 2HG2 THR 44 13.391 1.734 9.162 338 H PHE 45 H PHE 45 9.811 -0.511 9.495 339 HA PHE 45 HA PHE 45 7.029 0.351 10.129 340 HB2 PHE 45 1HB PHE 45 8.345 -2.383 9.860 341 HB3 PHE 45 2HB PHE 45 6.690 -2.155 10.401 342 HD1 PHE 45 2HD PHE 45 4.955 -1.417 8.865 343 HD2 PHE 45 1HD PHE 45 8.978 -2.002 7.551 344 HE1 PHE 45 2HE PHE 45 4.187 -1.398 6.515 345 HE2 PHE 45 1HE PHE 45 8.214 -1.981 5.199 346 HZ PHE 45 HZ PHE 45 5.819 -1.677 4.681 347 H HIS 46 H HIS 46 6.910 1.287 12.062 348 HA HIS 46 HA HIS 46 8.906 0.579 14.096 349 HB2 HIS 46 1HB HIS 46 8.005 2.479 15.334 350 HB3 HIS 46 2HB HIS 46 8.274 2.951 13.662 351 HD2 HIS 46 2HD HIS 46 5.600 3.363 16.217 352 HE1 HIS 46 1HE HIS 46 3.549 3.370 12.480 353 H ARG 47 H ARG 47 5.730 -0.392 13.335 354 HA ARG 47 HA ARG 47 5.667 -1.922 15.897 355 HB2 ARG 47 1HB ARG 47 3.350 -0.360 14.695 356 HB3 ARG 47 2HB ARG 47 3.182 -1.552 15.973 357 HG2 ARG 47 1HG ARG 47 4.861 0.955 16.212 358 HG3 ARG 47 2HG ARG 47 3.176 0.801 16.764 359 HD2 ARG 47 1HD ARG 47 3.885 -1.084 18.195 360 HD3 ARG 47 2HD ARG 47 5.568 -0.747 17.727 361 HE ARG 47 HE ARG 47 3.866 0.816 19.515 362 HH11 ARG 47 1HH1 ARG 47 6.815 0.691 17.610 363 HH12 ARG 47 1HH2 ARG 47 7.603 1.963 18.516 364 HH21 ARG 47 2HH1 ARG 47 4.900 2.466 20.684 365 HH22 ARG 47 2HH2 ARG 47 6.520 2.967 20.257 366 H VAL 48 H VAL 48 6.544 -3.552 14.476 367 HA VAL 48 HA VAL 48 4.623 -4.774 12.562 368 HB VAL 48 HB VAL 48 7.327 -5.725 13.624 369 HG11 VAL 48 1HG1 VAL 48 7.278 -7.299 11.752 370 HG12 VAL 48 1HG2 VAL 48 5.931 -7.568 12.884 371 HG13 VAL 48 1HG3 VAL 48 5.640 -6.746 11.331 372 HG21 VAL 48 2HG3 VAL 48 7.502 -3.638 12.314 373 HG22 VAL 48 2HG1 VAL 48 8.185 -5.014 11.415 374 HG23 VAL 48 2HG2 VAL 48 6.574 -4.388 10.993 375 H ILE 49 H ILE 49 3.131 -6.137 12.992 376 HA ILE 49 HA ILE 49 3.281 -7.681 15.559 377 HB ILE 49 HB ILE 49 0.801 -6.209 14.545 378 HG12 ILE 49 1HG1 ILE 49 2.629 -5.435 16.832 379 HG13 ILE 49 1HG2 ILE 49 2.521 -4.607 15.286 380 HG21 ILE 49 2HG1 ILE 49 -0.106 -6.804 16.756 381 HG22 ILE 49 2HG2 ILE 49 0.365 -8.258 15.847 382 HG23 ILE 49 2HG3 ILE 49 1.408 -7.650 17.155 383 HD11 ILE 49 1HD3 ILE 49 0.276 -4.898 17.293 384 HD12 ILE 49 1HD1 ILE 49 1.248 -3.439 16.996 385 HD13 ILE 49 1HD2 ILE 49 0.166 -4.062 15.726 386 HA PRO 50 HA PRO 50 2.324 -10.613 12.217 387 HB2 PRO 50 1HB PRO 50 3.691 -12.326 14.311 388 HB3 PRO 50 2HB PRO 50 3.984 -12.283 12.568 389 HG2 PRO 50 1HG PRO 50 5.788 -11.176 14.187 390 HG3 PRO 50 2HG PRO 50 5.342 -10.336 12.700 391 HD2 PRO 50 1HD PRO 50 4.351 -9.850 15.544 392 HD3 PRO 50 2HD PRO 50 4.899 -8.644 14.312 393 H GLY 51 H GLY 51 0.602 -11.795 12.094 394 HA2 GLY 51 1HA GLY 51 -1.034 -13.320 12.912 395 HA3 GLY 51 2HA GLY 51 -0.581 -12.898 14.580 396 H PHE 52 H PHE 52 -0.639 -9.981 13.304 397 HA PHE 52 HA PHE 52 -3.602 -9.613 13.324 398 HB2 PHE 52 1HB PHE 52 -1.622 -8.063 15.048 399 HB3 PHE 52 2HB PHE 52 -3.317 -7.650 14.840 400 HD1 PHE 52 2HD PHE 52 -5.083 -9.191 15.702 401 HD2 PHE 52 1HD PHE 52 -0.935 -9.755 16.559 402 HE1 PHE 52 2HE PHE 52 -5.677 -10.668 17.595 403 HE2 PHE 52 1HE PHE 52 -1.526 -11.234 18.450 404 HZ PHE 52 HZ PHE 52 -3.897 -11.691 18.967 405 H VAL 53 H VAL 53 -1.921 -6.754 13.769 406 HA VAL 53 HA VAL 53 -1.641 -6.258 10.820 407 HB VAL 53 HB VAL 53 -3.086 -4.422 12.790 408 HG11 VAL 53 1HG1 VAL 53 -3.643 -3.118 10.796 409 HG12 VAL 53 1HG2 VAL 53 -1.885 -3.235 11.045 410 HG13 VAL 53 1HG3 VAL 53 -2.677 -4.231 9.799 411 HG21 VAL 53 2HG3 VAL 53 -4.443 -6.423 12.280 412 HG22 VAL 53 2HG1 VAL 53 -5.129 -4.975 11.507 413 HG23 VAL 53 2HG2 VAL 53 -4.202 -6.145 10.539 414 H SER 54 H SER 54 0.164 -5.416 10.286 415 HA SER 54 HA SER 54 1.977 -4.242 12.354 416 HB2 SER 54 1HB SER 54 2.403 -4.885 9.486 417 HB3 SER 54 2HB SER 54 3.583 -4.199 10.591 418 HG SER 54 HG SER 54 3.702 -6.445 10.442 419 H GLN 55 H GLN 55 2.900 -2.183 12.130 420 HA GLN 55 HA GLN 55 1.577 -0.308 10.222 421 HB2 GLN 55 1HB GLN 55 0.418 -0.164 12.455 422 HB3 GLN 55 2HB GLN 55 1.958 0.248 13.194 423 HG2 GLN 55 1HG GLN 55 2.088 2.264 11.773 424 HG3 GLN 55 2HG GLN 55 0.488 1.854 11.095 425 HE21 GLN 55 2HE2 GLN 55 0.290 4.185 12.018 426 HE22 GLN 55 2HE1 GLN 55 -0.341 4.287 13.629 427 H GLY 56 H GLY 56 2.814 1.239 9.386 428 HA2 GLY 56 1HA GLY 56 5.479 1.786 10.492 429 HA3 GLY 56 2HA GLY 56 5.469 0.887 8.957 430 H GLY 57 H GLY 57 6.731 3.008 8.511 431 HA2 GLY 57 1HA GLY 57 6.365 4.638 6.716 432 HA3 GLY 57 2HA GLY 57 4.778 5.000 7.434 433 H CYS 58 H CYS 58 7.532 4.487 9.506 434 HA CYS 58 HA CYS 58 7.440 7.413 10.300 435 HB2 CYS 58 1HB CYS 58 7.907 5.023 12.014 436 HB3 CYS 58 2HB CYS 58 8.030 6.708 12.499 437 HG CYS 58 HG CYS 58 5.405 5.209 11.216 438 HA PRO 59 HA PRO 59 11.785 7.460 9.146 439 HB2 PRO 59 1HB PRO 59 11.672 9.781 11.109 440 HB3 PRO 59 2HB PRO 59 12.331 9.763 9.468 441 HG2 PRO 59 1HG PRO 59 9.997 10.970 9.869 442 HG3 PRO 59 2HG PRO 59 10.185 9.935 8.451 443 HD2 PRO 59 1HD PRO 59 8.860 9.303 11.122 444 HD3 PRO 59 2HD PRO 59 8.281 8.932 9.448 445 H ARG 60 H ARG 60 12.752 5.802 9.990 446 HA ARG 60 HA ARG 60 13.816 4.467 11.576 447 HB2 ARG 60 1HB ARG 60 14.425 7.198 12.777 448 HB3 ARG 60 2HB ARG 60 15.255 5.702 13.176 449 HG2 ARG 60 1HG ARG 60 16.138 5.543 10.910 450 HG3 ARG 60 2HG ARG 60 15.243 7.009 10.444 451 HD2 ARG 60 1HD ARG 60 16.482 8.219 12.233 452 HD3 ARG 60 2HD ARG 60 17.482 6.762 12.430 453 HE ARG 60 HE ARG 60 17.494 7.419 9.707 454 HH11 ARG 60 1HH1 ARG 60 18.560 8.807 12.752 455 HH12 ARG 60 1HH2 ARG 60 19.894 9.680 12.031 456 HH21 ARG 60 2HH1 ARG 60 19.228 8.557 8.782 457 HH22 ARG 60 2HH2 ARG 60 20.272 9.539 9.784 458 H GLY 61 H GLY 61 10.988 5.096 12.017 459 HA2 GLY 61 1HA GLY 61 9.413 4.561 13.623 460 HA3 GLY 61 2HA GLY 61 10.731 3.846 14.579 461 H ASN 62 H ASN 62 10.516 7.213 13.490 462 HA ASN 62 HA ASN 62 10.536 8.096 16.335 463 HB2 ASN 62 1HB ASN 62 11.034 9.538 13.720 464 HB3 ASN 62 2HB ASN 62 10.923 10.356 15.272 465 HD21 ASN 62 2HD2 ASN 62 13.177 10.218 13.476 466 HD22 ASN 62 2HD1 ASN 62 14.473 9.482 14.357 467 H GLY 63 H GLY 63 8.217 7.183 14.302 468 HA2 GLY 63 1HA GLY 63 5.919 7.409 14.641 469 HA3 GLY 63 2HA GLY 63 6.240 8.688 15.836 470 H THR 64 H THR 64 6.981 10.811 14.934 471 HA THR 64 HA THR 64 5.020 11.536 12.849 472 HB THR 64 HB THR 64 6.866 13.267 14.554 473 HG1 THR 64 1HG THR 64 4.876 13.680 15.671 474 HG21 THR 64 2HG3 THR 64 4.502 13.997 12.783 475 HG22 THR 64 2HG1 THR 64 5.409 15.116 13.826 476 HG23 THR 64 2HG2 THR 64 6.210 14.351 12.432 477 H GLY 65 H GLY 65 5.422 11.714 10.807 478 HA2 GLY 65 1HA GLY 65 8.248 12.073 9.932 479 HA3 GLY 65 2HA GLY 65 6.908 11.476 8.925 480 H ASP 66 H ASP 66 7.707 13.085 7.378 481 HA ASP 66 HA ASP 66 6.362 15.707 7.861 482 HB2 ASP 66 1HB ASP 66 8.884 15.888 8.239 483 HB3 ASP 66 2HB ASP 66 9.099 15.440 6.552 484 H ALA 67 H ALA 67 4.942 13.985 6.603 485 HA ALA 67 HA ALA 67 5.489 13.779 3.771 486 HB1 ALA 67 3HB ALA 67 2.886 13.465 5.309 487 HB2 ALA 67 1HB ALA 67 3.159 12.978 3.620 488 HB3 ALA 67 2HB ALA 67 4.044 12.168 4.936 489 H GLY 68 H GLY 68 3.625 16.017 5.782 490 HA2 GLY 68 1HA GLY 68 3.015 18.219 5.232 491 HA3 GLY 68 2HA GLY 68 3.565 17.947 3.562 492 H TYR 69 H TYR 69 1.612 15.419 4.697 493 HA TYR 69 HA TYR 69 -0.812 16.625 3.397 494 HB2 TYR 69 1HB TYR 69 0.191 13.755 3.244 495 HB3 TYR 69 2HB TYR 69 -1.351 14.322 2.617 496 HD1 TYR 69 2HD TYR 69 -1.369 16.049 0.768 497 HD2 TYR 69 1HD TYR 69 2.178 13.972 2.000 498 HE1 TYR 69 2HE TYR 69 -0.286 16.629 -1.376 499 HE2 TYR 69 1HE TYR 69 3.261 14.552 -0.145 500 HH TYR 69 HH TYR 69 3.040 15.590 -2.096 501 H THR 70 H THR 70 -2.448 16.878 4.675 502 HA THR 70 HA THR 70 -2.986 14.762 6.719 503 HB THR 70 HB THR 70 -3.219 17.767 7.199 504 HG1 THR 70 1HG THR 70 -1.562 17.308 8.756 505 HG21 THR 70 2HG3 THR 70 -3.756 15.385 9.012 506 HG22 THR 70 2HG1 THR 70 -3.836 17.097 9.487 507 HG23 THR 70 2HG2 THR 70 -4.992 16.446 8.301 508 H ILE 71 H ILE 71 -4.787 13.813 6.233 509 HA ILE 71 HA ILE 71 -7.053 15.473 5.171 510 HB ILE 71 HB ILE 71 -7.597 13.608 3.616 511 HG12 ILE 71 1HG1 ILE 71 -4.963 12.381 4.456 512 HG13 ILE 71 1HG2 ILE 71 -6.536 11.833 5.013 513 HG21 ILE 71 2HG1 ILE 71 -5.760 13.926 2.008 514 HG22 ILE 71 2HG2 ILE 71 -6.206 15.464 2.782 515 HG23 ILE 71 2HG3 ILE 71 -4.740 14.600 3.301 516 HD11 ILE 71 1HD3 ILE 71 -5.597 11.874 2.136 517 HD12 ILE 71 1HD1 ILE 71 -5.721 10.446 3.190 518 HD13 ILE 71 1HD2 ILE 71 -7.192 11.322 2.701 519 HA PRO 72 HA PRO 72 -9.506 13.328 8.056 520 HB2 PRO 72 1HB PRO 72 -11.968 13.552 6.908 521 HB3 PRO 72 2HB PRO 72 -11.129 15.011 7.452 522 HG2 PRO 72 1HG PRO 72 -11.289 13.835 4.643 523 HG3 PRO 72 2HG PRO 72 -11.568 15.505 5.145 524 HD2 PRO 72 1HD PRO 72 -9.161 14.694 4.136 525 HD3 PRO 72 2HD PRO 72 -9.277 15.969 5.413 526 H CYS 73 H CYS 73 -10.559 11.449 8.512 527 HA CYS 73 HA CYS 73 -9.923 9.054 7.157 528 HB2 CYS 73 1HB CYS 73 -10.747 9.109 9.386 529 HB3 CYS 73 2HB CYS 73 -12.332 9.612 8.818 530 HG CYS 73 HG CYS 73 -12.398 7.151 9.541 531 H GLU 74 H GLU 74 -10.441 8.342 5.190 532 HA GLU 74 HA GLU 74 -12.819 9.489 3.805 533 HB2 GLU 74 1HB GLU 74 -10.597 9.496 2.646 534 HB3 GLU 74 2HB GLU 74 -10.555 7.742 2.749 535 HG2 GLU 74 1HG GLU 74 -11.239 8.508 0.538 536 HG3 GLU 74 2HG GLU 74 -12.505 7.562 1.318 537 H THR 75 H THR 75 -14.488 8.343 3.021 538 HA THR 75 HA THR 75 -14.662 5.504 3.978 539 HB THR 75 HB THR 75 -17.049 5.895 4.458 540 HG1 THR 75 1HG THR 75 -17.814 8.083 4.369 541 HG21 THR 75 2HG3 THR 75 -15.250 7.961 5.781 542 HG22 THR 75 2HG1 THR 75 -16.799 7.363 6.420 543 HG23 THR 75 2HG2 THR 75 -15.411 6.258 6.272 544 H ASP 76 H ASP 76 -14.888 7.678 1.376 545 HA ASP 76 HA ASP 76 -16.476 5.692 -0.214 546 HB2 ASP 76 1HB ASP 76 -15.970 8.664 -0.665 547 HB3 ASP 76 2HB ASP 76 -16.803 7.614 -1.803 548 H ASN 77 H ASN 77 -14.124 5.117 -2.698 549 HA ASN 77 HA ASN 77 -16.971 5.635 -1.946 550 HB2 ASN 77 1HB ASN 77 -15.691 4.511 -4.451 551 HB3 ASN 77 2HB ASN 77 -17.425 4.519 -4.160 552 HD21 ASN 77 2HD2 ASN 77 -14.815 6.230 -5.389 553 HD22 ASN 77 2HD1 ASN 77 -15.577 7.774 -5.573 554 H ASN 78 H ASN 78 -14.523 3.152 -2.046 555 HA ASN 78 HA ASN 78 -16.557 1.012 -1.702 556 HB2 ASN 78 1HB ASN 78 -13.553 0.965 -2.087 557 HB3 ASN 78 2HB ASN 78 -14.518 -0.470 -1.770 558 HD21 ASN 78 2HD2 ASN 78 -12.942 0.016 -4.082 559 HD22 ASN 78 2HD1 ASN 78 -14.008 0.054 -5.446 560 HA PRO 79 HA PRO 79 -16.263 0.637 2.672 561 HB2 PRO 79 1HB PRO 79 -16.051 -2.330 2.038 562 HB3 PRO 79 2HB PRO 79 -17.184 -1.519 3.125 563 HG2 PRO 79 1HG PRO 79 -18.089 -2.383 0.776 564 HG3 PRO 79 2HG PRO 79 -18.588 -0.788 1.348 565 HD2 PRO 79 1HD PRO 79 -16.427 -1.508 -0.676 566 HD3 PRO 79 2HD PRO 79 -17.675 -0.201 -0.759 567 H HIS 80 H HIS 80 -14.869 0.052 4.312 568 HA HIS 80 HA HIS 80 -12.111 -0.576 3.310 569 HB2 HIS 80 1HB HIS 80 -12.871 1.317 5.576 570 HB3 HIS 80 2HB HIS 80 -11.243 0.967 5.013 571 HD2 HIS 80 2HD HIS 80 -14.191 3.434 4.144 572 HE1 HIS 80 1HE HIS 80 -11.172 3.782 1.176 573 H ARG 81 H ARG 81 -12.986 -2.793 3.810 574 HA ARG 81 HA ARG 81 -12.835 -3.449 6.701 575 HB2 ARG 81 1HB ARG 81 -14.508 -4.558 5.170 576 HB3 ARG 81 2HB ARG 81 -13.166 -5.279 4.294 577 HG2 ARG 81 1HG ARG 81 -12.506 -6.564 6.226 578 HG3 ARG 81 2HG ARG 81 -13.715 -5.735 7.236 579 HD2 ARG 81 1HD ARG 81 -14.336 -7.412 4.816 580 HD3 ARG 81 2HD ARG 81 -14.416 -7.967 6.504 581 HE ARG 81 HE ARG 81 -15.983 -5.700 6.433 582 HH11 ARG 81 1HH1 ARG 81 -15.927 -8.766 4.720 583 HH12 ARG 81 1HH2 ARG 81 -17.658 -8.799 4.466 584 HH21 ARG 81 2HH1 ARG 81 -18.229 -5.753 6.097 585 HH22 ARG 81 2HH2 ARG 81 -18.961 -7.094 5.245 586 H HIS 82 H HIS 82 -11.197 -4.328 7.729 587 HA HIS 82 HA HIS 82 -8.611 -4.377 6.310 588 HB2 HIS 82 1HB HIS 82 -9.424 -4.711 9.222 589 HB3 HIS 82 2HB HIS 82 -7.773 -4.959 8.670 590 HD2 HIS 82 2HD HIS 82 -6.261 -2.587 8.962 591 HE1 HIS 82 1HE HIS 82 -9.545 0.080 8.563 592 H VAL 83 H VAL 83 -9.407 -6.168 4.917 593 HA VAL 83 HA VAL 83 -9.374 -8.857 6.173 594 HB VAL 83 HB VAL 83 -9.685 -9.655 3.878 595 HG11 VAL 83 1HG1 VAL 83 -11.792 -8.553 3.302 596 HG12 VAL 83 1HG2 VAL 83 -11.670 -8.887 5.046 597 HG13 VAL 83 1HG3 VAL 83 -11.412 -7.234 4.434 598 HG21 VAL 83 2HG3 VAL 83 -8.153 -8.066 2.769 599 HG22 VAL 83 2HG1 VAL 83 -9.748 -8.069 1.980 600 HG23 VAL 83 2HG2 VAL 83 -9.301 -6.740 3.078 601 H THR 84 H THR 84 -8.056 -10.491 4.729 602 HA THR 84 HA THR 84 -5.374 -10.209 5.633 603 HB THR 84 HB THR 84 -6.412 -11.943 3.347 604 HG1 THR 84 1HG THR 84 -6.565 -13.515 5.047 605 HG21 THR 84 2HG3 THR 84 -3.953 -12.192 5.122 606 HG22 THR 84 2HG1 THR 84 -4.472 -13.362 3.888 607 HG23 THR 84 2HG2 THR 84 -3.951 -11.730 3.404 608 H GLY 85 H GLY 85 -3.892 -8.841 5.071 609 HA2 GLY 85 1HA GLY 85 -2.194 -8.219 3.519 610 HA3 GLY 85 2HA GLY 85 -3.300 -8.588 2.176 611 H ALA 86 H ALA 86 -5.273 -7.004 4.152 612 HA ALA 86 HA ALA 86 -5.490 -4.785 2.419 613 HB1 ALA 86 3HB ALA 86 -6.444 -5.053 5.291 614 HB2 ALA 86 1HB ALA 86 -7.011 -3.842 4.118 615 HB3 ALA 86 2HB ALA 86 -7.334 -5.570 3.841 616 H MET 87 H MET 87 -4.876 -2.685 2.459 617 HA MET 87 HA MET 87 -2.972 -1.881 4.634 618 HB2 MET 87 1HB MET 87 -2.757 -1.292 1.659 619 HB3 MET 87 2HB MET 87 -1.732 -0.592 2.903 620 HG2 MET 87 1HG MET 87 -0.833 -2.794 3.453 621 HG3 MET 87 2HG MET 87 -1.925 -3.555 2.293 622 HE1 MET 87 3HE MET 87 1.217 -1.282 2.812 623 HE2 MET 87 1HE MET 87 1.574 -0.749 1.152 624 HE3 MET 87 2HE MET 87 0.108 -0.167 1.979 625 H SER 88 H SER 88 -3.665 -0.271 5.774 626 HA SER 88 HA SER 88 -5.660 1.658 4.540 627 HB2 SER 88 1HB SER 88 -6.759 1.802 6.571 628 HB3 SER 88 2HB SER 88 -6.718 0.133 6.023 629 HG SER 88 HG SER 88 -6.192 0.105 8.110 630 H MET 89 H MET 89 -5.493 3.805 5.143 631 HA MET 89 HA MET 89 -2.949 4.657 6.419 632 HB2 MET 89 1HB MET 89 -3.822 5.789 4.355 633 HB3 MET 89 2HB MET 89 -5.225 6.317 5.274 634 HG2 MET 89 1HG MET 89 -3.653 8.126 5.136 635 HG3 MET 89 2HG MET 89 -3.714 7.566 6.808 636 HE1 MET 89 3HE MET 89 -1.644 7.761 3.503 637 HE2 MET 89 1HE MET 89 -0.254 6.709 3.861 638 HE3 MET 89 2HE MET 89 -1.877 6.003 3.659 639 H ALA 90 H ALA 90 -2.705 5.455 8.374 640 HA ALA 90 HA ALA 90 -4.694 4.872 10.343 641 HB1 ALA 90 3HB ALA 90 -2.247 6.665 10.526 642 HB2 ALA 90 1HB ALA 90 -3.184 6.044 11.904 643 HB3 ALA 90 2HB ALA 90 -2.291 4.918 10.854 644 H HIS 91 H HIS 91 -6.479 5.877 10.838 645 HA HIS 91 HA HIS 91 -6.449 8.865 10.851 646 HB2 HIS 91 1HB HIS 91 -8.697 7.105 9.778 647 HB3 HIS 91 2HB HIS 91 -8.824 8.835 10.059 648 HD2 HIS 91 2HD HIS 91 -7.819 6.450 7.273 649 HE1 HIS 91 1HE HIS 91 -6.289 10.278 6.196 650 H ARG 92 H ARG 92 -7.565 9.861 12.448 651 HA ARG 92 HA ARG 92 -8.970 8.064 14.401 652 HB2 ARG 92 1HB ARG 92 -7.414 10.626 14.929 653 HB3 ARG 92 2HB ARG 92 -8.365 9.764 16.129 654 HG2 ARG 92 1HG ARG 92 -6.879 7.807 15.898 655 HG3 ARG 92 2HG ARG 92 -5.904 8.709 14.712 656 HD2 ARG 92 1HD ARG 92 -5.410 10.390 16.379 657 HD3 ARG 92 2HD ARG 92 -6.409 9.518 17.566 658 HE ARG 92 HE ARG 92 -4.712 7.999 17.867 659 HH11 ARG 92 1HH1 ARG 92 -4.046 9.930 15.009 660 HH12 ARG 92 1HH2 ARG 92 -2.414 9.324 14.826 661 HH21 ARG 92 2HH1 ARG 92 -2.594 7.219 17.620 662 HH22 ARG 92 2HH2 ARG 92 -1.592 7.789 16.303 663 H GLY 93 H GLY 93 -9.299 10.524 12.145 664 HA2 GLY 93 1HA GLY 93 -12.031 10.797 12.300 665 HA3 GLY 93 2HA GLY 93 -11.437 11.989 13.481 666 H ARG 94 H ARG 94 -11.792 13.897 12.504 667 HA ARG 94 HA ARG 94 -11.250 14.253 9.628 668 HB2 ARG 94 1HB ARG 94 -13.188 15.357 10.766 669 HB3 ARG 94 2HB ARG 94 -12.063 16.269 11.759 670 HG2 ARG 94 1HG ARG 94 -11.233 17.472 9.855 671 HG3 ARG 94 2HG ARG 94 -12.142 16.426 8.737 672 HD2 ARG 94 1HD ARG 94 -14.228 17.224 9.696 673 HD3 ARG 94 2HD ARG 94 -13.314 18.276 10.802 674 HE ARG 94 HE ARG 94 -13.758 18.655 7.938 675 HH11 ARG 94 1HH1 ARG 94 -11.967 19.615 10.803 676 HH12 ARG 94 1HH2 ARG 94 -11.509 21.171 10.149 677 HH21 ARG 94 2HH1 ARG 94 -13.156 20.679 7.099 678 HH22 ARG 94 2HH2 ARG 94 -12.182 21.773 8.052 679 H ASP 95 H ASP 95 -9.524 15.033 8.704 680 HA ASP 95 HA ASP 95 -7.342 15.805 8.478 681 HB2 ASP 95 1HB ASP 95 -8.263 17.574 10.782 682 HB3 ASP 95 2HB ASP 95 -6.749 17.795 9.918 683 H THR 96 H THR 96 -7.412 13.425 9.695 684 HA THR 96 HA THR 96 -5.278 13.713 11.787 685 HB THR 96 HB THR 96 -6.081 11.538 12.716 686 HG1 THR 96 1HG THR 96 -7.324 11.272 10.501 687 HG21 THR 96 2HG3 THR 96 -8.221 13.695 12.566 688 HG22 THR 96 2HG1 THR 96 -8.118 12.411 13.792 689 HG23 THR 96 2HG2 THR 96 -6.857 13.664 13.706 690 H GLY 97 H GLY 97 -5.942 12.809 8.668 691 HA2 GLY 97 1HA GLY 97 -4.438 10.383 8.426 692 HA3 GLY 97 2HA GLY 97 -4.801 11.530 7.115 693 H SER 98 H SER 98 -2.350 10.073 7.482 694 HA SER 98 HA SER 98 -0.422 12.375 7.520 695 HB2 SER 98 1HB SER 98 1.025 11.491 9.056 696 HB3 SER 98 2HB SER 98 -0.553 11.657 9.812 697 HG SER 98 HG SER 98 -0.851 9.542 9.738 698 H CYS 99 H CYS 99 1.522 9.990 8.008 699 HA CYS 99 HA CYS 99 1.461 8.804 5.213 700 HB2 CYS 99 1HB CYS 99 3.764 8.762 5.153 701 HB3 CYS 99 2HB CYS 99 3.241 10.406 5.491 702 HG CYS 99 HG CYS 99 3.651 10.294 8.055 703 H GLN 100 H GLN 100 1.060 8.210 8.513 704 HA GLN 100 HA GLN 100 2.412 5.624 8.651 705 HB2 GLN 100 1HB GLN 100 0.296 6.928 10.414 706 HB3 GLN 100 2HB GLN 100 1.061 5.387 10.771 707 HG2 GLN 100 1HG GLN 100 3.239 6.464 10.934 708 HG3 GLN 100 2HG GLN 100 2.503 8.033 10.503 709 HE21 GLN 100 2HE2 GLN 100 3.824 8.219 12.717 710 HE22 GLN 100 2HE1 GLN 100 2.820 8.145 14.127 711 H PHE 101 H PHE 101 1.786 3.736 7.975 712 HA PHE 101 HA PHE 101 -1.100 3.357 7.269 713 HB2 PHE 101 1HB PHE 101 -0.507 2.417 5.126 714 HB3 PHE 101 2HB PHE 101 0.235 4.006 5.228 715 HD1 PHE 101 2HD PHE 101 2.660 4.242 5.525 716 HD2 PHE 101 1HD PHE 101 0.820 0.414 5.061 717 HE1 PHE 101 2HE PHE 101 4.864 3.248 5.009 718 HE2 PHE 101 1HE PHE 101 3.023 -0.583 4.546 719 HZ PHE 101 HZ PHE 101 5.044 0.833 4.520 720 H PHE 102 H PHE 102 -1.681 1.114 6.860 721 HA PHE 102 HA PHE 102 -0.193 -0.626 8.802 722 HB2 PHE 102 1HB PHE 102 -3.146 -0.560 8.049 723 HB3 PHE 102 2HB PHE 102 -2.413 -1.776 9.083 724 HD1 PHE 102 2HD PHE 102 -1.599 -1.191 11.324 725 HD2 PHE 102 1HD PHE 102 -3.574 1.670 8.841 726 HE1 PHE 102 2HE PHE 102 -1.968 0.259 13.293 727 HE2 PHE 102 1HE PHE 102 -3.942 3.123 10.807 728 HZ PHE 102 HZ PHE 102 -3.139 2.418 13.033 729 H ILE 103 H ILE 103 0.173 -2.773 8.359 730 HA ILE 103 HA ILE 103 -0.990 -3.816 5.791 731 HB ILE 103 HB ILE 103 1.713 -4.520 7.044 732 HG12 ILE 103 1HG1 ILE 103 1.079 -3.137 4.426 733 HG13 ILE 103 1HG2 ILE 103 1.711 -2.357 5.868 734 HG21 ILE 103 2HG1 ILE 103 1.985 -5.990 5.089 735 HG22 ILE 103 2HG2 ILE 103 0.578 -6.477 6.063 736 HG23 ILE 103 2HG3 ILE 103 0.340 -5.579 4.546 737 HD11 ILE 103 1HD3 ILE 103 3.100 -4.525 4.277 738 HD12 ILE 103 1HD1 ILE 103 3.479 -2.787 4.255 739 HD13 ILE 103 1HD2 ILE 103 3.741 -3.737 5.738 740 H VAL 104 H VAL 104 -2.552 -5.114 6.161 741 HA VAL 104 HA VAL 104 -2.818 -6.358 8.840 742 HB VAL 104 HB VAL 104 -4.599 -6.470 6.356 743 HG11 VAL 104 1HG1 VAL 104 -6.331 -7.268 7.888 744 HG12 VAL 104 1HG2 VAL 104 -4.940 -8.376 7.821 745 HG13 VAL 104 1HG3 VAL 104 -5.147 -7.288 9.216 746 HG21 VAL 104 2HG3 VAL 104 -4.371 -4.181 7.259 747 HG22 VAL 104 2HG1 VAL 104 -5.998 -4.830 7.569 748 HG23 VAL 104 2HG2 VAL 104 -4.797 -4.777 8.881 749 H HIS 105 H HIS 105 -1.918 -8.139 9.371 750 HA HIS 105 HA HIS 105 -1.273 -10.194 7.373 751 HB2 HIS 105 1HB HIS 105 0.165 -9.805 9.383 752 HB3 HIS 105 2HB HIS 105 -1.173 -10.285 10.418 753 HD2 HIS 105 2HD HIS 105 -0.658 -12.514 7.277 754 HE1 HIS 105 1HE HIS 105 0.949 -14.575 10.644 755 H GLU 106 H GLU 106 -3.369 -10.155 10.275 756 HA GLU 106 HA GLU 106 -5.099 -12.166 8.870 757 HB2 GLU 106 1HB GLU 106 -4.731 -11.643 11.851 758 HB3 GLU 106 2HB GLU 106 -5.875 -12.785 11.161 759 HG2 GLU 106 1HG GLU 106 -2.862 -12.929 10.908 760 HG3 GLU 106 2HG GLU 106 -3.858 -13.879 12.009 761 HA PRO 107 HA PRO 107 -8.276 -9.269 8.425 762 HB2 PRO 107 1HB PRO 107 -10.038 -11.602 9.309 763 HB3 PRO 107 2HB PRO 107 -10.223 -10.568 7.887 764 HG2 PRO 107 1HG PRO 107 -9.259 -13.022 7.537 765 HG3 PRO 107 2HG PRO 107 -8.496 -11.679 6.678 766 HD2 PRO 107 1HD PRO 107 -7.578 -13.117 9.193 767 HD3 PRO 107 2HD PRO 107 -6.598 -12.520 7.796 768 H GLN 108 H GLN 108 -9.164 -7.780 9.587 769 HA GLN 108 HA GLN 108 -9.867 -8.446 12.422 770 HB2 GLN 108 1HB GLN 108 -8.613 -5.840 11.467 771 HB3 GLN 108 2HB GLN 108 -9.019 -6.266 13.122 772 HG2 GLN 108 1HG GLN 108 -6.937 -7.651 11.419 773 HG3 GLN 108 2HG GLN 108 -6.622 -6.435 12.690 774 HE21 GLN 108 2HE2 GLN 108 -6.173 -9.524 12.174 775 HE22 GLN 108 2HE1 GLN 108 -6.544 -10.208 13.721 776 HA PRO 109 HA PRO 109 -13.646 -6.946 10.374 777 HB2 PRO 109 1HB PRO 109 -14.633 -8.240 12.954 778 HB3 PRO 109 2HB PRO 109 -15.307 -8.389 11.325 779 HG2 PRO 109 1HG PRO 109 -13.908 -10.431 12.298 780 HG3 PRO 109 2HG PRO 109 -13.639 -9.938 10.623 781 HD2 PRO 109 1HD PRO 109 -11.972 -9.330 13.094 782 HD3 PRO 109 2HD PRO 109 -11.424 -9.772 11.427 783 H HIS 110 H HIS 110 -12.401 -6.580 13.632 784 HA HIS 110 HA HIS 110 -14.393 -4.563 14.354 785 HB2 HIS 110 1HB HIS 110 -13.057 -4.309 16.401 786 HB3 HIS 110 2HB HIS 110 -13.362 -6.009 16.077 787 HD2 HIS 110 2HD HIS 110 -11.058 -7.495 15.227 788 HE1 HIS 110 1HE HIS 110 -8.302 -4.451 16.366 789 H LEU 111 H LEU 111 -11.602 -4.534 12.459 790 HA LEU 111 HA LEU 111 -11.206 -1.610 12.907 791 HB2 LEU 111 1HB LEU 111 -9.663 -3.648 11.248 792 HB3 LEU 111 2HB LEU 111 -9.267 -1.929 11.352 793 HG LEU 111 HG LEU 111 -9.148 -3.940 13.627 794 HD11 LEU 111 1HD1 LEU 111 -6.732 -3.536 13.483 795 HD12 LEU 111 1HD2 LEU 111 -7.379 -4.205 11.966 796 HD13 LEU 111 1HD3 LEU 111 -6.993 -2.471 12.082 797 HD21 LEU 111 2HD3 LEU 111 -9.842 -1.691 14.388 798 HD22 LEU 111 2HD1 LEU 111 -8.179 -2.060 14.907 799 HD23 LEU 111 2HD2 LEU 111 -8.461 -0.973 13.526 800 H ASP 112 H ASP 112 -13.196 -3.542 11.164 801 HA ASP 112 HA ASP 112 -13.038 -2.412 8.527 802 HB2 ASP 112 1HB ASP 112 -14.289 -4.507 9.111 803 HB3 ASP 112 2HB ASP 112 -15.463 -3.539 9.992 804 H GLY 113 H GLY 113 -13.055 -0.335 8.146 805 HA2 GLY 113 1HA GLY 113 -14.355 1.599 7.661 806 HA3 GLY 113 2HA GLY 113 -15.497 1.144 8.947 807 H VAL 114 H VAL 114 -12.606 0.617 10.325 808 HA VAL 114 HA VAL 114 -12.715 3.109 11.895 809 HB VAL 114 HB VAL 114 -10.790 0.733 11.920 810 HG11 VAL 114 1HG1 VAL 114 -10.037 1.596 14.083 811 HG12 VAL 114 1HG2 VAL 114 -9.711 2.739 12.758 812 HG13 VAL 114 1HG3 VAL 114 -11.071 3.028 13.870 813 HG21 VAL 114 2HG3 VAL 114 -13.102 0.152 12.571 814 HG22 VAL 114 2HG1 VAL 114 -12.012 0.098 13.976 815 HG23 VAL 114 2HG2 VAL 114 -13.105 1.483 13.753 816 H HIS 115 H HIS 115 -10.275 1.601 9.770 817 HA HIS 115 HA HIS 115 -9.219 4.374 9.329 818 HB2 HIS 115 1HB HIS 115 -7.803 1.697 8.973 819 HB3 HIS 115 2HB HIS 115 -7.107 3.274 8.630 820 HD2 HIS 115 2HD HIS 115 -7.384 0.831 11.533 821 HE1 HIS 115 1HE HIS 115 -6.228 4.575 13.209 822 H THR 116 H THR 116 -8.099 4.570 7.148 823 HA THR 116 HA THR 116 -10.161 3.805 5.138 824 HB THR 116 HB THR 116 -7.914 5.867 5.072 825 HG1 THR 116 1HG THR 116 -10.763 6.080 5.187 826 HG21 THR 116 2HG3 THR 116 -10.045 5.216 3.001 827 HG22 THR 116 2HG1 THR 116 -8.891 6.568 2.922 828 HG23 THR 116 2HG2 THR 116 -8.305 4.889 2.838 829 H VAL 117 H VAL 117 -9.658 1.676 4.745 830 HA VAL 117 HA VAL 117 -7.103 0.787 3.716 831 HB VAL 117 HB VAL 117 -9.936 -0.164 3.073 832 HG11 VAL 117 1HG1 VAL 117 -8.861 -2.258 2.401 833 HG12 VAL 117 1HG2 VAL 117 -8.328 -0.884 1.403 834 HG13 VAL 117 1HG3 VAL 117 -7.264 -1.525 2.678 835 HG21 VAL 117 2HG3 VAL 117 -9.417 -0.272 5.485 836 HG22 VAL 117 2HG1 VAL 117 -9.487 -1.902 4.775 837 HG23 VAL 117 2HG2 VAL 117 -7.911 -1.151 5.124 838 H PHE 118 H PHE 118 -6.033 1.261 2.015 839 HA PHE 118 HA PHE 118 -7.521 2.482 -0.287 840 HB2 PHE 118 1HB PHE 118 -5.761 4.118 -0.547 841 HB3 PHE 118 2HB PHE 118 -6.336 4.212 1.110 842 HD1 PHE 118 2HD PHE 118 -4.958 3.401 2.965 843 HD2 PHE 118 1HD PHE 118 -3.539 3.341 -1.064 844 HE1 PHE 118 2HE PHE 118 -2.647 3.093 3.787 845 HE2 PHE 118 1HE PHE 118 -1.227 3.031 -0.246 846 HZ PHE 118 HZ PHE 118 -0.781 2.906 2.178 847 H GLY 119 H GLY 119 -5.297 0.165 0.833 848 HA2 GLY 119 1HA GLY 119 -4.867 -0.705 -1.961 849 HA3 GLY 119 2HA GLY 119 -3.415 -0.364 -0.990 850 H GLN 120 H GLN 120 -3.340 -2.792 -1.790 851 HA GLN 120 HA GLN 120 -3.680 -4.346 0.663 852 HB2 GLN 120 1HB GLN 120 -5.933 -4.582 -0.422 853 HB3 GLN 120 2HB GLN 120 -5.151 -5.226 -1.858 854 HG2 GLN 120 1HG GLN 120 -4.270 -7.106 -0.518 855 HG3 GLN 120 2HG GLN 120 -5.142 -6.463 0.902 856 HE21 GLN 120 2HE2 GLN 120 -6.076 -8.698 0.797 857 HE22 GLN 120 2HE1 GLN 120 -7.485 -8.929 -0.184 858 H VAL 121 H VAL 121 -2.039 -5.634 0.926 859 HA VAL 121 HA VAL 121 0.019 -5.990 -1.073 860 HB VAL 121 HB VAL 121 -0.630 -7.608 1.440 861 HG11 VAL 121 1HG1 VAL 121 1.689 -8.377 1.316 862 HG12 VAL 121 1HG2 VAL 121 0.743 -8.879 -0.106 863 HG13 VAL 121 1HG3 VAL 121 1.889 -7.523 -0.233 864 HG21 VAL 121 2HG3 VAL 121 -0.175 -5.222 1.896 865 HG22 VAL 121 2HG1 VAL 121 1.160 -6.247 2.474 866 HG23 VAL 121 2HG2 VAL 121 1.335 -5.329 0.960 867 H THR 122 H THR 122 0.437 -7.410 -2.559 868 HA THR 122 HA THR 122 -1.689 -9.473 -3.035 869 HB THR 122 HB THR 122 -1.137 -9.290 -5.427 870 HG1 THR 122 1HG THR 122 0.342 -7.620 -6.064 871 HG21 THR 122 2HG3 THR 122 -1.609 -6.569 -4.149 872 HG22 THR 122 2HG1 THR 122 -1.965 -7.006 -5.837 873 HG23 THR 122 2HG2 THR 122 -2.863 -7.779 -4.509 874 H SER 123 H SER 123 1.697 -8.890 -2.591 875 HA SER 123 HA SER 123 2.180 -11.833 -2.426 876 HB2 SER 123 1HB SER 123 2.421 -11.511 -4.744 877 HB3 SER 123 2HB SER 123 3.558 -10.197 -4.487 878 HG SER 123 HG SER 123 4.567 -12.175 -4.840 879 H GLY 124 H GLY 124 3.529 -12.179 -0.781 880 HA2 GLY 124 1HA GLY 124 5.798 -11.692 0.129 881 HA3 GLY 124 2HA GLY 124 5.381 -9.965 0.019 882 H MET 125 H MET 125 2.840 -12.104 0.938 883 HA MET 125 HA MET 125 2.438 -10.852 3.489 884 HB2 MET 125 1HB MET 125 1.422 -13.469 2.331 885 HB3 MET 125 2HB MET 125 0.893 -12.818 3.876 886 HG2 MET 125 1HG MET 125 0.530 -11.520 1.161 887 HG3 MET 125 2HG MET 125 -0.716 -12.302 2.136 888 HE1 MET 125 3HE MET 125 -0.017 -11.339 5.079 889 HE2 MET 125 1HE MET 125 -1.030 -9.881 5.198 890 HE3 MET 125 2HE MET 125 -1.664 -11.343 4.402 891 H ASP 126 H ASP 126 4.258 -13.702 2.515 892 HA ASP 126 HA ASP 126 4.863 -14.631 5.174 893 HB2 ASP 126 1HB ASP 126 6.301 -14.870 2.505 894 HB3 ASP 126 2HB ASP 126 6.943 -15.575 3.982 895 H VAL 127 H VAL 127 6.527 -12.341 3.012 896 HA VAL 127 HA VAL 127 8.684 -11.698 4.806 897 HB VAL 127 HB VAL 127 7.243 -9.984 2.725 898 HG11 VAL 127 1HG1 VAL 127 9.256 -8.593 2.743 899 HG12 VAL 127 1HG2 VAL 127 8.439 -8.603 4.324 900 HG13 VAL 127 1HG3 VAL 127 9.915 -9.566 4.078 901 HG21 VAL 127 2HG3 VAL 127 8.254 -12.037 1.794 902 HG22 VAL 127 2HG1 VAL 127 9.154 -10.592 1.277 903 HG23 VAL 127 2HG2 VAL 127 9.803 -11.628 2.570 904 H VAL 128 H VAL 128 5.386 -10.443 4.579 905 HA VAL 128 HA VAL 128 5.726 -8.369 6.572 906 HB VAL 128 HB VAL 128 3.274 -9.998 5.744 907 HG11 VAL 128 1HG1 VAL 128 1.957 -8.208 6.768 908 HG12 VAL 128 1HG2 VAL 128 2.979 -9.050 7.958 909 HG13 VAL 128 1HG3 VAL 128 3.454 -7.444 7.355 910 HG21 VAL 128 2HG3 VAL 128 4.270 -8.680 3.906 911 HG22 VAL 128 2HG1 VAL 128 2.713 -7.988 4.415 912 HG23 VAL 128 2HG2 VAL 128 4.236 -7.224 4.929 913 H ARG 129 H ARG 129 4.407 -11.674 6.892 914 HA ARG 129 HA ARG 129 3.975 -11.352 9.728 915 HB2 ARG 129 1HB ARG 129 3.428 -13.690 9.724 916 HB3 ARG 129 2HB ARG 129 2.792 -13.013 8.233 917 HG2 ARG 129 1HG ARG 129 4.804 -13.892 7.036 918 HG3 ARG 129 2HG ARG 129 5.287 -14.693 8.551 919 HD2 ARG 129 1HD ARG 129 3.188 -15.914 8.571 920 HD3 ARG 129 2HD ARG 129 2.711 -15.118 7.053 921 HE ARG 129 HE ARG 129 4.198 -16.452 5.881 922 HH11 ARG 129 1HH1 ARG 129 4.605 -16.920 9.339 923 HH12 ARG 129 1HH2 ARG 129 5.596 -18.349 9.156 924 HH21 ARG 129 2HH1 ARG 129 5.484 -18.310 5.657 925 HH22 ARG 129 2HH2 ARG 129 6.094 -19.138 7.072 926 H THR 130 H THR 130 6.744 -12.228 7.834 927 HA THR 130 HA THR 130 8.173 -13.125 10.301 928 HB THR 130 HB THR 130 9.950 -13.874 8.761 929 HG1 THR 130 1HG THR 130 9.533 -13.703 6.485 930 HG21 THR 130 2HG3 THR 130 7.183 -14.774 7.868 931 HG22 THR 130 2HG1 THR 130 8.705 -15.657 7.602 932 HG23 THR 130 2HG2 THR 130 8.088 -15.423 9.255 933 H MET 131 H MET 131 7.416 -10.289 9.054 934 HA MET 131 HA MET 131 9.957 -8.974 8.691 935 HB2 MET 131 1HB MET 131 7.724 -8.101 7.923 936 HB3 MET 131 2HB MET 131 7.315 -7.777 9.602 937 HG2 MET 131 1HG MET 131 9.225 -6.214 9.759 938 HG3 MET 131 2HG MET 131 9.612 -6.529 8.066 939 HE1 MET 131 3HE MET 131 7.006 -6.619 6.478 940 HE2 MET 131 1HE MET 131 6.722 -4.901 6.107 941 HE3 MET 131 2HE MET 131 8.374 -5.565 6.043 942 H LYS 132 H LYS 132 11.353 -8.046 10.010 943 HA LYS 132 HA LYS 132 11.020 -8.398 12.917 944 HB2 LYS 132 1HB LYS 132 13.235 -8.718 11.878 945 HB3 LYS 132 2HB LYS 132 13.209 -7.069 11.272 946 HG2 LYS 132 1HG LYS 132 13.257 -6.189 13.551 947 HG3 LYS 132 2HG LYS 132 13.183 -7.831 14.206 948 HD2 LYS 132 1HD LYS 132 15.334 -8.369 13.114 949 HD3 LYS 132 2HD LYS 132 15.405 -6.734 12.441 950 HE2 LYS 132 1HE LYS 132 15.462 -5.783 14.711 951 HE3 LYS 132 2HE LYS 132 15.335 -7.400 15.408 952 HZ1 LYS 132 3HZ LYS 132 17.554 -6.433 13.731 953 HZ2 LYS 132 1HZ LYS 132 17.593 -6.631 15.368 954 HZ3 LYS 132 2HZ LYS 132 17.436 -7.944 14.381 955 H ASN 133 H ASN 133 10.601 -6.927 14.421 956 HA ASN 133 HA ASN 133 9.141 -4.566 13.725 957 HB2 ASN 133 1HB ASN 133 9.127 -5.886 15.926 958 HB3 ASN 133 2HB ASN 133 10.588 -4.999 16.339 959 HD21 ASN 133 2HD2 ASN 133 9.435 -4.091 18.101 960 HD22 ASN 133 2HD1 ASN 133 8.338 -2.773 17.856 961 H GLY 134 H GLY 134 9.761 -2.757 12.886 962 HA2 GLY 134 1HA GLY 134 11.024 -0.758 12.799 963 HA3 GLY 134 2HA GLY 134 12.303 -1.531 13.765 964 H ASP 135 H ASP 135 11.151 -3.503 11.238 965 HA ASP 135 HA ASP 135 13.572 -3.537 9.745 966 HB2 ASP 135 1HB ASP 135 11.579 -5.199 9.694 967 HB3 ASP 135 2HB ASP 135 10.825 -4.078 8.568 968 H VAL 136 H VAL 136 14.378 -2.476 8.062 969 HA VAL 136 HA VAL 136 13.151 0.213 7.599 970 HB VAL 136 HB VAL 136 15.888 -0.889 6.807 971 HG11 VAL 136 1HG1 VAL 136 16.488 1.466 6.517 972 HG12 VAL 136 1HG2 VAL 136 15.157 0.979 5.441 973 HG13 VAL 136 1HG3 VAL 136 14.816 1.938 6.902 974 HG21 VAL 136 2HG3 VAL 136 15.610 -0.870 9.262 975 HG22 VAL 136 2HG1 VAL 136 16.746 0.395 8.741 976 HG23 VAL 136 2HG2 VAL 136 15.080 0.828 9.192 977 H MET 137 H MET 137 12.269 0.888 5.842 978 HA MET 137 HA MET 137 12.082 -0.940 3.531 979 HB2 MET 137 1HB MET 137 10.925 1.809 4.104 980 HB3 MET 137 2HB MET 137 10.669 0.937 2.599 981 HG2 MET 137 1HG MET 137 9.592 -0.902 3.866 982 HG3 MET 137 2HG MET 137 9.815 0.014 5.358 983 HE1 MET 137 3HE MET 137 9.007 2.793 5.238 984 HE2 MET 137 1HE MET 137 7.227 2.766 5.277 985 HE3 MET 137 2HE MET 137 8.158 1.625 6.280 986 H LYS 138 H LYS 138 13.494 -1.050 1.991 987 HA LYS 138 HA LYS 138 15.608 0.995 1.833 988 HB2 LYS 138 1HB LYS 138 16.152 -1.424 1.701 989 HB3 LYS 138 2HB LYS 138 15.173 -1.568 0.248 990 HG2 LYS 138 1HG LYS 138 16.679 -0.114 -0.981 991 HG3 LYS 138 2HG LYS 138 17.615 0.213 0.485 992 HD2 LYS 138 1HD LYS 138 18.197 -2.193 0.642 993 HD3 LYS 138 2HD LYS 138 17.278 -2.505 -0.837 994 HE2 LYS 138 1HE LYS 138 18.771 -0.991 -2.093 995 HE3 LYS 138 2HE LYS 138 19.683 -0.657 -0.618 996 HZ1 LYS 138 3HZ LYS 138 19.415 -3.294 -1.899 997 HZ2 LYS 138 1HZ LYS 138 20.746 -2.322 -1.954 998 HZ3 LYS 138 2HZ LYS 138 20.265 -2.983 -0.521 999 H GLU 139 H GLU 139 12.975 -0.212 -0.219 1000 HA GLU 139 HA GLU 139 13.014 2.345 -1.697 1001 HB2 GLU 139 1HB GLU 139 14.620 0.974 -2.978 1002 HB3 GLU 139 2HB GLU 139 13.457 -0.340 -3.069 1003 HG2 GLU 139 1HG GLU 139 11.958 1.044 -4.415 1004 HG3 GLU 139 2HG GLU 139 13.068 2.406 -4.281 1005 H VAL 140 H VAL 140 11.028 2.996 -1.465 1006 HA VAL 140 HA VAL 140 8.816 1.040 -2.087 1007 HB VAL 140 HB VAL 140 8.688 3.688 -0.566 1008 HG11 VAL 140 1HG1 VAL 140 6.425 2.969 0.024 1009 HG12 VAL 140 1HG2 VAL 140 6.633 3.137 -1.736 1010 HG13 VAL 140 1HG3 VAL 140 6.622 1.520 -0.990 1011 HG21 VAL 140 2HG3 VAL 140 9.934 1.980 0.713 1012 HG22 VAL 140 2HG1 VAL 140 8.343 2.290 1.445 1013 HG23 VAL 140 2HG2 VAL 140 8.604 0.825 0.470 1014 H LYS 141 H LYS 141 8.048 1.135 -3.997 1015 HA LYS 141 HA LYS 141 7.863 3.820 -5.317 1016 HB2 LYS 141 1HB LYS 141 8.772 1.216 -6.611 1017 HB3 LYS 141 2HB LYS 141 8.485 2.731 -7.456 1018 HG2 LYS 141 1HG LYS 141 10.548 2.408 -5.261 1019 HG3 LYS 141 2HG LYS 141 10.892 2.207 -6.985 1020 HD2 LYS 141 1HD LYS 141 10.180 4.518 -7.422 1021 HD3 LYS 141 2HD LYS 141 9.754 4.727 -5.718 1022 HE2 LYS 141 1HE LYS 141 11.951 5.713 -6.199 1023 HE3 LYS 141 2HE LYS 141 12.102 4.365 -5.069 1024 HZ1 LYS 141 3HZ LYS 141 12.632 4.234 -7.962 1025 HZ2 LYS 141 1HZ LYS 141 13.771 4.281 -6.770 1026 HZ3 LYS 141 2HZ LYS 141 12.773 2.975 -6.907 1027 H VAL 142 H VAL 142 6.180 4.169 -6.697 1028 HA VAL 142 HA VAL 142 4.151 1.975 -6.985 1029 HB VAL 142 HB VAL 142 3.572 4.859 -6.154 1030 HG11 VAL 142 1HG1 VAL 142 1.241 4.127 -6.019 1031 HG12 VAL 142 1HG2 VAL 142 1.895 3.971 -7.666 1032 HG13 VAL 142 1HG3 VAL 142 1.709 2.527 -6.642 1033 HG21 VAL 142 2HG3 VAL 142 4.464 3.506 -4.288 1034 HG22 VAL 142 2HG1 VAL 142 2.733 3.849 -4.056 1035 HG23 VAL 142 2HG2 VAL 142 3.254 2.245 -4.623 1036 H PHE 143 H PHE 143 3.054 1.879 -8.806 1037 HA PHE 143 HA PHE 143 3.339 4.102 -10.763 1038 HB2 PHE 143 1HB PHE 143 4.007 2.498 -12.543 1039 HB3 PHE 143 2HB PHE 143 5.238 2.656 -11.300 1040 HD1 PHE 143 2HD PHE 143 5.667 0.837 -9.719 1041 HD2 PHE 143 1HD PHE 143 2.791 0.439 -12.854 1042 HE1 PHE 143 2HE PHE 143 5.666 -1.615 -9.404 1043 HE2 PHE 143 1HE PHE 143 2.786 -2.012 -12.539 1044 HZ PHE 143 HZ PHE 143 4.223 -3.039 -10.815 1045 H ASP 144 H ASP 144 2.069 3.615 -12.783 1046 HA ASP 144 HA ASP 144 -0.642 2.891 -11.906 1047 HB2 ASP 144 1HB ASP 144 0.491 3.872 -14.558 1048 HB3 ASP 144 2HB ASP 144 -1.213 3.520 -14.297 1049 H GLU 145 H GLU 145 -1.846 1.196 -12.426 1050 HA GLU 145 HA GLU 145 -0.994 -0.774 -14.411 1051 HB2 GLU 145 1HB GLU 145 0.542 -1.302 -12.509 1052 HB3 GLU 145 2HB GLU 145 -0.850 -1.493 -11.453 1053 HG2 GLU 145 1HG GLU 145 -0.118 -3.658 -12.100 1054 HG3 GLU 145 2HG GLU 145 -1.651 -3.347 -12.912 1055 HA PRO 146 HA PRO 146 -5.558 -0.493 -13.484 1056 HB2 PRO 146 1HB PRO 146 -5.336 -0.791 -16.510 1057 HB3 PRO 146 2HB PRO 146 -6.462 0.213 -15.587 1058 HG2 PRO 146 1HG PRO 146 -4.423 1.408 -16.806 1059 HG3 PRO 146 2HG PRO 146 -4.830 1.895 -15.158 1060 HD2 PRO 146 1HD PRO 146 -2.618 0.040 -16.120 1061 HD3 PRO 146 2HD PRO 146 -2.555 1.325 -14.848 Start of MODEL 13 1 H MET 1 1H MET 1 -6.647 2.890 -16.986 2 HA MET 1 HA MET 1 -4.622 1.142 -16.282 3 HB2 MET 1 1HB MET 1 -5.106 4.084 -15.682 4 HB3 MET 1 2HB MET 1 -3.573 3.248 -15.481 5 HG2 MET 1 1HG MET 1 -5.038 3.623 -18.110 6 HG3 MET 1 2HG MET 1 -3.655 4.567 -17.550 7 HE1 MET 1 3HE MET 1 -1.726 2.512 -16.220 8 HE2 MET 1 1HE MET 1 -0.734 2.004 -17.609 9 HE3 MET 1 2HE MET 1 -1.203 3.713 -17.426 10 H ALA 2 H ALA 2 -3.864 0.364 -14.443 11 HA ALA 2 HA ALA 2 -5.422 1.007 -11.971 12 HB1 ALA 2 3HB ALA 2 -3.902 -1.529 -12.678 13 HB2 ALA 2 1HB ALA 2 -4.746 -1.218 -11.143 14 HB3 ALA 2 2HB ALA 2 -5.670 -1.339 -12.660 15 H LYS 3 H LYS 3 -4.255 0.945 -9.950 16 HA LYS 3 HA LYS 3 -1.438 1.912 -10.308 17 HB2 LYS 3 1HB LYS 3 -3.513 2.561 -8.180 18 HB3 LYS 3 2HB LYS 3 -1.825 3.041 -8.085 19 HG2 LYS 3 1HG LYS 3 -2.123 4.306 -10.233 20 HG3 LYS 3 2HG LYS 3 -3.847 3.917 -10.162 21 HD2 LYS 3 1HD LYS 3 -4.080 5.089 -8.041 22 HD3 LYS 3 2HD LYS 3 -2.333 5.363 -7.959 23 HE2 LYS 3 1HE LYS 3 -4.163 6.447 -10.131 24 HE3 LYS 3 2HE LYS 3 -3.595 7.365 -8.734 25 HZ1 LYS 3 3HZ LYS 3 -1.877 6.182 -10.812 26 HZ2 LYS 3 1HZ LYS 3 -2.257 7.780 -10.665 27 HZ3 LYS 3 2HZ LYS 3 -1.346 7.038 -9.507 28 H LYS 4 H LYS 4 0.198 1.057 -9.222 29 HA LYS 4 HA LYS 4 -0.299 -0.760 -6.951 30 HB2 LYS 4 1HB LYS 4 0.823 -2.672 -7.934 31 HB3 LYS 4 2HB LYS 4 -0.554 -2.244 -8.940 32 HG2 LYS 4 1HG LYS 4 1.027 -1.024 -10.472 33 HG3 LYS 4 2HG LYS 4 2.365 -1.662 -9.506 34 HD2 LYS 4 1HD LYS 4 0.254 -3.424 -10.799 35 HD3 LYS 4 2HD LYS 4 1.783 -3.000 -11.582 36 HE2 LYS 4 1HE LYS 4 3.049 -4.046 -9.778 37 HE3 LYS 4 2HE LYS 4 1.566 -4.363 -8.873 38 HZ1 LYS 4 3HZ LYS 4 2.243 -5.513 -11.499 39 HZ2 LYS 4 1HZ LYS 4 2.312 -6.298 -10.050 40 HZ3 LYS 4 2HZ LYS 4 0.857 -5.807 -10.654 41 H GLY 5 H GLY 5 1.932 -1.819 -6.356 42 HA2 GLY 5 1HA GLY 5 4.315 -0.357 -6.997 43 HA3 GLY 5 2HA GLY 5 3.629 0.240 -5.469 44 H TYR 6 H TYR 6 5.904 -0.651 -4.906 45 HA TYR 6 HA TYR 6 5.446 -3.209 -3.523 46 HB2 TYR 6 1HB TYR 6 7.402 -4.332 -4.428 47 HB3 TYR 6 2HB TYR 6 6.293 -3.948 -5.737 48 HD1 TYR 6 1HD TYR 6 9.506 -3.081 -4.152 49 HD2 TYR 6 2HD TYR 6 6.874 -2.391 -7.468 50 HE1 TYR 6 1HE TYR 6 11.328 -1.927 -5.359 51 HE2 TYR 6 2HE TYR 6 8.696 -1.237 -8.676 52 HH TYR 6 HH TYR 6 11.921 -0.869 -7.220 53 H ILE 7 H ILE 7 7.012 -3.698 -1.930 54 HA ILE 7 HA ILE 7 8.757 -1.357 -1.199 55 HB ILE 7 HB ILE 7 7.317 -3.354 0.620 56 HG12 ILE 7 1HG1 ILE 7 6.927 -0.367 0.316 57 HG13 ILE 7 1HG2 ILE 7 5.861 -1.600 -0.340 58 HG21 ILE 7 2HG1 ILE 7 8.281 -2.042 2.467 59 HG22 ILE 7 2HG2 ILE 7 9.559 -2.768 1.464 60 HG23 ILE 7 2HG3 ILE 7 9.170 -1.040 1.297 61 HD11 ILE 7 1HD3 ILE 7 6.457 -1.162 2.595 62 HD12 ILE 7 1HD1 ILE 7 4.975 -0.689 1.732 63 HD13 ILE 7 1HD2 ILE 7 5.380 -2.411 1.929 64 H LEU 8 H LEU 8 10.721 -1.746 -1.756 65 HA LEU 8 HA LEU 8 11.866 -4.448 -1.413 66 HB2 LEU 8 1HB LEU 8 12.569 -3.113 -3.343 67 HB3 LEU 8 2HB LEU 8 13.051 -1.782 -2.287 68 HG LEU 8 HG LEU 8 14.831 -3.253 -1.320 69 HD11 LEU 8 1HD1 LEU 8 15.387 -5.332 -2.501 70 HD12 LEU 8 1HD2 LEU 8 13.767 -5.405 -1.768 71 HD13 LEU 8 1HD3 LEU 8 13.941 -5.140 -3.519 72 HD21 LEU 8 2HD3 LEU 8 15.293 -1.664 -3.158 73 HD22 LEU 8 2HD1 LEU 8 16.285 -3.134 -3.316 74 HD23 LEU 8 2HD2 LEU 8 14.851 -2.912 -4.347 75 H MET 9 H MET 9 12.486 -5.180 0.444 76 HA MET 9 HA MET 9 13.035 -3.328 2.672 77 HB2 MET 9 1HB MET 9 13.146 -6.364 2.529 78 HB3 MET 9 2HB MET 9 13.260 -5.398 3.994 79 HG2 MET 9 1HG MET 9 10.850 -5.574 2.163 80 HG3 MET 9 2HG MET 9 11.035 -6.360 3.733 81 HE1 MET 9 3HE MET 9 12.363 -4.264 5.596 82 HE2 MET 9 1HE MET 9 10.944 -3.408 6.247 83 HE3 MET 9 2HE MET 9 10.897 -5.175 6.032 84 H GLU 10 H GLU 10 14.908 -3.384 3.973 85 HA GLU 10 HA GLU 10 17.325 -3.125 2.456 86 HB2 GLU 10 1HB GLU 10 16.729 -2.081 4.743 87 HB3 GLU 10 2HB GLU 10 17.161 -3.632 5.448 88 HG2 GLU 10 1HG GLU 10 19.011 -2.095 5.608 89 HG3 GLU 10 2HG GLU 10 19.429 -3.432 4.537 90 H ASN 11 H ASN 11 15.825 -5.866 3.977 91 HA ASN 11 HA ASN 11 18.327 -7.457 3.819 92 HB2 ASN 11 1HB ASN 11 15.539 -8.122 4.806 93 HB3 ASN 11 2HB ASN 11 16.882 -9.258 4.777 94 HD21 ASN 11 2HD2 ASN 11 15.209 -7.211 6.696 95 HD22 ASN 11 2HD1 ASN 11 16.415 -6.862 7.889 96 H GLY 12 H GLY 12 16.061 -6.481 1.661 97 HA2 GLY 12 1HA GLY 12 16.042 -7.159 -0.601 98 HA3 GLY 12 2HA GLY 12 16.808 -8.698 -0.139 99 H GLY 13 H GLY 13 14.290 -7.974 1.966 100 HA2 GLY 13 1HA GLY 13 12.647 -10.125 0.851 101 HA3 GLY 13 2HA GLY 13 12.353 -9.223 2.356 102 H LYS 14 H LYS 14 12.404 -8.715 -1.194 103 HA LYS 14 HA LYS 14 10.727 -6.350 -1.038 104 HB2 LYS 14 1HB LYS 14 12.409 -6.901 -2.875 105 HB3 LYS 14 2HB LYS 14 11.262 -8.094 -3.470 106 HG2 LYS 14 1HG LYS 14 9.608 -6.357 -3.898 107 HG3 LYS 14 2HG LYS 14 10.671 -5.133 -3.191 108 HD2 LYS 14 1HD LYS 14 11.162 -4.853 -5.429 109 HD3 LYS 14 2HD LYS 14 12.392 -6.048 -4.991 110 HE2 LYS 14 1HE LYS 14 10.940 -7.864 -5.812 111 HE3 LYS 14 2HE LYS 14 9.686 -6.689 -6.222 112 HZ1 LYS 14 3HZ LYS 14 12.382 -6.787 -7.400 113 HZ2 LYS 14 1HZ LYS 14 10.991 -7.287 -8.127 114 HZ3 LYS 14 2HZ LYS 14 11.212 -5.690 -7.780 115 H ILE 15 H ILE 15 8.644 -6.129 -0.910 116 HA ILE 15 HA ILE 15 6.910 -8.451 -1.724 117 HB ILE 15 HB ILE 15 5.324 -7.774 0.018 118 HG12 ILE 15 1HG1 ILE 15 6.400 -5.956 1.680 119 HG13 ILE 15 1HG2 ILE 15 7.082 -5.383 0.166 120 HG21 ILE 15 2HG1 ILE 15 6.640 -8.239 2.047 121 HG22 ILE 15 2HG2 ILE 15 7.124 -9.310 0.712 122 HG23 ILE 15 2HG3 ILE 15 8.143 -7.919 1.150 123 HD11 ILE 15 1HD3 ILE 15 4.140 -5.821 0.723 124 HD12 ILE 15 1HD1 ILE 15 4.986 -4.258 0.664 125 HD13 ILE 15 1HD2 ILE 15 4.833 -5.243 -0.811 126 H GLU 16 H GLU 16 4.826 -7.983 -2.498 127 HA GLU 16 HA GLU 16 4.828 -5.390 -4.012 128 HB2 GLU 16 1HB GLU 16 5.557 -7.290 -5.454 129 HB3 GLU 16 2HB GLU 16 4.084 -8.159 -5.048 130 HG2 GLU 16 1HG GLU 16 2.734 -6.429 -6.124 131 HG3 GLU 16 2HG GLU 16 4.185 -5.495 -6.479 132 H PHE 17 H PHE 17 2.954 -4.361 -4.330 133 HA PHE 17 HA PHE 17 0.465 -5.603 -3.264 134 HB2 PHE 17 1HB PHE 17 0.002 -3.682 -1.835 135 HB3 PHE 17 2HB PHE 17 1.530 -4.402 -1.353 136 HD1 PHE 17 1HD PHE 17 -0.035 -1.540 -3.069 137 HD2 PHE 17 2HD PHE 17 3.592 -3.211 -1.551 138 HE1 PHE 17 1HE PHE 17 1.075 0.656 -3.308 139 HE2 PHE 17 2HE PHE 17 4.704 -1.016 -1.786 140 HZ PHE 17 HZ PHE 17 3.445 0.918 -2.667 141 H GLU 18 H GLU 18 -1.460 -4.328 -3.699 142 HA GLU 18 HA GLU 18 -1.120 -2.585 -6.118 143 HB2 GLU 18 1HB GLU 18 -3.288 -4.646 -5.539 144 HB3 GLU 18 2HB GLU 18 -3.360 -3.477 -6.849 145 HG2 GLU 18 1HG GLU 18 -1.298 -4.454 -7.810 146 HG3 GLU 18 2HG GLU 18 -1.280 -5.650 -6.516 147 H LEU 19 H LEU 19 -2.787 -1.030 -6.489 148 HA LEU 19 HA LEU 19 -3.830 -0.006 -3.869 149 HB2 LEU 19 1HB LEU 19 -2.887 1.541 -6.319 150 HB3 LEU 19 2HB LEU 19 -3.538 2.256 -4.841 151 HG LEU 19 HG LEU 19 -0.964 0.650 -4.989 152 HD11 LEU 19 1HD1 LEU 19 0.145 2.828 -4.763 153 HD12 LEU 19 1HD2 LEU 19 -0.805 2.726 -6.264 154 HD13 LEU 19 1HD3 LEU 19 -1.433 3.642 -4.874 155 HD21 LEU 19 2HD3 LEU 19 -2.100 0.597 -2.793 156 HD22 LEU 19 2HD1 LEU 19 -0.616 1.577 -2.723 157 HD23 LEU 19 2HD2 LEU 19 -2.205 2.374 -2.805 158 H PHE 20 H PHE 20 -5.707 1.348 -3.939 159 HA PHE 20 HA PHE 20 -7.512 0.718 -6.248 160 HB2 PHE 20 1HB PHE 20 -8.275 0.623 -3.298 161 HB3 PHE 20 2HB PHE 20 -9.350 0.337 -4.659 162 HD1 PHE 20 2HD PHE 20 -8.639 -1.602 -6.278 163 HD2 PHE 20 1HD PHE 20 -7.253 -1.168 -2.262 164 HE1 PHE 20 2HE PHE 20 -8.084 -4.010 -6.213 165 HE2 PHE 20 1HE PHE 20 -6.693 -3.576 -2.193 166 HZ PHE 20 HZ PHE 20 -7.109 -4.996 -4.169 167 HA PRO 21 HA PRO 21 -7.547 5.246 -5.415 168 HB2 PRO 21 1HB PRO 21 -7.571 5.898 -8.105 169 HB3 PRO 21 2HB PRO 21 -6.054 5.606 -7.246 170 HG2 PRO 21 1HG PRO 21 -7.670 3.685 -8.974 171 HG3 PRO 21 2HG PRO 21 -5.935 4.009 -9.027 172 HD2 PRO 21 1HD PRO 21 -6.866 1.846 -7.710 173 HD3 PRO 21 2HD PRO 21 -5.494 2.808 -7.028 174 H ASN 22 H ASN 22 -9.441 2.922 -7.122 175 HA ASN 22 HA ASN 22 -11.722 4.703 -7.537 176 HB2 ASN 22 1HB ASN 22 -11.409 1.693 -7.572 177 HB3 ASN 22 2HB ASN 22 -12.939 2.511 -7.856 178 HD21 ASN 22 2HD2 ASN 22 -11.617 0.830 -9.698 179 HD22 ASN 22 2HD1 ASN 22 -11.185 1.785 -11.078 180 H GLU 23 H GLU 23 -10.439 2.904 -4.878 181 HA GLU 23 HA GLU 23 -13.021 3.139 -3.397 182 HB2 GLU 23 1HB GLU 23 -10.423 1.700 -2.710 183 HB3 GLU 23 2HB GLU 23 -11.858 1.727 -1.694 184 HG2 GLU 23 1HG GLU 23 -11.625 0.503 -4.450 185 HG3 GLU 23 2HG GLU 23 -11.706 -0.356 -2.914 186 H ALA 24 H ALA 24 -9.700 4.307 -3.425 187 HA ALA 24 HA ALA 24 -10.588 6.489 -1.631 188 HB1 ALA 24 3HB ALA 24 -8.105 4.812 -1.122 189 HB2 ALA 24 1HB ALA 24 -8.554 6.294 -0.248 190 HB3 ALA 24 2HB ALA 24 -9.573 4.840 -0.119 191 HA PRO 25 HA PRO 25 -8.348 7.886 -5.421 192 HB2 PRO 25 1HB PRO 25 -10.103 10.251 -4.599 193 HB3 PRO 25 2HB PRO 25 -9.773 9.646 -6.228 194 HG2 PRO 25 1HG PRO 25 -12.129 9.080 -5.135 195 HG3 PRO 25 2HG PRO 25 -11.267 7.804 -6.000 196 HD2 PRO 25 1HD PRO 25 -11.498 8.276 -3.008 197 HD3 PRO 25 2HD PRO 25 -11.524 6.717 -3.925 198 H VAL 26 H VAL 26 -9.121 9.871 -2.545 199 HA VAL 26 HA VAL 26 -6.851 11.637 -2.983 200 HB VAL 26 HB VAL 26 -8.540 11.064 -0.500 201 HG11 VAL 26 1HG1 VAL 26 -7.660 13.174 0.372 202 HG12 VAL 26 1HG2 VAL 26 -6.374 11.971 0.117 203 HG13 VAL 26 1HG3 VAL 26 -6.584 13.307 -1.039 204 HG21 VAL 26 2HG3 VAL 26 -9.823 11.986 -2.399 205 HG22 VAL 26 2HG1 VAL 26 -9.661 13.187 -1.096 206 HG23 VAL 26 2HG2 VAL 26 -8.646 13.313 -2.553 207 H THR 27 H THR 27 -7.362 8.896 -0.768 208 HA THR 27 HA THR 27 -4.827 9.263 0.554 209 HB THR 27 HB THR 27 -6.569 6.767 0.336 210 HG1 THR 27 1HG THR 27 -6.421 8.798 2.343 211 HG21 THR 27 2HG3 THR 27 -4.371 7.519 2.301 212 HG22 THR 27 2HG1 THR 27 -5.390 6.063 2.382 213 HG23 THR 27 2HG2 THR 27 -4.250 6.278 1.033 214 H VAL 28 H VAL 28 -5.853 7.180 -2.134 215 HA VAL 28 HA VAL 28 -3.295 5.837 -2.424 216 HB VAL 28 HB VAL 28 -5.573 6.368 -4.391 217 HG11 VAL 28 1HG1 VAL 28 -4.567 4.626 -5.784 218 HG12 VAL 28 1HG2 VAL 28 -3.491 6.031 -5.593 219 HG13 VAL 28 1HG3 VAL 28 -3.181 4.539 -4.673 220 HG21 VAL 28 2HG3 VAL 28 -6.184 4.952 -2.462 221 HG22 VAL 28 2HG1 VAL 28 -6.127 3.995 -3.961 222 HG23 VAL 28 2HG2 VAL 28 -4.789 3.897 -2.791 223 H ALA 29 H ALA 29 -4.678 8.716 -3.981 224 HA ALA 29 HA ALA 29 -2.502 9.191 -5.736 225 HB1 ALA 29 3HB ALA 29 -4.328 11.196 -4.362 226 HB2 ALA 29 1HB ALA 29 -3.299 11.527 -5.775 227 HB3 ALA 29 2HB ALA 29 -4.648 10.374 -5.907 228 H ASN 30 H ASN 30 -3.051 10.358 -2.407 229 HA ASN 30 HA ASN 30 -0.562 11.865 -2.351 230 HB2 ASN 30 1HB ASN 30 -2.597 11.046 -0.282 231 HB3 ASN 30 2HB ASN 30 -1.079 11.802 0.183 232 HD21 ASN 30 2HD2 ASN 30 -4.242 12.330 -0.766 233 HD22 ASN 30 2HD1 ASN 30 -4.129 14.017 -1.139 234 H PHE 31 H PHE 31 -1.529 8.612 -1.388 235 HA PHE 31 HA PHE 31 0.893 7.867 -0.064 236 HB2 PHE 31 1HB PHE 31 -1.170 6.472 -0.084 237 HB3 PHE 31 2HB PHE 31 -0.962 6.185 -1.805 238 HD1 PHE 31 1HD PHE 31 0.486 5.553 1.537 239 HD2 PHE 31 2HD PHE 31 0.558 4.551 -2.615 240 HE1 PHE 31 1HE PHE 31 1.897 3.586 2.038 241 HE2 PHE 31 2HE PHE 31 1.967 2.580 -2.118 242 HZ PHE 31 HZ PHE 31 2.637 2.100 0.211 243 H GLU 32 H GLU 32 -0.013 7.621 -3.511 244 HA GLU 32 HA GLU 32 2.495 6.629 -4.436 245 HB2 GLU 32 1HB GLU 32 0.462 6.711 -5.845 246 HB3 GLU 32 2HB GLU 32 0.495 8.469 -5.816 247 HG2 GLU 32 1HG GLU 32 2.613 8.481 -7.028 248 HG3 GLU 32 2HG GLU 32 2.659 6.720 -7.002 249 H LYS 33 H LYS 33 1.365 9.983 -4.023 250 HA LYS 33 HA LYS 33 3.738 11.235 -5.005 251 HB2 LYS 33 1HB LYS 33 1.665 12.141 -2.973 252 HB3 LYS 33 2HB LYS 33 2.972 13.169 -3.542 253 HG2 LYS 33 1HG LYS 33 2.127 13.000 -5.845 254 HG3 LYS 33 2HG LYS 33 0.823 11.939 -5.291 255 HD2 LYS 33 1HD LYS 33 -0.012 13.746 -3.813 256 HD3 LYS 33 2HD LYS 33 1.283 14.806 -4.387 257 HE2 LYS 33 1HE LYS 33 0.403 14.615 -6.697 258 HE3 LYS 33 2HE LYS 33 -0.900 13.578 -6.112 259 HZ1 LYS 33 3HZ LYS 33 -0.442 16.369 -5.297 260 HZ2 LYS 33 1HZ LYS 33 -1.609 15.844 -6.336 261 HZ3 LYS 33 2HZ LYS 33 -1.659 15.401 -4.748 262 H LEU 34 H LEU 34 2.851 10.198 -1.718 263 HA LEU 34 HA LEU 34 5.192 11.133 -0.404 264 HB2 LEU 34 1HB LEU 34 3.360 8.760 0.086 265 HB3 LEU 34 2HB LEU 34 4.720 9.132 1.151 266 HG LEU 34 HG LEU 34 2.486 11.106 0.585 267 HD11 LEU 34 1HD1 LEU 34 1.531 10.389 2.730 268 HD12 LEU 34 1HD2 LEU 34 1.539 9.067 1.540 269 HD13 LEU 34 1HD3 LEU 34 2.751 9.099 2.843 270 HD21 LEU 34 2HD3 LEU 34 4.618 12.028 1.434 271 HD22 LEU 34 2HD1 LEU 34 3.338 12.130 2.668 272 HD23 LEU 34 2HD2 LEU 34 4.585 10.864 2.780 273 H ALA 35 H ALA 35 4.575 7.967 -1.933 274 HA ALA 35 HA ALA 35 7.150 6.887 -1.391 275 HB1 ALA 35 3HB ALA 35 5.273 6.323 -3.715 276 HB2 ALA 35 1HB ALA 35 6.645 5.306 -3.217 277 HB3 ALA 35 2HB ALA 35 5.252 5.514 -2.130 278 H ASN 36 H ASN 36 5.948 8.782 -4.149 279 HA ASN 36 HA ASN 36 8.351 8.567 -5.717 280 HB2 ASN 36 1HB ASN 36 6.071 10.551 -5.687 281 HB3 ASN 36 2HB ASN 36 7.429 10.691 -6.794 282 HD21 ASN 36 2HD2 ASN 36 4.775 10.353 -7.606 283 HD22 ASN 36 2HD1 ASN 36 4.631 8.819 -8.395 284 H GLU 37 H GLU 37 7.369 10.747 -3.133 285 HA GLU 37 HA GLU 37 9.800 12.402 -3.537 286 HB2 GLU 37 1HB GLU 37 7.550 12.584 -1.487 287 HB3 GLU 37 2HB GLU 37 8.867 13.736 -1.652 288 HG2 GLU 37 1HG GLU 37 6.857 13.135 -3.831 289 HG3 GLU 37 2HG GLU 37 6.705 14.450 -2.667 290 H GLY 38 H GLY 38 9.239 9.474 -2.203 291 HA2 GLY 38 1HA GLY 38 10.883 8.179 -1.183 292 HA3 GLY 38 2HA GLY 38 11.885 9.637 -0.997 293 H PHE 39 H PHE 39 8.609 9.751 0.128 294 HA PHE 39 HA PHE 39 9.483 10.164 2.887 295 HB2 PHE 39 1HB PHE 39 6.806 10.088 1.466 296 HB3 PHE 39 2HB PHE 39 6.888 10.109 3.221 297 HD1 PHE 39 2HD PHE 39 8.294 12.009 4.298 298 HD2 PHE 39 1HD PHE 39 6.857 12.076 0.275 299 HE1 PHE 39 2HE PHE 39 8.521 14.471 4.260 300 HE2 PHE 39 1HE PHE 39 7.084 14.537 0.233 301 HZ PHE 39 HZ PHE 39 7.916 15.735 2.226 302 H TYR 40 H TYR 40 8.772 7.422 1.018 303 HA TYR 40 HA TYR 40 8.529 5.814 3.541 304 HB2 TYR 40 1HB TYR 40 7.779 5.111 0.677 305 HB3 TYR 40 2HB TYR 40 7.748 3.980 2.022 306 HD1 TYR 40 2HD TYR 40 6.454 5.092 4.193 307 HD2 TYR 40 1HD TYR 40 5.733 5.922 0.046 308 HE1 TYR 40 2HE TYR 40 4.148 5.797 4.736 309 HE2 TYR 40 1HE TYR 40 3.427 6.627 0.589 310 HH TYR 40 HH TYR 40 2.338 6.962 3.908 311 H ASN 41 H ASN 41 10.872 7.029 1.803 312 HA ASN 41 HA ASN 41 12.379 4.483 1.389 313 HB2 ASN 41 1HB ASN 41 12.272 6.134 -0.472 314 HB3 ASN 41 2HB ASN 41 13.073 7.314 0.557 315 HD21 ASN 41 2HD2 ASN 41 13.553 5.090 -1.809 316 HD22 ASN 41 2HD1 ASN 41 15.233 4.754 -1.562 317 H GLY 42 H GLY 42 13.645 3.749 2.877 318 HA2 GLY 42 1HA GLY 42 15.481 3.844 4.355 319 HA3 GLY 42 2HA GLY 42 15.359 5.619 4.383 320 H LEU 43 H LEU 43 12.306 4.298 4.750 321 HA LEU 43 HA LEU 43 12.277 4.984 7.617 322 HB2 LEU 43 1HB LEU 43 10.250 4.400 5.479 323 HB3 LEU 43 2HB LEU 43 9.782 4.112 7.157 324 HG LEU 43 HG LEU 43 10.399 6.515 7.651 325 HD11 LEU 43 1HD1 LEU 43 10.590 8.036 5.734 326 HD12 LEU 43 1HD2 LEU 43 11.917 6.852 5.768 327 HD13 LEU 43 1HD3 LEU 43 10.568 6.644 4.627 328 HD21 LEU 43 2HD3 LEU 43 8.072 5.764 7.281 329 HD22 LEU 43 2HD1 LEU 43 8.331 7.398 6.625 330 HD23 LEU 43 2HD2 LEU 43 8.276 5.997 5.528 331 H THR 44 H THR 44 11.117 3.600 9.164 332 HA THR 44 HA THR 44 11.662 0.695 8.641 333 HB THR 44 HB THR 44 12.258 0.424 10.995 334 HG1 THR 44 1HG THR 44 12.398 2.322 12.322 335 HG21 THR 44 2HG3 THR 44 13.746 2.773 9.761 336 HG22 THR 44 2HG1 THR 44 14.350 1.724 11.063 337 HG23 THR 44 2HG2 THR 44 14.070 1.054 9.438 338 H PHE 45 H PHE 45 10.398 -0.795 9.932 339 HA PHE 45 HA PHE 45 7.602 0.129 10.233 340 HB2 PHE 45 1HB PHE 45 8.993 -2.564 10.408 341 HB3 PHE 45 2HB PHE 45 7.333 -2.355 10.942 342 HD1 PHE 45 1HD PHE 45 9.588 -2.416 8.056 343 HD2 PHE 45 2HD PHE 45 5.547 -1.929 9.355 344 HE1 PHE 45 1HE PHE 45 8.804 -2.727 5.731 345 HE2 PHE 45 2HE PHE 45 4.760 -2.242 7.033 346 HZ PHE 45 HZ PHE 45 6.390 -2.639 5.220 347 H HIS 46 H HIS 46 6.867 1.008 11.984 348 HA HIS 46 HA HIS 46 8.422 1.342 14.331 349 HB2 HIS 46 1HB HIS 46 6.545 2.833 13.770 350 HB3 HIS 46 2HB HIS 46 5.403 1.509 13.950 351 HD2 HIS 46 2HD HIS 46 4.421 1.186 16.494 352 HE1 HIS 46 1HE HIS 46 7.163 3.790 18.461 353 H ARG 47 H ARG 47 5.779 -0.961 13.690 354 HA ARG 47 HA ARG 47 6.934 -2.855 15.600 355 HB2 ARG 47 1HB ARG 47 5.618 -1.239 17.051 356 HB3 ARG 47 2HB ARG 47 4.174 -1.710 16.168 357 HG2 ARG 47 1HG ARG 47 4.372 -3.995 16.961 358 HG3 ARG 47 2HG ARG 47 5.912 -3.607 17.765 359 HD2 ARG 47 1HD ARG 47 4.792 -2.048 19.216 360 HD3 ARG 47 2HD ARG 47 3.251 -2.345 18.380 361 HE ARG 47 HE ARG 47 4.135 -4.834 19.220 362 HH11 ARG 47 1HH1 ARG 47 3.326 -1.771 20.738 363 HH12 ARG 47 1HH2 ARG 47 2.795 -2.510 22.232 364 HH21 ARG 47 2HH1 ARG 47 3.444 -5.780 21.164 365 HH22 ARG 47 2HH2 ARG 47 2.861 -4.779 22.475 366 H VAL 48 H VAL 48 6.788 -4.721 14.671 367 HA VAL 48 HA VAL 48 4.410 -5.302 12.919 368 HB VAL 48 HB VAL 48 7.086 -6.756 13.165 369 HG11 VAL 48 1HG1 VAL 48 6.392 -7.897 11.115 370 HG12 VAL 48 1HG2 VAL 48 5.266 -8.198 12.460 371 HG13 VAL 48 1HG3 VAL 48 4.829 -7.049 11.173 372 HG21 VAL 48 2HG3 VAL 48 7.371 -4.493 12.216 373 HG22 VAL 48 2HG1 VAL 48 7.609 -5.740 10.970 374 HG23 VAL 48 2HG2 VAL 48 6.084 -4.824 11.033 375 H ILE 49 H ILE 49 2.833 -6.389 13.674 376 HA ILE 49 HA ILE 49 3.412 -8.454 15.786 377 HB ILE 49 HB ILE 49 0.838 -6.865 15.321 378 HG12 ILE 49 1HG1 ILE 49 2.782 -6.622 17.625 379 HG13 ILE 49 1HG2 ILE 49 2.747 -5.528 16.251 380 HG21 ILE 49 2HG1 ILE 49 0.107 -7.917 17.424 381 HG22 ILE 49 2HG2 ILE 49 0.467 -9.143 16.187 382 HG23 ILE 49 2HG3 ILE 49 1.629 -8.835 17.498 383 HD11 ILE 49 1HD3 ILE 49 0.467 -6.010 18.183 384 HD12 ILE 49 1HD1 ILE 49 1.543 -4.594 18.145 385 HD13 ILE 49 1HD2 ILE 49 0.432 -4.904 16.789 386 HA PRO 50 HA PRO 50 2.327 -11.020 12.257 387 HB2 PRO 50 1HB PRO 50 3.180 -12.988 14.426 388 HB3 PRO 50 2HB PRO 50 3.628 -12.979 12.715 389 HG2 PRO 50 1HG PRO 50 5.430 -12.159 14.493 390 HG3 PRO 50 2HG PRO 50 5.231 -11.242 12.996 391 HD2 PRO 50 1HD PRO 50 4.155 -10.636 15.776 392 HD3 PRO 50 2HD PRO 50 4.868 -9.506 14.556 393 H GLY 51 H GLY 51 0.372 -11.523 11.845 394 HA2 GLY 51 1HA GLY 51 -1.592 -12.795 12.090 395 HA3 GLY 51 2HA GLY 51 -1.135 -13.165 13.769 396 H PHE 52 H PHE 52 -0.756 -9.878 13.131 397 HA PHE 52 HA PHE 52 -3.606 -9.205 13.717 398 HB2 PHE 52 1HB PHE 52 -2.300 -9.219 15.876 399 HB3 PHE 52 2HB PHE 52 -1.223 -8.011 15.194 400 HD1 PHE 52 1HD PHE 52 -4.697 -7.769 14.211 401 HD2 PHE 52 2HD PHE 52 -1.833 -6.609 17.161 402 HE1 PHE 52 1HE PHE 52 -6.217 -5.979 14.980 403 HE2 PHE 52 2HE PHE 52 -3.352 -4.819 17.935 404 HZ PHE 52 HZ PHE 52 -5.545 -4.503 16.842 405 H VAL 53 H VAL 53 -0.834 -7.043 13.824 406 HA VAL 53 HA VAL 53 -1.355 -6.079 11.055 407 HB VAL 53 HB VAL 53 -1.562 -3.732 11.862 408 HG11 VAL 53 1HG1 VAL 53 -3.874 -3.843 12.654 409 HG12 VAL 53 1HG2 VAL 53 -3.579 -4.959 11.300 410 HG13 VAL 53 1HG3 VAL 53 -3.683 -5.585 12.963 411 HG21 VAL 53 2HG3 VAL 53 -0.438 -4.037 14.042 412 HG22 VAL 53 2HG1 VAL 53 -2.050 -3.314 14.251 413 HG23 VAL 53 2HG2 VAL 53 -1.798 -5.039 14.603 414 H SER 54 H SER 54 0.243 -4.851 10.147 415 HA SER 54 HA SER 54 2.831 -4.679 11.724 416 HB2 SER 54 1HB SER 54 3.060 -6.152 9.932 417 HB3 SER 54 2HB SER 54 2.389 -4.984 8.804 418 HG SER 54 HG SER 54 4.637 -4.991 8.826 419 H GLN 55 H GLN 55 3.020 -2.647 12.500 420 HA GLN 55 HA GLN 55 1.804 -0.408 10.950 421 HB2 GLN 55 1HB GLN 55 1.165 -0.684 13.355 422 HB3 GLN 55 2HB GLN 55 2.852 -0.495 13.811 423 HG2 GLN 55 1HG GLN 55 2.877 1.778 12.961 424 HG3 GLN 55 2HG GLN 55 1.197 1.596 12.383 425 HE21 GLN 55 2HE2 GLN 55 1.577 3.688 13.952 426 HE22 GLN 55 2HE1 GLN 55 0.979 3.417 15.556 427 H GLY 56 H GLY 56 2.924 0.995 9.863 428 HA2 GLY 56 1HA GLY 56 5.830 0.732 9.758 429 HA3 GLY 56 2HA GLY 56 4.821 1.843 8.803 430 H GLY 57 H GLY 57 7.243 2.671 9.846 431 HA2 GLY 57 1HA GLY 57 6.648 4.190 12.316 432 HA3 GLY 57 2HA GLY 57 8.221 4.066 11.495 433 H CYS 58 H CYS 58 8.839 6.037 10.908 434 HA CYS 58 HA CYS 58 7.161 7.673 9.073 435 HB2 CYS 58 1HB CYS 58 7.004 9.593 10.370 436 HB3 CYS 58 2HB CYS 58 6.182 8.262 11.172 437 HG CYS 58 HG CYS 58 8.280 7.698 12.725 438 HA PRO 59 HA PRO 59 11.089 9.076 7.652 439 HB2 PRO 59 1HB PRO 59 9.904 11.874 7.903 440 HB3 PRO 59 2HB PRO 59 10.680 11.134 6.498 441 HG2 PRO 59 1HG PRO 59 8.033 11.362 6.487 442 HG3 PRO 59 2HG PRO 59 8.755 9.848 5.933 443 HD2 PRO 59 1HD PRO 59 7.494 10.499 8.626 444 HD3 PRO 59 2HD PRO 59 7.325 9.006 7.619 445 H ARG 60 H ARG 60 9.629 10.648 10.434 446 HA ARG 60 HA ARG 60 12.141 11.910 11.252 447 HB2 ARG 60 1HB ARG 60 9.524 11.433 12.730 448 HB3 ARG 60 2HB ARG 60 10.870 12.365 13.366 449 HG2 ARG 60 1HG ARG 60 9.435 13.071 10.798 450 HG3 ARG 60 2HG ARG 60 8.992 13.709 12.400 451 HD2 ARG 60 1HD ARG 60 11.671 13.997 11.061 452 HD3 ARG 60 2HD ARG 60 10.409 15.246 11.174 453 HE ARG 60 HE ARG 60 12.206 14.331 13.286 454 HH11 ARG 60 1HH1 ARG 60 9.296 16.116 12.460 455 HH12 ARG 60 1HH2 ARG 60 9.303 17.056 13.936 456 HH21 ARG 60 2HH1 ARG 60 12.206 15.557 15.196 457 HH22 ARG 60 2HH2 ARG 60 10.951 16.741 15.485 458 H GLY 61 H GLY 61 10.596 8.835 11.739 459 HA2 GLY 61 1HA GLY 61 11.446 6.915 12.738 460 HA3 GLY 61 2HA GLY 61 12.957 7.794 13.073 461 H ASN 62 H ASN 62 10.117 9.397 14.109 462 HA ASN 62 HA ASN 62 10.777 8.696 16.942 463 HB2 ASN 62 1HB ASN 62 9.368 11.084 15.721 464 HB3 ASN 62 2HB ASN 62 9.469 10.781 17.450 465 HD21 ASN 62 2HD2 ASN 62 10.523 12.996 15.869 466 HD22 ASN 62 2HD1 ASN 62 12.229 13.029 16.166 467 H GLY 63 H GLY 63 8.647 7.828 14.570 468 HA2 GLY 63 1HA GLY 63 6.886 6.268 14.938 469 HA3 GLY 63 2HA GLY 63 6.727 6.855 16.609 470 H THR 64 H THR 64 7.018 9.633 15.038 471 HA THR 64 HA THR 64 4.067 9.858 14.529 472 HB THR 64 HB THR 64 5.980 11.958 15.646 473 HG1 THR 64 1HG THR 64 4.639 11.681 17.518 474 HG21 THR 64 2HG3 THR 64 2.982 12.046 15.131 475 HG22 THR 64 2HG1 THR 64 3.945 13.321 15.913 476 HG23 THR 64 2HG2 THR 64 4.222 12.919 14.201 477 H GLY 65 H GLY 65 3.487 10.268 12.566 478 HA2 GLY 65 1HA GLY 65 5.345 10.701 10.454 479 HA3 GLY 65 2HA GLY 65 3.583 10.920 10.351 480 H ASP 66 H ASP 66 5.921 12.491 9.272 481 HA ASP 66 HA ASP 66 4.875 15.152 10.019 482 HB2 ASP 66 1HB ASP 66 6.851 14.504 11.595 483 HB3 ASP 66 2HB ASP 66 7.866 14.670 10.168 484 H ALA 67 H ALA 67 4.611 13.642 7.672 485 HA ALA 67 HA ALA 67 6.542 14.704 5.741 486 HB1 ALA 67 3HB ALA 67 3.919 13.224 5.340 487 HB2 ALA 67 1HB ALA 67 5.108 13.592 4.069 488 HB3 ALA 67 2HB ALA 67 5.537 12.488 5.398 489 H GLY 68 H GLY 68 3.475 15.637 7.078 490 HA2 GLY 68 1HA GLY 68 2.592 17.845 6.871 491 HA3 GLY 68 2HA GLY 68 3.511 18.061 5.364 492 H TYR 69 H TYR 69 2.316 15.059 5.063 493 HA TYR 69 HA TYR 69 0.147 15.973 3.285 494 HB2 TYR 69 1HB TYR 69 1.409 13.267 3.839 495 HB3 TYR 69 2HB TYR 69 0.008 13.468 2.797 496 HD1 TYR 69 1HD TYR 69 3.389 15.035 3.262 497 HD2 TYR 69 2HD TYR 69 0.403 13.590 0.542 498 HE1 TYR 69 1HE TYR 69 4.879 15.543 1.358 499 HE2 TYR 69 2HE TYR 69 1.893 14.098 -1.364 500 HH TYR 69 HH TYR 69 5.119 15.507 -0.850 501 H THR 70 H THR 70 -0.939 16.836 5.328 502 HA THR 70 HA THR 70 -2.560 14.802 6.716 503 HB THR 70 HB THR 70 -2.779 17.846 6.697 504 HG1 THR 70 1HG THR 70 -1.734 17.600 8.753 505 HG21 THR 70 2HG3 THR 70 -3.993 15.747 8.535 506 HG22 THR 70 2HG1 THR 70 -4.130 17.510 8.729 507 HG23 THR 70 2HG2 THR 70 -4.879 16.708 7.328 508 H ILE 71 H ILE 71 -4.178 13.810 5.824 509 HA ILE 71 HA ILE 71 -5.702 15.237 3.657 510 HB ILE 71 HB ILE 71 -5.840 13.066 2.469 511 HG12 ILE 71 1HG1 ILE 71 -3.949 11.976 4.564 512 HG13 ILE 71 1HG2 ILE 71 -5.681 11.679 4.547 513 HG21 ILE 71 2HG1 ILE 71 -3.495 12.869 1.747 514 HG22 ILE 71 2HG2 ILE 71 -3.974 14.575 1.905 515 HG23 ILE 71 2HG3 ILE 71 -2.975 13.811 3.165 516 HD11 ILE 71 1HD3 ILE 71 -3.733 10.904 2.364 517 HD12 ILE 71 1HD1 ILE 71 -4.462 9.817 3.569 518 HD13 ILE 71 1HD2 ILE 71 -5.488 10.605 2.345 519 HA PRO 72 HA PRO 72 -9.350 13.978 5.698 520 HB2 PRO 72 1HB PRO 72 -11.090 13.854 3.595 521 HB3 PRO 72 2HB PRO 72 -10.423 15.415 4.088 522 HG2 PRO 72 1HG PRO 72 -9.504 13.571 1.840 523 HG3 PRO 72 2HG PRO 72 -9.815 15.308 1.768 524 HD2 PRO 72 1HD PRO 72 -7.290 14.333 2.090 525 HD3 PRO 72 2HD PRO 72 -7.819 15.867 2.890 526 H CYS 73 H CYS 73 -10.914 12.315 5.879 527 HA CYS 73 HA CYS 73 -9.765 9.644 5.142 528 HB2 CYS 73 1HB CYS 73 -11.928 10.404 7.045 529 HB3 CYS 73 2HB CYS 73 -11.391 8.770 6.678 530 HG CYS 73 HG CYS 73 -10.511 9.490 8.980 531 H GLU 74 H GLU 74 -10.920 8.097 4.024 532 HA GLU 74 HA GLU 74 -13.008 9.248 2.219 533 HB2 GLU 74 1HB GLU 74 -11.259 6.772 1.887 534 HB3 GLU 74 2HB GLU 74 -12.393 7.399 0.698 535 HG2 GLU 74 1HG GLU 74 -9.842 8.702 1.659 536 HG3 GLU 74 2HG GLU 74 -10.167 8.016 0.069 537 H THR 75 H THR 75 -12.778 7.362 4.942 538 HA THR 75 HA THR 75 -14.736 5.311 4.175 539 HB THR 75 HB THR 75 -14.593 4.604 6.520 540 HG1 THR 75 1HG THR 75 -13.847 5.910 8.038 541 HG21 THR 75 2HG3 THR 75 -11.864 5.372 5.414 542 HG22 THR 75 2HG1 THR 75 -12.178 4.136 6.655 543 HG23 THR 75 2HG2 THR 75 -12.779 3.904 4.996 544 H ASP 76 H ASP 76 -14.934 8.558 5.007 545 HA ASP 76 HA ASP 76 -17.513 8.453 6.369 546 HB2 ASP 76 1HB ASP 76 -15.962 10.657 4.960 547 HB3 ASP 76 2HB ASP 76 -17.563 10.919 5.640 548 H ASN 77 H ASN 77 -16.442 8.382 3.056 549 HA ASN 77 HA ASN 77 -19.324 8.434 2.208 550 HB2 ASN 77 1HB ASN 77 -16.871 9.277 0.636 551 HB3 ASN 77 2HB ASN 77 -18.515 9.211 0.014 552 HD21 ASN 77 2HD2 ASN 77 -16.195 11.129 1.471 553 HD22 ASN 77 2HD1 ASN 77 -17.209 12.443 1.965 554 H ASN 78 H ASN 78 -16.391 6.658 2.357 555 HA ASN 78 HA ASN 78 -17.766 4.377 1.055 556 HB2 ASN 78 1HB ASN 78 -16.502 5.538 -0.757 557 HB3 ASN 78 2HB ASN 78 -15.022 5.304 0.164 558 HD21 ASN 78 2HD2 ASN 78 -14.180 4.091 -1.575 559 HD22 ASN 78 2HD1 ASN 78 -14.662 2.448 -1.836 560 HA PRO 79 HA PRO 79 -15.611 3.334 5.016 561 HB2 PRO 79 1HB PRO 79 -17.911 1.343 4.749 562 HB3 PRO 79 2HB PRO 79 -17.331 2.156 6.208 563 HG2 PRO 79 1HG PRO 79 -19.579 3.033 5.087 564 HG3 PRO 79 2HG PRO 79 -18.395 4.213 5.657 565 HD2 PRO 79 1HD PRO 79 -18.939 3.252 2.826 566 HD3 PRO 79 2HD PRO 79 -18.555 4.920 3.414 567 H HIS 80 H HIS 80 -14.150 1.834 5.316 568 HA HIS 80 HA HIS 80 -13.892 -0.187 3.112 569 HB2 HIS 80 1HB HIS 80 -11.712 1.327 4.614 570 HB3 HIS 80 2HB HIS 80 -11.421 0.023 3.471 571 HD2 HIS 80 2HD HIS 80 -13.410 1.063 1.034 572 HE1 HIS 80 1HE HIS 80 -11.059 4.611 1.260 573 H ARG 81 H ARG 81 -13.418 -2.235 3.560 574 HA ARG 81 HA ARG 81 -13.560 -3.035 6.416 575 HB2 ARG 81 1HB ARG 81 -13.518 -4.660 3.841 576 HB3 ARG 81 2HB ARG 81 -13.659 -5.343 5.454 577 HG2 ARG 81 1HG ARG 81 -15.653 -3.373 4.321 578 HG3 ARG 81 2HG ARG 81 -15.802 -5.140 4.166 579 HD2 ARG 81 1HD ARG 81 -15.748 -5.333 6.601 580 HD3 ARG 81 2HD ARG 81 -15.670 -3.561 6.724 581 HE ARG 81 HE ARG 81 -17.891 -4.216 5.133 582 HH11 ARG 81 1HH1 ARG 81 -16.796 -4.597 8.449 583 HH12 ARG 81 1HH2 ARG 81 -18.413 -4.595 9.115 584 HH21 ARG 81 2HH1 ARG 81 -19.986 -4.216 6.010 585 HH22 ARG 81 2HH2 ARG 81 -20.219 -4.379 7.736 586 H HIS 82 H HIS 82 -12.066 -4.247 7.490 587 HA HIS 82 HA HIS 82 -9.318 -4.145 6.289 588 HB2 HIS 82 1HB HIS 82 -10.212 -3.917 9.196 589 HB3 HIS 82 2HB HIS 82 -8.537 -4.090 8.691 590 HD2 HIS 82 2HD HIS 82 -7.283 -1.709 8.235 591 HE1 HIS 82 1HE HIS 82 -10.772 0.710 7.861 592 H VAL 83 H VAL 83 -8.844 -6.054 5.512 593 HA VAL 83 HA VAL 83 -9.189 -8.432 7.326 594 HB VAL 83 HB VAL 83 -9.756 -9.785 5.347 595 HG11 VAL 83 1HG1 VAL 83 -12.010 -8.941 4.903 596 HG12 VAL 83 1HG2 VAL 83 -11.593 -8.853 6.631 597 HG13 VAL 83 1HG3 VAL 83 -11.567 -7.379 5.632 598 HG21 VAL 83 2HG3 VAL 83 -8.549 -8.434 3.667 599 HG22 VAL 83 2HG1 VAL 83 -10.241 -8.690 3.181 600 HG23 VAL 83 2HG2 VAL 83 -9.738 -7.124 3.862 601 H THR 84 H THR 84 -7.989 -10.357 6.249 602 HA THR 84 HA THR 84 -5.223 -9.807 6.541 603 HB THR 84 HB THR 84 -6.504 -12.104 4.995 604 HG1 THR 84 1HG THR 84 -5.722 -11.967 7.738 605 HG21 THR 84 2HG3 THR 84 -3.798 -11.835 6.358 606 HG22 THR 84 2HG1 THR 84 -4.429 -13.300 5.572 607 HG23 THR 84 2HG2 THR 84 -4.079 -11.850 4.601 608 H GLY 85 H GLY 85 -3.923 -8.639 5.393 609 HA2 GLY 85 1HA GLY 85 -2.588 -8.585 3.352 610 HA3 GLY 85 2HA GLY 85 -4.064 -8.934 2.421 611 H ALA 86 H ALA 86 -5.470 -6.977 4.365 612 HA ALA 86 HA ALA 86 -5.546 -4.875 2.431 613 HB1 ALA 86 3HB ALA 86 -6.539 -4.909 5.304 614 HB2 ALA 86 1HB ALA 86 -6.994 -3.719 4.061 615 HB3 ALA 86 2HB ALA 86 -7.458 -5.428 3.872 616 H MET 87 H MET 87 -4.719 -2.861 2.338 617 HA MET 87 HA MET 87 -2.758 -2.112 4.486 618 HB2 MET 87 1HB MET 87 -2.774 -1.384 1.535 619 HB3 MET 87 2HB MET 87 -1.655 -0.735 2.725 620 HG2 MET 87 1HG MET 87 -0.723 -2.961 3.112 621 HG3 MET 87 2HG MET 87 -1.893 -3.668 1.996 622 HE1 MET 87 3HE MET 87 1.417 -1.729 2.446 623 HE2 MET 87 1HE MET 87 1.691 -0.995 0.848 624 HE3 MET 87 2HE MET 87 0.374 -0.397 1.888 625 H SER 88 H SER 88 -3.388 -0.584 5.774 626 HA SER 88 HA SER 88 -5.486 1.383 4.796 627 HB2 SER 88 1HB SER 88 -6.479 -0.296 6.141 628 HB3 SER 88 2HB SER 88 -5.342 0.035 7.439 629 HG SER 88 HG SER 88 -6.082 2.174 7.435 630 H MET 89 H MET 89 -5.007 3.463 5.114 631 HA MET 89 HA MET 89 -2.471 4.196 6.414 632 HB2 MET 89 1HB MET 89 -3.338 5.260 4.291 633 HB3 MET 89 2HB MET 89 -4.626 5.988 5.239 634 HG2 MET 89 1HG MET 89 -3.032 7.273 6.531 635 HG3 MET 89 2HG MET 89 -1.675 6.440 5.767 636 HE1 MET 89 3HE MET 89 -1.817 6.344 2.849 637 HE2 MET 89 1HE MET 89 -1.341 7.975 2.318 638 HE3 MET 89 2HE MET 89 -0.512 7.209 3.695 639 H ALA 90 H ALA 90 -2.156 5.444 8.188 640 HA ALA 90 HA ALA 90 -4.336 5.168 10.172 641 HB1 ALA 90 3HB ALA 90 -1.420 5.958 10.500 642 HB2 ALA 90 1HB ALA 90 -2.580 5.697 11.822 643 HB3 ALA 90 2HB ALA 90 -2.103 4.339 10.774 644 H HIS 91 H HIS 91 -4.952 6.850 11.587 645 HA HIS 91 HA HIS 91 -4.264 9.614 10.727 646 HB2 HIS 91 1HB HIS 91 -6.629 10.282 10.698 647 HB3 HIS 91 2HB HIS 91 -6.328 9.048 9.481 648 HD2 HIS 91 2HD HIS 91 -8.131 7.013 9.569 649 HE1 HIS 91 1HE HIS 91 -9.451 7.574 13.583 650 H ARG 92 H ARG 92 -5.192 11.255 12.230 651 HA ARG 92 HA ARG 92 -5.137 10.174 15.030 652 HB2 ARG 92 1HB ARG 92 -4.427 12.951 14.007 653 HB3 ARG 92 2HB ARG 92 -4.384 12.438 15.687 654 HG2 ARG 92 1HG ARG 92 -2.666 11.267 13.486 655 HG3 ARG 92 2HG ARG 92 -2.156 12.522 14.641 656 HD2 ARG 92 1HD ARG 92 -3.032 9.717 15.287 657 HD3 ARG 92 2HD ARG 92 -1.379 10.370 15.355 658 HE ARG 92 HE ARG 92 -2.949 11.995 16.992 659 HH11 ARG 92 1HH1 ARG 92 -1.967 8.625 16.851 660 HH12 ARG 92 1HH2 ARG 92 -2.032 8.403 18.585 661 HH21 ARG 92 2HH1 ARG 92 -3.030 11.695 19.241 662 HH22 ARG 92 2HH2 ARG 92 -2.634 10.141 19.939 663 H GLY 93 H GLY 93 -7.477 10.256 13.310 664 HA2 GLY 93 1HA GLY 93 -9.620 10.821 14.671 665 HA3 GLY 93 2HA GLY 93 -9.036 12.495 14.514 666 H ARG 94 H ARG 94 -11.351 12.438 13.525 667 HA ARG 94 HA ARG 94 -11.714 11.305 10.900 668 HB2 ARG 94 1HB ARG 94 -13.560 12.070 12.441 669 HB3 ARG 94 2HB ARG 94 -13.084 13.731 12.124 670 HG2 ARG 94 1HG ARG 94 -13.633 13.466 9.756 671 HG3 ARG 94 2HG ARG 94 -14.067 11.764 10.041 672 HD2 ARG 94 1HD ARG 94 -15.783 12.514 11.633 673 HD3 ARG 94 2HD ARG 94 -15.390 14.198 11.215 674 HE ARG 94 HE ARG 94 -15.940 12.737 8.845 675 HH11 ARG 94 1HH1 ARG 94 -17.552 14.041 11.681 676 HH12 ARG 94 1HH2 ARG 94 -19.087 14.249 10.867 677 HH21 ARG 94 2HH1 ARG 94 -17.937 13.013 7.800 678 HH22 ARG 94 2HH2 ARG 94 -19.306 13.668 8.670 679 H ASP 95 H ASP 95 -11.177 11.920 8.953 680 HA ASP 95 HA ASP 95 -10.031 13.103 7.307 681 HB2 ASP 95 1HB ASP 95 -11.461 15.354 8.775 682 HB3 ASP 95 2HB ASP 95 -10.557 15.604 7.288 683 H THR 96 H THR 96 -8.460 12.389 9.504 684 HA THR 96 HA THR 96 -6.426 14.569 9.321 685 HB THR 96 HB THR 96 -7.069 13.048 11.886 686 HG1 THR 96 1HG THR 96 -8.668 14.632 11.363 687 HG21 THR 96 2HG3 THR 96 -5.197 15.373 11.298 688 HG22 THR 96 2HG1 THR 96 -5.494 14.651 12.896 689 HG23 THR 96 2HG2 THR 96 -4.700 13.696 11.620 690 H GLY 97 H GLY 97 -6.359 12.538 7.605 691 HA2 GLY 97 1HA GLY 97 -4.875 10.263 8.675 692 HA3 GLY 97 2HA GLY 97 -5.246 10.591 6.967 693 H SER 98 H SER 98 -2.726 9.780 8.430 694 HA SER 98 HA SER 98 -0.923 12.141 7.855 695 HB2 SER 98 1HB SER 98 0.588 11.297 9.320 696 HB3 SER 98 2HB SER 98 -0.977 11.266 10.120 697 HG SER 98 HG SER 98 -1.133 9.091 9.630 698 H CYS 99 H CYS 99 1.420 11.035 7.509 699 HA CYS 99 HA CYS 99 1.347 9.621 4.906 700 HB2 CYS 99 1HB CYS 99 3.663 9.835 4.885 701 HB3 CYS 99 2HB CYS 99 2.919 11.375 5.290 702 HG CYS 99 HG CYS 99 3.304 11.197 7.852 703 H GLN 100 H GLN 100 1.078 8.667 8.140 704 HA GLN 100 HA GLN 100 2.724 6.217 7.842 705 HB2 GLN 100 1HB GLN 100 1.023 7.190 10.176 706 HB3 GLN 100 2HB GLN 100 2.120 5.817 10.203 707 HG2 GLN 100 1HG GLN 100 4.020 7.335 9.791 708 HG3 GLN 100 2HG GLN 100 2.890 8.718 9.827 709 HE21 GLN 100 2HE2 GLN 100 4.636 6.340 11.689 710 HE22 GLN 100 2HE1 GLN 100 4.234 6.963 13.255 711 H PHE 101 H PHE 101 1.971 4.138 7.983 712 HA PHE 101 HA PHE 101 -0.956 3.689 7.862 713 HB2 PHE 101 1HB PHE 101 -0.923 2.574 5.743 714 HB3 PHE 101 2HB PHE 101 -0.155 4.132 5.486 715 HD1 PHE 101 2HD PHE 101 2.305 4.284 5.229 716 HD2 PHE 101 1HD PHE 101 0.280 0.531 5.477 717 HE1 PHE 101 2HE PHE 101 4.291 3.153 4.286 718 HE2 PHE 101 1HE PHE 101 2.264 -0.605 4.537 719 HZ PHE 101 HZ PHE 101 4.270 0.706 3.942 720 H PHE 102 H PHE 102 -1.419 1.299 7.594 721 HA PHE 102 HA PHE 102 0.715 -0.428 8.730 722 HB2 PHE 102 1HB PHE 102 -0.760 -1.249 10.517 723 HB3 PHE 102 2HB PHE 102 -0.459 0.469 10.716 724 HD1 PHE 102 2HD PHE 102 -2.223 2.112 10.282 725 HD2 PHE 102 1HD PHE 102 -2.953 -2.086 9.978 726 HE1 PHE 102 2HE PHE 102 -4.657 2.533 10.354 727 HE2 PHE 102 1HE PHE 102 -5.389 -1.669 10.048 728 HZ PHE 102 HZ PHE 102 -6.241 0.641 10.235 729 H ILE 103 H ILE 103 0.406 -2.626 8.467 730 HA ILE 103 HA ILE 103 -1.579 -3.261 6.301 731 HB ILE 103 HB ILE 103 1.070 -4.624 7.004 732 HG12 ILE 103 1HG1 ILE 103 0.417 -2.878 4.620 733 HG13 ILE 103 1HG2 ILE 103 1.321 -2.344 6.029 734 HG21 ILE 103 2HG1 ILE 103 0.710 -5.860 4.905 735 HG22 ILE 103 2HG2 ILE 103 -0.612 -6.158 6.057 736 HG23 ILE 103 2HG3 ILE 103 -0.859 -5.047 4.690 737 HD11 ILE 103 1HD3 ILE 103 2.129 -4.578 4.154 738 HD12 ILE 103 1HD1 ILE 103 2.812 -2.936 4.204 739 HD13 ILE 103 1HD2 ILE 103 3.042 -4.039 5.583 740 H VAL 104 H VAL 104 -3.198 -4.474 6.690 741 HA VAL 104 HA VAL 104 -3.440 -5.715 9.366 742 HB VAL 104 HB VAL 104 -5.344 -5.676 6.976 743 HG11 VAL 104 1HG1 VAL 104 -7.063 -6.281 8.607 744 HG12 VAL 104 1HG2 VAL 104 -5.788 -7.518 8.493 745 HG13 VAL 104 1HG3 VAL 104 -5.819 -6.395 9.874 746 HG21 VAL 104 2HG3 VAL 104 -4.856 -3.406 7.821 747 HG22 VAL 104 2HG1 VAL 104 -6.519 -3.891 8.224 748 HG23 VAL 104 2HG2 VAL 104 -5.252 -3.934 9.473 749 H HIS 105 H HIS 105 -3.203 -7.694 9.945 750 HA HIS 105 HA HIS 105 -2.849 -9.736 7.775 751 HB2 HIS 105 1HB HIS 105 -1.695 -9.678 10.599 752 HB3 HIS 105 2HB HIS 105 -1.509 -11.004 9.460 753 HD2 HIS 105 2HD HIS 105 0.550 -7.958 10.524 754 HE1 HIS 105 1HE HIS 105 1.622 -8.813 6.502 755 H GLU 106 H GLU 106 -4.501 -8.895 10.740 756 HA GLU 106 HA GLU 106 -6.262 -11.281 10.260 757 HB2 GLU 106 1HB GLU 106 -5.003 -11.480 12.402 758 HB3 GLU 106 2HB GLU 106 -5.625 -9.917 12.912 759 HG2 GLU 106 1HG GLU 106 -7.911 -10.797 12.888 760 HG3 GLU 106 2HG GLU 106 -7.313 -12.359 12.332 761 HA PRO 107 HA PRO 107 -9.393 -8.327 9.286 762 HB2 PRO 107 1HB PRO 107 -11.066 -10.665 10.311 763 HB3 PRO 107 2HB PRO 107 -11.282 -9.733 8.824 764 HG2 PRO 107 1HG PRO 107 -10.228 -12.167 8.637 765 HG3 PRO 107 2HG PRO 107 -9.511 -10.856 7.694 766 HD2 PRO 107 1HD PRO 107 -8.557 -12.089 10.304 767 HD3 PRO 107 2HD PRO 107 -7.590 -11.562 8.869 768 H GLN 108 H GLN 108 -10.238 -6.780 10.384 769 HA GLN 108 HA GLN 108 -10.879 -7.252 13.263 770 HB2 GLN 108 1HB GLN 108 -8.527 -6.306 12.978 771 HB3 GLN 108 2HB GLN 108 -9.256 -4.883 12.249 772 HG2 GLN 108 1HG GLN 108 -8.708 -4.551 14.611 773 HG3 GLN 108 2HG GLN 108 -10.461 -4.396 14.302 774 HE21 GLN 108 2HE2 GLN 108 -7.995 -6.812 15.279 775 HE22 GLN 108 2HE1 GLN 108 -9.007 -7.634 16.420 776 HA PRO 109 HA PRO 109 -14.493 -5.221 11.479 777 HB2 PRO 109 1HB PRO 109 -15.350 -5.928 14.318 778 HB3 PRO 109 2HB PRO 109 -16.244 -6.168 12.811 779 HG2 PRO 109 1HG PRO 109 -15.120 -8.289 13.959 780 HG3 PRO 109 2HG PRO 109 -14.989 -8.100 12.208 781 HD2 PRO 109 1HD PRO 109 -12.931 -7.482 14.363 782 HD3 PRO 109 2HD PRO 109 -12.695 -8.269 12.750 783 H HIS 110 H HIS 110 -12.753 -4.678 14.472 784 HA HIS 110 HA HIS 110 -14.250 -2.301 15.199 785 HB2 HIS 110 1HB HIS 110 -11.543 -3.388 16.075 786 HB3 HIS 110 2HB HIS 110 -12.253 -1.924 16.739 787 HD2 HIS 110 2HD HIS 110 -14.386 -2.372 18.676 788 HE1 HIS 110 1HE HIS 110 -14.074 -6.603 18.451 789 H LEU 111 H LEU 111 -11.764 -2.928 12.926 790 HA LEU 111 HA LEU 111 -10.957 -0.066 12.844 791 HB2 LEU 111 1HB LEU 111 -9.988 -2.511 11.306 792 HB3 LEU 111 2HB LEU 111 -9.341 -0.878 11.111 793 HG LEU 111 HG LEU 111 -9.186 -2.553 13.643 794 HD11 LEU 111 1HD1 LEU 111 -6.794 -2.673 13.105 795 HD12 LEU 111 1HD2 LEU 111 -7.793 -3.415 11.833 796 HD13 LEU 111 1HD3 LEU 111 -7.093 -1.798 11.585 797 HD21 LEU 111 2HD3 LEU 111 -9.334 -0.124 14.079 798 HD22 LEU 111 2HD1 LEU 111 -7.700 -0.739 14.426 799 HD23 LEU 111 2HD2 LEU 111 -8.010 0.164 12.923 800 H ASP 112 H ASP 112 -13.257 -2.118 11.464 801 HA ASP 112 HA ASP 112 -13.193 -1.240 8.732 802 HB2 ASP 112 1HB ASP 112 -15.437 -2.368 10.456 803 HB3 ASP 112 2HB ASP 112 -15.606 -2.047 8.736 804 H GLY 113 H GLY 113 -13.628 0.599 7.836 805 HA2 GLY 113 1HA GLY 113 -14.865 2.518 7.338 806 HA3 GLY 113 2HA GLY 113 -15.922 2.180 8.728 807 H VAL 114 H VAL 114 -12.855 1.907 9.878 808 HA VAL 114 HA VAL 114 -12.997 4.647 11.083 809 HB VAL 114 HB VAL 114 -11.319 2.198 11.817 810 HG11 VAL 114 1HG1 VAL 114 -10.846 3.411 13.889 811 HG12 VAL 114 1HG2 VAL 114 -10.256 4.286 12.456 812 HG13 VAL 114 1HG3 VAL 114 -11.746 4.816 13.271 813 HG21 VAL 114 2HG3 VAL 114 -13.734 1.823 12.184 814 HG22 VAL 114 2HG1 VAL 114 -12.872 1.986 13.732 815 HG23 VAL 114 2HG2 VAL 114 -13.832 3.346 13.102 816 H HIS 115 H HIS 115 -10.570 2.480 9.618 817 HA HIS 115 HA HIS 115 -9.030 4.954 8.915 818 HB2 HIS 115 1HB HIS 115 -8.113 2.062 9.220 819 HB3 HIS 115 2HB HIS 115 -7.098 3.365 8.619 820 HD2 HIS 115 2HD HIS 115 -8.507 2.032 12.002 821 HE1 HIS 115 1HE HIS 115 -5.934 5.329 12.821 822 H THR 116 H THR 116 -8.108 5.174 6.880 823 HA THR 116 HA THR 116 -9.950 4.143 4.810 824 HB THR 116 HB THR 116 -7.689 6.188 4.669 825 HG1 THR 116 1HG THR 116 -9.556 6.828 5.886 826 HG21 THR 116 2HG3 THR 116 -9.825 5.437 2.637 827 HG22 THR 116 2HG1 THR 116 -8.648 6.761 2.474 828 HG23 THR 116 2HG2 THR 116 -8.089 5.072 2.501 829 H VAL 117 H VAL 117 -9.607 2.313 3.850 830 HA VAL 117 HA VAL 117 -6.867 1.244 3.471 831 HB VAL 117 HB VAL 117 -9.587 0.284 2.455 832 HG11 VAL 117 1HG1 VAL 117 -8.446 -1.838 2.024 833 HG12 VAL 117 1HG2 VAL 117 -7.756 -0.504 1.069 834 HG13 VAL 117 1HG3 VAL 117 -6.900 -1.103 2.510 835 HG21 VAL 117 2HG3 VAL 117 -9.432 0.262 4.920 836 HG22 VAL 117 2HG1 VAL 117 -9.412 -1.393 4.266 837 HG23 VAL 117 2HG2 VAL 117 -7.898 -0.637 4.817 838 H PHE 118 H PHE 118 -5.620 1.324 1.791 839 HA PHE 118 HA PHE 118 -6.662 2.904 -0.543 840 HB2 PHE 118 1HB PHE 118 -4.449 3.969 -0.672 841 HB3 PHE 118 2HB PHE 118 -5.194 4.289 0.886 842 HD1 PHE 118 1HD PHE 118 -2.575 2.371 -0.858 843 HD2 PHE 118 2HD PHE 118 -4.242 3.465 2.920 844 HE1 PHE 118 1HE PHE 118 -0.563 1.495 0.281 845 HE2 PHE 118 2HE PHE 118 -2.230 2.594 4.063 846 HZ PHE 118 HZ PHE 118 -0.391 1.607 2.741 847 H GLY 119 H GLY 119 -5.214 0.036 0.524 848 HA2 GLY 119 1HA GLY 119 -5.092 -1.034 -2.135 849 HA3 GLY 119 2HA GLY 119 -3.456 -0.637 -1.562 850 H GLN 120 H GLN 120 -3.323 -3.066 -1.911 851 HA GLN 120 HA GLN 120 -3.291 -4.231 0.769 852 HB2 GLN 120 1HB GLN 120 -4.656 -6.151 0.341 853 HB3 GLN 120 2HB GLN 120 -5.627 -4.752 -0.095 854 HG2 GLN 120 1HG GLN 120 -5.191 -5.118 -2.450 855 HG3 GLN 120 2HG GLN 120 -4.092 -6.469 -2.056 856 HE21 GLN 120 2HE2 GLN 120 -4.917 -8.467 -1.545 857 HE22 GLN 120 2HE1 GLN 120 -6.602 -8.856 -1.649 858 H VAL 121 H VAL 121 -1.932 -5.971 0.999 859 HA VAL 121 HA VAL 121 0.158 -6.181 -1.071 860 HB VAL 121 HB VAL 121 -0.262 -7.714 1.539 861 HG11 VAL 121 1HG1 VAL 121 2.109 -8.283 1.341 862 HG12 VAL 121 1HG2 VAL 121 1.156 -8.913 -0.023 863 HG13 VAL 121 1HG3 VAL 121 2.171 -7.468 -0.239 864 HG21 VAL 121 2HG3 VAL 121 -0.001 -5.285 1.905 865 HG22 VAL 121 2HG1 VAL 121 1.441 -6.170 2.456 866 HG23 VAL 121 2HG2 VAL 121 1.474 -5.292 0.910 867 H THR 122 H THR 122 0.508 -7.635 -2.535 868 HA THR 122 HA THR 122 -1.598 -9.761 -2.773 869 HB THR 122 HB THR 122 -1.335 -9.556 -5.217 870 HG1 THR 122 1HG THR 122 -0.025 -7.813 -6.010 871 HG21 THR 122 2HG3 THR 122 -1.788 -6.865 -3.873 872 HG22 THR 122 2HG1 THR 122 -2.316 -7.315 -5.510 873 HG23 THR 122 2HG2 THR 122 -3.014 -8.135 -4.093 874 H SER 123 H SER 123 1.785 -9.061 -2.687 875 HA SER 123 HA SER 123 2.345 -12.021 -2.766 876 HB2 SER 123 1HB SER 123 2.652 -11.333 -5.006 877 HB3 SER 123 2HB SER 123 3.753 -10.062 -4.498 878 HG SER 123 HG SER 123 4.811 -11.950 -5.106 879 H GLY 124 H GLY 124 3.779 -12.585 -1.243 880 HA2 GLY 124 1HA GLY 124 5.599 -12.383 0.223 881 HA3 GLY 124 2HA GLY 124 5.780 -10.678 -0.251 882 H MET 125 H MET 125 2.580 -11.599 0.530 883 HA MET 125 HA MET 125 2.303 -9.836 2.736 884 HB2 MET 125 1HB MET 125 0.424 -10.790 1.392 885 HB3 MET 125 2HB MET 125 0.704 -12.353 2.142 886 HG2 MET 125 1HG MET 125 0.189 -11.370 4.356 887 HG3 MET 125 2HG MET 125 -0.126 -9.817 3.580 888 HE1 MET 125 3HE MET 125 -1.410 -13.356 4.417 889 HE2 MET 125 1HE MET 125 -2.726 -13.614 3.245 890 HE3 MET 125 2HE MET 125 -1.033 -13.592 2.693 891 H ASP 126 H ASP 126 3.081 -13.299 2.678 892 HA ASP 126 HA ASP 126 3.164 -13.654 5.523 893 HB2 ASP 126 1HB ASP 126 4.616 -15.043 3.237 894 HB3 ASP 126 2HB ASP 126 4.788 -15.539 4.914 895 H VAL 127 H VAL 127 5.657 -12.638 3.200 896 HA VAL 127 HA VAL 127 7.817 -12.399 5.084 897 HB VAL 127 HB VAL 127 7.173 -10.793 2.564 898 HG11 VAL 127 1HG1 VAL 127 9.540 -10.173 2.566 899 HG12 VAL 127 1HG2 VAL 127 8.691 -9.566 4.007 900 HG13 VAL 127 1HG3 VAL 127 9.752 -10.990 4.131 901 HG21 VAL 127 2HG3 VAL 127 7.455 -13.215 2.168 902 HG22 VAL 127 2HG1 VAL 127 8.825 -12.297 1.502 903 HG23 VAL 127 2HG2 VAL 127 9.008 -13.179 3.037 904 H VAL 128 H VAL 128 5.321 -10.057 4.127 905 HA VAL 128 HA VAL 128 6.213 -7.922 5.834 906 HB VAL 128 HB VAL 128 3.393 -8.730 4.974 907 HG11 VAL 128 1HG1 VAL 128 2.773 -6.421 5.490 908 HG12 VAL 128 1HG2 VAL 128 3.340 -7.296 6.932 909 HG13 VAL 128 1HG3 VAL 128 4.409 -6.124 6.123 910 HG21 VAL 128 2HG3 VAL 128 4.909 -8.263 3.080 911 HG22 VAL 128 2HG1 VAL 128 3.689 -6.977 3.253 912 HG23 VAL 128 2HG2 VAL 128 5.355 -6.706 3.819 913 H ARG 129 H ARG 129 3.967 -10.603 6.492 914 HA ARG 129 HA ARG 129 3.348 -9.794 9.163 915 HB2 ARG 129 1HB ARG 129 2.156 -11.573 7.804 916 HB3 ARG 129 2HB ARG 129 3.527 -12.635 8.090 917 HG2 ARG 129 1HG ARG 129 3.113 -12.533 10.512 918 HG3 ARG 129 2HG ARG 129 1.723 -11.461 10.220 919 HD2 ARG 129 1HD ARG 129 2.038 -14.249 9.135 920 HD3 ARG 129 2HD ARG 129 1.075 -13.790 10.557 921 HE ARG 129 HE ARG 129 0.054 -12.181 8.639 922 HH11 ARG 129 1HH1 ARG 129 0.717 -15.630 8.720 923 HH12 ARG 129 1HH2 ARG 129 -0.588 -16.034 7.627 924 HH21 ARG 129 2HH1 ARG 129 -1.636 -12.718 7.221 925 HH22 ARG 129 2HH2 ARG 129 -1.920 -14.386 6.777 926 H THR 130 H THR 130 6.067 -11.605 7.840 927 HA THR 130 HA THR 130 6.993 -12.250 10.596 928 HB THR 130 HB THR 130 8.679 -13.665 9.442 929 HG1 THR 130 1HG THR 130 8.459 -13.883 7.142 930 HG21 THR 130 2HG3 THR 130 5.841 -14.095 8.436 931 HG22 THR 130 2HG1 THR 130 7.120 -15.329 8.508 932 HG23 THR 130 2HG2 THR 130 6.475 -14.626 10.011 933 H MET 131 H MET 131 7.102 -9.564 8.975 934 HA MET 131 HA MET 131 9.907 -8.862 9.021 935 HB2 MET 131 1HB MET 131 7.343 -7.250 9.184 936 HB3 MET 131 2HB MET 131 8.930 -6.499 9.251 937 HG2 MET 131 1HG MET 131 9.464 -7.448 7.028 938 HG3 MET 131 2HG MET 131 7.852 -8.167 6.960 939 HE1 MET 131 3HE MET 131 7.479 -6.965 4.612 940 HE2 MET 131 1HE MET 131 7.673 -5.212 4.364 941 HE3 MET 131 2HE MET 131 9.093 -6.223 4.730 942 H LYS 132 H LYS 132 10.929 -7.371 10.485 943 HA LYS 132 HA LYS 132 10.311 -8.182 13.294 944 HB2 LYS 132 1HB LYS 132 12.840 -7.004 12.077 945 HB3 LYS 132 2HB LYS 132 12.639 -7.467 13.761 946 HG2 LYS 132 1HG LYS 132 12.304 -9.818 13.074 947 HG3 LYS 132 2HG LYS 132 12.526 -9.346 11.384 948 HD2 LYS 132 1HD LYS 132 14.802 -8.544 11.892 949 HD3 LYS 132 2HD LYS 132 14.582 -8.977 13.595 950 HE2 LYS 132 1HE LYS 132 14.270 -11.349 12.945 951 HE3 LYS 132 2HE LYS 132 14.509 -10.913 11.250 952 HZ1 LYS 132 3HZ LYS 132 16.496 -10.575 13.396 953 HZ2 LYS 132 1HZ LYS 132 16.512 -11.749 12.238 954 HZ3 LYS 132 2HZ LYS 132 16.718 -10.167 11.813 955 H ASN 133 H ASN 133 10.607 -6.656 15.012 956 HA ASN 133 HA ASN 133 9.316 -4.110 14.498 957 HB2 ASN 133 1HB ASN 133 9.154 -5.367 16.644 958 HB3 ASN 133 2HB ASN 133 10.852 -5.025 16.945 959 HD21 ASN 133 2HD2 ASN 133 8.480 -4.249 18.463 960 HD22 ASN 133 2HD1 ASN 133 8.518 -2.520 18.557 961 H GLY 134 H GLY 134 10.181 -2.522 13.435 962 HA2 GLY 134 1HA GLY 134 11.713 -0.727 13.195 963 HA3 GLY 134 2HA GLY 134 12.902 -1.619 14.174 964 H ASP 135 H ASP 135 11.386 -3.565 11.833 965 HA ASP 135 HA ASP 135 13.737 -4.054 10.302 966 HB2 ASP 135 1HB ASP 135 11.541 -5.434 10.444 967 HB3 ASP 135 2HB ASP 135 10.907 -4.326 9.235 968 H VAL 136 H VAL 136 14.619 -3.248 8.508 969 HA VAL 136 HA VAL 136 13.805 -0.418 7.994 970 HB VAL 136 HB VAL 136 16.323 -1.965 7.217 971 HG11 VAL 136 1HG1 VAL 136 17.276 0.243 6.766 972 HG12 VAL 136 1HG2 VAL 136 15.866 -0.099 5.734 973 HG13 VAL 136 1HG3 VAL 136 15.703 0.994 7.130 974 HG21 VAL 136 2HG3 VAL 136 16.093 -1.745 9.667 975 HG22 VAL 136 2HG1 VAL 136 17.402 -0.708 9.054 976 HG23 VAL 136 2HG2 VAL 136 15.830 0.006 9.486 977 H MET 137 H MET 137 12.770 0.224 6.322 978 HA MET 137 HA MET 137 12.651 -1.470 3.895 979 HB2 MET 137 1HB MET 137 11.431 1.229 4.574 980 HB3 MET 137 2HB MET 137 11.193 0.386 3.051 981 HG2 MET 137 1HG MET 137 10.173 -1.515 4.314 982 HG3 MET 137 2HG MET 137 10.322 -0.565 5.794 983 HE1 MET 137 3HE MET 137 9.521 2.277 5.355 984 HE2 MET 137 1HE MET 137 7.743 2.229 5.449 985 HE3 MET 137 2HE MET 137 8.720 1.231 6.554 986 H LYS 138 H LYS 138 13.635 -1.153 2.022 987 HA LYS 138 HA LYS 138 15.871 0.814 2.057 988 HB2 LYS 138 1HB LYS 138 16.325 -1.597 1.531 989 HB3 LYS 138 2HB LYS 138 15.281 -1.462 0.122 990 HG2 LYS 138 1HG LYS 138 16.781 0.212 -0.862 991 HG3 LYS 138 2HG LYS 138 17.818 0.137 0.570 992 HD2 LYS 138 1HD LYS 138 18.226 -2.275 0.134 993 HD3 LYS 138 2HD LYS 138 17.217 -2.172 -1.317 994 HE2 LYS 138 1HE LYS 138 18.755 -0.511 -2.287 995 HE3 LYS 138 2HE LYS 138 19.752 -0.563 -0.830 996 HZ1 LYS 138 3HZ LYS 138 19.258 -2.831 -2.643 997 HZ2 LYS 138 1HZ LYS 138 20.644 -1.941 -2.559 998 HZ3 LYS 138 2HZ LYS 138 20.187 -2.879 -1.281 999 H GLU 139 H GLU 139 13.390 -0.311 -0.267 1000 HA GLU 139 HA GLU 139 13.076 2.521 -1.144 1001 HB2 GLU 139 1HB GLU 139 13.637 0.154 -2.981 1002 HB3 GLU 139 2HB GLU 139 13.037 1.711 -3.535 1003 HG2 GLU 139 1HG GLU 139 15.080 2.794 -2.658 1004 HG3 GLU 139 2HG GLU 139 15.681 1.218 -2.149 1005 H VAL 140 H VAL 140 11.085 3.118 -1.704 1006 HA VAL 140 HA VAL 140 9.015 0.964 -2.076 1007 HB VAL 140 HB VAL 140 8.680 3.588 -0.545 1008 HG11 VAL 140 1HG1 VAL 140 6.437 2.751 -0.038 1009 HG12 VAL 140 1HG2 VAL 140 6.691 2.961 -1.787 1010 HG13 VAL 140 1HG3 VAL 140 6.735 1.332 -1.069 1011 HG21 VAL 140 2HG3 VAL 140 9.967 1.920 0.745 1012 HG22 VAL 140 2HG1 VAL 140 8.341 2.139 1.432 1013 HG23 VAL 140 2HG2 VAL 140 8.702 0.705 0.440 1014 H LYS 141 H LYS 141 8.077 1.020 -3.916 1015 HA LYS 141 HA LYS 141 8.106 3.621 -5.414 1016 HB2 LYS 141 1HB LYS 141 8.605 0.841 -6.550 1017 HB3 LYS 141 2HB LYS 141 8.570 2.344 -7.462 1018 HG2 LYS 141 1HG LYS 141 10.572 1.722 -5.270 1019 HG3 LYS 141 2HG LYS 141 10.859 1.489 -7.000 1020 HD2 LYS 141 1HD LYS 141 10.466 3.905 -7.387 1021 HD3 LYS 141 2HD LYS 141 10.191 4.135 -5.655 1022 HE2 LYS 141 1HE LYS 141 12.495 3.311 -5.201 1023 HE3 LYS 141 2HE LYS 141 12.767 3.153 -6.938 1024 HZ1 LYS 141 3HZ LYS 141 12.149 5.663 -5.527 1025 HZ2 LYS 141 1HZ LYS 141 13.631 5.209 -6.094 1026 HZ3 LYS 141 2HZ LYS 141 12.402 5.514 -7.151 1027 H VAL 142 H VAL 142 6.351 4.214 -6.488 1028 HA VAL 142 HA VAL 142 4.147 2.199 -6.848 1029 HB VAL 142 HB VAL 142 3.848 5.100 -5.930 1030 HG11 VAL 142 1HG1 VAL 142 1.458 4.589 -5.791 1031 HG12 VAL 142 1HG2 VAL 142 2.081 4.422 -7.450 1032 HG13 VAL 142 1HG3 VAL 142 1.766 2.972 -6.467 1033 HG21 VAL 142 2HG3 VAL 142 4.621 3.611 -4.116 1034 HG22 VAL 142 2HG1 VAL 142 2.933 4.109 -3.855 1035 HG23 VAL 142 2HG2 VAL 142 3.293 2.481 -4.474 1036 H PHE 143 H PHE 143 3.159 2.151 -8.705 1037 HA PHE 143 HA PHE 143 3.625 4.293 -10.689 1038 HB2 PHE 143 1HB PHE 143 4.703 2.784 -12.299 1039 HB3 PHE 143 2HB PHE 143 5.689 2.932 -10.853 1040 HD1 PHE 143 2HD PHE 143 5.797 1.073 -9.220 1041 HD2 PHE 143 1HD PHE 143 3.737 0.700 -12.945 1042 HE1 PHE 143 2HE PHE 143 5.828 -1.388 -8.988 1043 HE2 PHE 143 1HE PHE 143 3.764 -1.761 -12.715 1044 HZ PHE 143 HZ PHE 143 4.809 -2.806 -10.737 1045 H ASP 144 H ASP 144 2.584 3.842 -12.763 1046 HA ASP 144 HA ASP 144 -0.020 2.500 -12.265 1047 HB2 ASP 144 1HB ASP 144 0.950 4.245 -14.570 1048 HB3 ASP 144 2HB ASP 144 -0.676 3.595 -14.410 1049 H GLU 145 H GLU 145 -0.759 0.750 -13.239 1050 HA GLU 145 HA GLU 145 0.988 -0.492 -15.341 1051 HB2 GLU 145 1HB GLU 145 1.047 -1.697 -13.120 1052 HB3 GLU 145 2HB GLU 145 -0.689 -1.941 -13.249 1053 HG2 GLU 145 1HG GLU 145 -0.338 -3.219 -15.340 1054 HG3 GLU 145 2HG GLU 145 1.402 -3.008 -15.158 1055 HA PRO 146 HA PRO 146 -2.741 -0.293 -17.693 1056 HB2 PRO 146 1HB PRO 146 -1.718 -1.253 -20.026 1057 HB3 PRO 146 2HB PRO 146 -1.194 0.333 -19.442 1058 HG2 PRO 146 1HG PRO 146 0.203 -2.363 -19.166 1059 HG3 PRO 146 2HG PRO 146 0.890 -0.824 -19.692 1060 HD2 PRO 146 1HD PRO 146 1.120 -1.715 -17.108 1061 HD3 PRO 146 2HD PRO 146 1.004 0.045 -17.513 Start of MODEL 14 1 H MET 1 1H MET 1 -7.295 2.223 -16.955 2 HA MET 1 HA MET 1 -5.139 0.675 -16.177 3 HB2 MET 1 1HB MET 1 -5.807 3.623 -15.849 4 HB3 MET 1 2HB MET 1 -4.218 2.918 -15.584 5 HG2 MET 1 1HG MET 1 -5.722 2.926 -18.217 6 HG3 MET 1 2HG MET 1 -4.397 4.006 -17.775 7 HE1 MET 1 3HE MET 1 -2.343 2.206 -16.261 8 HE2 MET 1 1HE MET 1 -1.326 1.627 -17.603 9 HE3 MET 1 2HE MET 1 -1.895 3.314 -17.582 10 H ALA 2 H ALA 2 -4.274 0.112 -14.308 11 HA ALA 2 HA ALA 2 -5.717 0.979 -11.835 12 HB1 ALA 2 3HB ALA 2 -4.377 -1.693 -12.385 13 HB2 ALA 2 1HB ALA 2 -5.115 -1.199 -10.844 14 HB3 ALA 2 2HB ALA 2 -6.129 -1.400 -12.292 15 H LYS 3 H LYS 3 -4.383 0.835 -9.849 16 HA LYS 3 HA LYS 3 -1.576 1.708 -10.454 17 HB2 LYS 3 1HB LYS 3 -3.452 2.464 -8.181 18 HB3 LYS 3 2HB LYS 3 -1.742 2.872 -8.216 19 HG2 LYS 3 1HG LYS 3 -2.133 4.136 -10.341 20 HG3 LYS 3 2HG LYS 3 -3.863 3.808 -10.167 21 HD2 LYS 3 1HD LYS 3 -3.912 4.990 -8.026 22 HD3 LYS 3 2HD LYS 3 -2.161 5.233 -8.089 23 HE2 LYS 3 1HE LYS 3 -4.089 6.297 -10.181 24 HE3 LYS 3 2HE LYS 3 -3.530 7.232 -8.791 25 HZ1 LYS 3 3HZ LYS 3 -1.805 6.088 -10.886 26 HZ2 LYS 3 1HZ LYS 3 -2.223 7.676 -10.737 27 HZ3 LYS 3 2HZ LYS 3 -1.282 6.961 -9.587 28 H LYS 4 H LYS 4 0.100 0.735 -9.574 29 HA LYS 4 HA LYS 4 -0.361 -1.080 -7.250 30 HB2 LYS 4 1HB LYS 4 1.229 -1.843 -9.731 31 HB3 LYS 4 2HB LYS 4 1.067 -2.805 -8.268 32 HG2 LYS 4 1HG LYS 4 -1.367 -3.012 -8.684 33 HG3 LYS 4 2HG LYS 4 -1.176 -2.080 -10.175 34 HD2 LYS 4 1HD LYS 4 0.346 -3.785 -11.078 35 HD3 LYS 4 2HD LYS 4 0.238 -4.703 -9.569 36 HE2 LYS 4 1HE LYS 4 -2.242 -4.907 -9.942 37 HE3 LYS 4 2HE LYS 4 -2.026 -4.133 -11.515 38 HZ1 LYS 4 3HZ LYS 4 -0.769 -6.658 -10.666 39 HZ2 LYS 4 1HZ LYS 4 -2.049 -6.511 -11.697 40 HZ3 LYS 4 2HZ LYS 4 -0.566 -5.934 -12.135 41 H GLY 5 H GLY 5 1.852 -1.923 -6.464 42 HA2 GLY 5 1HA GLY 5 4.177 -0.308 -6.998 43 HA3 GLY 5 2HA GLY 5 3.390 0.199 -5.485 44 H TYR 6 H TYR 6 5.765 -0.593 -4.969 45 HA TYR 6 HA TYR 6 5.368 -3.136 -3.535 46 HB2 TYR 6 1HB TYR 6 7.296 -4.263 -4.421 47 HB3 TYR 6 2HB TYR 6 6.265 -3.830 -5.779 48 HD1 TYR 6 1HD TYR 6 9.389 -3.013 -3.986 49 HD2 TYR 6 2HD TYR 6 6.980 -2.291 -7.462 50 HE1 TYR 6 1HE TYR 6 11.294 -1.869 -5.068 51 HE2 TYR 6 2HE TYR 6 8.886 -1.147 -8.544 52 HH TYR 6 HH TYR 6 11.889 -0.529 -6.806 53 H ILE 7 H ILE 7 6.891 -3.529 -1.896 54 HA ILE 7 HA ILE 7 8.647 -1.172 -1.250 55 HB ILE 7 HB ILE 7 7.177 -3.071 0.646 56 HG12 ILE 7 1HG1 ILE 7 6.812 -0.102 0.183 57 HG13 ILE 7 1HG2 ILE 7 5.730 -1.364 -0.387 58 HG21 ILE 7 2HG1 ILE 7 8.141 -1.686 2.438 59 HG22 ILE 7 2HG2 ILE 7 9.419 -2.467 1.477 60 HG23 ILE 7 2HG3 ILE 7 9.047 -0.745 1.229 61 HD11 ILE 7 1HD3 ILE 7 6.357 -0.748 2.509 62 HD12 ILE 7 1HD1 ILE 7 4.871 -0.317 1.632 63 HD13 ILE 7 1HD2 ILE 7 5.263 -2.027 1.933 64 H LEU 8 H LEU 8 10.608 -1.604 -1.779 65 HA LEU 8 HA LEU 8 11.709 -4.313 -1.372 66 HB2 LEU 8 1HB LEU 8 12.267 -2.310 -3.165 67 HB3 LEU 8 2HB LEU 8 13.517 -2.022 -1.951 68 HG LEU 8 HG LEU 8 13.078 -4.576 -3.536 69 HD11 LEU 8 1HD1 LEU 8 15.278 -4.018 -4.473 70 HD12 LEU 8 1HD2 LEU 8 14.082 -2.741 -4.798 71 HD13 LEU 8 1HD3 LEU 8 15.301 -2.514 -3.522 72 HD21 LEU 8 2HD3 LEU 8 13.788 -5.052 -1.216 73 HD22 LEU 8 2HD1 LEU 8 15.105 -5.377 -2.369 74 HD23 LEU 8 2HD2 LEU 8 15.127 -3.892 -1.387 75 H MET 9 H MET 9 12.335 -5.013 0.495 76 HA MET 9 HA MET 9 12.929 -3.118 2.675 77 HB2 MET 9 1HB MET 9 12.994 -6.157 2.621 78 HB3 MET 9 2HB MET 9 13.100 -5.146 4.054 79 HG2 MET 9 1HG MET 9 10.711 -5.383 2.204 80 HG3 MET 9 2HG MET 9 10.870 -6.082 3.817 81 HE1 MET 9 3HE MET 9 12.206 -3.881 5.563 82 HE2 MET 9 1HE MET 9 10.786 -2.985 6.156 83 HE3 MET 9 2HE MET 9 10.736 -4.761 6.047 84 H GLU 10 H GLU 10 14.809 -3.147 3.949 85 HA GLU 10 HA GLU 10 17.218 -2.983 2.416 86 HB2 GLU 10 1HB GLU 10 16.805 -1.785 4.580 87 HB3 GLU 10 2HB GLU 10 16.893 -3.321 5.428 88 HG2 GLU 10 1HG GLU 10 18.979 -2.199 5.679 89 HG3 GLU 10 2HG GLU 10 19.229 -3.595 4.633 90 H ASN 11 H ASN 11 15.724 -5.644 4.115 91 HA ASN 11 HA ASN 11 18.190 -7.279 3.940 92 HB2 ASN 11 1HB ASN 11 15.413 -7.863 5.006 93 HB3 ASN 11 2HB ASN 11 16.733 -9.025 4.986 94 HD21 ASN 11 2HD2 ASN 11 15.145 -6.867 6.863 95 HD22 ASN 11 2HD1 ASN 11 16.382 -6.508 8.020 96 H GLY 12 H GLY 12 15.939 -6.341 1.769 97 HA2 GLY 12 1HA GLY 12 15.907 -7.095 -0.466 98 HA3 GLY 12 2HA GLY 12 16.649 -8.628 0.046 99 H GLY 13 H GLY 13 14.134 -7.800 2.118 100 HA2 GLY 13 1HA GLY 13 12.463 -9.960 1.054 101 HA3 GLY 13 2HA GLY 13 12.189 -9.028 2.544 102 H LYS 14 H LYS 14 12.267 -8.531 -1.009 103 HA LYS 14 HA LYS 14 10.610 -6.162 -0.891 104 HB2 LYS 14 1HB LYS 14 12.238 -6.723 -2.739 105 HB3 LYS 14 2HB LYS 14 11.139 -7.990 -3.264 106 HG2 LYS 14 1HG LYS 14 9.400 -6.332 -3.732 107 HG3 LYS 14 2HG LYS 14 10.452 -5.039 -3.138 108 HD2 LYS 14 1HD LYS 14 10.853 -4.899 -5.412 109 HD3 LYS 14 2HD LYS 14 12.144 -6.007 -4.927 110 HE2 LYS 14 1HE LYS 14 10.763 -7.935 -5.581 111 HE3 LYS 14 2HE LYS 14 9.435 -6.856 -6.016 112 HZ1 LYS 14 3HZ LYS 14 12.089 -6.896 -7.290 113 HZ2 LYS 14 1HZ LYS 14 10.699 -7.514 -7.928 114 HZ3 LYS 14 2HZ LYS 14 10.849 -5.888 -7.697 115 H ILE 15 H ILE 15 8.529 -5.889 -0.778 116 HA ILE 15 HA ILE 15 6.750 -8.228 -1.430 117 HB ILE 15 HB ILE 15 5.138 -7.277 0.182 118 HG12 ILE 15 1HG1 ILE 15 7.230 -5.186 0.818 119 HG13 ILE 15 1HG2 ILE 15 5.823 -4.904 -0.196 120 HG21 ILE 15 2HG1 ILE 15 6.373 -7.663 2.275 121 HG22 ILE 15 2HG2 ILE 15 6.802 -8.877 1.048 122 HG23 ILE 15 2HG3 ILE 15 7.914 -7.532 1.395 123 HD11 ILE 15 1HD3 ILE 15 5.767 -5.738 2.714 124 HD12 ILE 15 1HD1 ILE 15 5.445 -4.111 2.071 125 HD13 ILE 15 1HD2 ILE 15 4.342 -5.454 1.686 126 H GLU 16 H GLU 16 4.754 -7.851 -2.366 127 HA GLU 16 HA GLU 16 4.692 -5.313 -3.965 128 HB2 GLU 16 1HB GLU 16 4.117 -8.150 -4.920 129 HB3 GLU 16 2HB GLU 16 3.825 -6.695 -5.863 130 HG2 GLU 16 1HG GLU 16 6.240 -6.181 -5.804 131 HG3 GLU 16 2HG GLU 16 6.522 -7.659 -4.885 132 H PHE 17 H PHE 17 2.754 -4.418 -4.432 133 HA PHE 17 HA PHE 17 0.313 -5.665 -3.295 134 HB2 PHE 17 1HB PHE 17 -0.178 -3.727 -1.884 135 HB3 PHE 17 2HB PHE 17 1.340 -4.454 -1.383 136 HD1 PHE 17 1HD PHE 17 -0.208 -1.575 -3.071 137 HD2 PHE 17 2HD PHE 17 3.426 -3.286 -1.613 138 HE1 PHE 17 1HE PHE 17 0.915 0.615 -3.302 139 HE2 PHE 17 2HE PHE 17 4.551 -1.096 -1.841 140 HZ PHE 17 HZ PHE 17 3.295 0.855 -2.688 141 H GLU 18 H GLU 18 -1.639 -4.550 -3.815 142 HA GLU 18 HA GLU 18 -1.349 -2.787 -6.224 143 HB2 GLU 18 1HB GLU 18 -3.686 -4.510 -5.293 144 HB3 GLU 18 2HB GLU 18 -3.723 -3.436 -6.684 145 HG2 GLU 18 1HG GLU 18 -1.928 -4.758 -7.744 146 HG3 GLU 18 2HG GLU 18 -1.917 -5.841 -6.355 147 H LEU 19 H LEU 19 -2.934 -1.099 -6.506 148 HA LEU 19 HA LEU 19 -3.827 0.037 -3.877 149 HB2 LEU 19 1HB LEU 19 -2.775 1.477 -6.347 150 HB3 LEU 19 2HB LEU 19 -3.483 2.280 -4.942 151 HG LEU 19 HG LEU 19 -0.959 0.591 -4.858 152 HD11 LEU 19 1HD1 LEU 19 0.216 2.741 -4.710 153 HD12 LEU 19 1HD2 LEU 19 -0.654 2.572 -6.252 154 HD13 LEU 19 1HD3 LEU 19 -1.322 3.599 -4.962 155 HD21 LEU 19 2HD3 LEU 19 -2.213 0.721 -2.731 156 HD22 LEU 19 2HD1 LEU 19 -0.698 1.653 -2.641 157 HD23 LEU 19 2HD2 LEU 19 -2.250 2.496 -2.862 158 H PHE 20 H PHE 20 -5.653 1.447 -3.933 159 HA PHE 20 HA PHE 20 -7.528 0.800 -6.183 160 HB2 PHE 20 1HB PHE 20 -8.223 0.856 -3.216 161 HB3 PHE 20 2HB PHE 20 -9.331 0.525 -4.540 162 HD1 PHE 20 2HD PHE 20 -8.952 -1.550 -5.951 163 HD2 PHE 20 1HD PHE 20 -6.954 -0.857 -2.239 164 HE1 PHE 20 2HE PHE 20 -8.442 -3.963 -5.777 165 HE2 PHE 20 1HE PHE 20 -6.439 -3.269 -2.063 166 HZ PHE 20 HZ PHE 20 -7.184 -4.821 -3.833 167 HA PRO 21 HA PRO 21 -7.402 5.358 -5.486 168 HB2 PRO 21 1HB PRO 21 -7.346 5.943 -8.189 169 HB3 PRO 21 2HB PRO 21 -5.857 5.623 -7.292 170 HG2 PRO 21 1HG PRO 21 -7.503 3.714 -9.006 171 HG3 PRO 21 2HG PRO 21 -5.758 3.980 -9.034 172 HD2 PRO 21 1HD PRO 21 -6.786 1.882 -7.683 173 HD3 PRO 21 2HD PRO 21 -5.396 2.815 -6.998 174 H ASN 22 H ASN 22 -9.323 3.063 -7.218 175 HA ASN 22 HA ASN 22 -11.522 4.909 -7.753 176 HB2 ASN 22 1HB ASN 22 -11.309 1.891 -7.706 177 HB3 ASN 22 2HB ASN 22 -12.804 2.747 -8.059 178 HD21 ASN 22 2HD2 ASN 22 -11.497 0.989 -9.826 179 HD22 ASN 22 2HD1 ASN 22 -10.983 1.898 -11.209 180 H GLU 23 H GLU 23 -10.396 3.177 -4.990 181 HA GLU 23 HA GLU 23 -13.042 3.548 -3.638 182 HB2 GLU 23 1HB GLU 23 -10.624 1.872 -2.837 183 HB3 GLU 23 2HB GLU 23 -12.130 1.983 -1.938 184 HG2 GLU 23 1HG GLU 23 -13.345 0.967 -3.806 185 HG3 GLU 23 2HG GLU 23 -11.858 0.896 -4.749 186 H ALA 24 H ALA 24 -9.644 4.431 -3.526 187 HA ALA 24 HA ALA 24 -10.395 6.562 -1.598 188 HB1 ALA 24 3HB ALA 24 -7.988 4.734 -1.282 189 HB2 ALA 24 1HB ALA 24 -8.338 6.170 -0.292 190 HB3 ALA 24 2HB ALA 24 -9.426 4.762 -0.235 191 HA PRO 25 HA PRO 25 -8.114 8.046 -5.398 192 HB2 PRO 25 1HB PRO 25 -9.907 10.345 -4.460 193 HB3 PRO 25 2HB PRO 25 -9.500 9.884 -6.117 194 HG2 PRO 25 1HG PRO 25 -11.894 9.209 -5.187 195 HG3 PRO 25 2HG PRO 25 -10.977 8.014 -6.111 196 HD2 PRO 25 1HD PRO 25 -11.377 8.228 -3.112 197 HD3 PRO 25 2HD PRO 25 -11.295 6.750 -4.153 198 H VAL 26 H VAL 26 -8.931 9.804 -2.392 199 HA VAL 26 HA VAL 26 -6.699 11.651 -2.722 200 HB VAL 26 HB VAL 26 -8.417 10.925 -0.299 201 HG11 VAL 26 1HG1 VAL 26 -7.589 13.002 0.695 202 HG12 VAL 26 1HG2 VAL 26 -6.278 11.835 0.402 203 HG13 VAL 26 1HG3 VAL 26 -6.491 13.225 -0.689 204 HG21 VAL 26 2HG3 VAL 26 -9.683 11.922 -2.171 205 HG22 VAL 26 2HG1 VAL 26 -9.564 13.058 -0.806 206 HG23 VAL 26 2HG2 VAL 26 -8.527 13.273 -2.236 207 H THR 27 H THR 27 -7.194 8.820 -0.615 208 HA THR 27 HA THR 27 -4.655 9.155 0.712 209 HB THR 27 HB THR 27 -6.383 6.656 0.419 210 HG1 THR 27 1HG THR 27 -7.433 8.451 1.441 211 HG21 THR 27 2HG3 THR 27 -4.199 7.373 2.412 212 HG22 THR 27 2HG1 THR 27 -5.204 5.905 2.448 213 HG23 THR 27 2HG2 THR 27 -4.060 6.169 1.110 214 H VAL 28 H VAL 28 -5.688 7.176 -2.050 215 HA VAL 28 HA VAL 28 -3.133 5.845 -2.407 216 HB VAL 28 HB VAL 28 -5.408 6.480 -4.349 217 HG11 VAL 28 1HG1 VAL 28 -4.408 4.802 -5.821 218 HG12 VAL 28 1HG2 VAL 28 -3.326 6.190 -5.563 219 HG13 VAL 28 1HG3 VAL 28 -3.023 4.655 -4.714 220 HG21 VAL 28 2HG3 VAL 28 -6.029 4.976 -2.489 221 HG22 VAL 28 2HG1 VAL 28 -5.974 4.092 -4.031 222 HG23 VAL 28 2HG2 VAL 28 -4.637 3.932 -2.866 223 H ALA 29 H ALA 29 -4.514 8.786 -3.852 224 HA ALA 29 HA ALA 29 -2.303 9.341 -5.548 225 HB1 ALA 29 3HB ALA 29 -4.193 11.275 -4.160 226 HB2 ALA 29 1HB ALA 29 -3.133 11.665 -5.534 227 HB3 ALA 29 2HB ALA 29 -4.461 10.499 -5.737 228 H ASN 30 H ASN 30 -2.948 10.358 -2.191 229 HA ASN 30 HA ASN 30 -0.545 11.915 -1.911 230 HB2 ASN 30 1HB ASN 30 -2.530 12.057 -0.410 231 HB3 ASN 30 2HB ASN 30 -2.127 10.471 0.232 232 HD21 ASN 30 2HD2 ASN 30 -1.013 10.479 2.045 233 HD22 ASN 30 2HD1 ASN 30 0.058 11.730 2.579 234 H PHE 31 H PHE 31 -1.277 8.522 -1.103 235 HA PHE 31 HA PHE 31 1.271 7.870 -0.011 236 HB2 PHE 31 1HB PHE 31 -0.711 6.379 0.123 237 HB3 PHE 31 2HB PHE 31 -0.652 6.129 -1.614 238 HD1 PHE 31 1HD PHE 31 1.173 5.541 1.554 239 HD2 PHE 31 2HD PHE 31 0.804 4.540 -2.583 240 HE1 PHE 31 1HE PHE 31 2.705 3.629 1.882 241 HE2 PHE 31 2HE PHE 31 2.333 2.625 -2.258 242 HZ PHE 31 HZ PHE 31 3.285 2.170 -0.025 243 H GLU 32 H GLU 32 0.115 7.630 -3.381 244 HA GLU 32 HA GLU 32 2.552 6.664 -4.496 245 HB2 GLU 32 1HB GLU 32 0.449 6.708 -5.768 246 HB3 GLU 32 2HB GLU 32 0.405 8.463 -5.695 247 HG2 GLU 32 1HG GLU 32 2.416 8.604 -7.066 248 HG3 GLU 32 2HG GLU 32 2.552 6.847 -7.084 249 H LYS 33 H LYS 33 1.418 10.022 -4.075 250 HA LYS 33 HA LYS 33 3.653 11.324 -5.214 251 HB2 LYS 33 1HB LYS 33 1.615 12.520 -4.535 252 HB3 LYS 33 2HB LYS 33 1.933 12.158 -2.845 253 HG2 LYS 33 1HG LYS 33 3.939 13.544 -2.879 254 HG3 LYS 33 2HG LYS 33 3.733 13.841 -4.611 255 HD2 LYS 33 1HD LYS 33 1.730 15.095 -4.261 256 HD3 LYS 33 2HD LYS 33 1.592 14.547 -2.585 257 HE2 LYS 33 1HE LYS 33 2.415 16.842 -2.641 258 HE3 LYS 33 2HE LYS 33 3.673 15.771 -2.019 259 HZ1 LYS 33 3HZ LYS 33 3.505 16.786 -4.777 260 HZ2 LYS 33 1HZ LYS 33 4.541 17.320 -3.611 261 HZ3 LYS 33 2HZ LYS 33 4.679 15.783 -4.196 262 H LEU 34 H LEU 34 3.188 10.288 -1.831 263 HA LEU 34 HA LEU 34 5.730 11.286 -0.934 264 HB2 LEU 34 1HB LEU 34 3.936 9.071 0.138 265 HB3 LEU 34 2HB LEU 34 5.352 9.699 0.987 266 HG LEU 34 HG LEU 34 2.928 11.375 0.249 267 HD11 LEU 34 1HD1 LEU 34 2.323 11.171 2.620 268 HD12 LEU 34 1HD2 LEU 34 2.316 9.592 1.801 269 HD13 LEU 34 1HD3 LEU 34 3.670 10.035 2.866 270 HD21 LEU 34 2HD3 LEU 34 5.046 12.621 0.527 271 HD22 LEU 34 2HD1 LEU 34 3.927 12.952 1.870 272 HD23 LEU 34 2HD2 LEU 34 5.298 11.841 2.107 273 H ALA 35 H ALA 35 4.703 8.033 -1.975 274 HA ALA 35 HA ALA 35 7.176 6.768 -1.354 275 HB1 ALA 35 3HB ALA 35 5.114 6.038 -3.464 276 HB2 ALA 35 1HB ALA 35 6.396 4.968 -2.851 277 HB3 ALA 35 2HB ALA 35 5.100 5.520 -1.763 278 H ASN 36 H ASN 36 6.017 8.265 -4.368 279 HA ASN 36 HA ASN 36 8.455 7.471 -5.806 280 HB2 ASN 36 1HB ASN 36 6.030 9.120 -6.541 281 HB3 ASN 36 2HB ASN 36 7.412 8.932 -7.612 282 HD21 ASN 36 2HD2 ASN 36 4.848 8.108 -8.288 283 HD22 ASN 36 2HD1 ASN 36 4.828 6.380 -8.411 284 H GLU 37 H GLU 37 7.833 9.820 -3.560 285 HA GLU 37 HA GLU 37 10.047 11.508 -4.673 286 HB2 GLU 37 1HB GLU 37 8.031 12.017 -2.447 287 HB3 GLU 37 2HB GLU 37 9.405 13.064 -2.777 288 HG2 GLU 37 1HG GLU 37 8.539 13.533 -5.016 289 HG3 GLU 37 2HG GLU 37 7.185 12.440 -4.737 290 H GLY 38 H GLY 38 9.668 8.816 -2.872 291 HA2 GLY 38 1HA GLY 38 11.439 7.658 -1.871 292 HA3 GLY 38 2HA GLY 38 12.406 9.151 -1.883 293 H PHE 39 H PHE 39 9.212 9.423 -0.629 294 HA PHE 39 HA PHE 39 10.099 10.397 1.902 295 HB2 PHE 39 1HB PHE 39 7.889 10.953 0.950 296 HB3 PHE 39 2HB PHE 39 7.392 9.272 1.067 297 HD1 PHE 39 1HD PHE 39 8.270 12.284 3.020 298 HD2 PHE 39 2HD PHE 39 6.611 8.347 3.113 299 HE1 PHE 39 1HE PHE 39 7.419 12.697 5.305 300 HE2 PHE 39 2HE PHE 39 5.757 8.758 5.396 301 HZ PHE 39 HZ PHE 39 6.163 10.935 6.493 302 H TYR 40 H TYR 40 8.887 7.189 0.954 303 HA TYR 40 HA TYR 40 9.102 6.243 3.743 304 HB2 TYR 40 1HB TYR 40 8.317 4.815 1.173 305 HB3 TYR 40 2HB TYR 40 8.274 4.098 2.777 306 HD1 TYR 40 2HD TYR 40 6.790 5.223 4.553 307 HD2 TYR 40 1HD TYR 40 6.492 6.008 0.345 308 HE1 TYR 40 2HE TYR 40 4.496 6.082 4.876 309 HE2 TYR 40 1HE TYR 40 4.197 6.868 0.670 310 HH TYR 40 HH TYR 40 2.740 7.046 3.917 311 H ASN 41 H ASN 41 11.214 6.625 1.174 312 HA ASN 41 HA ASN 41 12.851 4.258 1.568 313 HB2 ASN 41 1HB ASN 41 12.904 5.665 -0.483 314 HB3 ASN 41 2HB ASN 41 13.614 6.972 0.455 315 HD21 ASN 41 2HD2 ASN 41 14.708 5.556 -1.825 316 HD22 ASN 41 2HD1 ASN 41 16.203 4.856 -1.299 317 H GLY 42 H GLY 42 13.711 3.741 3.415 318 HA2 GLY 42 1HA GLY 42 15.579 4.081 4.915 319 HA3 GLY 42 2HA GLY 42 15.299 5.837 4.825 320 H LEU 43 H LEU 43 12.279 4.832 4.973 321 HA LEU 43 HA LEU 43 12.077 5.121 7.897 322 HB2 LEU 43 1HB LEU 43 9.966 4.651 5.750 323 HB3 LEU 43 2HB LEU 43 9.630 4.991 7.451 324 HG LEU 43 HG LEU 43 10.757 6.859 5.354 325 HD11 LEU 43 1HD1 LEU 43 8.837 8.225 6.042 326 HD12 LEU 43 1HD2 LEU 43 8.330 6.617 5.473 327 HD13 LEU 43 1HD3 LEU 43 8.368 6.974 7.216 328 HD21 LEU 43 2HD3 LEU 43 12.108 7.080 7.413 329 HD22 LEU 43 2HD1 LEU 43 11.058 8.497 7.180 330 HD23 LEU 43 2HD2 LEU 43 10.619 7.250 8.372 331 H THR 44 H THR 44 10.725 3.681 9.185 332 HA THR 44 HA THR 44 11.401 0.844 8.472 333 HB THR 44 HB THR 44 11.992 0.448 10.807 334 HG1 THR 44 1HG THR 44 12.006 2.253 12.264 335 HG21 THR 44 2HG3 THR 44 13.353 2.960 9.761 336 HG22 THR 44 2HG1 THR 44 14.003 1.858 10.996 337 HG23 THR 44 2HG2 THR 44 13.781 1.289 9.325 338 H PHE 45 H PHE 45 10.210 -0.785 9.721 339 HA PHE 45 HA PHE 45 7.406 0.068 10.250 340 HB2 PHE 45 1HB PHE 45 8.775 -2.641 10.034 341 HB3 PHE 45 2HB PHE 45 7.126 -2.459 10.611 342 HD1 PHE 45 2HD PHE 45 5.343 -1.708 9.104 343 HD2 PHE 45 1HD PHE 45 9.331 -2.345 7.711 344 HE1 PHE 45 2HE PHE 45 4.521 -1.736 6.773 345 HE2 PHE 45 1HE PHE 45 8.513 -2.371 5.378 346 HZ PHE 45 HZ PHE 45 6.108 -2.066 4.909 347 H HIS 46 H HIS 46 6.896 0.793 12.159 348 HA HIS 46 HA HIS 46 8.825 0.629 14.317 349 HB2 HIS 46 1HB HIS 46 7.241 2.581 13.829 350 HB3 HIS 46 2HB HIS 46 5.943 1.591 14.480 351 HD2 HIS 46 2HD HIS 46 5.551 2.135 17.229 352 HE1 HIS 46 1HE HIS 46 9.545 3.352 18.009 353 H ARG 47 H ARG 47 5.715 -0.932 13.666 354 HA ARG 47 HA ARG 47 6.282 -2.826 15.897 355 HB2 ARG 47 1HB ARG 47 3.720 -1.224 15.542 356 HB3 ARG 47 2HB ARG 47 3.857 -2.639 16.575 357 HG2 ARG 47 1HG ARG 47 5.554 -0.160 16.925 358 HG3 ARG 47 2HG ARG 47 4.002 -0.436 17.752 359 HD2 ARG 47 1HD ARG 47 4.908 -2.490 18.717 360 HD3 ARG 47 2HD ARG 47 6.468 -2.148 17.934 361 HE ARG 47 HE ARG 47 5.294 -0.780 20.243 362 HH11 ARG 47 1HH1 ARG 47 7.816 -0.860 17.799 363 HH12 ARG 47 1HH2 ARG 47 8.890 0.191 18.693 364 HH21 ARG 47 2HH1 ARG 47 6.696 0.586 21.394 365 HH22 ARG 47 2HH2 ARG 47 8.258 1.011 20.728 366 H VAL 48 H VAL 48 6.753 -4.385 14.386 367 HA VAL 48 HA VAL 48 4.582 -5.255 12.538 368 HB VAL 48 HB VAL 48 7.323 -6.455 13.164 369 HG11 VAL 48 1HG1 VAL 48 6.985 -7.760 11.123 370 HG12 VAL 48 1HG2 VAL 48 5.748 -8.115 12.353 371 HG13 VAL 48 1HG3 VAL 48 5.349 -7.081 10.960 372 HG21 VAL 48 2HG3 VAL 48 7.487 -4.222 12.120 373 HG22 VAL 48 2HG1 VAL 48 7.990 -5.495 10.983 374 HG23 VAL 48 2HG2 VAL 48 6.383 -4.745 10.824 375 H ILE 49 H ILE 49 2.940 -6.285 13.256 376 HA ILE 49 HA ILE 49 3.414 -8.430 15.311 377 HB ILE 49 HB ILE 49 0.920 -6.682 15.029 378 HG12 ILE 49 1HG1 ILE 49 3.046 -6.527 17.178 379 HG13 ILE 49 1HG2 ILE 49 2.911 -5.407 15.832 380 HG21 ILE 49 2HG1 ILE 49 0.289 -7.718 17.172 381 HG22 ILE 49 2HG2 ILE 49 0.520 -8.950 15.909 382 HG23 ILE 49 2HG3 ILE 49 1.776 -8.695 17.143 383 HD11 ILE 49 1HD3 ILE 49 0.805 -5.881 17.952 384 HD12 ILE 49 1HD1 ILE 49 1.903 -4.485 17.842 385 HD13 ILE 49 1HD2 ILE 49 0.668 -4.748 16.587 386 HA PRO 50 HA PRO 50 1.743 -10.668 11.793 387 HB2 PRO 50 1HB PRO 50 2.879 -13.058 12.559 388 HB3 PRO 50 2HB PRO 50 3.836 -11.836 11.713 389 HG2 PRO 50 1HG PRO 50 3.654 -12.384 14.708 390 HG3 PRO 50 2HG PRO 50 5.104 -12.179 13.721 391 HD2 PRO 50 1HD PRO 50 4.126 -10.111 15.167 392 HD3 PRO 50 2HD PRO 50 4.821 -9.836 13.519 393 H GLY 51 H GLY 51 -0.035 -11.801 11.636 394 HA2 GLY 51 1HA GLY 51 -1.871 -13.072 12.363 395 HA3 GLY 51 2HA GLY 51 -1.154 -13.165 13.987 396 H PHE 52 H PHE 52 -0.993 -10.000 12.962 397 HA PHE 52 HA PHE 52 -3.761 -9.264 13.739 398 HB2 PHE 52 1HB PHE 52 -2.469 -9.342 15.881 399 HB3 PHE 52 2HB PHE 52 -1.299 -8.221 15.204 400 HD1 PHE 52 1HD PHE 52 -5.034 -8.419 15.481 401 HD2 PHE 52 2HD PHE 52 -1.499 -6.062 15.933 402 HE1 PHE 52 1HE PHE 52 -6.405 -6.517 16.267 403 HE2 PHE 52 2HE PHE 52 -2.866 -4.159 16.722 404 HZ PHE 52 HZ PHE 52 -5.320 -4.387 16.887 405 H VAL 53 H VAL 53 -1.120 -7.022 13.979 406 HA VAL 53 HA VAL 53 -1.591 -5.968 11.230 407 HB VAL 53 HB VAL 53 -2.076 -4.354 13.781 408 HG11 VAL 53 1HG1 VAL 53 -2.611 -2.507 12.269 409 HG12 VAL 53 1HG2 VAL 53 -0.928 -3.052 12.084 410 HG13 VAL 53 1HG3 VAL 53 -2.152 -3.514 10.877 411 HG21 VAL 53 2HG3 VAL 53 -3.973 -5.829 13.203 412 HG22 VAL 53 2HG1 VAL 53 -4.381 -4.122 12.912 413 HG23 VAL 53 2HG2 VAL 53 -3.970 -5.184 11.545 414 H SER 54 H SER 54 0.172 -5.395 10.315 415 HA SER 54 HA SER 54 2.617 -4.794 11.960 416 HB2 SER 54 1HB SER 54 2.305 -5.228 9.038 417 HB3 SER 54 2HB SER 54 3.795 -4.918 9.916 418 HG SER 54 HG SER 54 3.341 -6.760 11.161 419 H GLN 55 H GLN 55 2.624 -2.700 12.631 420 HA GLN 55 HA GLN 55 1.539 -0.614 10.794 421 HB2 GLN 55 1HB GLN 55 0.662 -0.732 13.143 422 HB3 GLN 55 2HB GLN 55 2.288 -0.440 13.743 423 HG2 GLN 55 1HG GLN 55 2.327 1.754 12.711 424 HG3 GLN 55 2HG GLN 55 0.724 1.459 11.983 425 HE21 GLN 55 2HE2 GLN 55 0.789 3.677 13.358 426 HE22 GLN 55 2HE1 GLN 55 0.067 3.519 14.924 427 H GLY 56 H GLY 56 2.710 0.866 9.839 428 HA2 GLY 56 1HA GLY 56 5.604 0.612 9.889 429 HA3 GLY 56 2HA GLY 56 4.652 1.794 8.961 430 H GLY 57 H GLY 57 6.996 2.595 10.098 431 HA2 GLY 57 1HA GLY 57 6.310 3.916 12.668 432 HA3 GLY 57 2HA GLY 57 7.931 3.784 11.948 433 H CYS 58 H CYS 58 8.580 5.848 11.755 434 HA CYS 58 HA CYS 58 7.161 7.679 9.882 435 HB2 CYS 58 1HB CYS 58 6.746 9.421 11.351 436 HB3 CYS 58 2HB CYS 58 5.867 7.992 11.876 437 HG CYS 58 HG CYS 58 7.969 7.332 13.542 438 HA PRO 59 HA PRO 59 11.211 9.314 9.261 439 HB2 PRO 59 1HB PRO 59 9.921 12.033 9.764 440 HB3 PRO 59 2HB PRO 59 10.921 11.532 8.395 441 HG2 PRO 59 1HG PRO 59 8.301 11.738 8.016 442 HG3 PRO 59 2HG PRO 59 9.143 10.335 7.353 443 HD2 PRO 59 1HD PRO 59 7.468 10.547 9.883 444 HD3 PRO 59 2HD PRO 59 7.509 9.224 8.650 445 H ARG 60 H ARG 60 9.329 10.416 12.014 446 HA ARG 60 HA ARG 60 11.659 11.562 13.367 447 HB2 ARG 60 1HB ARG 60 8.889 10.812 14.385 448 HB3 ARG 60 2HB ARG 60 10.102 11.679 15.317 449 HG2 ARG 60 1HG ARG 60 10.025 13.527 13.674 450 HG3 ARG 60 2HG ARG 60 8.752 12.654 12.788 451 HD2 ARG 60 1HD ARG 60 7.736 14.281 14.187 452 HD3 ARG 60 2HD ARG 60 7.398 12.669 14.857 453 HE ARG 60 HE ARG 60 9.744 13.761 16.049 454 HH11 ARG 60 1HH1 ARG 60 6.247 14.091 16.036 455 HH12 ARG 60 1HH2 ARG 60 6.173 14.696 17.675 456 HH21 ARG 60 2HH1 ARG 60 9.636 14.547 18.176 457 HH22 ARG 60 2HH2 ARG 60 8.090 14.955 18.887 458 H GLY 61 H GLY 61 10.221 8.422 13.096 459 HA2 GLY 61 1HA GLY 61 11.075 6.383 13.811 460 HA3 GLY 61 2HA GLY 61 12.469 7.245 14.505 461 H ASN 62 H ASN 62 9.419 8.472 15.455 462 HA ASN 62 HA ASN 62 9.796 7.257 18.163 463 HB2 ASN 62 1HB ASN 62 8.325 9.741 17.243 464 HB3 ASN 62 2HB ASN 62 8.274 9.113 18.886 465 HD21 ASN 62 2HD2 ASN 62 9.292 11.658 17.857 466 HD22 ASN 62 2HD1 ASN 62 10.946 11.748 18.365 467 H GLY 63 H GLY 63 7.930 6.919 15.392 468 HA2 GLY 63 1HA GLY 63 6.247 5.240 15.181 469 HA3 GLY 63 2HA GLY 63 5.921 5.360 16.926 470 H THR 64 H THR 64 6.158 8.458 16.227 471 HA THR 64 HA THR 64 3.270 8.714 15.448 472 HB THR 64 HB THR 64 4.964 10.544 17.205 473 HG1 THR 64 1HG THR 64 3.472 9.800 18.818 474 HG21 THR 64 2HG3 THR 64 2.026 10.670 16.424 475 HG22 THR 64 2HG1 THR 64 2.847 11.751 17.573 476 HG23 THR 64 2HG2 THR 64 3.300 11.771 15.852 477 H GLY 65 H GLY 65 2.990 9.351 13.474 478 HA2 GLY 65 1HA GLY 65 5.095 10.545 11.913 479 HA3 GLY 65 2HA GLY 65 3.397 10.346 11.423 480 H ASP 66 H ASP 66 5.339 12.618 11.131 481 HA ASP 66 HA ASP 66 3.397 14.714 11.835 482 HB2 ASP 66 1HB ASP 66 5.022 14.391 13.843 483 HB3 ASP 66 2HB ASP 66 6.259 15.055 12.785 484 H ALA 67 H ALA 67 4.074 13.697 9.372 485 HA ALA 67 HA ALA 67 6.215 15.274 8.186 486 HB1 ALA 67 3HB ALA 67 4.025 13.606 6.901 487 HB2 ALA 67 1HB ALA 67 5.442 14.279 6.065 488 HB3 ALA 67 2HB ALA 67 5.658 13.042 7.326 489 H GLY 68 H GLY 68 2.793 15.661 8.682 490 HA2 GLY 68 1HA GLY 68 1.853 17.872 8.715 491 HA3 GLY 68 2HA GLY 68 3.049 18.382 7.500 492 H TYR 69 H TYR 69 2.150 15.453 6.436 493 HA TYR 69 HA TYR 69 0.315 16.604 4.431 494 HB2 TYR 69 1HB TYR 69 1.581 13.858 4.749 495 HB3 TYR 69 2HB TYR 69 0.473 14.278 3.450 496 HD1 TYR 69 1HD TYR 69 3.788 15.013 4.928 497 HD2 TYR 69 2HD TYR 69 1.180 15.534 1.562 498 HE1 TYR 69 1HE TYR 69 5.679 15.890 3.600 499 HE2 TYR 69 2HE TYR 69 3.071 16.410 0.233 500 HH TYR 69 HH TYR 69 6.329 16.693 1.633 501 H THR 70 H THR 70 -1.212 17.034 6.318 502 HA THR 70 HA THR 70 -2.805 14.734 7.186 503 HB THR 70 HB THR 70 -3.389 17.726 7.344 504 HG1 THR 70 1HG THR 70 -2.678 17.404 9.529 505 HG21 THR 70 2HG3 THR 70 -4.631 15.352 8.785 506 HG22 THR 70 2HG1 THR 70 -5.008 17.064 9.078 507 HG23 THR 70 2HG2 THR 70 -5.413 16.319 7.514 508 H ILE 71 H ILE 71 -4.243 13.696 6.084 509 HA ILE 71 HA ILE 71 -5.662 15.143 3.858 510 HB ILE 71 HB ILE 71 -5.737 12.949 2.676 511 HG12 ILE 71 1HG1 ILE 71 -3.898 11.924 4.849 512 HG13 ILE 71 1HG2 ILE 71 -5.618 11.577 4.763 513 HG21 ILE 71 2HG1 ILE 71 -3.364 12.809 2.038 514 HG22 ILE 71 2HG2 ILE 71 -3.892 14.502 2.168 515 HG23 ILE 71 2HG3 ILE 71 -2.919 13.773 3.467 516 HD11 ILE 71 1HD3 ILE 71 -3.563 10.847 2.666 517 HD12 ILE 71 1HD1 ILE 71 -4.307 9.746 3.847 518 HD13 ILE 71 1HD2 ILE 71 -5.305 10.497 2.579 519 HA PRO 72 HA PRO 72 -9.419 13.922 5.701 520 HB2 PRO 72 1HB PRO 72 -11.043 13.862 3.497 521 HB3 PRO 72 2HB PRO 72 -10.395 15.404 4.073 522 HG2 PRO 72 1HG PRO 72 -9.361 13.616 1.829 523 HG3 PRO 72 2HG PRO 72 -9.651 15.358 1.792 524 HD2 PRO 72 1HD PRO 72 -7.159 14.356 2.226 525 HD3 PRO 72 2HD PRO 72 -7.723 15.862 3.055 526 H CYS 73 H CYS 73 -10.927 12.264 5.882 527 HA CYS 73 HA CYS 73 -9.785 9.601 5.143 528 HB2 CYS 73 1HB CYS 73 -11.981 10.390 6.992 529 HB3 CYS 73 2HB CYS 73 -11.506 8.741 6.612 530 HG CYS 73 HG CYS 73 -9.031 8.996 7.363 531 H GLU 74 H GLU 74 -10.757 8.163 3.804 532 HA GLU 74 HA GLU 74 -12.838 9.290 2.008 533 HB2 GLU 74 1HB GLU 74 -11.168 6.751 1.777 534 HB3 GLU 74 2HB GLU 74 -12.246 7.387 0.544 535 HG2 GLU 74 1HG GLU 74 -9.903 8.971 1.593 536 HG3 GLU 74 2HG GLU 74 -9.745 7.806 0.279 537 H THR 75 H THR 75 -12.687 7.336 4.731 538 HA THR 75 HA THR 75 -14.681 5.357 3.983 539 HB THR 75 HB THR 75 -14.747 4.830 6.387 540 HG1 THR 75 1HG THR 75 -13.912 6.177 7.871 541 HG21 THR 75 2HG3 THR 75 -11.923 5.432 5.425 542 HG22 THR 75 2HG1 THR 75 -12.364 4.305 6.731 543 HG23 THR 75 2HG2 THR 75 -12.856 3.963 5.055 544 H ASP 76 H ASP 76 -14.840 8.662 4.852 545 HA ASP 76 HA ASP 76 -17.530 8.663 5.924 546 HB2 ASP 76 1HB ASP 76 -15.798 10.784 4.604 547 HB3 ASP 76 2HB ASP 76 -17.441 11.114 5.135 548 H ASN 77 H ASN 77 -16.205 8.520 2.701 549 HA ASN 77 HA ASN 77 -18.963 8.835 1.578 550 HB2 ASN 77 1HB ASN 77 -16.230 8.971 0.275 551 HB3 ASN 77 2HB ASN 77 -17.750 8.990 -0.610 552 HD21 ASN 77 2HD2 ASN 77 -15.409 10.855 0.866 553 HD22 ASN 77 2HD1 ASN 77 -16.273 12.353 0.953 554 H ASN 78 H ASN 78 -16.282 6.603 1.948 555 HA ASN 78 HA ASN 78 -18.116 4.392 1.261 556 HB2 ASN 78 1HB ASN 78 -17.012 5.133 -0.901 557 HB3 ASN 78 2HB ASN 78 -15.477 4.644 -0.196 558 HD21 ASN 78 2HD2 ASN 78 -16.491 3.520 -2.518 559 HD22 ASN 78 2HD1 ASN 78 -16.881 1.859 -2.217 560 HA PRO 79 HA PRO 79 -15.613 3.503 4.964 561 HB2 PRO 79 1HB PRO 79 -17.881 1.458 5.007 562 HB3 PRO 79 2HB PRO 79 -17.224 2.393 6.355 563 HG2 PRO 79 1HG PRO 79 -19.561 3.140 5.325 564 HG3 PRO 79 2HG PRO 79 -18.370 4.382 5.721 565 HD2 PRO 79 1HD PRO 79 -19.076 3.190 3.017 566 HD3 PRO 79 2HD PRO 79 -18.694 4.905 3.446 567 H HIS 80 H HIS 80 -14.028 2.156 5.154 568 HA HIS 80 HA HIS 80 -13.886 -0.042 3.126 569 HB2 HIS 80 1HB HIS 80 -11.683 1.454 4.610 570 HB3 HIS 80 2HB HIS 80 -11.411 0.094 3.531 571 HD2 HIS 80 2HD HIS 80 -11.530 0.688 0.795 572 HE1 HIS 80 1HE HIS 80 -12.209 4.866 1.297 573 H ARG 81 H ARG 81 -13.589 -2.091 3.649 574 HA ARG 81 HA ARG 81 -13.606 -2.786 6.541 575 HB2 ARG 81 1HB ARG 81 -13.871 -4.480 4.027 576 HB3 ARG 81 2HB ARG 81 -13.910 -5.118 5.663 577 HG2 ARG 81 1HG ARG 81 -15.932 -3.759 6.125 578 HG3 ARG 81 2HG ARG 81 -15.908 -3.205 4.434 579 HD2 ARG 81 1HD ARG 81 -16.034 -5.567 3.724 580 HD3 ARG 81 2HD ARG 81 -16.228 -6.022 5.432 581 HE ARG 81 HE ARG 81 -18.148 -4.056 4.840 582 HH11 ARG 81 1HH1 ARG 81 -17.370 -7.364 3.945 583 HH12 ARG 81 1HH2 ARG 81 -19.033 -7.798 3.618 584 HH21 ARG 81 2HH1 ARG 81 -20.302 -4.633 4.411 585 HH22 ARG 81 2HH2 ARG 81 -20.693 -6.253 3.881 586 H HIS 82 H HIS 82 -12.138 -4.127 7.528 587 HA HIS 82 HA HIS 82 -9.451 -4.110 6.197 588 HB2 HIS 82 1HB HIS 82 -10.226 -3.997 9.142 589 HB3 HIS 82 2HB HIS 82 -8.581 -4.237 8.574 590 HD2 HIS 82 2HD HIS 82 -7.179 -1.807 8.027 591 HE1 HIS 82 1HE HIS 82 -10.630 0.664 8.182 592 H VAL 83 H VAL 83 -8.983 -5.976 5.348 593 HA VAL 83 HA VAL 83 -9.460 -8.449 7.004 594 HB VAL 83 HB VAL 83 -9.921 -9.662 4.913 595 HG11 VAL 83 1HG1 VAL 83 -12.115 -8.730 4.364 596 HG12 VAL 83 1HG2 VAL 83 -11.821 -8.754 6.119 597 HG13 VAL 83 1HG3 VAL 83 -11.688 -7.226 5.215 598 HG21 VAL 83 2HG3 VAL 83 -8.563 -8.251 3.406 599 HG22 VAL 83 2HG1 VAL 83 -10.222 -8.429 2.789 600 HG23 VAL 83 2HG2 VAL 83 -9.731 -6.921 3.597 601 H THR 84 H THR 84 -8.220 -10.332 5.939 602 HA THR 84 HA THR 84 -5.463 -9.815 6.423 603 HB THR 84 HB THR 84 -6.693 -12.094 4.808 604 HG1 THR 84 1HG THR 84 -6.030 -11.973 7.583 605 HG21 THR 84 2HG3 THR 84 -4.047 -11.860 6.291 606 HG22 THR 84 2HG1 THR 84 -4.660 -13.316 5.473 607 HG23 THR 84 2HG2 THR 84 -4.249 -11.869 4.523 608 H GLY 85 H GLY 85 -4.024 -8.753 5.347 609 HA2 GLY 85 1HA GLY 85 -2.610 -8.671 3.378 610 HA3 GLY 85 2HA GLY 85 -4.041 -8.993 2.372 611 H ALA 86 H ALA 86 -5.521 -7.027 4.245 612 HA ALA 86 HA ALA 86 -5.488 -4.926 2.318 613 HB1 ALA 86 3HB ALA 86 -6.579 -4.933 5.155 614 HB2 ALA 86 1HB ALA 86 -6.973 -3.742 3.894 615 HB3 ALA 86 2HB ALA 86 -7.457 -5.443 3.694 616 H MET 87 H MET 87 -4.626 -2.925 2.245 617 HA MET 87 HA MET 87 -2.730 -2.197 4.458 618 HB2 MET 87 1HB MET 87 -1.649 -2.701 2.243 619 HB3 MET 87 2HB MET 87 -2.581 -1.392 1.530 620 HG2 MET 87 1HG MET 87 -1.486 0.209 3.071 621 HG3 MET 87 2HG MET 87 -0.529 -1.112 3.744 622 HE1 MET 87 3HE MET 87 0.427 -2.903 1.486 623 HE2 MET 87 1HE MET 87 1.900 -2.076 0.925 624 HE3 MET 87 2HE MET 87 1.533 -2.158 2.665 625 H SER 88 H SER 88 -3.266 -0.544 5.646 626 HA SER 88 HA SER 88 -5.462 1.288 4.623 627 HB2 SER 88 1HB SER 88 -6.371 -0.403 6.017 628 HB3 SER 88 2HB SER 88 -5.256 0.027 7.304 629 HG SER 88 HG SER 88 -7.384 1.004 7.312 630 H MET 89 H MET 89 -5.120 3.401 4.932 631 HA MET 89 HA MET 89 -2.626 4.333 6.152 632 HB2 MET 89 1HB MET 89 -3.759 5.377 4.133 633 HB3 MET 89 2HB MET 89 -5.012 5.964 5.216 634 HG2 MET 89 1HG MET 89 -3.482 7.750 4.854 635 HG3 MET 89 2HG MET 89 -3.232 7.184 6.507 636 HE1 MET 89 3HE MET 89 -1.772 7.599 2.945 637 HE2 MET 89 1HE MET 89 -0.367 6.506 2.949 638 HE3 MET 89 2HE MET 89 -2.016 5.834 2.966 639 H ALA 90 H ALA 90 -2.238 5.095 8.086 640 HA ALA 90 HA ALA 90 -4.372 4.904 10.093 641 HB1 ALA 90 3HB ALA 90 -1.452 5.706 10.346 642 HB2 ALA 90 1HB ALA 90 -2.571 5.419 11.699 643 HB3 ALA 90 2HB ALA 90 -2.119 4.079 10.618 644 H HIS 91 H HIS 91 -4.994 6.556 11.520 645 HA HIS 91 HA HIS 91 -4.332 9.340 10.707 646 HB2 HIS 91 1HB HIS 91 -6.684 9.998 10.653 647 HB3 HIS 91 2HB HIS 91 -6.402 8.740 9.457 648 HD2 HIS 91 2HD HIS 91 -8.270 6.771 9.571 649 HE1 HIS 91 1HE HIS 91 -9.471 7.327 13.622 650 H ARG 92 H ARG 92 -5.271 10.946 12.239 651 HA ARG 92 HA ARG 92 -5.255 9.810 15.018 652 HB2 ARG 92 1HB ARG 92 -4.494 12.602 14.073 653 HB3 ARG 92 2HB ARG 92 -4.467 12.038 15.737 654 HG2 ARG 92 1HG ARG 92 -2.749 10.919 13.507 655 HG3 ARG 92 2HG ARG 92 -2.232 12.123 14.713 656 HD2 ARG 92 1HD ARG 92 -3.151 9.308 15.248 657 HD3 ARG 92 2HD ARG 92 -1.490 9.934 15.349 658 HE ARG 92 HE ARG 92 -3.053 11.518 17.036 659 HH11 ARG 92 1HH1 ARG 92 -2.091 8.149 16.778 660 HH12 ARG 92 1HH2 ARG 92 -2.164 7.866 18.503 661 HH21 ARG 92 2HH1 ARG 92 -3.144 11.138 19.273 662 HH22 ARG 92 2HH2 ARG 92 -2.760 9.557 19.916 663 H GLY 93 H GLY 93 -7.565 9.961 13.267 664 HA2 GLY 93 1HA GLY 93 -9.716 10.527 14.619 665 HA3 GLY 93 2HA GLY 93 -9.111 12.195 14.494 666 H ARG 94 H ARG 94 -11.454 12.094 13.490 667 HA ARG 94 HA ARG 94 -11.745 11.072 10.812 668 HB2 ARG 94 1HB ARG 94 -13.638 11.724 12.340 669 HB3 ARG 94 2HB ARG 94 -13.186 13.409 12.125 670 HG2 ARG 94 1HG ARG 94 -13.675 13.260 9.732 671 HG3 ARG 94 2HG ARG 94 -14.094 11.541 9.920 672 HD2 ARG 94 1HD ARG 94 -15.865 12.170 11.484 673 HD3 ARG 94 2HD ARG 94 -15.467 13.883 11.218 674 HE ARG 94 HE ARG 94 -15.931 12.649 8.716 675 HH11 ARG 94 1HH1 ARG 94 -17.661 13.616 11.617 676 HH12 ARG 94 1HH2 ARG 94 -19.177 13.866 10.780 677 HH21 ARG 94 2HH1 ARG 94 -17.904 12.975 7.642 678 HH22 ARG 94 2HH2 ARG 94 -19.316 13.503 8.531 679 H ASP 95 H ASP 95 -11.229 11.798 8.892 680 HA ASP 95 HA ASP 95 -10.063 13.061 7.321 681 HB2 ASP 95 1HB ASP 95 -11.521 15.224 8.889 682 HB3 ASP 95 2HB ASP 95 -10.579 15.570 7.445 683 H THR 96 H THR 96 -8.580 12.271 9.619 684 HA THR 96 HA THR 96 -6.496 14.414 9.488 685 HB THR 96 HB THR 96 -7.190 12.830 12.001 686 HG1 THR 96 1HG THR 96 -8.764 14.449 11.494 687 HG21 THR 96 2HG3 THR 96 -5.287 15.151 11.501 688 HG22 THR 96 2HG1 THR 96 -5.611 14.388 13.074 689 HG23 THR 96 2HG2 THR 96 -4.811 13.461 11.783 690 H GLY 97 H GLY 97 -6.453 12.414 7.721 691 HA2 GLY 97 1HA GLY 97 -4.997 10.102 8.743 692 HA3 GLY 97 2HA GLY 97 -5.344 10.480 7.040 693 H SER 98 H SER 98 -2.851 9.603 8.511 694 HA SER 98 HA SER 98 -1.010 11.946 7.970 695 HB2 SER 98 1HB SER 98 0.478 11.079 9.438 696 HB3 SER 98 2HB SER 98 -1.090 11.046 10.230 697 HG SER 98 HG SER 98 -1.255 8.881 9.731 698 H CYS 99 H CYS 99 1.317 10.801 7.626 699 HA CYS 99 HA CYS 99 1.280 9.439 5.013 700 HB2 CYS 99 1HB CYS 99 3.546 10.049 6.848 701 HB3 CYS 99 2HB CYS 99 3.648 9.405 5.216 702 HG CYS 99 HG CYS 99 2.315 12.241 6.196 703 H GLN 100 H GLN 100 1.091 8.463 8.326 704 HA GLN 100 HA GLN 100 2.598 5.975 8.031 705 HB2 GLN 100 1HB GLN 100 0.683 6.913 10.210 706 HB3 GLN 100 2HB GLN 100 1.703 5.486 10.306 707 HG2 GLN 100 1HG GLN 100 3.702 6.976 10.064 708 HG3 GLN 100 2HG GLN 100 2.593 8.370 10.188 709 HE21 GLN 100 2HE2 GLN 100 4.348 5.930 11.881 710 HE22 GLN 100 2HE1 GLN 100 3.825 6.341 13.480 711 H PHE 101 H PHE 101 1.918 3.931 7.796 712 HA PHE 101 HA PHE 101 -1.009 3.411 7.650 713 HB2 PHE 101 1HB PHE 101 -0.851 2.286 5.520 714 HB3 PHE 101 2HB PHE 101 -0.206 3.907 5.311 715 HD1 PHE 101 2HD PHE 101 2.217 4.268 5.057 716 HD2 PHE 101 1HD PHE 101 0.540 0.346 5.300 717 HE1 PHE 101 2HE PHE 101 4.308 3.320 4.142 718 HE2 PHE 101 1HE PHE 101 2.631 -0.606 4.387 719 HZ PHE 101 HZ PHE 101 4.516 0.881 3.808 720 H PHE 102 H PHE 102 -1.436 1.034 7.370 721 HA PHE 102 HA PHE 102 0.667 -0.670 8.596 722 HB2 PHE 102 1HB PHE 102 -0.923 -1.480 10.325 723 HB3 PHE 102 2HB PHE 102 -0.510 0.213 10.551 724 HD1 PHE 102 2HD PHE 102 -2.146 1.972 10.140 725 HD2 PHE 102 1HD PHE 102 -3.153 -2.153 9.671 726 HE1 PHE 102 2HE PHE 102 -4.548 2.559 10.155 727 HE2 PHE 102 1HE PHE 102 -5.556 -1.570 9.683 728 HZ PHE 102 HZ PHE 102 -6.253 0.787 9.924 729 H ILE 103 H ILE 103 0.414 -2.852 8.312 730 HA ILE 103 HA ILE 103 -1.588 -3.568 6.189 731 HB ILE 103 HB ILE 103 1.062 -4.890 6.961 732 HG12 ILE 103 1HG1 ILE 103 0.389 -3.381 4.429 733 HG13 ILE 103 1HG2 ILE 103 1.223 -2.663 5.798 734 HG21 ILE 103 2HG1 ILE 103 0.688 -6.281 4.965 735 HG22 ILE 103 2HG2 ILE 103 -0.617 -6.504 6.154 736 HG23 ILE 103 2HG3 ILE 103 -0.890 -5.499 4.710 737 HD11 ILE 103 1HD3 ILE 103 2.187 -5.038 4.189 738 HD12 ILE 103 1HD1 ILE 103 2.796 -3.370 4.084 739 HD13 ILE 103 1HD2 ILE 103 3.032 -4.311 5.577 740 H VAL 104 H VAL 104 -3.226 -4.733 6.631 741 HA VAL 104 HA VAL 104 -3.463 -5.932 9.331 742 HB VAL 104 HB VAL 104 -5.386 -5.880 6.954 743 HG11 VAL 104 1HG1 VAL 104 -7.099 -6.474 8.597 744 HG12 VAL 104 1HG2 VAL 104 -5.838 -7.722 8.470 745 HG13 VAL 104 1HG3 VAL 104 -5.848 -6.604 9.854 746 HG21 VAL 104 2HG3 VAL 104 -4.868 -3.618 7.802 747 HG22 VAL 104 2HG1 VAL 104 -6.534 -4.088 8.216 748 HG23 VAL 104 2HG2 VAL 104 -5.259 -4.146 9.457 749 H HIS 105 H HIS 105 -3.222 -7.907 9.925 750 HA HIS 105 HA HIS 105 -3.006 -9.990 7.777 751 HB2 HIS 105 1HB HIS 105 -1.925 -10.045 10.628 752 HB3 HIS 105 2HB HIS 105 -1.737 -11.318 9.431 753 HD2 HIS 105 2HD HIS 105 0.229 -8.394 10.717 754 HE1 HIS 105 1HE HIS 105 1.662 -9.071 6.761 755 H GLU 106 H GLU 106 -4.529 -9.124 10.837 756 HA GLU 106 HA GLU 106 -6.467 -11.364 10.342 757 HB2 GLU 106 1HB GLU 106 -5.213 -11.517 12.513 758 HB3 GLU 106 2HB GLU 106 -5.839 -9.937 12.961 759 HG2 GLU 106 1HG GLU 106 -8.124 -10.800 12.924 760 HG3 GLU 106 2HG GLU 106 -7.538 -12.377 12.397 761 HA PRO 107 HA PRO 107 -9.308 -8.267 9.111 762 HB2 PRO 107 1HB PRO 107 -11.228 -10.416 10.130 763 HB3 PRO 107 2HB PRO 107 -11.284 -9.536 8.598 764 HG2 PRO 107 1HG PRO 107 -10.413 -12.047 8.569 765 HG3 PRO 107 2HG PRO 107 -9.541 -10.836 7.623 766 HD2 PRO 107 1HD PRO 107 -8.837 -12.034 10.325 767 HD3 PRO 107 2HD PRO 107 -7.750 -11.620 8.939 768 H GLN 108 H GLN 108 -10.366 -6.668 9.998 769 HA GLN 108 HA GLN 108 -11.028 -6.907 12.908 770 HB2 GLN 108 1HB GLN 108 -9.677 -4.520 11.581 771 HB3 GLN 108 2HB GLN 108 -10.127 -4.653 13.274 772 HG2 GLN 108 1HG GLN 108 -8.093 -6.405 11.880 773 HG3 GLN 108 2HG GLN 108 -7.727 -4.984 12.900 774 HE21 GLN 108 2HE2 GLN 108 -7.411 -8.128 12.990 775 HE22 GLN 108 2HE1 GLN 108 -7.824 -8.488 14.634 776 HA PRO 109 HA PRO 109 -14.770 -5.577 10.679 777 HB2 PRO 109 1HB PRO 109 -15.798 -6.519 13.391 778 HB3 PRO 109 2HB PRO 109 -16.467 -6.854 11.789 779 HG2 PRO 109 1HG PRO 109 -15.123 -8.791 13.019 780 HG3 PRO 109 2HG PRO 109 -14.836 -8.518 11.299 781 HD2 PRO 109 1HD PRO 109 -13.165 -7.642 13.686 782 HD3 PRO 109 2HD PRO 109 -12.619 -8.309 12.094 783 H HIS 110 H HIS 110 -13.518 -4.846 13.873 784 HA HIS 110 HA HIS 110 -15.472 -2.712 14.326 785 HB2 HIS 110 1HB HIS 110 -14.200 -2.280 16.368 786 HB3 HIS 110 2HB HIS 110 -14.495 -4.006 16.214 787 HD2 HIS 110 2HD HIS 110 -12.178 -5.575 15.655 788 HE1 HIS 110 1HE HIS 110 -9.438 -2.402 16.421 789 H LEU 111 H LEU 111 -12.647 -2.979 12.502 790 HA LEU 111 HA LEU 111 -12.141 -0.045 12.637 791 HB2 LEU 111 1HB LEU 111 -10.702 -2.296 11.174 792 HB3 LEU 111 2HB LEU 111 -10.227 -0.595 11.125 793 HG LEU 111 HG LEU 111 -10.180 -2.414 13.558 794 HD11 LEU 111 1HD1 LEU 111 -7.751 -2.098 13.387 795 HD12 LEU 111 1HD2 LEU 111 -8.419 -2.862 11.925 796 HD13 LEU 111 1HD3 LEU 111 -7.981 -1.137 11.907 797 HD21 LEU 111 2HD3 LEU 111 -10.802 -0.093 14.143 798 HD22 LEU 111 2HD1 LEU 111 -9.150 -0.473 14.691 799 HD23 LEU 111 2HD2 LEU 111 -9.400 0.513 13.229 800 H ASP 112 H ASP 112 -14.301 -1.957 11.166 801 HA ASP 112 HA ASP 112 -14.152 -1.208 8.408 802 HB2 ASP 112 1HB ASP 112 -15.646 -3.000 9.343 803 HB3 ASP 112 2HB ASP 112 -16.632 -1.754 10.097 804 H GLY 113 H GLY 113 -13.903 0.778 7.735 805 HA2 GLY 113 1HA GLY 113 -14.826 2.836 7.052 806 HA3 GLY 113 2HA GLY 113 -16.094 2.670 8.288 807 H VAL 114 H VAL 114 -13.200 1.932 9.733 808 HA VAL 114 HA VAL 114 -13.079 4.596 11.065 809 HB VAL 114 HB VAL 114 -11.583 1.980 11.582 810 HG11 VAL 114 1HG1 VAL 114 -10.946 3.001 13.712 811 HG12 VAL 114 1HG2 VAL 114 -10.319 3.917 12.322 812 HG13 VAL 114 1HG3 VAL 114 -11.732 4.519 13.219 813 HG21 VAL 114 2HG3 VAL 114 -14.010 1.795 12.003 814 HG22 VAL 114 2HG1 VAL 114 -13.094 1.775 13.529 815 HG23 VAL 114 2HG2 VAL 114 -13.946 3.253 13.022 816 H HIS 115 H HIS 115 -10.723 2.376 9.551 817 HA HIS 115 HA HIS 115 -9.145 4.819 8.827 818 HB2 HIS 115 1HB HIS 115 -8.291 1.904 9.095 819 HB3 HIS 115 2HB HIS 115 -7.256 3.189 8.487 820 HD2 HIS 115 2HD HIS 115 -8.583 1.817 11.876 821 HE1 HIS 115 1HE HIS 115 -6.019 5.123 12.689 822 H THR 116 H THR 116 -8.250 5.028 6.779 823 HA THR 116 HA THR 116 -10.060 3.949 4.699 824 HB THR 116 HB THR 116 -7.829 6.027 4.563 825 HG1 THR 116 1HG THR 116 -9.734 6.656 5.729 826 HG21 THR 116 2HG3 THR 116 -9.910 5.202 2.501 827 HG22 THR 116 2HG1 THR 116 -8.753 6.543 2.338 828 HG23 THR 116 2HG2 THR 116 -8.166 4.865 2.409 829 H VAL 117 H VAL 117 -9.632 1.962 4.063 830 HA VAL 117 HA VAL 117 -6.908 1.025 3.479 831 HB VAL 117 HB VAL 117 -9.633 0.007 2.540 832 HG11 VAL 117 1HG1 VAL 117 -8.454 -2.086 2.073 833 HG12 VAL 117 1HG2 VAL 117 -7.820 -0.734 1.106 834 HG13 VAL 117 1HG3 VAL 117 -6.913 -1.316 2.522 835 HG21 VAL 117 2HG3 VAL 117 -9.415 -0.019 5.001 836 HG22 VAL 117 2HG1 VAL 117 -9.373 -1.670 4.340 837 HG23 VAL 117 2HG2 VAL 117 -7.864 -0.881 4.856 838 H PHE 118 H PHE 118 -5.699 1.246 1.797 839 HA PHE 118 HA PHE 118 -6.900 2.642 -0.571 840 HB2 PHE 118 1HB PHE 118 -4.993 4.126 -0.663 841 HB3 PHE 118 2HB PHE 118 -5.686 4.243 0.946 842 HD1 PHE 118 2HD PHE 118 -4.521 3.344 2.888 843 HD2 PHE 118 1HD PHE 118 -2.821 3.118 -1.025 844 HE1 PHE 118 2HE PHE 118 -2.316 2.830 3.879 845 HE2 PHE 118 1HE PHE 118 -0.614 2.601 -0.038 846 HZ PHE 118 HZ PHE 118 -0.362 2.456 2.415 847 H GLY 119 H GLY 119 -4.964 0.128 0.656 848 HA2 GLY 119 1HA GLY 119 -4.435 -0.768 -2.103 849 HA3 GLY 119 2HA GLY 119 -3.004 -0.489 -1.084 850 H GLN 120 H GLN 120 -2.983 -2.918 -1.828 851 HA GLN 120 HA GLN 120 -3.546 -4.444 0.598 852 HB2 GLN 120 1HB GLN 120 -5.751 -4.595 -0.536 853 HB3 GLN 120 2HB GLN 120 -4.967 -5.182 -1.996 854 HG2 GLN 120 1HG GLN 120 -4.198 -7.179 -0.787 855 HG3 GLN 120 2HG GLN 120 -5.020 -6.585 0.683 856 HE21 GLN 120 2HE2 GLN 120 -5.868 -8.936 0.152 857 HE22 GLN 120 2HE1 GLN 120 -7.373 -8.969 -0.706 858 H VAL 121 H VAL 121 -2.029 -5.862 0.942 859 HA VAL 121 HA VAL 121 0.105 -6.245 -1.029 860 HB VAL 121 HB VAL 121 -0.470 -7.661 1.619 861 HG11 VAL 121 1HG1 VAL 121 1.890 -8.301 1.553 862 HG12 VAL 121 1HG2 VAL 121 0.980 -8.967 0.176 863 HG13 VAL 121 1HG3 VAL 121 2.046 -7.560 -0.056 864 HG21 VAL 121 2HG3 VAL 121 -0.157 -5.225 1.889 865 HG22 VAL 121 2HG1 VAL 121 1.233 -6.124 2.543 866 HG23 VAL 121 2HG2 VAL 121 1.360 -5.316 0.962 867 H THR 122 H THR 122 0.447 -7.709 -2.466 868 HA THR 122 HA THR 122 -1.569 -9.927 -2.627 869 HB THR 122 HB THR 122 -1.262 -9.839 -5.078 870 HG1 THR 122 1HG THR 122 -0.036 -8.065 -5.932 871 HG21 THR 122 2HG3 THR 122 -1.892 -7.117 -3.876 872 HG22 THR 122 2HG1 THR 122 -2.361 -7.674 -5.499 873 HG23 THR 122 2HG2 THR 122 -3.041 -8.464 -4.055 874 H SER 123 H SER 123 1.777 -9.083 -2.515 875 HA SER 123 HA SER 123 2.465 -12.014 -2.437 876 HB2 SER 123 1HB SER 123 2.766 -11.443 -4.710 877 HB3 SER 123 2HB SER 123 3.803 -10.096 -4.268 878 HG SER 123 HG SER 123 4.952 -11.965 -4.759 879 H GLY 124 H GLY 124 3.881 -12.425 -0.855 880 HA2 GLY 124 1HA GLY 124 5.828 -12.068 0.441 881 HA3 GLY 124 2HA GLY 124 5.823 -10.355 -0.034 882 H MET 125 H MET 125 2.739 -11.423 0.873 883 HA MET 125 HA MET 125 2.521 -9.845 3.227 884 HB2 MET 125 1HB MET 125 0.617 -10.779 1.873 885 HB3 MET 125 2HB MET 125 0.964 -12.366 2.544 886 HG2 MET 125 1HG MET 125 0.486 -11.528 4.806 887 HG3 MET 125 2HG MET 125 0.167 -9.920 4.150 888 HE1 MET 125 3HE MET 125 -1.149 -13.472 4.822 889 HE2 MET 125 1HE MET 125 -2.493 -13.656 3.670 890 HE3 MET 125 2HE MET 125 -0.813 -13.632 3.081 891 H ASP 126 H ASP 126 3.444 -13.246 2.829 892 HA ASP 126 HA ASP 126 3.716 -13.833 5.625 893 HB2 ASP 126 1HB ASP 126 5.095 -14.938 3.148 894 HB3 ASP 126 2HB ASP 126 5.401 -15.559 4.764 895 H VAL 127 H VAL 127 5.976 -12.440 3.266 896 HA VAL 127 HA VAL 127 8.243 -12.247 5.033 897 HB VAL 127 HB VAL 127 7.355 -10.469 2.709 898 HG11 VAL 127 1HG1 VAL 127 9.680 -9.717 2.626 899 HG12 VAL 127 1HG2 VAL 127 8.896 -9.289 4.165 900 HG13 VAL 127 1HG3 VAL 127 10.036 -10.655 4.096 901 HG21 VAL 127 2HG3 VAL 127 7.735 -12.828 2.079 902 HG22 VAL 127 2HG1 VAL 127 9.011 -11.778 1.418 903 HG23 VAL 127 2HG2 VAL 127 9.337 -12.778 2.853 904 H VAL 128 H VAL 128 5.547 -10.008 4.452 905 HA VAL 128 HA VAL 128 6.403 -7.936 6.228 906 HB VAL 128 HB VAL 128 3.588 -8.975 5.637 907 HG11 VAL 128 1HG1 VAL 128 2.823 -6.771 6.375 908 HG12 VAL 128 1HG2 VAL 128 3.640 -7.664 7.680 909 HG13 VAL 128 1HG3 VAL 128 4.489 -6.347 6.835 910 HG21 VAL 128 2HG3 VAL 128 4.814 -8.252 3.618 911 HG22 VAL 128 2HG1 VAL 128 3.511 -7.107 4.015 912 HG23 VAL 128 2HG2 VAL 128 5.200 -6.703 4.403 913 H ARG 129 H ARG 129 4.530 -10.877 6.931 914 HA ARG 129 HA ARG 129 4.152 -10.277 9.709 915 HB2 ARG 129 1HB ARG 129 4.261 -12.908 8.190 916 HB3 ARG 129 2HB ARG 129 3.863 -12.799 9.898 917 HG2 ARG 129 1HG ARG 129 1.895 -11.441 9.376 918 HG3 ARG 129 2HG ARG 129 2.305 -11.503 7.645 919 HD2 ARG 129 1HD ARG 129 2.101 -13.929 7.697 920 HD3 ARG 129 2HD ARG 129 1.660 -13.847 9.419 921 HE ARG 129 HE ARG 129 -0.082 -12.154 8.012 922 HH11 ARG 129 1HH1 ARG 129 0.681 -15.576 8.227 923 HH12 ARG 129 1HH2 ARG 129 -0.935 -16.092 7.804 924 HH21 ARG 129 2HH1 ARG 129 -2.178 -12.836 7.465 925 HH22 ARG 129 2HH2 ARG 129 -2.556 -14.541 7.373 926 H THR 130 H THR 130 6.876 -11.556 7.943 927 HA THR 130 HA THR 130 8.176 -12.415 10.488 928 HB THR 130 HB THR 130 9.879 -13.444 9.005 929 HG1 THR 130 1HG THR 130 9.640 -11.938 7.254 930 HG21 THR 130 2HG3 THR 130 7.022 -14.125 8.209 931 HG22 THR 130 2HG1 THR 130 8.443 -15.176 8.002 932 HG23 THR 130 2HG2 THR 130 7.880 -14.753 9.636 933 H MET 131 H MET 131 7.810 -9.597 8.978 934 HA MET 131 HA MET 131 10.504 -8.553 8.964 935 HB2 MET 131 1HB MET 131 7.774 -7.266 9.262 936 HB3 MET 131 2HB MET 131 9.265 -6.336 9.271 937 HG2 MET 131 1HG MET 131 9.797 -7.187 7.008 938 HG3 MET 131 2HG MET 131 8.277 -8.085 7.000 939 HE1 MET 131 3HE MET 131 7.477 -6.974 4.770 940 HE2 MET 131 1HE MET 131 7.494 -5.218 4.475 941 HE3 MET 131 2HE MET 131 9.027 -6.101 4.682 942 H LYS 132 H LYS 132 11.500 -7.139 10.436 943 HA LYS 132 HA LYS 132 10.848 -7.832 13.272 944 HB2 LYS 132 1HB LYS 132 13.383 -6.674 12.046 945 HB3 LYS 132 2HB LYS 132 13.153 -7.048 13.748 946 HG2 LYS 132 1HG LYS 132 12.878 -9.438 13.188 947 HG3 LYS 132 2HG LYS 132 13.121 -9.057 11.477 948 HD2 LYS 132 1HD LYS 132 15.372 -8.184 11.978 949 HD3 LYS 132 2HD LYS 132 15.130 -8.526 13.698 950 HE2 LYS 132 1HE LYS 132 14.873 -10.936 13.176 951 HE3 LYS 132 2HE LYS 132 15.135 -10.590 11.465 952 HZ1 LYS 132 3HZ LYS 132 17.075 -10.096 13.624 953 HZ2 LYS 132 1HZ LYS 132 17.135 -11.331 12.532 954 HZ3 LYS 132 2HZ LYS 132 17.321 -9.772 12.025 955 H ASN 133 H ASN 133 11.050 -6.219 14.911 956 HA ASN 133 HA ASN 133 9.777 -3.703 14.214 957 HB2 ASN 133 1HB ASN 133 11.092 -4.714 16.747 958 HB3 ASN 133 2HB ASN 133 10.336 -3.132 16.611 959 HD21 ASN 133 2HD2 ASN 133 9.495 -5.037 18.434 960 HD22 ASN 133 2HD1 ASN 133 7.906 -5.571 18.004 961 H GLY 134 H GLY 134 10.636 -2.042 13.280 962 HA2 GLY 134 1HA GLY 134 12.221 -0.289 13.050 963 HA3 GLY 134 2HA GLY 134 13.410 -1.254 13.957 964 H ASP 135 H ASP 135 11.838 -3.184 11.699 965 HA ASP 135 HA ASP 135 14.104 -3.538 9.992 966 HB2 ASP 135 1HB ASP 135 12.100 -5.113 10.307 967 HB3 ASP 135 2HB ASP 135 11.201 -4.043 9.240 968 H VAL 136 H VAL 136 14.823 -2.619 8.201 969 HA VAL 136 HA VAL 136 13.672 0.089 7.684 970 HB VAL 136 HB VAL 136 16.299 -1.203 6.803 971 HG11 VAL 136 1HG1 VAL 136 16.978 1.073 6.220 972 HG12 VAL 136 1HG2 VAL 136 15.564 0.539 5.281 973 HG13 VAL 136 1HG3 VAL 136 15.354 1.665 6.643 974 HG21 VAL 136 2HG3 VAL 136 16.172 -0.905 9.253 975 HG22 VAL 136 2HG1 VAL 136 17.327 0.240 8.530 976 HG23 VAL 136 2HG2 VAL 136 15.710 0.799 9.022 977 H MET 137 H MET 137 12.676 0.720 5.965 978 HA MET 137 HA MET 137 12.458 -1.120 3.651 979 HB2 MET 137 1HB MET 137 11.242 1.605 4.229 980 HB3 MET 137 2HB MET 137 10.953 0.679 2.763 981 HG2 MET 137 1HG MET 137 9.971 -1.145 4.130 982 HG3 MET 137 2HG MET 137 10.221 -0.170 5.580 983 HE1 MET 137 3HE MET 137 9.387 2.636 5.248 984 HE2 MET 137 1HE MET 137 7.613 2.590 5.409 985 HE3 MET 137 2HE MET 137 8.630 1.561 6.449 986 H LYS 138 H LYS 138 13.651 -1.081 1.924 987 HA LYS 138 HA LYS 138 15.858 0.855 1.807 988 HB2 LYS 138 1HB LYS 138 16.176 -1.574 1.306 989 HB3 LYS 138 2HB LYS 138 15.112 -1.411 -0.085 990 HG2 LYS 138 1HG LYS 138 16.671 0.100 -1.171 991 HG3 LYS 138 2HG LYS 138 17.707 0.118 0.262 992 HD2 LYS 138 1HD LYS 138 18.063 -2.335 0.009 993 HD3 LYS 138 2HD LYS 138 17.077 -2.308 -1.462 994 HE2 LYS 138 1HE LYS 138 18.666 -0.740 -2.510 995 HE3 LYS 138 2HE LYS 138 19.642 -0.728 -1.040 996 HZ1 LYS 138 3HZ LYS 138 19.114 -3.088 -2.720 997 HZ2 LYS 138 1HZ LYS 138 20.521 -2.231 -2.671 998 HZ3 LYS 138 2HZ LYS 138 20.025 -3.077 -1.345 999 H GLU 139 H GLU 139 13.051 0.023 -0.227 1000 HA GLU 139 HA GLU 139 12.790 2.844 -0.954 1001 HB2 GLU 139 1HB GLU 139 13.009 2.568 -3.355 1002 HB3 GLU 139 2HB GLU 139 14.510 2.055 -2.598 1003 HG2 GLU 139 1HG GLU 139 13.879 -0.286 -2.852 1004 HG3 GLU 139 2HG GLU 139 12.319 0.184 -3.524 1005 H VAL 140 H VAL 140 10.811 3.396 -1.744 1006 HA VAL 140 HA VAL 140 8.851 1.152 -2.189 1007 HB VAL 140 HB VAL 140 8.314 3.795 -0.753 1008 HG11 VAL 140 1HG1 VAL 140 6.116 2.827 -0.286 1009 HG12 VAL 140 1HG2 VAL 140 6.417 2.986 -2.033 1010 HG13 VAL 140 1HG3 VAL 140 6.545 1.393 -1.249 1011 HG21 VAL 140 2HG3 VAL 140 9.665 2.270 0.645 1012 HG22 VAL 140 2HG1 VAL 140 8.003 2.403 1.268 1013 HG23 VAL 140 2HG2 VAL 140 8.496 0.961 0.349 1014 H LYS 141 H LYS 141 7.898 1.153 -4.025 1015 HA LYS 141 HA LYS 141 7.939 3.705 -5.605 1016 HB2 LYS 141 1HB LYS 141 8.471 0.896 -6.651 1017 HB3 LYS 141 2HB LYS 141 8.448 2.373 -7.604 1018 HG2 LYS 141 1HG LYS 141 10.411 1.829 -5.358 1019 HG3 LYS 141 2HG LYS 141 10.731 1.533 -7.072 1020 HD2 LYS 141 1HD LYS 141 10.332 3.934 -7.554 1021 HD3 LYS 141 2HD LYS 141 10.041 4.223 -5.832 1022 HE2 LYS 141 1HE LYS 141 12.344 3.418 -5.332 1023 HE3 LYS 141 2HE LYS 141 12.628 3.199 -7.060 1024 HZ1 LYS 141 3HZ LYS 141 11.998 5.757 -5.745 1025 HZ2 LYS 141 1HZ LYS 141 13.484 5.285 -6.282 1026 HZ3 LYS 141 2HZ LYS 141 12.264 5.552 -7.360 1027 H VAL 142 H VAL 142 6.200 4.246 -6.737 1028 HA VAL 142 HA VAL 142 3.990 2.215 -6.994 1029 HB VAL 142 HB VAL 142 3.721 5.191 -6.343 1030 HG11 VAL 142 1HG1 VAL 142 1.322 4.734 -6.215 1031 HG12 VAL 142 1HG2 VAL 142 1.975 4.413 -7.838 1032 HG13 VAL 142 1HG3 VAL 142 1.612 3.059 -6.741 1033 HG21 VAL 142 2HG3 VAL 142 4.430 3.852 -4.391 1034 HG22 VAL 142 2HG1 VAL 142 2.747 4.399 -4.211 1035 HG23 VAL 142 2HG2 VAL 142 3.090 2.717 -4.680 1036 H PHE 143 H PHE 143 2.867 2.141 -8.815 1037 HA PHE 143 HA PHE 143 3.565 4.004 -11.007 1038 HB2 PHE 143 1HB PHE 143 4.376 2.185 -12.465 1039 HB3 PHE 143 2HB PHE 143 5.427 2.392 -11.073 1040 HD1 PHE 143 2HD PHE 143 5.458 0.733 -9.266 1041 HD2 PHE 143 1HD PHE 143 3.075 0.185 -12.769 1042 HE1 PHE 143 2HE PHE 143 5.214 -1.667 -8.722 1043 HE2 PHE 143 1HE PHE 143 2.826 -2.214 -12.226 1044 HZ PHE 143 HZ PHE 143 3.896 -3.140 -10.203 1045 H ASP 144 H ASP 144 2.460 3.418 -13.046 1046 HA ASP 144 HA ASP 144 -0.243 2.304 -12.421 1047 HB2 ASP 144 1HB ASP 144 0.727 3.969 -14.784 1048 HB3 ASP 144 2HB ASP 144 -0.923 3.412 -14.540 1049 H GLU 145 H GLU 145 -1.226 0.760 -13.648 1050 HA GLU 145 HA GLU 145 0.384 -0.610 -15.732 1051 HB2 GLU 145 1HB GLU 145 1.013 -1.680 -13.550 1052 HB3 GLU 145 2HB GLU 145 -0.682 -2.045 -13.265 1053 HG2 GLU 145 1HG GLU 145 -0.737 -3.489 -15.228 1054 HG3 GLU 145 2HG GLU 145 0.932 -3.071 -15.609 1055 HA PRO 146 HA PRO 146 -3.699 -0.942 -17.357 1056 HB2 PRO 146 1HB PRO 146 -3.043 -2.185 -19.694 1057 HB3 PRO 146 2HB PRO 146 -2.547 -0.508 -19.433 1058 HG2 PRO 146 1HG PRO 146 -0.923 -3.061 -19.061 1059 HG3 PRO 146 2HG PRO 146 -0.460 -1.585 -19.913 1060 HD2 PRO 146 1HD PRO 146 0.311 -2.057 -17.331 1061 HD3 PRO 146 2HD PRO 146 -0.043 -0.387 -17.933 Start of MODEL 15 1 H MET 1 1H MET 1 -3.673 3.785 -17.111 2 HA MET 1 HA MET 1 -3.997 1.164 -16.289 3 HB2 MET 1 1HB MET 1 -1.863 3.275 -15.815 4 HB3 MET 1 2HB MET 1 -1.684 1.581 -15.383 5 HG2 MET 1 1HG MET 1 -1.916 0.941 -17.746 6 HG3 MET 1 2HG MET 1 -2.128 2.636 -18.191 7 HE1 MET 1 3HE MET 1 -0.169 2.410 -19.962 8 HE2 MET 1 1HE MET 1 1.453 1.793 -19.565 9 HE3 MET 1 2HE MET 1 0.046 0.704 -19.504 10 H ALA 2 H ALA 2 -3.555 0.264 -14.222 11 HA ALA 2 HA ALA 2 -4.920 1.790 -12.080 12 HB1 ALA 2 3HB ALA 2 -4.014 -1.109 -12.203 13 HB2 ALA 2 1HB ALA 2 -4.944 -0.367 -10.881 14 HB3 ALA 2 2HB ALA 2 -5.664 -0.514 -12.501 15 H LYS 3 H LYS 3 -4.072 1.666 -9.867 16 HA LYS 3 HA LYS 3 -1.179 2.348 -9.918 17 HB2 LYS 3 1HB LYS 3 -3.265 2.654 -7.721 18 HB3 LYS 3 2HB LYS 3 -1.607 3.236 -7.647 19 HG2 LYS 3 1HG LYS 3 -3.685 4.174 -9.648 20 HG3 LYS 3 2HG LYS 3 -3.235 5.018 -8.160 21 HD2 LYS 3 1HD LYS 3 -0.889 5.176 -8.981 22 HD3 LYS 3 2HD LYS 3 -1.383 4.387 -10.487 23 HE2 LYS 3 1HE LYS 3 -2.953 6.232 -10.950 24 HE3 LYS 3 2HE LYS 3 -2.495 7.015 -9.436 25 HZ1 LYS 3 3HZ LYS 3 -0.686 6.482 -11.697 26 HZ2 LYS 3 1HZ LYS 3 -1.331 7.946 -11.298 27 HZ3 LYS 3 2HZ LYS 3 -0.258 7.212 -10.282 28 H LYS 4 H LYS 4 0.381 1.151 -9.168 29 HA LYS 4 HA LYS 4 -0.217 -0.932 -7.134 30 HB2 LYS 4 1HB LYS 4 -0.414 -2.040 -9.374 31 HB3 LYS 4 2HB LYS 4 1.230 -1.536 -9.743 32 HG2 LYS 4 1HG LYS 4 2.106 -2.906 -7.928 33 HG3 LYS 4 2HG LYS 4 0.464 -3.341 -7.429 34 HD2 LYS 4 1HD LYS 4 0.075 -4.466 -9.570 35 HD3 LYS 4 2HD LYS 4 1.667 -3.960 -10.153 36 HE2 LYS 4 1HE LYS 4 2.758 -5.279 -8.390 37 HE3 LYS 4 2HE LYS 4 1.185 -5.744 -7.738 38 HZ1 LYS 4 3HZ LYS 4 2.188 -6.421 -10.422 39 HZ2 LYS 4 1HZ LYS 4 2.099 -7.447 -9.135 40 HZ3 LYS 4 2HZ LYS 4 0.718 -6.855 -9.813 41 H GLY 5 H GLY 5 1.342 -1.270 -5.697 42 HA2 GLY 5 1HA GLY 5 3.820 0.367 -6.077 43 HA3 GLY 5 2HA GLY 5 2.863 0.425 -4.578 44 H TYR 6 H TYR 6 5.544 -0.191 -4.485 45 HA TYR 6 HA TYR 6 5.359 -2.885 -3.271 46 HB2 TYR 6 1HB TYR 6 7.259 -3.795 -4.384 47 HB3 TYR 6 2HB TYR 6 6.189 -3.200 -5.648 48 HD1 TYR 6 1HD TYR 6 9.366 -2.673 -3.879 49 HD2 TYR 6 2HD TYR 6 6.784 -1.293 -7.014 50 HE1 TYR 6 1HE TYR 6 11.215 -1.321 -4.807 51 HE2 TYR 6 2HE TYR 6 8.633 0.059 -7.943 52 HH TYR 6 HH TYR 6 10.752 0.668 -7.732 53 H ILE 7 H ILE 7 6.641 -3.199 -1.540 54 HA ILE 7 HA ILE 7 8.608 -1.013 -0.897 55 HB ILE 7 HB ILE 7 6.995 -2.841 0.951 56 HG12 ILE 7 1HG1 ILE 7 7.029 0.178 0.818 57 HG13 ILE 7 1HG2 ILE 7 5.856 -0.814 -0.033 58 HG21 ILE 7 2HG1 ILE 7 8.161 -1.700 2.794 59 HG22 ILE 7 2HG2 ILE 7 9.309 -2.580 1.759 60 HG23 ILE 7 2HG3 ILE 7 9.160 -0.814 1.620 61 HD11 ILE 7 1HD3 ILE 7 6.282 -0.757 2.963 62 HD12 ILE 7 1HD1 ILE 7 4.949 0.010 2.067 63 HD13 ILE 7 1HD2 ILE 7 5.094 -1.764 2.101 64 H LEU 8 H LEU 8 10.507 -1.582 -1.541 65 HA LEU 8 HA LEU 8 11.461 -4.344 -1.070 66 HB2 LEU 8 1HB LEU 8 12.151 -3.165 -3.123 67 HB3 LEU 8 2HB LEU 8 12.834 -1.851 -2.160 68 HG LEU 8 HG LEU 8 14.483 -3.498 -1.208 69 HD11 LEU 8 1HD1 LEU 8 14.764 -5.635 -2.382 70 HD12 LEU 8 1HD2 LEU 8 13.177 -5.527 -1.582 71 HD13 LEU 8 1HD3 LEU 8 13.304 -5.299 -3.343 72 HD21 LEU 8 2HD3 LEU 8 15.036 -1.985 -3.084 73 HD22 LEU 8 2HD1 LEU 8 15.857 -3.554 -3.263 74 HD23 LEU 8 2HD2 LEU 8 14.413 -3.189 -4.238 75 H MET 9 H MET 9 12.331 -5.033 0.701 76 HA MET 9 HA MET 9 13.051 -3.057 2.800 77 HB2 MET 9 1HB MET 9 12.954 -6.089 2.954 78 HB3 MET 9 2HB MET 9 13.067 -4.965 4.302 79 HG2 MET 9 1HG MET 9 10.702 -5.268 2.428 80 HG3 MET 9 2HG MET 9 10.812 -5.867 4.084 81 HE1 MET 9 3HE MET 9 12.158 -3.623 5.740 82 HE2 MET 9 1HE MET 9 10.756 -2.643 6.233 83 HE3 MET 9 2HE MET 9 10.640 -4.420 6.222 84 H GLU 10 H GLU 10 14.982 -3.082 3.946 85 HA GLU 10 HA GLU 10 17.349 -3.402 2.348 86 HB2 GLU 10 1HB GLU 10 16.870 -3.012 5.323 87 HB3 GLU 10 2HB GLU 10 18.489 -3.194 4.660 88 HG2 GLU 10 1HG GLU 10 16.548 -1.074 3.725 89 HG3 GLU 10 2HG GLU 10 17.688 -0.836 5.049 90 H ASN 11 H ASN 11 15.513 -5.637 4.220 91 HA ASN 11 HA ASN 11 17.780 -7.537 4.452 92 HB2 ASN 11 1HB ASN 11 14.887 -7.643 5.342 93 HB3 ASN 11 2HB ASN 11 16.004 -8.991 5.504 94 HD21 ASN 11 2HD2 ASN 11 14.639 -7.525 7.584 95 HD22 ASN 11 2HD1 ASN 11 15.865 -6.849 8.604 96 H GLY 12 H GLY 12 15.921 -6.598 1.973 97 HA2 GLY 12 1HA GLY 12 16.042 -7.629 -0.156 98 HA3 GLY 12 2HA GLY 12 16.393 -9.188 0.626 99 H GLY 13 H GLY 13 13.898 -7.754 2.291 100 HA2 GLY 13 1HA GLY 13 11.913 -9.603 1.341 101 HA3 GLY 13 2HA GLY 13 11.637 -8.229 2.436 102 H LYS 14 H LYS 14 10.090 -9.296 0.095 103 HA LYS 14 HA LYS 14 9.961 -6.738 -1.463 104 HB2 LYS 14 1HB LYS 14 9.759 -9.573 -2.555 105 HB3 LYS 14 2HB LYS 14 9.386 -8.118 -3.468 106 HG2 LYS 14 1HG LYS 14 11.766 -7.361 -3.073 107 HG3 LYS 14 2HG LYS 14 12.084 -8.960 -2.384 108 HD2 LYS 14 1HD LYS 14 11.381 -10.021 -4.502 109 HD3 LYS 14 2HD LYS 14 11.043 -8.427 -5.192 110 HE2 LYS 14 1HE LYS 14 13.375 -7.797 -5.051 111 HE3 LYS 14 2HE LYS 14 13.770 -9.258 -4.143 112 HZ1 LYS 14 3HZ LYS 14 12.805 -9.184 -6.924 113 HZ2 LYS 14 1HZ LYS 14 14.358 -9.465 -6.445 114 HZ3 LYS 14 2HZ LYS 14 13.173 -10.550 -6.075 115 H ILE 15 H ILE 15 8.249 -5.894 -0.427 116 HA ILE 15 HA ILE 15 5.748 -7.524 -0.271 117 HB ILE 15 HB ILE 15 6.390 -4.720 0.774 118 HG12 ILE 15 1HG1 ILE 15 6.137 -7.287 2.353 119 HG13 ILE 15 1HG2 ILE 15 7.672 -6.598 1.847 120 HG21 ILE 15 2HG1 ILE 15 4.296 -4.976 2.043 121 HG22 ILE 15 2HG2 ILE 15 3.997 -5.066 0.292 122 HG23 ILE 15 2HG3 ILE 15 4.015 -6.553 1.269 123 HD11 ILE 15 1HD3 ILE 15 5.632 -5.249 3.629 124 HD12 ILE 15 1HD1 ILE 15 7.158 -6.001 4.148 125 HD13 ILE 15 1HD2 ILE 15 7.185 -4.551 3.116 126 H GLU 16 H GLU 16 4.743 -7.701 -2.095 127 HA GLU 16 HA GLU 16 4.456 -5.242 -3.780 128 HB2 GLU 16 1HB GLU 16 5.448 -7.238 -4.889 129 HB3 GLU 16 2HB GLU 16 4.027 -8.182 -4.465 130 HG2 GLU 16 1HG GLU 16 2.626 -6.749 -5.865 131 HG3 GLU 16 2HG GLU 16 4.017 -5.739 -6.252 132 H PHE 17 H PHE 17 2.603 -4.264 -4.066 133 HA PHE 17 HA PHE 17 0.086 -5.595 -3.222 134 HB2 PHE 17 1HB PHE 17 -0.462 -3.655 -1.731 135 HB3 PHE 17 2HB PHE 17 0.851 -4.649 -1.121 136 HD1 PHE 17 2HD PHE 17 3.156 -3.830 -1.128 137 HD2 PHE 17 1HD PHE 17 -0.084 -1.390 -2.468 138 HE1 PHE 17 2HE PHE 17 4.595 -1.828 -0.953 139 HE2 PHE 17 1HE PHE 17 1.352 0.614 -2.297 140 HZ PHE 17 HZ PHE 17 3.692 0.396 -1.539 141 H GLU 18 H GLU 18 -1.791 -4.631 -3.932 142 HA GLU 18 HA GLU 18 -1.358 -2.626 -6.119 143 HB2 GLU 18 1HB GLU 18 -3.590 -4.656 -5.684 144 HB3 GLU 18 2HB GLU 18 -3.563 -3.461 -6.973 145 HG2 GLU 18 1HG GLU 18 -1.478 -4.480 -7.845 146 HG3 GLU 18 2HG GLU 18 -1.572 -5.705 -6.581 147 H LEU 19 H LEU 19 -2.722 -0.891 -6.383 148 HA LEU 19 HA LEU 19 -4.001 -0.053 -3.805 149 HB2 LEU 19 1HB LEU 19 -2.879 1.679 -6.043 150 HB3 LEU 19 2HB LEU 19 -3.506 2.244 -4.491 151 HG LEU 19 HG LEU 19 -0.991 0.583 -4.888 152 HD11 LEU 19 1HD1 LEU 19 0.160 2.649 -4.227 153 HD12 LEU 19 1HD2 LEU 19 -0.779 2.869 -5.722 154 HD13 LEU 19 1HD3 LEU 19 -1.400 3.503 -4.179 155 HD21 LEU 19 2HD3 LEU 19 -2.145 0.119 -2.752 156 HD22 LEU 19 2HD1 LEU 19 -0.641 1.032 -2.483 157 HD23 LEU 19 2HD2 LEU 19 -2.213 1.863 -2.408 158 H PHE 20 H PHE 20 -5.795 1.433 -3.937 159 HA PHE 20 HA PHE 20 -7.547 0.722 -6.272 160 HB2 PHE 20 1HB PHE 20 -8.358 1.051 -3.352 161 HB3 PHE 20 2HB PHE 20 -9.434 0.668 -4.686 162 HD1 PHE 20 2HD PHE 20 -8.991 -1.513 -5.979 163 HD2 PHE 20 1HD PHE 20 -7.309 -0.646 -2.150 164 HE1 PHE 20 2HE PHE 20 -8.596 -3.925 -5.610 165 HE2 PHE 20 1HE PHE 20 -6.909 -3.056 -1.777 166 HZ PHE 20 HZ PHE 20 -7.552 -4.695 -3.507 167 HA PRO 21 HA PRO 21 -7.424 5.281 -6.036 168 HB2 PRO 21 1HB PRO 21 -7.165 5.686 -8.735 169 HB3 PRO 21 2HB PRO 21 -5.748 5.270 -7.762 170 HG2 PRO 21 1HG PRO 21 -7.505 3.442 -9.457 171 HG3 PRO 21 2HG PRO 21 -5.741 3.550 -9.434 172 HD2 PRO 21 1HD PRO 21 -7.049 1.633 -8.014 173 HD3 PRO 21 2HD PRO 21 -5.544 2.410 -7.376 174 H ASN 22 H ASN 22 -9.443 2.883 -7.265 175 HA ASN 22 HA ASN 22 -11.549 4.849 -8.007 176 HB2 ASN 22 1HB ASN 22 -11.468 1.821 -8.035 177 HB3 ASN 22 2HB ASN 22 -12.892 2.772 -8.431 178 HD21 ASN 22 2HD2 ASN 22 -11.417 0.936 -10.109 179 HD22 ASN 22 2HD1 ASN 22 -10.872 1.845 -11.479 180 H GLU 23 H GLU 23 -10.386 3.217 -5.260 181 HA GLU 23 HA GLU 23 -13.067 3.401 -3.927 182 HB2 GLU 23 1HB GLU 23 -10.596 1.786 -3.163 183 HB3 GLU 23 2HB GLU 23 -12.111 1.815 -2.271 184 HG2 GLU 23 1HG GLU 23 -13.273 0.839 -4.212 185 HG3 GLU 23 2HG GLU 23 -11.751 0.803 -5.100 186 H ALA 24 H ALA 24 -9.719 4.436 -3.800 187 HA ALA 24 HA ALA 24 -10.550 6.682 -2.131 188 HB1 ALA 24 3HB ALA 24 -8.505 4.700 -1.071 189 HB2 ALA 24 1HB ALA 24 -8.890 6.280 -0.350 190 HB3 ALA 24 2HB ALA 24 -10.123 4.997 -0.395 191 HA PRO 25 HA PRO 25 -7.246 7.300 -5.336 192 HB2 PRO 25 1HB PRO 25 -8.404 9.708 -6.212 193 HB3 PRO 25 2HB PRO 25 -8.792 8.137 -6.927 194 HG2 PRO 25 1HG PRO 25 -10.280 9.678 -4.766 195 HG3 PRO 25 2HG PRO 25 -10.943 8.852 -6.180 196 HD2 PRO 25 1HD PRO 25 -11.050 7.636 -3.800 197 HD3 PRO 25 2HD PRO 25 -10.580 6.677 -5.261 198 H VAL 26 H VAL 26 -8.702 9.412 -2.930 199 HA VAL 26 HA VAL 26 -6.547 11.375 -2.953 200 HB VAL 26 HB VAL 26 -8.585 10.611 -0.805 201 HG11 VAL 26 1HG1 VAL 26 -8.058 12.774 0.209 202 HG12 VAL 26 1HG2 VAL 26 -6.645 11.693 0.174 203 HG13 VAL 26 1HG3 VAL 26 -6.775 13.027 -0.998 204 HG21 VAL 26 2HG3 VAL 26 -9.605 11.450 -2.892 205 HG22 VAL 26 2HG1 VAL 26 -9.774 12.638 -1.577 206 HG23 VAL 26 2HG2 VAL 26 -8.544 12.878 -2.840 207 H THR 27 H THR 27 -7.237 8.583 -0.850 208 HA THR 27 HA THR 27 -4.806 8.965 0.690 209 HB THR 27 HB THR 27 -6.552 6.482 0.376 210 HG1 THR 27 1HG THR 27 -7.448 7.270 2.365 211 HG21 THR 27 2HG3 THR 27 -4.523 7.270 2.501 212 HG22 THR 27 2HG1 THR 27 -5.548 5.816 2.525 213 HG23 THR 27 2HG2 THR 27 -4.299 6.005 1.271 214 H VAL 28 H VAL 28 -5.668 6.984 -2.117 215 HA VAL 28 HA VAL 28 -3.134 5.631 -2.383 216 HB VAL 28 HB VAL 28 -5.205 6.547 -4.434 217 HG11 VAL 28 1HG1 VAL 28 -4.094 5.052 -6.021 218 HG12 VAL 28 1HG2 VAL 28 -3.032 6.383 -5.504 219 HG13 VAL 28 1HG3 VAL 28 -2.806 4.749 -4.833 220 HG21 VAL 28 2HG3 VAL 28 -5.981 4.831 -2.834 221 HG22 VAL 28 2HG1 VAL 28 -5.803 4.146 -4.466 222 HG23 VAL 28 2HG2 VAL 28 -4.567 3.823 -3.227 223 H ALA 29 H ALA 29 -4.244 8.771 -3.623 224 HA ALA 29 HA ALA 29 -1.823 9.409 -4.978 225 HB1 ALA 29 3HB ALA 29 -3.816 11.257 -3.616 226 HB2 ALA 29 1HB ALA 29 -2.580 11.752 -4.795 227 HB3 ALA 29 2HB ALA 29 -3.906 10.675 -5.294 228 H ASN 30 H ASN 30 -2.854 10.068 -1.628 229 HA ASN 30 HA ASN 30 -0.580 11.452 -0.713 230 HB2 ASN 30 1HB ASN 30 -2.582 11.073 0.652 231 HB3 ASN 30 2HB ASN 30 -2.219 9.354 0.739 232 HD21 ASN 30 2HD2 ASN 30 -2.157 9.512 3.010 233 HD22 ASN 30 2HD1 ASN 30 -0.781 10.180 3.826 234 H PHE 31 H PHE 31 -1.052 7.913 -0.428 235 HA PHE 31 HA PHE 31 1.627 7.414 0.432 236 HB2 PHE 31 1HB PHE 31 -0.288 5.812 0.677 237 HB3 PHE 31 2HB PHE 31 -0.271 5.554 -1.061 238 HD1 PHE 31 1HD PHE 31 1.481 4.931 2.098 239 HD2 PHE 31 2HD PHE 31 1.482 4.262 -2.122 240 HE1 PHE 31 1HE PHE 31 3.159 3.138 2.383 241 HE2 PHE 31 2HE PHE 31 3.158 2.466 -1.840 242 HZ PHE 31 HZ PHE 31 3.997 1.906 0.414 243 H GLU 32 H GLU 32 0.173 7.282 -2.816 244 HA GLU 32 HA GLU 32 2.441 6.243 -4.173 245 HB2 GLU 32 1HB GLU 32 0.234 6.417 -5.241 246 HB3 GLU 32 2HB GLU 32 0.284 8.170 -5.133 247 HG2 GLU 32 1HG GLU 32 2.246 8.184 -6.650 248 HG3 GLU 32 2HG GLU 32 2.122 6.433 -6.793 249 H LYS 33 H LYS 33 1.520 9.654 -3.639 250 HA LYS 33 HA LYS 33 3.753 10.730 -5.080 251 HB2 LYS 33 1HB LYS 33 1.986 11.885 -2.893 252 HB3 LYS 33 2HB LYS 33 3.235 12.815 -3.711 253 HG2 LYS 33 1HG LYS 33 2.099 12.482 -5.865 254 HG3 LYS 33 2HG LYS 33 0.855 11.510 -5.064 255 HD2 LYS 33 1HD LYS 33 0.254 13.460 -3.652 256 HD3 LYS 33 2HD LYS 33 1.479 14.430 -4.483 257 HE2 LYS 33 1HE LYS 33 0.300 14.069 -6.632 258 HE3 LYS 33 2HE LYS 33 -0.928 13.113 -5.797 259 HZ1 LYS 33 3HZ LYS 33 -0.337 15.952 -5.288 260 HZ2 LYS 33 1HZ LYS 33 -1.635 15.368 -6.121 261 HZ3 LYS 33 2HZ LYS 33 -1.483 15.059 -4.507 262 H LEU 34 H LEU 34 3.280 10.181 -1.586 263 HA LEU 34 HA LEU 34 5.814 11.149 -0.747 264 HB2 LEU 34 1HB LEU 34 4.031 8.944 0.357 265 HB3 LEU 34 2HB LEU 34 5.482 9.522 1.182 266 HG LEU 34 HG LEU 34 3.055 11.233 0.532 267 HD11 LEU 34 1HD1 LEU 34 2.601 11.088 2.941 268 HD12 LEU 34 1HD2 LEU 34 2.538 9.489 2.163 269 HD13 LEU 34 1HD3 LEU 34 3.959 9.955 3.128 270 HD21 LEU 34 2HD3 LEU 34 5.188 12.478 0.644 271 HD22 LEU 34 2HD1 LEU 34 4.157 12.845 2.048 272 HD23 LEU 34 2HD2 LEU 34 5.538 11.736 2.224 273 H ALA 35 H ALA 35 4.865 7.851 -1.715 274 HA ALA 35 HA ALA 35 7.390 6.649 -1.250 275 HB1 ALA 35 3HB ALA 35 5.304 5.966 -3.353 276 HB2 ALA 35 1HB ALA 35 6.631 4.908 -2.825 277 HB3 ALA 35 2HB ALA 35 5.345 5.357 -1.682 278 H ASN 36 H ASN 36 6.090 8.133 -4.228 279 HA ASN 36 HA ASN 36 8.518 7.516 -5.731 280 HB2 ASN 36 1HB ASN 36 6.060 9.177 -6.316 281 HB3 ASN 36 2HB ASN 36 7.417 9.063 -7.429 282 HD21 ASN 36 2HD2 ASN 36 4.813 8.242 -8.039 283 HD22 ASN 36 2HD1 ASN 36 4.818 6.526 -8.274 284 H GLU 37 H GLU 37 7.539 10.051 -3.623 285 HA GLU 37 HA GLU 37 9.692 11.852 -4.574 286 HB2 GLU 37 1HB GLU 37 7.719 11.984 -2.259 287 HB3 GLU 37 2HB GLU 37 8.988 13.173 -2.507 288 HG2 GLU 37 1HG GLU 37 8.041 13.829 -4.633 289 HG3 GLU 37 2HG GLU 37 6.844 12.537 -4.543 290 H GLY 38 H GLY 38 9.631 9.031 -2.897 291 HA2 GLY 38 1HA GLY 38 11.483 7.963 -1.967 292 HA3 GLY 38 2HA GLY 38 12.392 9.488 -2.079 293 H PHE 39 H PHE 39 9.276 9.547 -0.563 294 HA PHE 39 HA PHE 39 10.400 10.458 1.955 295 HB2 PHE 39 1HB PHE 39 8.204 11.249 1.140 296 HB3 PHE 39 2HB PHE 39 7.570 9.611 1.200 297 HD1 PHE 39 1HD PHE 39 8.808 12.424 3.256 298 HD2 PHE 39 2HD PHE 39 6.795 8.656 3.229 299 HE1 PHE 39 1HE PHE 39 8.104 12.785 5.598 300 HE2 PHE 39 2HE PHE 39 6.087 9.014 5.570 301 HZ PHE 39 HZ PHE 39 6.745 11.079 6.755 302 H TYR 40 H TYR 40 8.544 7.522 1.092 303 HA TYR 40 HA TYR 40 8.934 6.339 3.710 304 HB2 TYR 40 1HB TYR 40 8.059 5.158 1.048 305 HB3 TYR 40 2HB TYR 40 8.087 4.260 2.560 306 HD1 TYR 40 2HD TYR 40 6.881 5.639 4.583 307 HD2 TYR 40 1HD TYR 40 6.023 5.981 0.393 308 HE1 TYR 40 2HE TYR 40 4.612 6.463 5.114 309 HE2 TYR 40 1HE TYR 40 3.755 6.804 0.925 310 HH TYR 40 HH TYR 40 2.315 7.319 2.537 311 H ASN 41 H ASN 41 10.715 6.242 0.686 312 HA ASN 41 HA ASN 41 12.499 4.107 1.300 313 HB2 ASN 41 1HB ASN 41 12.366 5.253 -0.893 314 HB3 ASN 41 2HB ASN 41 13.086 6.688 -0.175 315 HD21 ASN 41 2HD2 ASN 41 14.121 5.164 -2.352 316 HD22 ASN 41 2HD1 ASN 41 15.659 4.538 -1.860 317 H GLY 42 H GLY 42 13.517 3.810 3.114 318 HA2 GLY 42 1HA GLY 42 15.563 4.429 4.329 319 HA3 GLY 42 2HA GLY 42 15.049 6.129 4.224 320 H LEU 43 H LEU 43 12.201 5.217 4.752 321 HA LEU 43 HA LEU 43 12.365 5.355 7.685 322 HB2 LEU 43 1HB LEU 43 9.988 5.129 5.792 323 HB3 LEU 43 2HB LEU 43 9.879 5.404 7.533 324 HG LEU 43 HG LEU 43 11.026 7.305 5.461 325 HD11 LEU 43 1HD1 LEU 43 9.137 8.715 6.144 326 HD12 LEU 43 1HD2 LEU 43 8.590 7.155 5.484 327 HD13 LEU 43 1HD3 LEU 43 8.577 7.431 7.243 328 HD21 LEU 43 2HD3 LEU 43 12.310 7.379 7.573 329 HD22 LEU 43 2HD1 LEU 43 11.323 8.846 7.370 330 HD23 LEU 43 2HD2 LEU 43 10.794 7.565 8.487 331 H THR 44 H THR 44 10.761 3.950 8.937 332 HA THR 44 HA THR 44 11.408 1.119 8.183 333 HB THR 44 HB THR 44 12.105 0.662 10.457 334 HG1 THR 44 1HG THR 44 12.117 2.392 12.002 335 HG21 THR 44 2HG3 THR 44 13.380 3.255 9.504 336 HG22 THR 44 2HG1 THR 44 14.087 2.108 10.666 337 HG23 THR 44 2HG2 THR 44 13.834 1.619 8.974 338 H PHE 45 H PHE 45 10.264 -0.471 9.639 339 HA PHE 45 HA PHE 45 7.492 0.476 10.233 340 HB2 PHE 45 1HB PHE 45 8.727 -2.301 10.039 341 HB3 PHE 45 2HB PHE 45 7.088 -2.008 10.597 342 HD1 PHE 45 2HD PHE 45 5.356 -1.236 9.060 343 HD2 PHE 45 1HD PHE 45 9.325 -2.057 7.711 344 HE1 PHE 45 2HE PHE 45 4.551 -1.276 6.722 345 HE2 PHE 45 1HE PHE 45 8.525 -2.094 5.371 346 HZ PHE 45 HZ PHE 45 6.137 -1.704 4.878 347 H HIS 46 H HIS 46 7.351 1.428 12.139 348 HA HIS 46 HA HIS 46 9.357 0.785 14.190 349 HB2 HIS 46 1HB HIS 46 8.344 2.693 15.410 350 HB3 HIS 46 2HB HIS 46 8.800 3.138 13.772 351 HD2 HIS 46 2HD HIS 46 5.709 3.532 16.037 352 HE1 HIS 46 1HE HIS 46 4.355 3.733 12.016 353 H ARG 47 H ARG 47 6.163 -0.179 13.459 354 HA ARG 47 HA ARG 47 6.028 -1.594 16.080 355 HB2 ARG 47 1HB ARG 47 3.802 0.088 14.866 356 HB3 ARG 47 2HB ARG 47 3.577 -1.047 16.187 357 HG2 ARG 47 1HG ARG 47 5.444 1.332 16.317 358 HG3 ARG 47 2HG ARG 47 3.755 1.337 16.882 359 HD2 ARG 47 1HD ARG 47 4.319 -0.542 18.383 360 HD3 ARG 47 2HD ARG 47 6.019 -0.368 17.890 361 HE ARG 47 HE ARG 47 4.480 1.395 19.635 362 HH11 ARG 47 1HH1 ARG 47 7.373 0.972 17.688 363 HH12 ARG 47 1HH2 ARG 47 8.273 2.212 18.532 364 HH21 ARG 47 2HH1 ARG 47 5.658 3.002 20.722 365 HH22 ARG 47 2HH2 ARG 47 7.303 3.362 20.250 366 H VAL 48 H VAL 48 6.676 -3.408 14.879 367 HA VAL 48 HA VAL 48 4.699 -4.442 12.879 368 HB VAL 48 HB VAL 48 7.396 -5.538 13.814 369 HG11 VAL 48 1HG1 VAL 48 7.227 -7.018 11.873 370 HG12 VAL 48 1HG2 VAL 48 5.902 -7.283 13.031 371 HG13 VAL 48 1HG3 VAL 48 5.603 -6.378 11.528 372 HG21 VAL 48 2HG3 VAL 48 7.622 -3.400 12.595 373 HG22 VAL 48 2HG1 VAL 48 8.221 -4.759 11.615 374 HG23 VAL 48 2HG2 VAL 48 6.626 -4.049 11.270 375 H ILE 49 H ILE 49 3.192 -5.788 13.299 376 HA ILE 49 HA ILE 49 3.478 -7.540 15.726 377 HB ILE 49 HB ILE 49 0.886 -6.297 14.682 378 HG12 ILE 49 1HG1 ILE 49 2.451 -5.511 17.150 379 HG13 ILE 49 1HG2 ILE 49 2.425 -4.597 15.649 380 HG21 ILE 49 2HG1 ILE 49 -0.051 -7.159 16.788 381 HG22 ILE 49 2HG2 ILE 49 0.631 -8.476 15.806 382 HG23 ILE 49 2HG3 ILE 49 1.531 -7.858 17.211 383 HD11 ILE 49 1HD3 ILE 49 0.026 -5.203 17.393 384 HD12 ILE 49 1HD1 ILE 49 0.888 -3.652 17.279 385 HD13 ILE 49 1HD2 ILE 49 -0.002 -4.280 15.872 386 HA PRO 50 HA PRO 50 3.195 -10.318 12.175 387 HB2 PRO 50 1HB PRO 50 4.227 -12.087 14.429 388 HB3 PRO 50 2HB PRO 50 4.803 -11.988 12.761 389 HG2 PRO 50 1HG PRO 50 6.275 -10.860 14.668 390 HG3 PRO 50 2HG PRO 50 6.032 -9.987 13.152 391 HD2 PRO 50 1HD PRO 50 4.622 -9.616 15.827 392 HD3 PRO 50 2HD PRO 50 5.243 -8.360 14.682 393 H GLY 51 H GLY 51 1.468 -11.311 11.628 394 HA2 GLY 51 1HA GLY 51 -0.164 -13.030 11.897 395 HA3 GLY 51 2HA GLY 51 0.024 -12.920 13.663 396 H PHE 52 H PHE 52 -0.029 -9.811 12.876 397 HA PHE 52 HA PHE 52 -3.014 -9.602 12.702 398 HB2 PHE 52 1HB PHE 52 -1.150 -8.133 14.612 399 HB3 PHE 52 2HB PHE 52 -2.816 -7.665 14.317 400 HD1 PHE 52 2HD PHE 52 -4.670 -9.069 15.089 401 HD2 PHE 52 1HD PHE 52 -0.603 -10.074 15.929 402 HE1 PHE 52 2HE PHE 52 -5.423 -10.643 16.840 403 HE2 PHE 52 1HE PHE 52 -1.352 -11.651 17.679 404 HZ PHE 52 HZ PHE 52 -3.763 -11.935 18.135 405 H VAL 53 H VAL 53 -0.739 -6.977 13.214 406 HA VAL 53 HA VAL 53 -0.747 -6.120 10.401 407 HB VAL 53 HB VAL 53 -3.068 -5.495 11.112 408 HG11 VAL 53 1HG1 VAL 53 -3.396 -3.835 12.880 409 HG12 VAL 53 1HG2 VAL 53 -2.688 -5.343 13.506 410 HG13 VAL 53 1HG3 VAL 53 -1.661 -3.909 13.270 411 HG21 VAL 53 2HG3 VAL 53 -1.831 -4.063 9.524 412 HG22 VAL 53 2HG1 VAL 53 -2.892 -3.087 10.569 413 HG23 VAL 53 2HG2 VAL 53 -1.141 -3.146 10.885 414 H SER 54 H SER 54 0.889 -4.918 9.935 415 HA SER 54 HA SER 54 2.623 -3.924 12.194 416 HB2 SER 54 1HB SER 54 4.369 -3.866 10.668 417 HB3 SER 54 2HB SER 54 3.623 -5.456 10.688 418 HG SER 54 HG SER 54 3.152 -3.405 8.818 419 H GLN 55 H GLN 55 3.406 -1.822 12.196 420 HA GLN 55 HA GLN 55 2.146 0.078 10.249 421 HB2 GLN 55 1HB GLN 55 2.695 0.516 13.216 422 HB3 GLN 55 2HB GLN 55 2.168 1.766 12.098 423 HG2 GLN 55 1HG GLN 55 0.093 0.469 11.674 424 HG3 GLN 55 2HG GLN 55 0.623 -0.701 12.914 425 HE21 GLN 55 2HE2 GLN 55 0.080 -0.340 14.975 426 HE22 GLN 55 2HE1 GLN 55 -0.560 1.146 15.595 427 H GLY 56 H GLY 56 3.365 1.620 9.361 428 HA2 GLY 56 1HA GLY 56 6.065 2.173 10.326 429 HA3 GLY 56 2HA GLY 56 6.022 1.224 8.823 430 H GLY 57 H GLY 57 7.260 3.426 8.402 431 HA2 GLY 57 1HA GLY 57 7.198 5.078 6.743 432 HA3 GLY 57 2HA GLY 57 5.429 4.915 6.663 433 H CYS 58 H CYS 58 7.424 5.520 9.543 434 HA CYS 58 HA CYS 58 6.155 8.263 9.825 435 HB2 CYS 58 1HB CYS 58 6.964 6.347 11.957 436 HB3 CYS 58 2HB CYS 58 6.469 8.018 12.191 437 HG CYS 58 HG CYS 58 4.764 5.608 10.753 438 HA PRO 59 HA PRO 59 10.393 9.668 9.714 439 HB2 PRO 59 1HB PRO 59 9.924 12.265 10.434 440 HB3 PRO 59 2HB PRO 59 9.397 11.682 8.850 441 HG2 PRO 59 1HG PRO 59 7.774 11.981 11.413 442 HG3 PRO 59 2HG PRO 59 7.356 12.524 9.785 443 HD2 PRO 59 1HD PRO 59 6.402 10.173 10.785 444 HD3 PRO 59 2HD PRO 59 6.817 10.357 9.034 445 H ARG 60 H ARG 60 8.304 9.691 12.476 446 HA ARG 60 HA ARG 60 10.678 10.083 14.252 447 HB2 ARG 60 1HB ARG 60 7.714 9.934 14.926 448 HB3 ARG 60 2HB ARG 60 9.012 10.256 16.065 449 HG2 ARG 60 1HG ARG 60 8.382 12.040 13.703 450 HG3 ARG 60 2HG ARG 60 7.719 12.264 15.340 451 HD2 ARG 60 1HD ARG 60 10.022 12.399 16.201 452 HD3 ARG 60 2HD ARG 60 10.613 12.314 14.525 453 HE ARG 60 HE ARG 60 8.699 14.394 14.741 454 HH11 ARG 60 1HH1 ARG 60 11.970 13.592 15.739 455 HH12 ARG 60 1HH2 ARG 60 12.496 15.261 15.794 456 HH21 ARG 60 2HH1 ARG 60 9.393 16.555 14.816 457 HH22 ARG 60 2HH2 ARG 60 11.038 16.938 15.272 458 H GLY 61 H GLY 61 7.936 7.856 13.735 459 HA2 GLY 61 1HA GLY 61 7.906 5.535 13.981 460 HA3 GLY 61 2HA GLY 61 9.629 5.577 14.422 461 H ASN 62 H ASN 62 7.102 7.504 15.967 462 HA ASN 62 HA ASN 62 7.675 6.039 18.520 463 HB2 ASN 62 1HB ASN 62 7.106 8.058 19.680 464 HB3 ASN 62 2HB ASN 62 8.308 8.441 18.454 465 HD21 ASN 62 2HD2 ASN 62 7.198 10.581 19.188 466 HD22 ASN 62 2HD1 ASN 62 5.923 11.126 18.149 467 H GLY 63 H GLY 63 5.514 5.906 16.153 468 HA2 GLY 63 1HA GLY 63 3.614 4.420 16.519 469 HA3 GLY 63 2HA GLY 63 3.348 5.208 18.091 470 H THR 64 H THR 64 4.003 7.854 16.669 471 HA THR 64 HA THR 64 1.275 8.230 15.474 472 HB THR 64 HB THR 64 1.156 10.417 16.550 473 HG1 THR 64 1HG THR 64 3.769 9.747 17.477 474 HG21 THR 64 2HG3 THR 64 1.988 8.276 18.545 475 HG22 THR 64 2HG1 THR 64 1.043 9.737 18.916 476 HG23 THR 64 2HG2 THR 64 0.360 8.479 17.859 477 H GLY 65 H GLY 65 4.663 9.225 15.516 478 HA2 GLY 65 1HA GLY 65 5.929 9.949 13.684 479 HA3 GLY 65 2HA GLY 65 4.456 9.967 12.687 480 H ASP 66 H ASP 66 5.723 12.014 12.028 481 HA ASP 66 HA ASP 66 4.416 14.297 13.375 482 HB2 ASP 66 1HB ASP 66 6.718 13.880 14.484 483 HB3 ASP 66 2HB ASP 66 7.423 14.346 12.941 484 H ALA 67 H ALA 67 3.875 13.139 10.918 485 HA ALA 67 HA ALA 67 5.213 14.591 8.800 486 HB1 ALA 67 3HB ALA 67 2.511 13.200 8.844 487 HB2 ALA 67 1HB ALA 67 3.365 13.763 7.389 488 HB3 ALA 67 2HB ALA 67 4.062 12.461 8.383 489 H GLY 68 H GLY 68 2.196 15.069 10.617 490 HA2 GLY 68 1HA GLY 68 1.058 17.058 11.027 491 HA3 GLY 68 2HA GLY 68 2.318 17.936 10.130 492 H TYR 69 H TYR 69 0.938 15.227 8.521 493 HA TYR 69 HA TYR 69 -0.133 16.961 6.423 494 HB2 TYR 69 1HB TYR 69 -0.200 13.941 6.786 495 HB3 TYR 69 2HB TYR 69 -0.756 14.791 5.351 496 HD1 TYR 69 1HD TYR 69 1.725 16.877 5.990 497 HD2 TYR 69 2HD TYR 69 1.248 12.703 5.121 498 HE1 TYR 69 1HE TYR 69 4.015 16.808 5.062 499 HE2 TYR 69 2HE TYR 69 3.538 12.634 4.193 500 HH TYR 69 HH TYR 69 5.581 15.546 4.118 501 H THR 70 H THR 70 -2.210 17.163 5.698 502 HA THR 70 HA THR 70 -4.344 16.130 7.534 503 HB THR 70 HB THR 70 -5.619 18.221 7.107 504 HG1 THR 70 1HG THR 70 -4.447 19.977 6.142 505 HG21 THR 70 2HG3 THR 70 -2.832 18.703 8.228 506 HG22 THR 70 2HG1 THR 70 -4.264 19.718 8.519 507 HG23 THR 70 2HG2 THR 70 -4.215 18.048 9.133 508 H ILE 71 H ILE 71 -3.917 14.442 5.709 509 HA ILE 71 HA ILE 71 -4.999 15.149 3.074 510 HB ILE 71 HB ILE 71 -4.335 12.420 4.292 511 HG12 ILE 71 1HG1 ILE 71 -2.369 13.837 4.289 512 HG13 ILE 71 1HG2 ILE 71 -2.223 12.571 3.080 513 HG21 ILE 71 2HG1 ILE 71 -4.246 11.671 1.948 514 HG22 ILE 71 2HG2 ILE 71 -5.858 12.300 2.357 515 HG23 ILE 71 2HG3 ILE 71 -4.730 13.295 1.406 516 HD11 ILE 71 1HD3 ILE 71 -2.979 15.452 2.539 517 HD12 ILE 71 1HD1 ILE 71 -1.398 14.695 2.230 518 HD13 ILE 71 1HD2 ILE 71 -2.832 14.169 1.315 519 HA PRO 72 HA PRO 72 -9.267 14.730 4.026 520 HB2 PRO 72 1HB PRO 72 -9.240 14.261 1.012 521 HB3 PRO 72 2HB PRO 72 -10.280 15.347 1.944 522 HG2 PRO 72 1HG PRO 72 -8.284 16.412 0.547 523 HG3 PRO 72 2HG PRO 72 -8.582 16.998 2.186 524 HD2 PRO 72 1HD PRO 72 -6.473 15.039 1.202 525 HD3 PRO 72 2HD PRO 72 -6.315 16.376 2.413 526 H CYS 73 H CYS 73 -10.752 13.156 4.170 527 HA CYS 73 HA CYS 73 -9.682 10.371 3.730 528 HB2 CYS 73 1HB CYS 73 -11.841 11.371 5.523 529 HB3 CYS 73 2HB CYS 73 -11.381 9.692 5.281 530 HG CYS 73 HG CYS 73 -10.517 10.521 7.551 531 H GLU 74 H GLU 74 -10.225 10.035 1.539 532 HA GLU 74 HA GLU 74 -12.789 10.738 0.416 533 HB2 GLU 74 1HB GLU 74 -10.652 10.270 -0.880 534 HB3 GLU 74 2HB GLU 74 -10.867 8.565 -0.512 535 HG2 GLU 74 1HG GLU 74 -11.650 9.257 -2.772 536 HG3 GLU 74 2HG GLU 74 -12.863 8.435 -1.794 537 H THR 75 H THR 75 -14.570 9.541 -0.076 538 HA THR 75 HA THR 75 -14.827 6.954 1.421 539 HB THR 75 HB THR 75 -17.157 7.567 1.958 540 HG1 THR 75 1HG THR 75 -17.811 9.752 1.533 541 HG21 THR 75 2HG3 THR 75 -15.168 9.713 2.793 542 HG22 THR 75 2HG1 THR 75 -16.699 9.333 3.615 543 HG23 THR 75 2HG2 THR 75 -15.383 8.134 3.582 544 H ASP 76 H ASP 76 -15.002 8.561 -1.528 545 HA ASP 76 HA ASP 76 -16.766 6.418 -2.661 546 HB2 ASP 76 1HB ASP 76 -15.924 9.125 -3.781 547 HB3 ASP 76 2HB ASP 76 -16.845 7.926 -4.677 548 H ASN 77 H ASN 77 -14.462 5.019 -4.852 549 HA ASN 77 HA ASN 77 -17.256 5.846 -4.356 550 HB2 ASN 77 1HB ASN 77 -16.037 3.563 -5.931 551 HB3 ASN 77 2HB ASN 77 -17.765 3.842 -5.772 552 HD21 ASN 77 2HD2 ASN 77 -16.286 3.818 -8.195 553 HD22 ASN 77 2HD1 ASN 77 -16.410 5.394 -8.902 554 H ASN 78 H ASN 78 -14.980 3.409 -3.257 555 HA ASN 78 HA ASN 78 -16.574 2.784 -0.935 556 HB2 ASN 78 1HB ASN 78 -17.916 1.607 -2.680 557 HB3 ASN 78 2HB ASN 78 -16.498 0.648 -3.083 558 HD21 ASN 78 2HD2 ASN 78 -17.803 -1.189 -2.532 559 HD22 ASN 78 2HD1 ASN 78 -17.984 -1.656 -0.874 560 HA PRO 79 HA PRO 79 -12.107 1.972 -0.317 561 HB2 PRO 79 1HB PRO 79 -13.333 2.352 2.449 562 HB3 PRO 79 2HB PRO 79 -11.794 2.975 1.836 563 HG2 PRO 79 1HG PRO 79 -13.838 4.666 2.068 564 HG3 PRO 79 2HG PRO 79 -12.831 4.739 0.620 565 HD2 PRO 79 1HD PRO 79 -15.563 3.457 0.994 566 HD3 PRO 79 2HD PRO 79 -14.938 4.427 -0.400 567 H HIS 80 H HIS 80 -11.103 0.237 0.608 568 HA HIS 80 HA HIS 80 -12.839 -2.132 0.520 569 HB2 HIS 80 1HB HIS 80 -10.255 -1.654 -0.293 570 HB3 HIS 80 2HB HIS 80 -9.973 -2.433 1.258 571 HD2 HIS 80 2HD HIS 80 -10.686 -3.409 -2.337 572 HE1 HIS 80 1HE HIS 80 -11.589 -6.834 0.034 573 H ARG 81 H ARG 81 -11.673 -3.929 2.140 574 HA ARG 81 HA ARG 81 -12.506 -2.882 4.825 575 HB2 ARG 81 1HB ARG 81 -12.602 -5.723 3.739 576 HB3 ARG 81 2HB ARG 81 -13.141 -5.209 5.330 577 HG2 ARG 81 1HG ARG 81 -14.353 -4.158 2.767 578 HG3 ARG 81 2HG ARG 81 -14.951 -5.595 3.632 579 HD2 ARG 81 1HD ARG 81 -14.754 -2.793 4.712 580 HD3 ARG 81 2HD ARG 81 -16.234 -3.658 4.235 581 HE ARG 81 HE ARG 81 -14.696 -3.982 6.682 582 HH11 ARG 81 1HH1 ARG 81 -17.068 -5.406 4.517 583 HH12 ARG 81 1HH2 ARG 81 -17.750 -6.447 5.748 584 HH21 ARG 81 2HH1 ARG 81 -15.590 -5.336 8.270 585 HH22 ARG 81 2HH2 ARG 81 -16.915 -6.408 7.871 586 H HIS 82 H HIS 82 -11.462 -3.565 6.681 587 HA HIS 82 HA HIS 82 -8.579 -3.924 6.323 588 HB2 HIS 82 1HB HIS 82 -10.325 -3.853 8.823 589 HB3 HIS 82 2HB HIS 82 -8.568 -3.924 8.835 590 HD2 HIS 82 2HD HIS 82 -11.394 -1.355 7.815 591 HE1 HIS 82 1HE HIS 82 -7.706 0.719 8.328 592 H VAL 83 H VAL 83 -8.900 -5.961 5.094 593 HA VAL 83 HA VAL 83 -9.134 -8.309 6.978 594 HB VAL 83 HB VAL 83 -9.911 -9.599 5.029 595 HG11 VAL 83 1HG1 VAL 83 -12.116 -8.585 4.717 596 HG12 VAL 83 1HG2 VAL 83 -11.597 -8.542 6.419 597 HG13 VAL 83 1HG3 VAL 83 -11.516 -7.067 5.426 598 HG21 VAL 83 2HG3 VAL 83 -8.701 -8.330 3.289 599 HG22 VAL 83 2HG1 VAL 83 -10.432 -8.454 2.898 600 HG23 VAL 83 2HG2 VAL 83 -9.775 -6.936 3.556 601 H THR 84 H THR 84 -8.272 -10.255 5.286 602 HA THR 84 HA THR 84 -5.507 -10.252 5.824 603 HB THR 84 HB THR 84 -6.938 -11.747 3.581 604 HG1 THR 84 1HG THR 84 -7.077 -13.393 5.211 605 HG21 THR 84 2HG3 THR 84 -4.353 -12.327 5.077 606 HG22 THR 84 2HG1 THR 84 -5.104 -13.370 3.848 607 HG23 THR 84 2HG2 THR 84 -4.475 -11.770 3.392 608 H GLY 85 H GLY 85 -4.094 -8.797 5.221 609 HA2 GLY 85 1HA GLY 85 -2.408 -8.348 3.597 610 HA3 GLY 85 2HA GLY 85 -3.573 -8.709 2.301 611 H ALA 86 H ALA 86 -5.356 -6.916 4.309 612 HA ALA 86 HA ALA 86 -5.510 -4.767 2.464 613 HB1 ALA 86 3HB ALA 86 -6.414 -4.870 5.365 614 HB2 ALA 86 1HB ALA 86 -6.940 -3.677 4.155 615 HB3 ALA 86 2HB ALA 86 -7.362 -5.394 3.954 616 H MET 87 H MET 87 -4.809 -2.686 2.433 617 HA MET 87 HA MET 87 -2.884 -1.876 4.587 618 HB2 MET 87 1HB MET 87 -2.628 -1.472 1.587 619 HB3 MET 87 2HB MET 87 -1.648 -0.628 2.777 620 HG2 MET 87 1HG MET 87 -0.730 -2.769 3.561 621 HG3 MET 87 2HG MET 87 -1.736 -3.635 2.396 622 HE1 MET 87 3HE MET 87 1.234 -1.103 2.875 623 HE2 MET 87 1HE MET 87 1.659 -0.728 1.188 624 HE3 MET 87 2HE MET 87 0.102 -0.180 1.857 625 H SER 88 H SER 88 -3.609 -0.257 5.693 626 HA SER 88 HA SER 88 -5.495 1.718 4.370 627 HB2 SER 88 1HB SER 88 -6.479 2.065 6.456 628 HB3 SER 88 2HB SER 88 -6.590 0.380 5.971 629 HG SER 88 HG SER 88 -4.819 -0.047 7.300 630 H MET 89 H MET 89 -5.455 3.865 5.411 631 HA MET 89 HA MET 89 -2.678 4.631 6.265 632 HB2 MET 89 1HB MET 89 -3.385 5.523 4.035 633 HB3 MET 89 2HB MET 89 -4.747 6.320 4.810 634 HG2 MET 89 1HG MET 89 -3.020 7.939 4.475 635 HG3 MET 89 2HG MET 89 -3.128 7.619 6.207 636 HE1 MET 89 3HE MET 89 -0.996 7.446 2.991 637 HE2 MET 89 1HE MET 89 0.282 6.278 3.401 638 HE3 MET 89 2HE MET 89 -1.393 5.720 3.169 639 H ALA 90 H ALA 90 -2.379 5.524 8.148 640 HA ALA 90 HA ALA 90 -4.594 5.723 9.997 641 HB1 ALA 90 3HB ALA 90 -1.719 6.677 10.248 642 HB2 ALA 90 1HB ALA 90 -2.890 6.549 11.580 643 HB3 ALA 90 2HB ALA 90 -2.339 5.082 10.735 644 H HIS 91 H HIS 91 -5.324 7.549 11.143 645 HA HIS 91 HA HIS 91 -4.668 10.205 9.973 646 HB2 HIS 91 1HB HIS 91 -7.012 10.818 9.746 647 HB3 HIS 91 2HB HIS 91 -6.707 9.383 8.777 648 HD2 HIS 91 2HD HIS 91 -8.352 7.257 9.336 649 HE1 HIS 91 1HE HIS 91 -10.034 8.810 12.930 650 H ARG 92 H ARG 92 -5.570 12.000 11.248 651 HA ARG 92 HA ARG 92 -5.744 11.247 14.150 652 HB2 ARG 92 1HB ARG 92 -4.485 13.721 12.900 653 HB3 ARG 92 2HB ARG 92 -4.662 13.432 14.624 654 HG2 ARG 92 1HG ARG 92 -3.164 11.488 14.458 655 HG3 ARG 92 2HG ARG 92 -2.979 11.791 12.714 656 HD2 ARG 92 1HD ARG 92 -2.081 14.008 13.222 657 HD3 ARG 92 2HD ARG 92 -2.210 13.642 14.958 658 HE ARG 92 HE ARG 92 -0.720 11.621 13.583 659 HH11 ARG 92 1HH1 ARG 92 -0.492 14.897 14.829 660 HH12 ARG 92 1HH2 ARG 92 1.239 14.821 15.065 661 HH21 ARG 92 2HH1 ARG 92 1.528 11.534 13.893 662 HH22 ARG 92 2HH2 ARG 92 2.384 12.918 14.534 663 H GLY 93 H GLY 93 -7.994 11.362 12.506 664 HA2 GLY 93 1HA GLY 93 -10.037 12.408 13.649 665 HA3 GLY 93 2HA GLY 93 -9.239 13.961 13.307 666 H ARG 94 H ARG 94 -11.364 14.312 12.197 667 HA ARG 94 HA ARG 94 -11.980 12.814 9.787 668 HB2 ARG 94 1HB ARG 94 -13.669 14.102 11.125 669 HB3 ARG 94 2HB ARG 94 -12.884 15.595 10.632 670 HG2 ARG 94 1HG ARG 94 -13.474 15.217 8.321 671 HG3 ARG 94 2HG ARG 94 -14.128 13.608 8.716 672 HD2 ARG 94 1HD ARG 94 -15.787 14.663 10.166 673 HD3 ARG 94 2HD ARG 94 -15.152 16.260 9.703 674 HE ARG 94 HE ARG 94 -16.788 14.455 8.090 675 HH11 ARG 94 1HH1 ARG 94 -14.725 17.297 8.163 676 HH12 ARG 94 1HH2 ARG 94 -15.363 17.952 6.672 677 HH21 ARG 94 2HH1 ARG 94 -17.608 15.315 6.154 678 HH22 ARG 94 2HH2 ARG 94 -16.995 16.831 5.535 679 H ASP 95 H ASP 95 -11.286 12.978 7.808 680 HA ASP 95 HA ASP 95 -9.956 13.688 6.029 681 HB2 ASP 95 1HB ASP 95 -11.069 16.356 6.993 682 HB3 ASP 95 2HB ASP 95 -10.215 16.135 5.472 683 H THR 96 H THR 96 -8.477 13.173 8.293 684 HA THR 96 HA THR 96 -6.217 15.062 7.835 685 HB THR 96 HB THR 96 -7.098 14.162 10.613 686 HG1 THR 96 1HG THR 96 -8.493 15.771 9.756 687 HG21 THR 96 2HG3 THR 96 -4.951 16.101 9.673 688 HG22 THR 96 2HG1 THR 96 -5.370 15.748 11.365 689 HG23 THR 96 2HG2 THR 96 -4.664 14.477 10.339 690 H GLY 97 H GLY 97 -6.062 12.942 6.467 691 HA2 GLY 97 1HA GLY 97 -4.925 10.680 7.924 692 HA3 GLY 97 2HA GLY 97 -4.984 10.895 6.159 693 H SER 98 H SER 98 -2.763 9.935 7.765 694 HA SER 98 HA SER 98 -0.741 12.182 7.502 695 HB2 SER 98 1HB SER 98 0.477 11.283 9.191 696 HB3 SER 98 2HB SER 98 -1.183 11.392 9.755 697 HG SER 98 HG SER 98 -1.413 9.196 9.198 698 H CYS 99 H CYS 99 1.521 10.733 7.658 699 HA CYS 99 HA CYS 99 1.702 9.223 5.092 700 HB2 CYS 99 1HB CYS 99 3.987 9.267 5.360 701 HB3 CYS 99 2HB CYS 99 3.360 10.878 5.677 702 HG CYS 99 HG CYS 99 3.284 10.432 8.341 703 H GLN 100 H GLN 100 1.255 8.618 8.483 704 HA GLN 100 HA GLN 100 2.590 6.046 8.596 705 HB2 GLN 100 1HB GLN 100 2.109 7.436 10.616 706 HB3 GLN 100 2HB GLN 100 0.386 7.199 10.360 707 HG2 GLN 100 1HG GLN 100 0.525 4.882 10.846 708 HG3 GLN 100 2HG GLN 100 2.309 4.911 10.784 709 HE21 GLN 100 2HE2 GLN 100 1.001 3.836 12.964 710 HE22 GLN 100 2HE1 GLN 100 1.226 4.865 14.341 711 H PHE 101 H PHE 101 1.976 4.097 8.045 712 HA PHE 101 HA PHE 101 -0.855 3.706 7.167 713 HB2 PHE 101 1HB PHE 101 -0.166 2.810 5.047 714 HB3 PHE 101 2HB PHE 101 0.601 4.382 5.206 715 HD1 PHE 101 2HD PHE 101 3.002 4.583 5.528 716 HD2 PHE 101 1HD PHE 101 1.134 0.763 5.121 717 HE1 PHE 101 2HE PHE 101 5.210 3.551 5.110 718 HE2 PHE 101 1HE PHE 101 3.338 -0.273 4.703 719 HZ PHE 101 HZ PHE 101 5.378 1.121 4.698 720 H PHE 102 H PHE 102 -1.364 1.445 6.679 721 HA PHE 102 HA PHE 102 0.050 -0.308 8.662 722 HB2 PHE 102 1HB PHE 102 -2.826 -0.424 7.661 723 HB3 PHE 102 2HB PHE 102 -2.103 -1.527 8.822 724 HD1 PHE 102 1HD PHE 102 -3.006 2.035 8.274 725 HD2 PHE 102 2HD PHE 102 -2.047 -1.013 11.109 726 HE1 PHE 102 1HE PHE 102 -3.670 3.544 10.117 727 HE2 PHE 102 2HE PHE 102 -2.712 0.492 12.955 728 HZ PHE 102 HZ PHE 102 -3.522 2.771 12.457 729 H ILE 103 H ILE 103 0.621 -2.392 8.148 730 HA ILE 103 HA ILE 103 -0.502 -3.452 5.569 731 HB ILE 103 HB ILE 103 2.199 -4.107 6.853 732 HG12 ILE 103 1HG1 ILE 103 1.541 -2.707 4.249 733 HG13 ILE 103 1HG2 ILE 103 2.210 -1.957 5.690 734 HG21 ILE 103 2HG1 ILE 103 2.519 -5.574 4.902 735 HG22 ILE 103 2HG2 ILE 103 1.112 -6.086 5.863 736 HG23 ILE 103 2HG3 ILE 103 0.873 -5.195 4.341 737 HD11 ILE 103 1HD3 ILE 103 3.550 -4.105 4.032 738 HD12 ILE 103 1HD1 ILE 103 3.940 -2.370 4.032 739 HD13 ILE 103 1HD2 ILE 103 4.228 -3.347 5.492 740 H VAL 104 H VAL 104 -2.086 -4.718 5.969 741 HA VAL 104 HA VAL 104 -2.207 -6.136 8.590 742 HB VAL 104 HB VAL 104 -4.212 -5.933 6.290 743 HG11 VAL 104 1HG1 VAL 104 -5.835 -6.795 7.906 744 HG12 VAL 104 1HG2 VAL 104 -4.516 -7.950 7.606 745 HG13 VAL 104 1HG3 VAL 104 -4.535 -6.992 9.105 746 HG21 VAL 104 2HG3 VAL 104 -3.783 -3.752 7.368 747 HG22 VAL 104 2HG1 VAL 104 -5.406 -4.354 7.775 748 HG23 VAL 104 2HG2 VAL 104 -4.088 -4.477 8.964 749 H HIS 105 H HIS 105 -1.882 -8.158 8.959 750 HA HIS 105 HA HIS 105 -1.455 -9.961 6.615 751 HB2 HIS 105 1HB HIS 105 0.324 -9.856 8.388 752 HB3 HIS 105 2HB HIS 105 -0.852 -10.414 9.568 753 HD2 HIS 105 2HD HIS 105 -0.666 -13.215 9.917 754 HE1 HIS 105 1HE HIS 105 0.808 -14.045 6.019 755 H GLU 106 H GLU 106 -3.332 -9.666 9.617 756 HA GLU 106 HA GLU 106 -5.345 -11.482 8.342 757 HB2 GLU 106 1HB GLU 106 -4.496 -11.436 11.269 758 HB3 GLU 106 2HB GLU 106 -5.888 -12.310 10.646 759 HG2 GLU 106 1HG GLU 106 -4.368 -13.651 9.211 760 HG3 GLU 106 2HG GLU 106 -2.993 -12.807 9.920 761 HA PRO 107 HA PRO 107 -8.334 -8.385 8.782 762 HB2 PRO 107 1HB PRO 107 -9.966 -10.592 10.135 763 HB3 PRO 107 2HB PRO 107 -10.471 -9.494 8.843 764 HG2 PRO 107 1HG PRO 107 -9.857 -12.003 8.199 765 HG3 PRO 107 2HG PRO 107 -9.280 -10.693 7.166 766 HD2 PRO 107 1HD PRO 107 -7.772 -12.300 9.250 767 HD3 PRO 107 2HD PRO 107 -7.200 -11.673 7.652 768 H GLN 108 H GLN 108 -8.893 -6.875 10.155 769 HA GLN 108 HA GLN 108 -8.351 -7.429 13.047 770 HB2 GLN 108 1HB GLN 108 -6.345 -6.400 11.872 771 HB3 GLN 108 2HB GLN 108 -7.343 -4.999 11.512 772 HG2 GLN 108 1HG GLN 108 -6.053 -4.471 13.421 773 HG3 GLN 108 2HG GLN 108 -7.724 -4.742 13.990 774 HE21 GLN 108 2HE2 GLN 108 -4.820 -5.036 15.117 775 HE22 GLN 108 2HE1 GLN 108 -4.876 -6.572 15.915 776 HA PRO 109 HA PRO 109 -12.404 -5.410 12.953 777 HB2 PRO 109 1HB PRO 109 -12.154 -6.423 15.807 778 HB3 PRO 109 2HB PRO 109 -13.524 -6.587 14.701 779 HG2 PRO 109 1HG PRO 109 -12.013 -8.730 15.171 780 HG3 PRO 109 2HG PRO 109 -12.535 -8.397 13.516 781 HD2 PRO 109 1HD PRO 109 -9.851 -7.812 14.833 782 HD3 PRO 109 2HD PRO 109 -10.188 -8.503 13.196 783 H HIS 110 H HIS 110 -9.595 -5.095 14.983 784 HA HIS 110 HA HIS 110 -10.615 -2.782 16.441 785 HB2 HIS 110 1HB HIS 110 -7.787 -3.865 16.081 786 HB3 HIS 110 2HB HIS 110 -8.220 -2.546 17.160 787 HD2 HIS 110 2HD HIS 110 -7.924 -6.331 17.246 788 HE1 HIS 110 1HE HIS 110 -10.295 -5.236 20.613 789 H LEU 111 H LEU 111 -9.294 -3.270 13.323 790 HA LEU 111 HA LEU 111 -8.944 -0.304 13.055 791 HB2 LEU 111 1HB LEU 111 -7.929 -2.559 11.276 792 HB3 LEU 111 2HB LEU 111 -7.663 -0.834 11.005 793 HG LEU 111 HG LEU 111 -6.578 -2.443 13.346 794 HD11 LEU 111 1HD1 LEU 111 -4.416 -2.128 12.227 795 HD12 LEU 111 1HD2 LEU 111 -5.552 -3.048 11.214 796 HD13 LEU 111 1HD3 LEU 111 -5.236 -1.332 10.864 797 HD21 LEU 111 2HD3 LEU 111 -7.042 -0.078 13.900 798 HD22 LEU 111 2HD1 LEU 111 -5.290 -0.384 13.807 799 HD23 LEU 111 2HD2 LEU 111 -6.123 0.438 12.465 800 H ASP 112 H ASP 112 -10.867 -3.013 12.194 801 HA ASP 112 HA ASP 112 -11.968 -2.099 9.724 802 HB2 ASP 112 1HB ASP 112 -12.309 -4.385 10.738 803 HB3 ASP 112 2HB ASP 112 -13.373 -3.657 11.935 804 H GLY 113 H GLY 113 -12.717 -0.161 9.367 805 HA2 GLY 113 1HA GLY 113 -14.550 1.339 9.385 806 HA3 GLY 113 2HA GLY 113 -15.061 0.687 10.959 807 H VAL 114 H VAL 114 -11.763 1.177 11.039 808 HA VAL 114 HA VAL 114 -12.105 3.777 12.506 809 HB VAL 114 HB VAL 114 -9.779 1.794 12.452 810 HG11 VAL 114 1HG1 VAL 114 -8.941 3.063 14.368 811 HG12 VAL 114 1HG2 VAL 114 -9.069 4.071 12.906 812 HG13 VAL 114 1HG3 VAL 114 -10.288 4.212 14.196 813 HG21 VAL 114 2HG3 VAL 114 -11.787 0.837 13.527 814 HG22 VAL 114 2HG1 VAL 114 -10.526 1.189 14.732 815 HG23 VAL 114 2HG2 VAL 114 -11.922 2.279 14.562 816 H HIS 115 H HIS 115 -9.944 2.240 10.123 817 HA HIS 115 HA HIS 115 -9.327 5.014 9.158 818 HB2 HIS 115 1HB HIS 115 -7.538 2.547 9.047 819 HB3 HIS 115 2HB HIS 115 -7.136 4.142 8.426 820 HD2 HIS 115 2HD HIS 115 -6.660 2.134 11.592 821 HE1 HIS 115 1HE HIS 115 -6.176 6.219 12.708 822 H THR 116 H THR 116 -8.231 4.723 6.843 823 HA THR 116 HA THR 116 -10.368 3.358 5.242 824 HB THR 116 HB THR 116 -8.673 5.800 4.555 825 HG1 THR 116 1HG THR 116 -11.457 5.516 5.139 826 HG21 THR 116 2HG3 THR 116 -10.923 4.432 3.031 827 HG22 THR 116 2HG1 THR 116 -10.110 5.942 2.558 828 HG23 THR 116 2HG2 THR 116 -9.202 4.412 2.581 829 H VAL 117 H VAL 117 -9.843 1.667 4.134 830 HA VAL 117 HA VAL 117 -7.009 1.008 3.586 831 HB VAL 117 HB VAL 117 -9.608 -0.348 2.718 832 HG11 VAL 117 1HG1 VAL 117 -8.192 -2.293 2.267 833 HG12 VAL 117 1HG2 VAL 117 -7.741 -0.893 1.265 834 HG13 VAL 117 1HG3 VAL 117 -6.749 -1.335 2.675 835 HG21 VAL 117 2HG3 VAL 117 -9.351 -0.299 5.174 836 HG22 VAL 117 2HG1 VAL 117 -9.121 -1.947 4.542 837 HG23 VAL 117 2HG2 VAL 117 -7.710 -0.972 5.018 838 H PHE 118 H PHE 118 -5.885 1.236 1.837 839 HA PHE 118 HA PHE 118 -7.280 2.455 -0.523 840 HB2 PHE 118 1HB PHE 118 -5.511 4.062 -0.759 841 HB3 PHE 118 2HB PHE 118 -6.060 4.161 0.907 842 HD1 PHE 118 2HD PHE 118 -4.671 3.335 2.739 843 HD2 PHE 118 1HD PHE 118 -3.315 3.223 -1.311 844 HE1 PHE 118 2HE PHE 118 -2.356 2.976 3.527 845 HE2 PHE 118 1HE PHE 118 -0.999 2.861 -0.527 846 HZ PHE 118 HZ PHE 118 -0.519 2.737 1.892 847 H GLY 119 H GLY 119 -5.206 0.066 0.686 848 HA2 GLY 119 1HA GLY 119 -4.738 -0.871 -2.072 849 HA3 GLY 119 2HA GLY 119 -3.288 -0.546 -1.095 850 H GLN 120 H GLN 120 -3.377 -3.018 -1.894 851 HA GLN 120 HA GLN 120 -3.731 -4.500 0.609 852 HB2 GLN 120 1HB GLN 120 -6.007 -4.647 -0.454 853 HB3 GLN 120 2HB GLN 120 -5.269 -5.374 -1.874 854 HG2 GLN 120 1HG GLN 120 -4.498 -7.268 -0.519 855 HG3 GLN 120 2HG GLN 120 -5.249 -6.528 0.923 856 HE21 GLN 120 2HE2 GLN 120 -6.380 -8.640 0.992 857 HE22 GLN 120 2HE1 GLN 120 -7.833 -8.820 0.067 858 H VAL 121 H VAL 121 -2.168 -5.885 0.876 859 HA VAL 121 HA VAL 121 -0.135 -6.302 -1.157 860 HB VAL 121 HB VAL 121 -0.736 -7.832 1.422 861 HG11 VAL 121 1HG1 VAL 121 1.582 -8.599 1.277 862 HG12 VAL 121 1HG2 VAL 121 0.612 -9.145 -0.112 863 HG13 VAL 121 1HG3 VAL 121 1.751 -7.790 -0.300 864 HG21 VAL 121 2HG3 VAL 121 -0.280 -5.434 1.800 865 HG22 VAL 121 2HG1 VAL 121 1.068 -6.437 2.382 866 HG23 VAL 121 2HG2 VAL 121 1.212 -5.564 0.839 867 H THR 122 H THR 122 0.213 -7.756 -2.617 868 HA THR 122 HA THR 122 -1.811 -9.963 -2.838 869 HB THR 122 HB THR 122 -1.527 -9.842 -5.276 870 HG1 THR 122 1HG THR 122 -0.260 -8.098 -6.132 871 HG21 THR 122 2HG3 THR 122 -2.082 -7.108 -4.062 872 HG22 THR 122 2HG1 THR 122 -2.573 -7.649 -5.683 873 HG23 THR 122 2HG2 THR 122 -3.265 -8.424 -4.239 874 H SER 123 H SER 123 1.526 -9.088 -2.700 875 HA SER 123 HA SER 123 2.283 -11.995 -2.688 876 HB2 SER 123 1HB SER 123 2.428 -11.468 -4.979 877 HB3 SER 123 2HB SER 123 3.441 -10.074 -4.636 878 HG SER 123 HG SER 123 4.624 -11.912 -5.165 879 H GLY 124 H GLY 124 4.119 -12.388 -1.506 880 HA2 GLY 124 1HA GLY 124 6.019 -11.828 -0.200 881 HA3 GLY 124 2HA GLY 124 5.621 -10.103 -0.373 882 H MET 125 H MET 125 3.019 -12.226 0.418 883 HA MET 125 HA MET 125 2.442 -10.962 2.921 884 HB2 MET 125 1HB MET 125 1.573 -13.620 1.737 885 HB3 MET 125 2HB MET 125 0.948 -12.988 3.254 886 HG2 MET 125 1HG MET 125 0.061 -11.016 2.078 887 HG3 MET 125 2HG MET 125 0.706 -11.631 0.553 888 HE1 MET 125 3HE MET 125 -1.937 -12.087 3.402 889 HE2 MET 125 1HE MET 125 -2.697 -13.637 2.965 890 HE3 MET 125 2HE MET 125 -1.009 -13.602 3.534 891 H ASP 126 H ASP 126 4.362 -13.806 2.111 892 HA ASP 126 HA ASP 126 4.787 -14.686 4.821 893 HB2 ASP 126 1HB ASP 126 6.415 -14.993 2.268 894 HB3 ASP 126 2HB ASP 126 6.900 -15.710 3.798 895 H VAL 127 H VAL 127 6.508 -12.376 2.746 896 HA VAL 127 HA VAL 127 8.625 -11.768 4.612 897 HB VAL 127 HB VAL 127 7.261 -10.050 2.482 898 HG11 VAL 127 1HG1 VAL 127 9.256 -8.638 2.592 899 HG12 VAL 127 1HG2 VAL 127 8.370 -8.659 4.135 900 HG13 VAL 127 1HG3 VAL 127 9.866 -9.607 3.954 901 HG21 VAL 127 2HG3 VAL 127 8.334 -12.090 1.594 902 HG22 VAL 127 2HG1 VAL 127 9.241 -10.636 1.119 903 HG23 VAL 127 2HG2 VAL 127 9.842 -11.668 2.439 904 H VAL 128 H VAL 128 5.397 -10.345 4.188 905 HA VAL 128 HA VAL 128 5.661 -8.451 6.366 906 HB VAL 128 HB VAL 128 3.214 -9.854 5.185 907 HG11 VAL 128 1HG1 VAL 128 1.905 -8.075 6.237 908 HG12 VAL 128 1HG2 VAL 128 2.761 -9.070 7.438 909 HG13 VAL 128 1HG3 VAL 128 3.378 -7.454 7.019 910 HG21 VAL 128 2HG3 VAL 128 4.451 -8.456 3.566 911 HG22 VAL 128 2HG1 VAL 128 2.891 -7.712 3.989 912 HG23 VAL 128 2HG2 VAL 128 4.398 -7.088 4.703 913 H ARG 129 H ARG 129 4.398 -11.774 6.257 914 HA ARG 129 HA ARG 129 3.589 -11.900 8.979 915 HB2 ARG 129 1HB ARG 129 3.078 -13.626 7.236 916 HB3 ARG 129 2HB ARG 129 4.763 -14.124 7.263 917 HG2 ARG 129 1HG ARG 129 4.558 -14.856 9.572 918 HG3 ARG 129 2HG ARG 129 2.879 -14.265 9.631 919 HD2 ARG 129 1HD ARG 129 2.265 -15.829 7.884 920 HD3 ARG 129 2HD ARG 129 3.943 -16.413 7.812 921 HE ARG 129 HE ARG 129 3.644 -17.536 9.825 922 HH11 ARG 129 1HH1 ARG 129 0.816 -15.602 9.048 923 HH12 ARG 129 1HH2 ARG 129 -0.198 -16.378 10.244 924 HH21 ARG 129 2HH1 ARG 129 2.318 -18.536 11.373 925 HH22 ARG 129 2HH2 ARG 129 0.651 -18.039 11.560 926 H THR 130 H THR 130 6.760 -12.505 7.502 927 HA THR 130 HA THR 130 7.870 -13.096 10.204 928 HB THR 130 HB THR 130 9.906 -13.784 8.972 929 HG1 THR 130 1HG THR 130 9.786 -13.792 6.655 930 HG21 THR 130 2HG3 THR 130 7.356 -14.961 7.801 931 HG22 THR 130 2HG1 THR 130 8.958 -15.733 7.799 932 HG23 THR 130 2HG2 THR 130 8.112 -15.444 9.337 933 H MET 131 H MET 131 7.073 -10.379 8.879 934 HA MET 131 HA MET 131 9.466 -8.806 8.775 935 HB2 MET 131 1HB MET 131 7.176 -8.095 7.997 936 HB3 MET 131 2HB MET 131 6.696 -7.937 9.680 937 HG2 MET 131 1HG MET 131 8.486 -6.235 10.000 938 HG3 MET 131 2HG MET 131 8.870 -6.357 8.281 939 HE1 MET 131 3HE MET 131 6.269 -6.534 6.705 940 HE2 MET 131 1HE MET 131 5.820 -4.824 6.504 941 HE3 MET 131 2HE MET 131 7.526 -5.318 6.371 942 H LYS 132 H LYS 132 10.667 -7.756 10.213 943 HA LYS 132 HA LYS 132 10.019 -8.240 13.103 944 HB2 LYS 132 1HB LYS 132 12.699 -7.765 11.740 945 HB3 LYS 132 2HB LYS 132 12.466 -7.875 13.479 946 HG2 LYS 132 1HG LYS 132 11.670 -10.199 13.230 947 HG3 LYS 132 2HG LYS 132 11.910 -10.088 11.481 948 HD2 LYS 132 1HD LYS 132 14.319 -9.648 11.836 949 HD3 LYS 132 2HD LYS 132 14.080 -9.758 13.586 950 HE2 LYS 132 1HE LYS 132 13.308 -12.096 13.331 951 HE3 LYS 132 2HE LYS 132 13.556 -11.988 11.587 952 HZ1 LYS 132 3HZ LYS 132 15.656 -11.702 13.632 953 HZ2 LYS 132 1HZ LYS 132 15.406 -13.026 12.680 954 HZ3 LYS 132 2HZ LYS 132 15.889 -11.601 12.002 955 H ASN 133 H ASN 133 10.382 -6.618 14.617 956 HA ASN 133 HA ASN 133 9.492 -4.017 13.743 957 HB2 ASN 133 1HB ASN 133 9.047 -4.980 15.992 958 HB3 ASN 133 2HB ASN 133 10.755 -4.823 16.378 959 HD21 ASN 133 2HD2 ASN 133 7.757 -3.337 16.467 960 HD22 ASN 133 2HD1 ASN 133 8.272 -1.724 16.832 961 H GLY 134 H GLY 134 10.502 -2.328 13.009 962 HA2 GLY 134 1HA GLY 134 12.203 -0.671 13.103 963 HA3 GLY 134 2HA GLY 134 13.303 -1.854 13.848 964 H ASP 135 H ASP 135 11.776 -3.416 11.367 965 HA ASP 135 HA ASP 135 14.066 -3.553 9.662 966 HB2 ASP 135 1HB ASP 135 11.131 -4.223 9.286 967 HB3 ASP 135 2HB ASP 135 12.273 -4.376 7.958 968 H VAL 136 H VAL 136 14.653 -2.604 7.789 969 HA VAL 136 HA VAL 136 13.530 0.167 7.500 970 HB VAL 136 HB VAL 136 16.170 -1.022 6.525 971 HG11 VAL 136 1HG1 VAL 136 16.823 1.310 6.174 972 HG12 VAL 136 1HG2 VAL 136 15.408 0.860 5.195 973 HG13 VAL 136 1HG3 VAL 136 15.197 1.838 6.666 974 HG21 VAL 136 2HG3 VAL 136 16.057 -0.979 8.992 975 HG22 VAL 136 2HG1 VAL 136 17.196 0.246 8.385 976 HG23 VAL 136 2HG2 VAL 136 15.578 0.734 8.942 977 H MET 137 H MET 137 12.517 0.860 5.828 978 HA MET 137 HA MET 137 12.092 -0.930 3.530 979 HB2 MET 137 1HB MET 137 11.173 1.913 4.089 980 HB3 MET 137 2HB MET 137 10.688 0.956 2.697 981 HG2 MET 137 1HG MET 137 9.696 -0.725 4.273 982 HG3 MET 137 2HG MET 137 10.071 0.371 5.605 983 HE1 MET 137 3HE MET 137 9.420 3.199 4.912 984 HE2 MET 137 1HE MET 137 7.665 3.307 5.189 985 HE3 MET 137 2HE MET 137 8.687 2.363 6.302 986 H LYS 138 H LYS 138 13.793 -1.234 2.275 987 HA LYS 138 HA LYS 138 15.871 0.701 1.881 988 HB2 LYS 138 1HB LYS 138 16.190 -1.734 1.547 989 HB3 LYS 138 2HB LYS 138 15.089 -1.698 0.176 990 HG2 LYS 138 1HG LYS 138 16.622 -0.269 -1.072 991 HG3 LYS 138 2HG LYS 138 17.707 -0.175 0.322 992 HD2 LYS 138 1HD LYS 138 18.066 -2.613 0.222 993 HD3 LYS 138 2HD LYS 138 16.957 -2.727 -1.152 994 HE2 LYS 138 1HE LYS 138 18.450 -1.228 -2.459 995 HE3 LYS 138 2HE LYS 138 19.567 -1.168 -1.094 996 HZ1 LYS 138 3HZ LYS 138 18.811 -3.597 -2.574 997 HZ2 LYS 138 1HZ LYS 138 20.239 -2.786 -2.712 998 HZ3 LYS 138 2HZ LYS 138 19.854 -3.541 -1.297 999 H GLU 139 H GLU 139 13.100 -0.207 -0.171 1000 HA GLU 139 HA GLU 139 13.267 2.418 -1.521 1001 HB2 GLU 139 1HB GLU 139 14.849 1.008 -2.819 1002 HB3 GLU 139 2HB GLU 139 13.598 -0.208 -3.033 1003 HG2 GLU 139 1HG GLU 139 12.265 1.323 -4.357 1004 HG3 GLU 139 2HG GLU 139 13.402 2.633 -4.050 1005 H VAL 140 H VAL 140 11.306 3.140 -1.313 1006 HA VAL 140 HA VAL 140 9.023 1.279 -1.968 1007 HB VAL 140 HB VAL 140 8.997 3.812 -0.260 1008 HG11 VAL 140 1HG1 VAL 140 6.750 3.075 0.367 1009 HG12 VAL 140 1HG2 VAL 140 6.894 3.361 -1.384 1010 HG13 VAL 140 1HG3 VAL 140 6.890 1.698 -0.750 1011 HG21 VAL 140 2HG3 VAL 140 10.269 2.010 0.853 1012 HG22 VAL 140 2HG1 VAL 140 8.710 2.283 1.664 1013 HG23 VAL 140 2HG2 VAL 140 8.916 0.885 0.583 1014 H LYS 141 H LYS 141 7.999 1.583 -3.731 1015 HA LYS 141 HA LYS 141 7.709 4.321 -4.830 1016 HB2 LYS 141 1HB LYS 141 9.178 2.069 -6.250 1017 HB3 LYS 141 2HB LYS 141 8.498 3.454 -7.093 1018 HG2 LYS 141 1HG LYS 141 9.945 4.966 -5.781 1019 HG3 LYS 141 2HG LYS 141 10.636 3.567 -4.946 1020 HD2 LYS 141 1HD LYS 141 11.473 2.676 -7.077 1021 HD3 LYS 141 2HD LYS 141 10.727 4.022 -7.951 1022 HE2 LYS 141 1HE LYS 141 12.208 5.614 -6.983 1023 HE3 LYS 141 2HE LYS 141 12.749 4.479 -5.743 1024 HZ1 LYS 141 3HZ LYS 141 13.284 4.238 -8.628 1025 HZ2 LYS 141 1HZ LYS 141 14.365 4.723 -7.480 1026 HZ3 LYS 141 2HZ LYS 141 13.788 3.177 -7.470 1027 H VAL 142 H VAL 142 6.092 4.569 -6.345 1028 HA VAL 142 HA VAL 142 4.323 2.166 -6.773 1029 HB VAL 142 HB VAL 142 3.468 5.044 -6.199 1030 HG11 VAL 142 1HG1 VAL 142 1.191 4.149 -6.228 1031 HG12 VAL 142 1HG2 VAL 142 2.010 3.942 -7.795 1032 HG13 VAL 142 1HG3 VAL 142 1.826 2.554 -6.695 1033 HG21 VAL 142 2HG3 VAL 142 4.267 3.880 -4.172 1034 HG22 VAL 142 2HG1 VAL 142 2.503 4.106 -4.123 1035 HG23 VAL 142 2HG2 VAL 142 3.185 2.513 -4.529 1036 H PHE 143 H PHE 143 3.379 1.894 -8.678 1037 HA PHE 143 HA PHE 143 4.174 3.801 -10.837 1038 HB2 PHE 143 1HB PHE 143 5.030 1.936 -12.193 1039 HB3 PHE 143 2HB PHE 143 5.958 2.093 -10.710 1040 HD1 PHE 143 2HD PHE 143 5.754 0.436 -8.920 1041 HD2 PHE 143 1HD PHE 143 3.636 0.015 -12.606 1042 HE1 PHE 143 2HE PHE 143 5.331 -1.945 -8.402 1043 HE2 PHE 143 1HE PHE 143 3.209 -2.366 -12.092 1044 HZ PHE 143 HZ PHE 143 4.058 -3.345 -9.990 1045 H ASP 144 H ASP 144 3.235 3.143 -12.966 1046 HA ASP 144 HA ASP 144 0.389 2.374 -12.511 1047 HB2 ASP 144 1HB ASP 144 1.789 3.667 -14.892 1048 HB3 ASP 144 2HB ASP 144 0.077 3.271 -14.834 1049 H GLU 145 H GLU 145 -0.527 0.608 -13.240 1050 HA GLU 145 HA GLU 145 1.030 -1.100 -15.149 1051 HB2 GLU 145 1HB GLU 145 1.220 -1.950 -12.783 1052 HB3 GLU 145 2HB GLU 145 -0.531 -2.085 -12.724 1053 HG2 GLU 145 1HG GLU 145 -0.490 -3.727 -14.536 1054 HG3 GLU 145 2HG GLU 145 1.259 -3.563 -14.664 1055 HA PRO 146 HA PRO 146 -2.860 -1.028 -17.231 1056 HB2 PRO 146 1HB PRO 146 -2.085 -2.440 -19.429 1057 HB3 PRO 146 2HB PRO 146 -1.437 -0.816 -19.170 1058 HG2 PRO 146 1HG PRO 146 -0.159 -3.507 -18.526 1059 HG3 PRO 146 2HG PRO 146 0.560 -2.127 -19.361 1060 HD2 PRO 146 1HD PRO 146 0.961 -2.572 -16.688 1061 HD3 PRO 146 2HD PRO 146 0.885 -0.903 -17.382 Start of MODEL 16 1 H MET 1 1H MET 1 -3.602 4.038 -16.669 2 HA MET 1 HA MET 1 -4.100 1.320 -16.529 3 HB2 MET 1 1HB MET 1 -1.700 3.063 -15.865 4 HB3 MET 1 2HB MET 1 -1.653 1.307 -15.932 5 HG2 MET 1 1HG MET 1 -2.361 1.422 -18.325 6 HG3 MET 1 2HG MET 1 -2.270 3.182 -18.231 7 HE1 MET 1 3HE MET 1 0.206 3.909 -16.576 8 HE2 MET 1 1HE MET 1 1.495 3.911 -17.805 9 HE3 MET 1 2HE MET 1 -0.111 4.572 -18.198 10 H ALA 2 H ALA 2 -3.563 -0.159 -14.889 11 HA ALA 2 HA ALA 2 -4.778 0.491 -12.367 12 HB1 ALA 2 3HB ALA 2 -3.015 -1.860 -13.144 13 HB2 ALA 2 1HB ALA 2 -4.021 -1.755 -11.681 14 HB3 ALA 2 2HB ALA 2 -4.787 -1.787 -13.287 15 H LYS 3 H LYS 3 -3.913 0.642 -10.306 16 HA LYS 3 HA LYS 3 -1.128 1.727 -10.276 17 HB2 LYS 3 1HB LYS 3 -3.400 1.978 -8.265 18 HB3 LYS 3 2HB LYS 3 -1.797 2.671 -8.066 19 HG2 LYS 3 1HG LYS 3 -2.206 3.979 -10.202 20 HG3 LYS 3 2HG LYS 3 -3.883 3.418 -10.125 21 HD2 LYS 3 1HD LYS 3 -4.174 4.458 -7.932 22 HD3 LYS 3 2HD LYS 3 -2.468 4.932 -7.900 23 HE2 LYS 3 1HE LYS 3 -4.438 5.853 -10.022 24 HE3 LYS 3 2HE LYS 3 -4.063 6.772 -8.561 25 HZ1 LYS 3 3HZ LYS 3 -2.120 5.985 -10.630 26 HZ2 LYS 3 1HZ LYS 3 -2.752 7.494 -10.419 27 HZ3 LYS 3 2HZ LYS 3 -1.771 6.843 -9.265 28 H LYS 4 H LYS 4 0.482 0.652 -9.474 29 HA LYS 4 HA LYS 4 -0.054 -1.382 -7.353 30 HB2 LYS 4 1HB LYS 4 0.095 -2.548 -9.567 31 HB3 LYS 4 2HB LYS 4 1.695 -1.857 -9.798 32 HG2 LYS 4 1HG LYS 4 2.504 -3.053 -7.794 33 HG3 LYS 4 2HG LYS 4 0.896 -3.754 -7.572 34 HD2 LYS 4 1HD LYS 4 1.041 -4.925 -9.689 35 HD3 LYS 4 2HD LYS 4 2.551 -4.099 -10.096 36 HE2 LYS 4 1HE LYS 4 3.674 -5.185 -8.189 37 HE3 LYS 4 2HE LYS 4 2.166 -5.988 -7.744 38 HZ1 LYS 4 3HZ LYS 4 3.622 -6.373 -10.274 39 HZ2 LYS 4 1HZ LYS 4 3.592 -7.425 -9.005 40 HZ3 LYS 4 2HZ LYS 4 2.213 -7.121 -9.858 41 H GLY 5 H GLY 5 1.255 -1.305 -5.701 42 HA2 GLY 5 1HA GLY 5 3.605 0.527 -5.933 43 HA3 GLY 5 2HA GLY 5 2.690 0.211 -4.441 44 H TYR 6 H TYR 6 5.505 0.009 -4.656 45 HA TYR 6 HA TYR 6 5.851 -2.878 -4.006 46 HB2 TYR 6 1HB TYR 6 6.582 -2.737 -6.323 47 HB3 TYR 6 2HB TYR 6 7.551 -1.310 -5.979 48 HD1 TYR 6 1HD TYR 6 7.176 -4.861 -4.834 49 HD2 TYR 6 2HD TYR 6 9.809 -1.565 -5.615 50 HE1 TYR 6 1HE TYR 6 9.124 -6.300 -4.342 51 HE2 TYR 6 2HE TYR 6 11.757 -3.004 -5.121 52 HH TYR 6 HH TYR 6 12.452 -5.041 -4.588 53 H ILE 7 H ILE 7 6.783 -3.151 -2.144 54 HA ILE 7 HA ILE 7 8.725 -1.052 -1.205 55 HB ILE 7 HB ILE 7 6.956 -2.983 0.375 56 HG12 ILE 7 1HG1 ILE 7 7.037 0.036 0.481 57 HG13 ILE 7 1HG2 ILE 7 5.929 -0.863 -0.542 58 HG21 ILE 7 2HG1 ILE 7 7.991 -2.002 2.382 59 HG22 ILE 7 2HG2 ILE 7 9.204 -2.824 1.374 60 HG23 ILE 7 2HG3 ILE 7 9.089 -1.048 1.355 61 HD11 ILE 7 1HD3 ILE 7 6.098 -1.055 2.473 62 HD12 ILE 7 1HD1 ILE 7 4.857 -0.192 1.534 63 HD13 ILE 7 1HD2 ILE 7 4.976 -1.967 1.436 64 H LEU 8 H LEU 8 10.693 -1.580 -1.635 65 HA LEU 8 HA LEU 8 11.584 -4.373 -1.179 66 HB2 LEU 8 1HB LEU 8 12.549 -3.171 -3.083 67 HB3 LEU 8 2HB LEU 8 13.042 -1.839 -2.033 68 HG LEU 8 HG LEU 8 14.604 -3.422 -0.861 69 HD11 LEU 8 1HD1 LEU 8 15.113 -5.556 -1.964 70 HD12 LEU 8 1HD2 LEU 8 13.430 -5.498 -1.389 71 HD13 LEU 8 1HD3 LEU 8 13.787 -5.274 -3.118 72 HD21 LEU 8 2HD3 LEU 8 15.355 -1.901 -2.659 73 HD22 LEU 8 2HD1 LEU 8 16.244 -3.443 -2.709 74 HD23 LEU 8 2HD2 LEU 8 14.935 -3.131 -3.875 75 H MET 9 H MET 9 12.102 -5.104 0.707 76 HA MET 9 HA MET 9 12.724 -3.227 2.910 77 HB2 MET 9 1HB MET 9 12.589 -6.263 2.917 78 HB3 MET 9 2HB MET 9 12.644 -5.212 4.325 79 HG2 MET 9 1HG MET 9 10.384 -5.352 2.307 80 HG3 MET 9 2HG MET 9 10.391 -6.067 3.921 81 HE1 MET 9 3HE MET 9 11.634 -4.007 5.837 82 HE2 MET 9 1HE MET 9 10.223 -3.024 6.295 83 HE3 MET 9 2HE MET 9 10.062 -4.790 6.131 84 H GLU 10 H GLU 10 14.553 -3.392 4.244 85 HA GLU 10 HA GLU 10 17.005 -3.597 2.690 86 HB2 GLU 10 1HB GLU 10 16.637 -1.948 4.557 87 HB3 GLU 10 2HB GLU 10 16.630 -3.284 5.699 88 HG2 GLU 10 1HG GLU 10 18.919 -3.780 5.285 89 HG3 GLU 10 2HG GLU 10 18.967 -2.729 3.872 90 H ASN 11 H ASN 11 15.097 -5.922 4.135 91 HA ASN 11 HA ASN 11 17.414 -7.755 4.562 92 HB2 ASN 11 1HB ASN 11 14.448 -8.057 5.098 93 HB3 ASN 11 2HB ASN 11 15.624 -9.347 5.307 94 HD21 ASN 11 2HD2 ASN 11 13.953 -7.017 6.883 95 HD22 ASN 11 2HD1 ASN 11 14.992 -6.774 8.247 96 H GLY 12 H GLY 12 15.838 -6.635 1.983 97 HA2 GLY 12 1HA GLY 12 16.095 -7.482 -0.207 98 HA3 GLY 12 2HA GLY 12 16.435 -9.095 0.464 99 H GLY 13 H GLY 13 13.779 -7.753 2.015 100 HA2 GLY 13 1HA GLY 13 11.956 -9.683 0.921 101 HA3 GLY 13 2HA GLY 13 11.539 -8.334 2.004 102 H LYS 14 H LYS 14 10.412 -9.549 -0.614 103 HA LYS 14 HA LYS 14 10.293 -6.985 -2.172 104 HB2 LYS 14 1HB LYS 14 10.063 -9.855 -3.163 105 HB3 LYS 14 2HB LYS 14 9.822 -8.421 -4.153 106 HG2 LYS 14 1HG LYS 14 12.187 -7.751 -3.677 107 HG3 LYS 14 2HG LYS 14 12.402 -9.281 -2.815 108 HD2 LYS 14 1HD LYS 14 11.797 -10.522 -4.874 109 HD3 LYS 14 2HD LYS 14 11.604 -8.988 -5.735 110 HE2 LYS 14 1HE LYS 14 13.995 -8.452 -5.227 111 HE3 LYS 14 2HE LYS 14 14.166 -10.044 -4.485 112 HZ1 LYS 14 3HZ LYS 14 13.441 -9.539 -7.293 113 HZ2 LYS 14 1HZ LYS 14 14.913 -10.043 -6.749 114 HZ3 LYS 14 2HZ LYS 14 13.598 -11.027 -6.599 115 H ILE 15 H ILE 15 8.543 -6.053 -1.290 116 HA ILE 15 HA ILE 15 6.033 -7.684 -1.115 117 HB ILE 15 HB ILE 15 6.732 -4.943 0.054 118 HG12 ILE 15 1HG1 ILE 15 6.387 -7.561 1.525 119 HG13 ILE 15 1HG2 ILE 15 7.949 -6.923 1.036 120 HG21 ILE 15 2HG1 ILE 15 4.626 -5.197 1.302 121 HG22 ILE 15 2HG2 ILE 15 4.334 -5.198 -0.452 122 HG23 ILE 15 2HG3 ILE 15 4.304 -6.729 0.455 123 HD11 ILE 15 1HD3 ILE 15 5.979 -5.551 2.879 124 HD12 ILE 15 1HD1 ILE 15 7.473 -6.389 3.359 125 HD13 ILE 15 1HD2 ILE 15 7.560 -4.904 2.381 126 H GLU 16 H GLU 16 4.855 -7.728 -2.816 127 HA GLU 16 HA GLU 16 4.470 -5.157 -4.312 128 HB2 GLU 16 1HB GLU 16 4.087 -8.054 -5.179 129 HB3 GLU 16 2HB GLU 16 3.608 -6.663 -6.144 130 HG2 GLU 16 1HG GLU 16 5.980 -5.909 -6.167 131 HG3 GLU 16 2HG GLU 16 6.423 -7.374 -5.294 132 H PHE 17 H PHE 17 2.569 -4.220 -4.453 133 HA PHE 17 HA PHE 17 0.134 -5.666 -3.575 134 HB2 PHE 17 1HB PHE 17 -0.407 -3.890 -1.915 135 HB3 PHE 17 2HB PHE 17 1.003 -4.829 -1.449 136 HD1 PHE 17 2HD PHE 17 3.276 -3.859 -1.667 137 HD2 PHE 17 1HD PHE 17 -0.253 -1.558 -2.377 138 HE1 PHE 17 2HE PHE 17 4.589 -1.777 -1.435 139 HE2 PHE 17 1HE PHE 17 1.057 0.526 -2.150 140 HZ PHE 17 HZ PHE 17 3.479 0.416 -1.680 141 H GLU 18 H GLU 18 -1.805 -4.658 -4.088 142 HA GLU 18 HA GLU 18 -1.498 -2.721 -6.344 143 HB2 GLU 18 1HB GLU 18 -3.795 -4.563 -5.551 144 HB3 GLU 18 2HB GLU 18 -3.840 -3.435 -6.899 145 HG2 GLU 18 1HG GLU 18 -1.963 -4.634 -7.961 146 HG3 GLU 18 2HG GLU 18 -1.940 -5.773 -6.616 147 H LEU 19 H LEU 19 -2.910 -0.972 -6.599 148 HA LEU 19 HA LEU 19 -3.859 0.099 -3.965 149 HB2 LEU 19 1HB LEU 19 -2.400 1.272 -6.276 150 HB3 LEU 19 2HB LEU 19 -3.720 2.263 -5.646 151 HG LEU 19 HG LEU 19 -2.666 2.595 -3.585 152 HD11 LEU 19 1HD1 LEU 19 -0.810 1.217 -2.759 153 HD12 LEU 19 1HD2 LEU 19 -2.259 0.238 -3.090 154 HD13 LEU 19 1HD3 LEU 19 -0.894 0.222 -4.231 155 HD21 LEU 19 2HD3 LEU 19 -1.478 3.722 -5.438 156 HD22 LEU 19 2HD1 LEU 19 -0.352 3.265 -4.138 157 HD23 LEU 19 2HD2 LEU 19 -0.428 2.298 -5.630 158 H PHE 20 H PHE 20 -5.753 1.301 -3.851 159 HA PHE 20 HA PHE 20 -7.672 0.748 -6.091 160 HB2 PHE 20 1HB PHE 20 -8.252 0.525 -3.108 161 HB3 PHE 20 2HB PHE 20 -9.398 0.256 -4.411 162 HD1 PHE 20 2HD PHE 20 -8.893 -1.646 -6.064 163 HD2 PHE 20 1HD PHE 20 -6.962 -1.227 -2.276 164 HE1 PHE 20 2HE PHE 20 -8.270 -4.038 -6.121 165 HE2 PHE 20 1HE PHE 20 -6.335 -3.618 -2.330 166 HZ PHE 20 HZ PHE 20 -6.989 -5.024 -4.252 167 HA PRO 21 HA PRO 21 -7.814 5.239 -5.088 168 HB2 PRO 21 1HB PRO 21 -7.962 5.994 -7.742 169 HB3 PRO 21 2HB PRO 21 -6.401 5.714 -6.960 170 HG2 PRO 21 1HG PRO 21 -8.035 3.817 -8.699 171 HG3 PRO 21 2HG PRO 21 -6.314 4.197 -8.815 172 HD2 PRO 21 1HD PRO 21 -7.133 1.955 -7.547 173 HD3 PRO 21 2HD PRO 21 -5.747 2.921 -6.898 174 H ASN 22 H ASN 22 -9.682 2.884 -6.763 175 HA ASN 22 HA ASN 22 -12.057 4.535 -7.077 176 HB2 ASN 22 1HB ASN 22 -11.610 1.544 -6.980 177 HB3 ASN 22 2HB ASN 22 -13.196 2.273 -7.191 178 HD21 ASN 22 2HD2 ASN 22 -11.948 0.567 -9.047 179 HD22 ASN 22 2HD1 ASN 22 -11.655 1.468 -10.497 180 H GLU 23 H GLU 23 -10.550 2.930 -4.409 181 HA GLU 23 HA GLU 23 -13.029 3.137 -2.772 182 HB2 GLU 23 1HB GLU 23 -10.259 2.039 -2.131 183 HB3 GLU 23 2HB GLU 23 -11.622 2.038 -1.021 184 HG2 GLU 23 1HG GLU 23 -12.873 0.564 -2.516 185 HG3 GLU 23 2HG GLU 23 -11.556 0.605 -3.685 186 H ALA 24 H ALA 24 -9.763 4.496 -2.995 187 HA ALA 24 HA ALA 24 -10.744 6.873 -1.553 188 HB1 ALA 24 3HB ALA 24 -8.364 5.260 -0.566 189 HB2 ALA 24 1HB ALA 24 -8.863 6.854 0.045 190 HB3 ALA 24 2HB ALA 24 -9.924 5.443 0.270 191 HA PRO 25 HA PRO 25 -8.163 7.907 -5.213 192 HB2 PRO 25 1HB PRO 25 -9.785 10.421 -4.590 193 HB3 PRO 25 2HB PRO 25 -9.417 9.718 -6.171 194 HG2 PRO 25 1HG PRO 25 -11.861 9.373 -5.181 195 HG3 PRO 25 2HG PRO 25 -11.053 8.001 -5.945 196 HD2 PRO 25 1HD PRO 25 -11.396 8.625 -2.992 197 HD3 PRO 25 2HD PRO 25 -11.496 7.031 -3.844 198 H VAL 26 H VAL 26 -8.927 9.941 -2.378 199 HA VAL 26 HA VAL 26 -6.554 11.600 -2.761 200 HB VAL 26 HB VAL 26 -8.376 11.172 -0.343 201 HG11 VAL 26 1HG1 VAL 26 -7.438 13.267 0.505 202 HG12 VAL 26 1HG2 VAL 26 -6.199 12.001 0.335 203 HG13 VAL 26 1HG3 VAL 26 -6.304 13.313 -0.865 204 HG21 VAL 26 2HG3 VAL 26 -9.543 12.094 -2.316 205 HG22 VAL 26 2HG1 VAL 26 -9.378 13.324 -1.041 206 HG23 VAL 26 2HG2 VAL 26 -8.303 13.364 -2.458 207 H THR 27 H THR 27 -7.333 8.965 -0.492 208 HA THR 27 HA THR 27 -4.821 9.110 0.888 209 HB THR 27 HB THR 27 -6.710 6.740 0.528 210 HG1 THR 27 1HG THR 27 -6.531 8.260 2.881 211 HG21 THR 27 2HG3 THR 27 -4.517 7.262 2.571 212 HG22 THR 27 2HG1 THR 27 -5.634 5.877 2.570 213 HG23 THR 27 2HG2 THR 27 -4.448 6.065 1.257 214 H VAL 28 H VAL 28 -5.881 7.136 -1.876 215 HA VAL 28 HA VAL 28 -3.380 5.697 -2.163 216 HB VAL 28 HB VAL 28 -5.582 6.416 -4.157 217 HG11 VAL 28 1HG1 VAL 28 -4.615 4.702 -5.612 218 HG12 VAL 28 1HG2 VAL 28 -3.488 6.051 -5.330 219 HG13 VAL 28 1HG3 VAL 28 -3.257 4.506 -4.477 220 HG21 VAL 28 2HG3 VAL 28 -6.292 4.936 -2.310 221 HG22 VAL 28 2HG1 VAL 28 -6.239 4.050 -3.853 222 HG23 VAL 28 2HG2 VAL 28 -4.933 3.842 -2.662 223 H ALA 29 H ALA 29 -4.585 8.684 -3.670 224 HA ALA 29 HA ALA 29 -2.321 9.127 -5.317 225 HB1 ALA 29 3HB ALA 29 -4.121 11.159 -3.953 226 HB2 ALA 29 1HB ALA 29 -3.024 11.492 -5.311 227 HB3 ALA 29 2HB ALA 29 -4.411 10.400 -5.535 228 H ASN 30 H ASN 30 -2.948 10.138 -1.959 229 HA ASN 30 HA ASN 30 -0.534 11.644 -1.633 230 HB2 ASN 30 1HB ASN 30 -2.351 10.222 0.320 231 HB3 ASN 30 2HB ASN 30 -0.924 11.111 0.834 232 HD21 ASN 30 2HD2 ASN 30 -3.485 11.778 1.655 233 HD22 ASN 30 2HD1 ASN 30 -3.908 13.319 0.988 234 H PHE 31 H PHE 31 -1.266 8.241 -0.839 235 HA PHE 31 HA PHE 31 1.326 7.591 0.162 236 HB2 PHE 31 1HB PHE 31 -0.692 6.134 0.396 237 HB3 PHE 31 2HB PHE 31 -0.652 5.813 -1.331 238 HD1 PHE 31 1HD PHE 31 1.019 5.211 1.886 239 HD2 PHE 31 2HD PHE 31 0.975 4.318 -2.292 240 HE1 PHE 31 1HE PHE 31 2.547 3.307 2.277 241 HE2 PHE 31 2HE PHE 31 2.500 2.412 -1.903 242 HZ PHE 31 HZ PHE 31 3.288 1.908 0.383 243 H GLU 32 H GLU 32 0.012 7.283 -3.143 244 HA GLU 32 HA GLU 32 2.349 6.172 -4.324 245 HB2 GLU 32 1HB GLU 32 0.188 6.261 -5.498 246 HB3 GLU 32 2HB GLU 32 0.233 8.018 -5.508 247 HG2 GLU 32 1HG GLU 32 2.230 7.961 -6.948 248 HG3 GLU 32 2HG GLU 32 2.183 6.199 -6.938 249 H LYS 33 H LYS 33 1.382 9.597 -4.034 250 HA LYS 33 HA LYS 33 3.677 10.641 -5.386 251 HB2 LYS 33 1HB LYS 33 1.830 11.846 -3.293 252 HB3 LYS 33 2HB LYS 33 3.108 12.755 -4.088 253 HG2 LYS 33 1HG LYS 33 2.049 12.364 -6.274 254 HG3 LYS 33 2HG LYS 33 0.773 11.420 -5.490 255 HD2 LYS 33 1HD LYS 33 0.131 13.411 -4.157 256 HD3 LYS 33 2HD LYS 33 1.394 14.351 -4.964 257 HE2 LYS 33 1HE LYS 33 0.296 13.938 -7.148 258 HE3 LYS 33 2HE LYS 33 -0.972 13.019 -6.334 259 HZ1 LYS 33 3HZ LYS 33 -0.371 15.866 -5.884 260 HZ2 LYS 33 1HZ LYS 33 -1.643 15.270 -6.749 261 HZ3 LYS 33 2HZ LYS 33 -1.555 15.006 -5.122 262 H LEU 34 H LEU 34 3.065 10.180 -1.900 263 HA LEU 34 HA LEU 34 5.554 11.175 -0.977 264 HB2 LEU 34 1HB LEU 34 3.735 8.981 0.087 265 HB3 LEU 34 2HB LEU 34 5.158 9.560 0.959 266 HG LEU 34 HG LEU 34 2.808 11.322 0.183 267 HD11 LEU 34 1HD1 LEU 34 2.152 11.135 2.540 268 HD12 LEU 34 1HD2 LEU 34 2.102 9.559 1.717 269 HD13 LEU 34 1HD3 LEU 34 3.452 9.951 2.809 270 HD21 LEU 34 2HD3 LEU 34 4.963 12.490 0.502 271 HD22 LEU 34 2HD1 LEU 34 3.831 12.858 1.826 272 HD23 LEU 34 2HD2 LEU 34 5.157 11.698 2.085 273 H ALA 35 H ALA 35 4.680 7.844 -1.906 274 HA ALA 35 HA ALA 35 7.197 6.686 -1.312 275 HB1 ALA 35 3HB ALA 35 5.205 5.923 -3.477 276 HB2 ALA 35 1HB ALA 35 6.522 4.895 -2.870 277 HB3 ALA 35 2HB ALA 35 5.185 5.359 -1.791 278 H ASN 36 H ASN 36 6.007 8.125 -4.352 279 HA ASN 36 HA ASN 36 8.491 7.505 -5.763 280 HB2 ASN 36 1HB ASN 36 6.053 9.158 -6.449 281 HB3 ASN 36 2HB ASN 36 7.450 9.034 -7.510 282 HD21 ASN 36 2HD2 ASN 36 4.836 8.202 -8.160 283 HD22 ASN 36 2HD1 ASN 36 4.864 6.487 -8.401 284 H GLU 37 H GLU 37 7.408 10.060 -3.721 285 HA GLU 37 HA GLU 37 9.566 11.883 -4.588 286 HB2 GLU 37 1HB GLU 37 7.578 11.932 -2.281 287 HB3 GLU 37 2HB GLU 37 8.830 13.148 -2.498 288 HG2 GLU 37 1HG GLU 37 7.880 13.846 -4.601 289 HG3 GLU 37 2HG GLU 37 6.719 12.521 -4.570 290 H GLY 38 H GLY 38 9.433 9.053 -2.843 291 HA2 GLY 38 1HA GLY 38 11.299 7.974 -1.920 292 HA3 GLY 38 2HA GLY 38 12.192 9.513 -1.954 293 H PHE 39 H PHE 39 9.022 9.583 -0.595 294 HA PHE 39 HA PHE 39 9.996 10.402 2.002 295 HB2 PHE 39 1HB PHE 39 7.830 11.180 1.124 296 HB3 PHE 39 2HB PHE 39 7.229 9.530 1.067 297 HD1 PHE 39 1HD PHE 39 8.441 12.165 3.392 298 HD2 PHE 39 2HD PHE 39 6.211 8.550 2.934 299 HE1 PHE 39 1HE PHE 39 7.600 12.392 5.706 300 HE2 PHE 39 2HE PHE 39 5.366 8.775 5.247 301 HZ PHE 39 HZ PHE 39 6.063 10.698 6.633 302 H TYR 40 H TYR 40 8.200 7.468 1.005 303 HA TYR 40 HA TYR 40 8.520 6.249 3.620 304 HB2 TYR 40 1HB TYR 40 7.680 5.115 0.926 305 HB3 TYR 40 2HB TYR 40 7.669 4.197 2.425 306 HD1 TYR 40 1HD TYR 40 6.393 5.432 4.438 307 HD2 TYR 40 2HD TYR 40 5.716 6.098 0.254 308 HE1 TYR 40 1HE TYR 40 4.125 6.276 4.939 309 HE2 TYR 40 2HE TYR 40 3.448 6.942 0.755 310 HH TYR 40 HH TYR 40 2.313 7.296 4.093 311 H ASN 41 H ASN 41 10.395 6.241 0.667 312 HA ASN 41 HA ASN 41 12.119 4.041 1.262 313 HB2 ASN 41 1HB ASN 41 12.078 5.206 -0.908 314 HB3 ASN 41 2HB ASN 41 12.748 6.647 -0.153 315 HD21 ASN 41 2HD2 ASN 41 13.878 5.143 -2.305 316 HD22 ASN 41 2HD1 ASN 41 15.411 4.544 -1.765 317 H GLY 42 H GLY 42 13.038 3.701 3.131 318 HA2 GLY 42 1HA GLY 42 15.104 4.140 4.343 319 HA3 GLY 42 2HA GLY 42 14.803 5.884 4.155 320 H LEU 43 H LEU 43 11.834 4.771 4.736 321 HA LEU 43 HA LEU 43 12.003 5.365 7.632 322 HB2 LEU 43 1HB LEU 43 9.595 4.815 5.851 323 HB3 LEU 43 2HB LEU 43 9.544 5.403 7.516 324 HG LEU 43 HG LEU 43 10.505 6.894 5.056 325 HD11 LEU 43 1HD1 LEU 43 8.699 8.433 5.685 326 HD12 LEU 43 1HD2 LEU 43 8.088 6.789 5.386 327 HD13 LEU 43 1HD3 LEU 43 8.277 7.379 7.055 328 HD21 LEU 43 2HD3 LEU 43 12.025 7.329 6.958 329 HD22 LEU 43 2HD1 LEU 43 11.012 8.751 6.607 330 HD23 LEU 43 2HD2 LEU 43 10.623 7.701 7.991 331 H THR 44 H THR 44 10.635 4.090 9.133 332 HA THR 44 HA THR 44 11.118 1.178 8.589 333 HB THR 44 HB THR 44 11.930 0.898 10.855 334 HG1 THR 44 1HG THR 44 12.101 2.760 12.228 335 HG21 THR 44 2HG3 THR 44 13.240 3.336 9.592 336 HG22 THR 44 2HG1 THR 44 13.975 2.271 10.813 337 HG23 THR 44 2HG2 THR 44 13.599 1.640 9.192 338 H PHE 45 H PHE 45 10.003 -0.255 10.162 339 HA PHE 45 HA PHE 45 7.222 0.724 10.591 340 HB2 PHE 45 1HB PHE 45 8.507 -2.033 10.654 341 HB3 PHE 45 2HB PHE 45 6.858 -1.743 11.187 342 HD1 PHE 45 1HD PHE 45 9.126 -1.769 8.290 343 HD2 PHE 45 2HD PHE 45 5.091 -1.311 9.619 344 HE1 PHE 45 1HE PHE 45 8.334 -2.001 5.960 345 HE2 PHE 45 2HE PHE 45 4.295 -1.546 7.290 346 HZ PHE 45 HZ PHE 45 5.918 -1.889 5.460 347 H HIS 46 H HIS 46 6.777 1.685 12.418 348 HA HIS 46 HA HIS 46 8.731 1.583 14.576 349 HB2 HIS 46 1HB HIS 46 7.288 3.248 15.659 350 HB3 HIS 46 2HB HIS 46 7.562 3.686 13.978 351 HD2 HIS 46 2HD HIS 46 4.625 2.505 16.290 352 HE1 HIS 46 1HE HIS 46 3.027 3.634 12.504 353 H ARG 47 H ARG 47 5.915 -0.197 13.822 354 HA ARG 47 HA ARG 47 6.028 -1.652 16.356 355 HB2 ARG 47 1HB ARG 47 4.697 0.400 16.956 356 HB3 ARG 47 2HB ARG 47 3.540 -0.024 15.704 357 HG2 ARG 47 1HG ARG 47 2.959 -2.077 16.875 358 HG3 ARG 47 2HG ARG 47 4.196 -1.741 18.111 359 HD2 ARG 47 1HD ARG 47 1.810 -0.016 17.487 360 HD3 ARG 47 2HD ARG 47 1.966 -1.139 18.858 361 HE ARG 47 HE ARG 47 4.139 0.454 19.158 362 HH11 ARG 47 1HH1 ARG 47 0.731 1.146 18.659 363 HH12 ARG 47 1HH2 ARG 47 0.777 2.649 19.553 364 HH21 ARG 47 2HH1 ARG 47 4.186 2.407 20.315 365 HH22 ARG 47 2HH2 ARG 47 2.733 3.364 20.490 366 H VAL 48 H VAL 48 6.403 -3.399 15.027 367 HA VAL 48 HA VAL 48 4.148 -4.293 13.278 368 HB VAL 48 HB VAL 48 6.810 -5.629 13.966 369 HG11 VAL 48 1HG1 VAL 48 6.342 -7.043 12.025 370 HG12 VAL 48 1HG2 VAL 48 5.097 -7.208 13.286 371 HG13 VAL 48 1HG3 VAL 48 4.765 -6.246 11.825 372 HG21 VAL 48 2HG3 VAL 48 7.141 -3.497 12.763 373 HG22 VAL 48 2HG1 VAL 48 7.524 -4.884 11.717 374 HG23 VAL 48 2HG2 VAL 48 5.983 -4.018 11.516 375 H ILE 49 H ILE 49 2.512 -5.309 14.003 376 HA ILE 49 HA ILE 49 2.915 -7.180 16.325 377 HB ILE 49 HB ILE 49 0.404 -5.567 15.648 378 HG12 ILE 49 1HG1 ILE 49 2.332 -5.137 17.940 379 HG13 ILE 49 1HG2 ILE 49 2.285 -4.159 16.482 380 HG21 ILE 49 2HG1 ILE 49 -0.397 -6.399 17.823 381 HG22 ILE 49 2HG2 ILE 49 -0.032 -7.745 16.719 382 HG23 ILE 49 2HG3 ILE 49 1.105 -7.333 18.023 383 HD11 ILE 49 1HD3 ILE 49 0.020 -4.488 18.462 384 HD12 ILE 49 1HD1 ILE 49 1.091 -3.077 18.303 385 HD13 ILE 49 1HD2 ILE 49 -0.028 -3.499 16.984 386 HA PRO 50 HA PRO 50 1.745 -9.924 12.906 387 HB2 PRO 50 1HB PRO 50 2.848 -11.746 15.080 388 HB3 PRO 50 2HB PRO 50 3.168 -11.794 13.342 389 HG2 PRO 50 1HG PRO 50 5.064 -10.838 14.945 390 HG3 PRO 50 2HG PRO 50 4.720 -9.991 13.434 391 HD2 PRO 50 1HD PRO 50 3.805 -9.319 16.259 392 HD3 PRO 50 2HD PRO 50 4.425 -8.213 14.970 393 H GLY 51 H GLY 51 -0.166 -10.683 12.686 394 HA2 GLY 51 1HA GLY 51 -2.071 -11.947 13.296 395 HA3 GLY 51 2HA GLY 51 -1.542 -11.913 14.994 396 H PHE 52 H PHE 52 -1.182 -8.842 13.790 397 HA PHE 52 HA PHE 52 -4.041 -8.057 14.108 398 HB2 PHE 52 1HB PHE 52 -2.886 -7.766 16.332 399 HB3 PHE 52 2HB PHE 52 -1.736 -6.687 15.558 400 HD1 PHE 52 1HD PHE 52 -5.440 -6.966 15.139 401 HD2 PHE 52 2HD PHE 52 -2.134 -4.582 16.419 402 HE1 PHE 52 1HE PHE 52 -6.967 -5.061 15.530 403 HE2 PHE 52 2HE PHE 52 -3.658 -2.676 16.813 404 HZ PHE 52 HZ PHE 52 -6.076 -2.917 16.367 405 H VAL 53 H VAL 53 -1.469 -5.731 14.198 406 HA VAL 53 HA VAL 53 -1.528 -5.383 11.225 407 HB VAL 53 HB VAL 53 -1.907 -2.998 11.418 408 HG11 VAL 53 1HG1 VAL 53 -4.195 -2.903 12.280 409 HG12 VAL 53 1HG2 VAL 53 -3.916 -4.356 11.292 410 HG13 VAL 53 1HG3 VAL 53 -3.964 -4.482 13.068 411 HG21 VAL 53 2HG3 VAL 53 -0.721 -2.657 13.559 412 HG22 VAL 53 2HG1 VAL 53 -2.340 -1.920 13.602 413 HG23 VAL 53 2HG2 VAL 53 -2.046 -3.471 14.425 414 H SER 54 H SER 54 0.202 -4.343 10.324 415 HA SER 54 HA SER 54 2.624 -4.064 12.124 416 HB2 SER 54 1HB SER 54 2.951 -5.722 10.537 417 HB3 SER 54 2HB SER 54 2.404 -4.682 9.231 418 HG SER 54 HG SER 54 4.099 -3.272 9.756 419 H GLN 55 H GLN 55 2.601 -1.943 12.773 420 HA GLN 55 HA GLN 55 1.809 0.158 10.834 421 HB2 GLN 55 1HB GLN 55 2.629 0.403 13.760 422 HB3 GLN 55 2HB GLN 55 1.914 1.666 12.768 423 HG2 GLN 55 1HG GLN 55 -0.147 0.324 12.560 424 HG3 GLN 55 2HG GLN 55 0.582 -0.911 13.624 425 HE21 GLN 55 2HE2 GLN 55 -1.569 -0.276 14.727 426 HE22 GLN 55 2HE1 GLN 55 -1.451 0.960 15.934 427 H GLY 56 H GLY 56 3.067 1.692 9.996 428 HA2 GLY 56 1HA GLY 56 5.841 2.026 10.846 429 HA3 GLY 56 2HA GLY 56 5.668 1.199 9.281 430 H GLY 57 H GLY 57 7.010 3.390 9.014 431 HA2 GLY 57 1HA GLY 57 6.559 5.098 7.270 432 HA3 GLY 57 2HA GLY 57 5.047 5.471 8.130 433 H CYS 58 H CYS 58 7.871 4.730 10.003 434 HA CYS 58 HA CYS 58 8.058 7.629 10.871 435 HB2 CYS 58 1HB CYS 58 8.544 5.151 12.452 436 HB3 CYS 58 2HB CYS 58 8.829 6.805 12.975 437 HG CYS 58 HG CYS 58 5.978 5.622 11.865 438 HA PRO 59 HA PRO 59 12.264 7.317 9.450 439 HB2 PRO 59 1HB PRO 59 13.149 9.724 10.391 440 HB3 PRO 59 2HB PRO 59 11.972 9.679 9.072 441 HG2 PRO 59 1HG PRO 59 11.487 10.096 12.054 442 HG3 PRO 59 2HG PRO 59 10.855 11.040 10.701 443 HD2 PRO 59 1HD PRO 59 9.378 9.070 11.883 444 HD3 PRO 59 2HD PRO 59 9.261 9.409 10.109 445 H ARG 60 H ARG 60 11.270 7.534 12.743 446 HA ARG 60 HA ARG 60 14.020 6.658 13.573 447 HB2 ARG 60 1HB ARG 60 11.973 8.250 15.167 448 HB3 ARG 60 2HB ARG 60 13.516 7.674 15.779 449 HG2 ARG 60 1HG ARG 60 14.691 9.107 14.146 450 HG3 ARG 60 2HG ARG 60 13.118 9.712 13.575 451 HD2 ARG 60 1HD ARG 60 12.637 10.509 15.840 452 HD3 ARG 60 2HD ARG 60 14.255 9.971 16.348 453 HE ARG 60 HE ARG 60 14.567 11.640 14.109 454 HH11 ARG 60 1HH1 ARG 60 13.474 11.847 17.441 455 HH12 ARG 60 1HH2 ARG 60 13.947 13.521 17.624 456 HH21 ARG 60 2HH1 ARG 60 15.177 13.813 14.359 457 HH22 ARG 60 2HH2 ARG 60 14.911 14.635 15.880 458 H GLY 61 H GLY 61 10.663 5.962 13.471 459 HA2 GLY 61 1HA GLY 61 9.594 3.965 14.035 460 HA3 GLY 61 2HA GLY 61 11.122 3.360 14.715 461 H ASN 62 H ASN 62 9.709 6.454 15.617 462 HA ASN 62 HA ASN 62 9.425 5.396 18.405 463 HB2 ASN 62 1HB ASN 62 9.752 7.665 19.152 464 HB3 ASN 62 2HB ASN 62 11.072 7.208 18.083 465 HD21 ASN 62 2HD2 ASN 62 10.881 9.771 18.413 466 HD22 ASN 62 2HD1 ASN 62 10.138 10.571 17.069 467 H GLY 63 H GLY 63 7.528 5.786 15.840 468 HA2 GLY 63 1HA GLY 63 5.172 5.460 16.001 469 HA3 GLY 63 2HA GLY 63 5.185 6.226 17.607 470 H THR 64 H THR 64 7.123 8.177 15.908 471 HA THR 64 HA THR 64 4.855 9.892 14.943 472 HB THR 64 HB THR 64 7.604 10.726 15.975 473 HG1 THR 64 1HG THR 64 6.309 11.621 17.679 474 HG21 THR 64 2HG3 THR 64 5.215 12.377 15.069 475 HG22 THR 64 2HG1 THR 64 6.719 13.015 15.771 476 HG23 THR 64 2HG2 THR 64 6.751 12.203 14.189 477 H GLY 65 H GLY 65 4.657 10.147 12.880 478 HA2 GLY 65 1HA GLY 65 6.701 9.167 11.058 479 HA3 GLY 65 2HA GLY 65 5.151 9.922 10.618 480 H ASP 66 H ASP 66 7.170 10.602 9.055 481 HA ASP 66 HA ASP 66 8.273 13.180 10.101 482 HB2 ASP 66 1HB ASP 66 9.657 11.190 8.927 483 HB3 ASP 66 2HB ASP 66 9.109 12.004 7.467 484 H ALA 67 H ALA 67 5.491 12.788 9.248 485 HA ALA 67 HA ALA 67 5.148 14.003 6.665 486 HB1 ALA 67 3HB ALA 67 3.284 13.938 9.064 487 HB2 ALA 67 1HB ALA 67 2.824 14.382 7.404 488 HB3 ALA 67 2HB ALA 67 3.361 12.725 7.766 489 H GLY 68 H GLY 68 5.007 15.355 9.970 490 HA2 GLY 68 1HA GLY 68 5.769 17.475 10.639 491 HA3 GLY 68 2HA GLY 68 6.052 17.902 8.936 492 H TYR 69 H TYR 69 3.050 16.556 9.028 493 HA TYR 69 HA TYR 69 1.410 18.669 10.081 494 HB2 TYR 69 1HB TYR 69 0.632 19.545 7.827 495 HB3 TYR 69 2HB TYR 69 2.213 20.104 8.359 496 HD1 TYR 69 1HD TYR 69 0.541 17.580 6.184 497 HD2 TYR 69 2HD TYR 69 4.109 19.810 7.025 498 HE1 TYR 69 1HE TYR 69 1.535 16.790 4.063 499 HE2 TYR 69 2HE TYR 69 5.102 19.019 4.904 500 HH TYR 69 HH TYR 69 3.310 16.849 2.729 501 H THR 70 H THR 70 -0.845 18.598 8.999 502 HA THR 70 HA THR 70 -1.575 15.715 8.931 503 HB THR 70 HB THR 70 -3.299 18.224 9.153 504 HG1 THR 70 1HG THR 70 -3.534 17.438 11.323 505 HG21 THR 70 2HG3 THR 70 -4.018 15.279 9.404 506 HG22 THR 70 2HG1 THR 70 -5.113 16.649 9.699 507 HG23 THR 70 2HG2 THR 70 -4.482 16.349 8.062 508 H ILE 71 H ILE 71 -2.410 14.658 7.278 509 HA ILE 71 HA ILE 71 -2.963 16.222 4.767 510 HB ILE 71 HB ILE 71 -2.241 14.216 3.508 511 HG12 ILE 71 1HG1 ILE 71 -1.432 13.014 6.163 512 HG13 ILE 71 1HG2 ILE 71 -2.911 12.602 5.308 513 HG21 ILE 71 2HG1 ILE 71 0.171 14.288 4.000 514 HG22 ILE 71 2HG2 ILE 71 -0.538 15.920 4.032 515 HG23 ILE 71 2HG3 ILE 71 -0.166 15.081 5.557 516 HD11 ILE 71 1HD3 ILE 71 -0.098 12.237 4.250 517 HD12 ILE 71 1HD1 ILE 71 -1.166 10.963 4.884 518 HD13 ILE 71 1HD2 ILE 71 -1.596 11.821 3.384 519 HA PRO 72 HA PRO 72 -6.947 14.563 4.803 520 HB2 PRO 72 1HB PRO 72 -7.583 14.697 2.147 521 HB3 PRO 72 2HB PRO 72 -7.298 16.186 3.058 522 HG2 PRO 72 1HG PRO 72 -5.380 14.655 1.248 523 HG3 PRO 72 2HG PRO 72 -5.729 16.387 1.256 524 HD2 PRO 72 1HD PRO 72 -3.547 15.371 2.542 525 HD3 PRO 72 2HD PRO 72 -4.456 16.792 3.197 526 H CYS 73 H CYS 73 -7.939 12.714 4.869 527 HA CYS 73 HA CYS 73 -6.993 10.487 3.035 528 HB2 CYS 73 1HB CYS 73 -7.810 10.225 5.888 529 HB3 CYS 73 2HB CYS 73 -7.510 8.918 4.752 530 HG CYS 73 HG CYS 73 -5.048 9.573 4.236 531 H GLU 74 H GLU 74 -8.582 9.285 2.090 532 HA GLU 74 HA GLU 74 -11.339 10.435 2.326 533 HB2 GLU 74 1HB GLU 74 -10.239 10.643 0.100 534 HB3 GLU 74 2HB GLU 74 -10.021 8.900 0.045 535 HG2 GLU 74 1HG GLU 74 -11.904 9.555 -1.313 536 HG3 GLU 74 2HG GLU 74 -12.452 8.581 0.050 537 H THR 75 H THR 75 -12.835 9.330 3.276 538 HA THR 75 HA THR 75 -12.411 6.394 3.650 539 HB THR 75 HB THR 75 -14.070 6.578 5.461 540 HG1 THR 75 1HG THR 75 -14.859 8.695 5.987 541 HG21 THR 75 2HG3 THR 75 -11.954 8.757 5.622 542 HG22 THR 75 2HG1 THR 75 -12.795 8.017 7.003 543 HG23 THR 75 2HG2 THR 75 -11.702 7.036 5.996 544 H ASP 76 H ASP 76 -14.213 8.619 1.823 545 HA ASP 76 HA ASP 76 -16.426 6.640 1.424 546 HB2 ASP 76 1HB ASP 76 -16.255 9.596 0.696 547 HB3 ASP 76 2HB ASP 76 -17.640 8.553 0.400 548 H ASN 77 H ASN 77 -16.042 6.119 -1.995 549 HA ASN 77 HA ASN 77 -17.826 6.564 0.363 550 HB2 ASN 77 1HB ASN 77 -18.383 5.520 -2.426 551 HB3 ASN 77 2HB ASN 77 -19.571 5.576 -1.131 552 HD21 ASN 77 2HD2 ASN 77 -18.145 7.252 -3.679 553 HD22 ASN 77 2HD1 ASN 77 -18.806 8.820 -3.354 554 H ASN 78 H ASN 78 -15.723 4.253 -1.007 555 HA ASN 78 HA ASN 78 -17.328 1.904 -0.300 556 HB2 ASN 78 1HB ASN 78 -14.501 2.260 -1.318 557 HB3 ASN 78 2HB ASN 78 -15.201 0.693 -0.938 558 HD21 ASN 78 2HD2 ASN 78 -14.258 1.611 -3.484 559 HD22 ASN 78 2HD1 ASN 78 -15.607 1.576 -4.569 560 HA PRO 79 HA PRO 79 -16.066 1.650 3.962 561 HB2 PRO 79 1HB PRO 79 -16.982 -1.193 3.396 562 HB3 PRO 79 2HB PRO 79 -17.456 -0.132 4.729 563 HG2 PRO 79 1HG PRO 79 -19.200 -0.540 2.761 564 HG3 PRO 79 2HG PRO 79 -18.997 1.096 3.394 565 HD2 PRO 79 1HD PRO 79 -17.817 -0.143 0.872 566 HD3 PRO 79 2HD PRO 79 -18.569 1.487 1.094 567 H HIS 80 H HIS 80 -14.548 0.520 5.167 568 HA HIS 80 HA HIS 80 -12.510 -0.840 3.436 569 HB2 HIS 80 1HB HIS 80 -11.983 0.999 5.808 570 HB3 HIS 80 2HB HIS 80 -10.769 0.221 4.802 571 HD2 HIS 80 2HD HIS 80 -12.588 3.634 4.941 572 HE1 HIS 80 1HE HIS 80 -11.125 3.119 0.987 573 H ARG 81 H ARG 81 -12.661 -2.919 3.885 574 HA ARG 81 HA ARG 81 -13.771 -3.820 6.412 575 HB2 ARG 81 1HB ARG 81 -12.490 -5.288 4.078 576 HB3 ARG 81 2HB ARG 81 -13.169 -6.105 5.478 577 HG2 ARG 81 1HG ARG 81 -15.382 -5.228 4.967 578 HG3 ARG 81 2HG ARG 81 -14.719 -4.308 3.595 579 HD2 ARG 81 1HD ARG 81 -14.025 -6.385 2.544 580 HD3 ARG 81 2HD ARG 81 -14.700 -7.301 3.911 581 HE ARG 81 HE ARG 81 -16.766 -5.702 2.979 582 HH11 ARG 81 1HH1 ARG 81 -14.697 -8.223 1.677 583 HH12 ARG 81 1HH2 ARG 81 -15.902 -8.803 0.549 584 HH21 ARG 81 2HH1 ARG 81 -18.323 -6.463 1.511 585 HH22 ARG 81 2HH2 ARG 81 -17.954 -7.808 0.454 586 H HIS 82 H HIS 82 -10.541 -3.338 5.198 587 HA HIS 82 HA HIS 82 -8.455 -3.863 6.075 588 HB2 HIS 82 1HB HIS 82 -10.062 -3.621 8.652 589 HB3 HIS 82 2HB HIS 82 -8.315 -3.808 8.610 590 HD2 HIS 82 2HD HIS 82 -6.862 -1.363 8.145 591 HE1 HIS 82 1HE HIS 82 -10.341 0.960 7.404 592 H VAL 83 H VAL 83 -8.745 -5.936 4.976 593 HA VAL 83 HA VAL 83 -9.038 -8.225 6.913 594 HB VAL 83 HB VAL 83 -9.442 -9.601 4.922 595 HG11 VAL 83 1HG1 VAL 83 -11.573 -8.666 4.169 596 HG12 VAL 83 1HG2 VAL 83 -11.374 -8.533 5.932 597 HG13 VAL 83 1HG3 VAL 83 -11.144 -7.101 4.900 598 HG21 VAL 83 2HG3 VAL 83 -7.963 -8.374 3.370 599 HG22 VAL 83 2HG1 VAL 83 -9.592 -8.566 2.680 600 HG23 VAL 83 2HG2 VAL 83 -9.097 -7.001 3.371 601 H THR 84 H THR 84 -7.780 -10.203 6.067 602 HA THR 84 HA THR 84 -5.036 -9.715 6.594 603 HB THR 84 HB THR 84 -6.295 -12.044 5.076 604 HG1 THR 84 1HG THR 84 -5.587 -11.802 7.833 605 HG21 THR 84 2HG3 THR 84 -3.621 -11.794 6.504 606 HG22 THR 84 2HG1 THR 84 -4.276 -13.274 5.767 607 HG23 THR 84 2HG2 THR 84 -3.852 -11.882 4.743 608 H GLY 85 H GLY 85 -3.570 -8.684 5.523 609 HA2 GLY 85 1HA GLY 85 -2.065 -8.627 3.651 610 HA3 GLY 85 2HA GLY 85 -3.389 -9.161 2.590 611 H ALA 86 H ALA 86 -5.083 -7.112 4.228 612 HA ALA 86 HA ALA 86 -5.031 -5.079 2.219 613 HB1 ALA 86 3HB ALA 86 -6.228 -5.018 5.012 614 HB2 ALA 86 1HB ALA 86 -6.599 -3.878 3.698 615 HB3 ALA 86 2HB ALA 86 -7.039 -5.595 3.537 616 H MET 87 H MET 87 -4.345 -2.974 2.206 617 HA MET 87 HA MET 87 -2.430 -2.218 4.394 618 HB2 MET 87 1HB MET 87 -2.266 -1.569 1.429 619 HB3 MET 87 2HB MET 87 -1.184 -0.948 2.666 620 HG2 MET 87 1HG MET 87 -0.483 -3.297 3.165 621 HG3 MET 87 2HG MET 87 -1.488 -3.842 1.819 622 HE1 MET 87 3HE MET 87 1.740 -1.971 2.937 623 HE2 MET 87 1HE MET 87 2.298 -1.217 1.425 624 HE3 MET 87 2HE MET 87 0.816 -0.630 2.218 625 H SER 88 H SER 88 -2.755 -0.396 5.428 626 HA SER 88 HA SER 88 -4.943 1.448 4.427 627 HB2 SER 88 1HB SER 88 -6.030 -0.140 5.751 628 HB3 SER 88 2HB SER 88 -4.873 0.070 7.056 629 HG SER 88 HG SER 88 -6.889 1.276 7.135 630 H MET 89 H MET 89 -4.527 3.543 4.798 631 HA MET 89 HA MET 89 -2.154 4.298 6.415 632 HB2 MET 89 1HB MET 89 -4.006 5.776 4.533 633 HB3 MET 89 2HB MET 89 -2.909 6.640 5.601 634 HG2 MET 89 1HG MET 89 -0.995 5.429 4.576 635 HG3 MET 89 2HG MET 89 -2.118 4.632 3.471 636 HE1 MET 89 3HE MET 89 -0.082 7.782 4.314 637 HE2 MET 89 1HE MET 89 -0.911 9.082 3.423 638 HE3 MET 89 2HE MET 89 -1.685 8.346 4.849 639 H ALA 90 H ALA 90 -2.171 5.671 8.159 640 HA ALA 90 HA ALA 90 -4.572 5.188 9.811 641 HB1 ALA 90 3HB ALA 90 -1.820 6.251 10.541 642 HB2 ALA 90 1HB ALA 90 -3.120 5.860 11.689 643 HB3 ALA 90 2HB ALA 90 -2.374 4.570 10.717 644 H HIS 91 H HIS 91 -5.963 6.652 10.500 645 HA HIS 91 HA HIS 91 -5.191 9.494 10.629 646 HB2 HIS 91 1HB HIS 91 -6.995 10.302 9.234 647 HB3 HIS 91 2HB HIS 91 -6.033 9.185 8.277 648 HD2 HIS 91 2HD HIS 91 -7.470 7.150 7.133 649 HE1 HIS 91 1HE HIS 91 -11.055 7.687 9.372 650 H ARG 92 H ARG 92 -7.033 10.841 11.472 651 HA ARG 92 HA ARG 92 -8.584 9.217 13.466 652 HB2 ARG 92 1HB ARG 92 -7.293 11.951 13.820 653 HB3 ARG 92 2HB ARG 92 -8.348 11.176 14.993 654 HG2 ARG 92 1HG ARG 92 -6.707 9.333 15.223 655 HG3 ARG 92 2HG ARG 92 -5.631 10.189 14.093 656 HD2 ARG 92 1HD ARG 92 -5.567 12.092 15.601 657 HD3 ARG 92 2HD ARG 92 -6.634 11.229 16.732 658 HE ARG 92 HE ARG 92 -4.354 9.634 16.135 659 HH11 ARG 92 1HH1 ARG 92 -5.308 12.509 17.917 660 HH12 ARG 92 1HH2 ARG 92 -4.036 12.345 19.106 661 HH21 ARG 92 2HH1 ARG 92 -2.707 9.435 17.685 662 HH22 ARG 92 2HH2 ARG 92 -2.563 10.607 18.975 663 H GLY 93 H GLY 93 -9.541 9.886 10.900 664 HA2 GLY 93 1HA GLY 93 -12.066 10.536 11.014 665 HA3 GLY 93 2HA GLY 93 -11.418 12.137 11.441 666 H ARG 94 H ARG 94 -12.985 12.083 9.292 667 HA ARG 94 HA ARG 94 -11.624 11.425 6.813 668 HB2 ARG 94 1HB ARG 94 -14.140 11.595 7.143 669 HB3 ARG 94 2HB ARG 94 -13.949 13.339 7.236 670 HG2 ARG 94 1HG ARG 94 -13.211 13.470 4.968 671 HG3 ARG 94 2HG ARG 94 -13.077 11.699 4.848 672 HD2 ARG 94 1HD ARG 94 -15.542 11.621 5.357 673 HD3 ARG 94 2HD ARG 94 -15.550 13.379 5.086 674 HE ARG 94 HE ARG 94 -15.213 11.269 3.092 675 HH11 ARG 94 1HH1 ARG 94 -14.970 14.693 3.841 676 HH12 ARG 94 1HH2 ARG 94 -15.039 15.192 2.166 677 HH21 ARG 94 2HH1 ARG 94 -15.303 11.929 0.922 678 HH22 ARG 94 2HH2 ARG 94 -15.228 13.629 0.513 679 H ASP 95 H ASP 95 -10.359 12.539 5.526 680 HA ASP 95 HA ASP 95 -8.900 14.221 4.859 681 HB2 ASP 95 1HB ASP 95 -11.133 15.982 5.957 682 HB3 ASP 95 2HB ASP 95 -9.776 16.568 5.005 683 H THR 96 H THR 96 -8.600 13.060 7.494 684 HA THR 96 HA THR 96 -6.846 15.118 8.664 685 HB THR 96 HB THR 96 -9.091 13.926 10.346 686 HG1 THR 96 1HG THR 96 -10.036 15.465 9.060 687 HG21 THR 96 2HG3 THR 96 -7.022 16.084 10.906 688 HG22 THR 96 2HG1 THR 96 -8.302 15.552 12.021 689 HG23 THR 96 2HG2 THR 96 -6.999 14.430 11.560 690 H GLY 97 H GLY 97 -5.340 13.539 7.902 691 HA2 GLY 97 1HA GLY 97 -4.922 11.423 9.944 692 HA3 GLY 97 2HA GLY 97 -4.992 10.943 8.233 693 H SER 98 H SER 98 -2.752 10.192 9.114 694 HA SER 98 HA SER 98 -0.702 12.362 8.559 695 HB2 SER 98 1HB SER 98 0.737 11.466 9.998 696 HB3 SER 98 2HB SER 98 -0.797 11.415 10.853 697 HG SER 98 HG SER 98 0.337 9.493 11.021 698 H CYS 99 H CYS 99 1.415 11.248 7.864 699 HA CYS 99 HA CYS 99 0.970 9.791 5.346 700 HB2 CYS 99 1HB CYS 99 3.483 10.578 6.738 701 HB3 CYS 99 2HB CYS 99 3.357 9.820 5.157 702 HG CYS 99 HG CYS 99 3.937 12.304 4.890 703 H GLN 100 H GLN 100 1.196 8.871 8.622 704 HA GLN 100 HA GLN 100 2.769 6.451 8.311 705 HB2 GLN 100 1HB GLN 100 0.747 7.246 10.450 706 HB3 GLN 100 2HB GLN 100 1.847 5.879 10.554 707 HG2 GLN 100 1HG GLN 100 3.739 7.258 10.754 708 HG3 GLN 100 2HG GLN 100 2.849 8.699 10.187 709 HE21 GLN 100 2HE2 GLN 100 3.960 6.972 12.880 710 HE22 GLN 100 2HE1 GLN 100 3.049 7.792 14.105 711 H PHE 101 H PHE 101 2.146 4.322 8.270 712 HA PHE 101 HA PHE 101 -0.710 3.750 7.650 713 HB2 PHE 101 1HB PHE 101 -0.190 2.582 5.614 714 HB3 PHE 101 2HB PHE 101 0.507 4.189 5.473 715 HD1 PHE 101 2HD PHE 101 2.961 4.508 5.746 716 HD2 PHE 101 1HD PHE 101 1.170 0.632 5.598 717 HE1 PHE 101 2HE PHE 101 5.166 3.510 5.242 718 HE2 PHE 101 1HE PHE 101 3.373 -0.369 5.097 719 HZ PHE 101 HZ PHE 101 5.372 1.070 4.919 720 H PHE 102 H PHE 102 -0.952 1.303 7.258 721 HA PHE 102 HA PHE 102 1.000 -0.375 8.672 722 HB2 PHE 102 1HB PHE 102 -0.579 -1.175 10.373 723 HB3 PHE 102 2HB PHE 102 -0.297 0.547 10.572 724 HD1 PHE 102 2HD PHE 102 -2.035 2.180 9.957 725 HD2 PHE 102 1HD PHE 102 -2.734 -2.029 9.758 726 HE1 PHE 102 2HE PHE 102 -4.471 2.592 9.871 727 HE2 PHE 102 1HE PHE 102 -5.171 -1.622 9.668 728 HZ PHE 102 HZ PHE 102 -6.040 0.689 9.725 729 H ILE 103 H ILE 103 0.750 -2.551 8.347 730 HA ILE 103 HA ILE 103 -1.254 -3.264 6.223 731 HB ILE 103 HB ILE 103 1.321 -4.701 7.041 732 HG12 ILE 103 1HG1 ILE 103 0.844 -3.006 4.582 733 HG13 ILE 103 1HG2 ILE 103 1.699 -2.452 6.014 734 HG21 ILE 103 2HG1 ILE 103 0.963 -5.971 4.963 735 HG22 ILE 103 2HG2 ILE 103 -0.408 -6.171 6.077 736 HG23 ILE 103 2HG3 ILE 103 -0.553 -5.084 4.678 737 HD11 ILE 103 1HD3 ILE 103 2.509 -4.784 4.263 738 HD12 ILE 103 1HD1 ILE 103 3.253 -3.169 4.287 739 HD13 ILE 103 1HD2 ILE 103 3.374 -4.225 5.715 740 H VAL 104 H VAL 104 -2.811 -4.607 6.530 741 HA VAL 104 HA VAL 104 -3.269 -5.482 9.326 742 HB VAL 104 HB VAL 104 -4.974 -5.788 6.807 743 HG11 VAL 104 1HG1 VAL 104 -6.814 -6.202 8.365 744 HG12 VAL 104 1HG2 VAL 104 -5.525 -7.420 8.517 745 HG13 VAL 104 1HG3 VAL 104 -5.675 -6.125 9.730 746 HG21 VAL 104 2HG3 VAL 104 -4.569 -3.419 7.377 747 HG22 VAL 104 2HG1 VAL 104 -6.257 -3.875 7.709 748 HG23 VAL 104 2HG2 VAL 104 -5.094 -3.729 9.049 749 H HIS 105 H HIS 105 -2.987 -7.350 10.170 750 HA HIS 105 HA HIS 105 -2.159 -9.591 8.400 751 HB2 HIS 105 1HB HIS 105 -2.157 -9.293 11.434 752 HB3 HIS 105 2HB HIS 105 -1.604 -10.719 10.569 753 HD2 HIS 105 2HD HIS 105 -0.073 -7.423 11.920 754 HE1 HIS 105 1HE HIS 105 2.544 -8.938 8.935 755 H GLU 106 H GLU 106 -4.658 -8.758 10.774 756 HA GLU 106 HA GLU 106 -6.224 -11.108 9.763 757 HB2 GLU 106 1HB GLU 106 -6.077 -10.094 12.634 758 HB3 GLU 106 2HB GLU 106 -7.131 -11.377 12.055 759 HG2 GLU 106 1HG GLU 106 -4.110 -11.488 11.942 760 HG3 GLU 106 2HG GLU 106 -5.082 -12.141 13.260 761 HA PRO 107 HA PRO 107 -9.492 -8.387 8.806 762 HB2 PRO 107 1HB PRO 107 -11.198 -10.494 10.206 763 HB3 PRO 107 2HB PRO 107 -11.427 -9.787 8.601 764 HG2 PRO 107 1HG PRO 107 -10.452 -12.256 8.759 765 HG3 PRO 107 2HG PRO 107 -9.724 -11.128 7.613 766 HD2 PRO 107 1HD PRO 107 -8.735 -11.979 10.359 767 HD3 PRO 107 2HD PRO 107 -7.793 -11.720 8.836 768 H GLN 108 H GLN 108 -10.030 -6.628 9.733 769 HA GLN 108 HA GLN 108 -11.032 -6.734 12.543 770 HB2 GLN 108 1HB GLN 108 -8.899 -4.843 11.467 771 HB3 GLN 108 2HB GLN 108 -9.751 -4.600 12.984 772 HG2 GLN 108 1HG GLN 108 -8.067 -7.028 12.337 773 HG3 GLN 108 2HG GLN 108 -7.510 -5.599 13.251 774 HE21 GLN 108 2HE2 GLN 108 -7.951 -8.565 13.905 775 HE22 GLN 108 2HE1 GLN 108 -8.876 -8.530 15.369 776 HA PRO 109 HA PRO 109 -13.976 -4.480 9.829 777 HB2 PRO 109 1HB PRO 109 -15.688 -5.537 12.113 778 HB3 PRO 109 2HB PRO 109 -16.049 -5.534 10.382 779 HG2 PRO 109 1HG PRO 109 -15.349 -7.836 11.521 780 HG3 PRO 109 2HG PRO 109 -14.667 -7.422 9.945 781 HD2 PRO 109 1HD PRO 109 -13.407 -7.172 12.705 782 HD3 PRO 109 2HD PRO 109 -12.669 -7.770 11.165 783 H HIS 110 H HIS 110 -13.130 -4.437 13.205 784 HA HIS 110 HA HIS 110 -14.711 -2.145 13.938 785 HB2 HIS 110 1HB HIS 110 -12.106 -3.231 15.096 786 HB3 HIS 110 2HB HIS 110 -13.072 -1.960 15.836 787 HD2 HIS 110 2HD HIS 110 -12.747 -5.709 16.014 788 HE1 HIS 110 1HE HIS 110 -16.668 -4.820 17.425 789 H LEU 111 H LEU 111 -11.844 -2.481 12.067 790 HA LEU 111 HA LEU 111 -10.988 0.308 12.524 791 HB2 LEU 111 1HB LEU 111 -10.011 -1.840 10.597 792 HB3 LEU 111 2HB LEU 111 -9.262 -0.255 10.809 793 HG LEU 111 HG LEU 111 -9.431 -2.443 12.912 794 HD11 LEU 111 1HD1 LEU 111 -7.002 -2.575 12.579 795 HD12 LEU 111 1HD2 LEU 111 -7.892 -2.955 11.086 796 HD13 LEU 111 1HD3 LEU 111 -7.115 -1.367 11.278 797 HD21 LEU 111 2HD3 LEU 111 -9.536 -0.169 13.876 798 HD22 LEU 111 2HD1 LEU 111 -7.968 -0.939 14.219 799 HD23 LEU 111 2HD2 LEU 111 -8.094 0.295 12.941 800 H ASP 112 H ASP 112 -13.255 -1.282 10.593 801 HA ASP 112 HA ASP 112 -13.121 0.324 8.211 802 HB2 ASP 112 1HB ASP 112 -14.446 -1.819 8.493 803 HB3 ASP 112 2HB ASP 112 -15.583 -0.930 9.496 804 H GLY 113 H GLY 113 -13.094 2.431 8.202 805 HA2 GLY 113 1HA GLY 113 -14.330 4.493 8.301 806 HA3 GLY 113 2HA GLY 113 -15.255 3.852 9.680 807 H VAL 114 H VAL 114 -12.510 2.783 10.668 808 HA VAL 114 HA VAL 114 -11.723 5.244 12.152 809 HB VAL 114 HB VAL 114 -10.707 2.364 12.295 810 HG11 VAL 114 1HG1 VAL 114 -9.678 3.050 14.406 811 HG12 VAL 114 1HG2 VAL 114 -9.036 3.967 13.023 812 HG13 VAL 114 1HG3 VAL 114 -10.213 4.723 14.122 813 HG21 VAL 114 2HG3 VAL 114 -13.070 2.573 12.983 814 HG22 VAL 114 2HG1 VAL 114 -12.026 2.246 14.386 815 HG23 VAL 114 2HG2 VAL 114 -12.633 3.894 14.093 816 H HIS 115 H HIS 115 -10.226 2.893 9.934 817 HA HIS 115 HA HIS 115 -8.413 5.132 9.116 818 HB2 HIS 115 1HB HIS 115 -7.647 2.192 9.382 819 HB3 HIS 115 2HB HIS 115 -6.620 3.461 8.729 820 HD2 HIS 115 2HD HIS 115 -6.931 1.668 11.940 821 HE1 HIS 115 1HE HIS 115 -5.708 5.596 13.050 822 H THR 116 H THR 116 -7.245 4.399 6.983 823 HA THR 116 HA THR 116 -9.516 3.690 5.149 824 HB THR 116 HB THR 116 -7.400 5.863 4.815 825 HG1 THR 116 1HG THR 116 -9.317 7.192 4.817 826 HG21 THR 116 2HG3 THR 116 -9.645 4.977 2.962 827 HG22 THR 116 2HG1 THR 116 -8.571 6.372 2.708 828 HG23 THR 116 2HG2 THR 116 -7.906 4.722 2.684 829 H VAL 117 H VAL 117 -9.092 1.741 4.406 830 HA VAL 117 HA VAL 117 -6.471 0.813 3.557 831 HB VAL 117 HB VAL 117 -9.296 0.044 2.679 832 HG11 VAL 117 1HG1 VAL 117 -8.277 -1.981 1.757 833 HG12 VAL 117 1HG2 VAL 117 -7.683 -0.510 0.951 834 HG13 VAL 117 1HG3 VAL 117 -6.662 -1.344 2.147 835 HG21 VAL 117 2HG3 VAL 117 -8.821 -0.389 5.064 836 HG22 VAL 117 2HG1 VAL 117 -8.931 -1.912 4.150 837 HG23 VAL 117 2HG2 VAL 117 -7.339 -1.265 4.612 838 H PHE 118 H PHE 118 -5.320 1.047 1.830 839 HA PHE 118 HA PHE 118 -6.500 2.693 -0.385 840 HB2 PHE 118 1HB PHE 118 -4.400 3.863 -0.606 841 HB3 PHE 118 2HB PHE 118 -4.906 3.994 1.072 842 HD1 PHE 118 1HD PHE 118 -2.489 2.491 -1.240 843 HD2 PHE 118 2HD PHE 118 -3.695 2.871 2.842 844 HE1 PHE 118 1HE PHE 118 -0.310 1.577 -0.512 845 HE2 PHE 118 2HE PHE 118 -1.516 1.960 3.572 846 HZ PHE 118 HZ PHE 118 0.176 1.311 1.893 847 H GLY 119 H GLY 119 -4.846 -0.139 0.565 848 HA2 GLY 119 1HA GLY 119 -4.729 -1.063 -2.202 849 HA3 GLY 119 2HA GLY 119 -3.130 -0.791 -1.471 850 H GLN 120 H GLN 120 -3.178 -3.214 -2.074 851 HA GLN 120 HA GLN 120 -3.493 -4.681 0.441 852 HB2 GLN 120 1HB GLN 120 -5.787 -4.854 -0.527 853 HB3 GLN 120 2HB GLN 120 -5.107 -5.517 -2.007 854 HG2 GLN 120 1HG GLN 120 -4.279 -7.463 -0.787 855 HG3 GLN 120 2HG GLN 120 -4.927 -6.786 0.734 856 HE21 GLN 120 2HE2 GLN 120 -5.825 -9.180 0.334 857 HE22 GLN 120 2HE1 GLN 120 -7.428 -9.211 -0.323 858 H VAL 121 H VAL 121 -1.977 -6.131 0.681 859 HA VAL 121 HA VAL 121 0.074 -6.474 -1.348 860 HB VAL 121 HB VAL 121 -0.527 -8.075 1.186 861 HG11 VAL 121 1HG1 VAL 121 1.802 -8.812 1.035 862 HG12 VAL 121 1HG2 VAL 121 0.846 -9.332 -0.373 863 HG13 VAL 121 1HG3 VAL 121 1.971 -7.960 -0.518 864 HG21 VAL 121 2HG3 VAL 121 -0.101 -5.683 1.631 865 HG22 VAL 121 2HG1 VAL 121 1.256 -6.687 2.195 866 HG23 VAL 121 2HG2 VAL 121 1.399 -5.771 0.676 867 H THR 122 H THR 122 0.396 -7.844 -2.882 868 HA THR 122 HA THR 122 -1.535 -10.132 -3.107 869 HB THR 122 HB THR 122 -1.263 -9.970 -5.550 870 HG1 THR 122 1HG THR 122 -0.091 -8.151 -6.383 871 HG21 THR 122 2HG3 THR 122 -1.951 -7.287 -4.291 872 HG22 THR 122 2HG1 THR 122 -2.422 -7.828 -5.920 873 HG23 THR 122 2HG2 THR 122 -3.065 -8.660 -4.485 874 H SER 123 H SER 123 1.771 -9.126 -3.005 875 HA SER 123 HA SER 123 2.617 -12.009 -2.971 876 HB2 SER 123 1HB SER 123 2.771 -11.465 -5.262 877 HB3 SER 123 2HB SER 123 3.751 -10.053 -4.897 878 HG SER 123 HG SER 123 4.979 -11.861 -5.420 879 H GLY 124 H GLY 124 4.286 -12.346 -1.602 880 HA2 GLY 124 1HA GLY 124 6.214 -11.781 -0.341 881 HA3 GLY 124 2HA GLY 124 5.913 -10.057 -0.666 882 H MET 125 H MET 125 3.139 -11.839 0.254 883 HA MET 125 HA MET 125 2.687 -10.421 2.687 884 HB2 MET 125 1HB MET 125 0.955 -11.648 1.338 885 HB3 MET 125 2HB MET 125 1.634 -13.165 1.910 886 HG2 MET 125 1HG MET 125 -0.278 -12.684 3.241 887 HG3 MET 125 2HG MET 125 1.139 -12.425 4.260 888 HE1 MET 125 3HE MET 125 0.451 -10.838 6.061 889 HE2 MET 125 1HE MET 125 -0.792 -9.582 5.852 890 HE3 MET 125 2HE MET 125 -1.202 -11.294 5.583 891 H ASP 126 H ASP 126 4.438 -13.403 2.037 892 HA ASP 126 HA ASP 126 4.835 -14.228 4.744 893 HB2 ASP 126 1HB ASP 126 6.561 -14.494 2.253 894 HB3 ASP 126 2HB ASP 126 7.002 -15.208 3.798 895 H VAL 127 H VAL 127 6.724 -11.993 2.707 896 HA VAL 127 HA VAL 127 8.651 -11.288 4.738 897 HB VAL 127 HB VAL 127 7.528 -9.691 2.386 898 HG11 VAL 127 1HG1 VAL 127 9.523 -8.292 2.611 899 HG12 VAL 127 1HG2 VAL 127 8.488 -8.214 4.057 900 HG13 VAL 127 1HG3 VAL 127 9.981 -9.183 4.082 901 HG21 VAL 127 2HG3 VAL 127 8.655 -11.789 1.728 902 HG22 VAL 127 2HG1 VAL 127 9.625 -10.372 1.263 903 HG23 VAL 127 2HG2 VAL 127 10.078 -11.329 2.694 904 H VAL 128 H VAL 128 5.488 -9.897 3.920 905 HA VAL 128 HA VAL 128 5.517 -7.813 5.898 906 HB VAL 128 HB VAL 128 3.218 -9.501 4.797 907 HG11 VAL 128 1HG1 VAL 128 1.748 -7.716 5.595 908 HG12 VAL 128 1HG2 VAL 128 2.610 -8.515 6.930 909 HG13 VAL 128 1HG3 VAL 128 3.139 -6.914 6.362 910 HG21 VAL 128 2HG3 VAL 128 4.435 -8.202 3.084 911 HG22 VAL 128 2HG1 VAL 128 2.811 -7.527 3.362 912 HG23 VAL 128 2HG2 VAL 128 4.240 -6.728 4.060 913 H ARG 129 H ARG 129 4.440 -11.195 6.153 914 HA ARG 129 HA ARG 129 3.541 -10.900 8.878 915 HB2 ARG 129 1HB ARG 129 4.341 -13.318 7.223 916 HB3 ARG 129 2HB ARG 129 3.736 -13.443 8.868 917 HG2 ARG 129 1HG ARG 129 1.604 -12.501 8.217 918 HG3 ARG 129 2HG ARG 129 2.208 -12.197 6.569 919 HD2 ARG 129 1HD ARG 129 2.520 -14.579 6.241 920 HD3 ARG 129 2HD ARG 129 1.930 -14.886 7.891 921 HE ARG 129 HE ARG 129 -0.042 -13.389 6.609 922 HH11 ARG 129 1HH1 ARG 129 1.515 -16.512 6.208 923 HH12 ARG 129 1HH2 ARG 129 0.111 -17.260 5.480 924 HH21 ARG 129 2HH1 ARG 129 -1.859 -14.371 5.663 925 HH22 ARG 129 2HH2 ARG 129 -1.799 -16.048 5.172 926 H THR 130 H THR 130 6.660 -11.525 7.440 927 HA THR 130 HA THR 130 7.778 -12.234 10.116 928 HB THR 130 HB THR 130 9.822 -12.858 8.838 929 HG1 THR 130 1HG THR 130 9.633 -12.868 6.525 930 HG21 THR 130 2HG3 THR 130 7.264 -14.087 7.741 931 HG22 THR 130 2HG1 THR 130 8.881 -14.825 7.689 932 HG23 THR 130 2HG2 THR 130 8.075 -14.555 9.252 933 H MET 131 H MET 131 6.938 -9.485 9.014 934 HA MET 131 HA MET 131 9.335 -7.883 9.058 935 HB2 MET 131 1HB MET 131 6.420 -7.326 9.660 936 HB3 MET 131 2HB MET 131 7.654 -6.091 9.861 937 HG2 MET 131 1HG MET 131 8.265 -6.324 7.472 938 HG3 MET 131 2HG MET 131 6.995 -7.536 7.279 939 HE1 MET 131 3HE MET 131 6.093 -6.030 5.239 940 HE2 MET 131 1HE MET 131 5.635 -4.319 5.419 941 HE3 MET 131 2HE MET 131 7.342 -4.804 5.566 942 H LYS 132 H LYS 132 10.156 -6.543 10.690 943 HA LYS 132 HA LYS 132 9.582 -7.523 13.469 944 HB2 LYS 132 1HB LYS 132 12.262 -6.737 12.255 945 HB3 LYS 132 2HB LYS 132 11.990 -7.043 13.966 946 HG2 LYS 132 1HG LYS 132 11.361 -9.373 13.458 947 HG3 LYS 132 2HG LYS 132 11.628 -9.067 11.737 948 HD2 LYS 132 1HD LYS 132 13.995 -8.510 12.202 949 HD3 LYS 132 2HD LYS 132 13.728 -8.823 13.923 950 HE2 LYS 132 1HE LYS 132 13.119 -11.166 13.399 951 HE3 LYS 132 2HE LYS 132 13.395 -10.854 11.684 952 HZ1 LYS 132 3HZ LYS 132 15.429 -10.658 13.804 953 HZ2 LYS 132 1HZ LYS 132 15.287 -11.882 12.709 954 HZ3 LYS 132 2HZ LYS 132 15.687 -10.365 12.202 955 H ASN 133 H ASN 133 10.027 -6.029 15.176 956 HA ASN 133 HA ASN 133 8.912 -3.414 14.582 957 HB2 ASN 133 1HB ASN 133 8.567 -4.668 16.722 958 HB3 ASN 133 2HB ASN 133 10.256 -4.381 17.121 959 HD21 ASN 133 2HD2 ASN 133 7.841 -3.512 18.500 960 HD22 ASN 133 2HD1 ASN 133 7.925 -1.783 18.579 961 H GLY 134 H GLY 134 10.018 -2.059 13.375 962 HA2 GLY 134 1HA GLY 134 11.682 -0.268 13.462 963 HA3 GLY 134 2HA GLY 134 12.790 -1.395 14.280 964 H ASP 135 H ASP 135 11.170 -3.133 11.971 965 HA ASP 135 HA ASP 135 13.423 -3.503 10.262 966 HB2 ASP 135 1HB ASP 135 11.277 -4.960 10.552 967 HB3 ASP 135 2HB ASP 135 10.547 -3.878 9.375 968 H VAL 136 H VAL 136 13.821 -2.904 8.110 969 HA VAL 136 HA VAL 136 13.074 -0.002 7.777 970 HB VAL 136 HB VAL 136 15.626 -1.460 6.944 971 HG11 VAL 136 1HG1 VAL 136 16.506 0.793 6.571 972 HG12 VAL 136 1HG2 VAL 136 15.090 0.453 5.549 973 HG13 VAL 136 1HG3 VAL 136 14.920 1.481 6.992 974 HG21 VAL 136 2HG3 VAL 136 15.431 -1.348 9.404 975 HG22 VAL 136 2HG1 VAL 136 16.700 -0.249 8.815 976 HG23 VAL 136 2HG2 VAL 136 15.116 0.400 9.302 977 H MET 137 H MET 137 12.107 0.660 6.069 978 HA MET 137 HA MET 137 11.854 -1.123 3.723 979 HB2 MET 137 1HB MET 137 10.802 1.669 4.301 980 HB3 MET 137 2HB MET 137 10.481 0.772 2.824 981 HG2 MET 137 1HG MET 137 9.331 -0.974 4.123 982 HG3 MET 137 2HG MET 137 9.669 -0.093 5.616 983 HE1 MET 137 3HE MET 137 9.103 2.811 5.355 984 HE2 MET 137 1HE MET 137 7.337 2.921 5.552 985 HE3 MET 137 2HE MET 137 8.276 1.783 6.550 986 H LYS 138 H LYS 138 13.562 -1.339 2.488 987 HA LYS 138 HA LYS 138 15.675 0.618 2.389 988 HB2 LYS 138 1HB LYS 138 16.013 -1.822 2.003 989 HB3 LYS 138 2HB LYS 138 15.091 -1.707 0.510 990 HG2 LYS 138 1HG LYS 138 16.767 -0.256 -0.479 991 HG3 LYS 138 2HG LYS 138 17.660 -0.189 1.047 992 HD2 LYS 138 1HD LYS 138 18.061 -2.621 0.934 993 HD3 LYS 138 2HD LYS 138 17.147 -2.707 -0.579 994 HE2 LYS 138 1HE LYS 138 18.777 -1.176 -1.646 995 HE3 LYS 138 2HE LYS 138 19.694 -1.105 -0.140 996 HZ1 LYS 138 3HZ LYS 138 19.208 -3.534 -1.731 997 HZ2 LYS 138 1HZ LYS 138 20.622 -2.687 -1.665 998 HZ3 LYS 138 2HZ LYS 138 20.064 -3.469 -0.323 999 H GLU 139 H GLU 139 13.104 -0.239 0.074 1000 HA GLU 139 HA GLU 139 13.339 2.448 -1.137 1001 HB2 GLU 139 1HB GLU 139 15.025 1.119 -2.384 1002 HB3 GLU 139 2HB GLU 139 13.814 -0.105 -2.737 1003 HG2 GLU 139 1HG GLU 139 12.544 1.473 -4.078 1004 HG3 GLU 139 2HG GLU 139 13.651 2.775 -3.649 1005 H VAL 140 H VAL 140 11.361 3.145 -1.038 1006 HA VAL 140 HA VAL 140 9.141 1.287 -1.886 1007 HB VAL 140 HB VAL 140 8.993 3.838 -0.211 1008 HG11 VAL 140 1HG1 VAL 140 6.702 3.113 0.253 1009 HG12 VAL 140 1HG2 VAL 140 6.977 3.380 -1.484 1010 HG13 VAL 140 1HG3 VAL 140 6.922 1.723 -0.835 1011 HG21 VAL 140 2HG3 VAL 140 10.174 2.044 1.011 1012 HG22 VAL 140 2HG1 VAL 140 8.559 2.329 1.702 1013 HG23 VAL 140 2HG2 VAL 140 8.842 0.920 0.652 1014 H LYS 141 H LYS 141 7.930 1.690 -3.538 1015 HA LYS 141 HA LYS 141 7.725 4.349 -4.725 1016 HB2 LYS 141 1HB LYS 141 8.785 3.746 -6.877 1017 HB3 LYS 141 2HB LYS 141 9.950 3.781 -5.561 1018 HG2 LYS 141 1HG LYS 141 9.758 1.280 -5.406 1019 HG3 LYS 141 2HG LYS 141 8.736 1.323 -6.850 1020 HD2 LYS 141 1HD LYS 141 10.548 2.354 -8.140 1021 HD3 LYS 141 2HD LYS 141 11.568 2.422 -6.696 1022 HE2 LYS 141 1HE LYS 141 11.360 -0.103 -6.550 1023 HE3 LYS 141 2HE LYS 141 10.573 -0.063 -8.130 1024 HZ1 LYS 141 3HZ LYS 141 13.285 0.921 -7.549 1025 HZ2 LYS 141 1HZ LYS 141 12.912 -0.487 -8.321 1026 HZ3 LYS 141 2HZ LYS 141 12.550 0.960 -9.025 1027 H VAL 142 H VAL 142 6.272 4.479 -6.457 1028 HA VAL 142 HA VAL 142 4.531 2.051 -6.803 1029 HB VAL 142 HB VAL 142 3.597 4.890 -6.163 1030 HG11 VAL 142 1HG1 VAL 142 1.355 3.913 -6.128 1031 HG12 VAL 142 1HG2 VAL 142 2.128 3.750 -7.723 1032 HG13 VAL 142 1HG3 VAL 142 2.030 2.346 -6.632 1033 HG21 VAL 142 2HG3 VAL 142 4.504 3.737 -4.177 1034 HG22 VAL 142 2HG1 VAL 142 2.736 3.899 -4.067 1035 HG23 VAL 142 2HG2 VAL 142 3.461 2.335 -4.512 1036 H PHE 143 H PHE 143 3.701 1.698 -8.705 1037 HA PHE 143 HA PHE 143 4.185 3.790 -10.803 1038 HB2 PHE 143 1HB PHE 143 4.545 0.772 -11.056 1039 HB3 PHE 143 2HB PHE 143 4.683 1.926 -12.373 1040 HD1 PHE 143 2HD PHE 143 6.551 3.566 -12.401 1041 HD2 PHE 143 1HD PHE 143 6.324 0.425 -9.515 1042 HE1 PHE 143 2HE PHE 143 8.953 3.862 -11.893 1043 HE2 PHE 143 1HE PHE 143 8.725 0.719 -9.004 1044 HZ PHE 143 HZ PHE 143 10.039 2.438 -10.193 1045 H ASP 144 H ASP 144 2.894 3.512 -12.758 1046 HA ASP 144 HA ASP 144 0.161 2.499 -12.093 1047 HB2 ASP 144 1HB ASP 144 1.192 4.365 -14.270 1048 HB3 ASP 144 2HB ASP 144 -0.457 3.759 -14.213 1049 H GLU 145 H GLU 145 0.742 0.293 -12.281 1050 HA GLU 145 HA GLU 145 1.984 -0.790 -14.637 1051 HB2 GLU 145 1HB GLU 145 1.872 -1.970 -12.437 1052 HB3 GLU 145 2HB GLU 145 0.132 -2.138 -12.625 1053 HG2 GLU 145 1HG GLU 145 0.466 -3.519 -14.624 1054 HG3 GLU 145 2HG GLU 145 2.212 -3.333 -14.469 1055 HA PRO 146 HA PRO 146 -1.260 -0.489 -17.640 1056 HB2 PRO 146 1HB PRO 146 0.296 -2.930 -18.611 1057 HB3 PRO 146 2HB PRO 146 -0.251 -1.537 -19.551 1058 HG2 PRO 146 1HG PRO 146 2.323 -1.681 -18.905 1059 HG3 PRO 146 2HG PRO 146 1.495 -0.130 -18.748 1060 HD2 PRO 146 1HD PRO 146 2.209 -2.152 -16.594 1061 HD3 PRO 146 2HD PRO 146 2.295 -0.346 -16.538 Start of MODEL 17 1 H MET 1 1H MET 1 -6.397 4.543 -15.627 2 HA MET 1 HA MET 1 -7.962 2.468 -14.681 3 HB2 MET 1 1HB MET 1 -5.105 2.584 -15.713 4 HB3 MET 1 2HB MET 1 -6.059 1.119 -15.532 5 HG2 MET 1 1HG MET 1 -6.740 3.435 -17.366 6 HG3 MET 1 2HG MET 1 -5.985 1.918 -17.857 7 HE1 MET 1 3HE MET 1 -7.437 -0.328 -16.293 8 HE2 MET 1 1HE MET 1 -8.799 -0.704 -17.376 9 HE3 MET 1 2HE MET 1 -7.188 -0.364 -18.056 10 H ALA 2 H ALA 2 -6.667 0.541 -13.650 11 HA ALA 2 HA ALA 2 -6.197 1.373 -10.900 12 HB1 ALA 2 3HB ALA 2 -5.884 -1.336 -12.242 13 HB2 ALA 2 1HB ALA 2 -5.850 -1.035 -10.489 14 HB3 ALA 2 2HB ALA 2 -7.341 -0.740 -11.414 15 H LYS 3 H LYS 3 -4.316 0.672 -9.645 16 HA LYS 3 HA LYS 3 -1.781 0.483 -11.176 17 HB2 LYS 3 1HB LYS 3 -0.772 2.359 -9.932 18 HB3 LYS 3 2HB LYS 3 -2.100 2.905 -10.948 19 HG2 LYS 3 1HG LYS 3 -3.586 2.935 -8.953 20 HG3 LYS 3 2HG LYS 3 -2.207 2.461 -7.950 21 HD2 LYS 3 1HD LYS 3 -2.408 4.844 -7.787 22 HD3 LYS 3 2HD LYS 3 -0.993 4.514 -8.798 23 HE2 LYS 3 1HE LYS 3 -2.187 5.042 -10.805 24 HE3 LYS 3 2HE LYS 3 -3.740 5.047 -9.966 25 HZ1 LYS 3 3HZ LYS 3 -1.559 6.974 -9.530 26 HZ2 LYS 3 1HZ LYS 3 -2.949 7.260 -10.369 27 HZ3 LYS 3 2HZ LYS 3 -3.009 6.977 -8.745 28 H LYS 4 H LYS 4 0.113 0.330 -9.632 29 HA LYS 4 HA LYS 4 -0.541 -0.882 -7.024 30 HB2 LYS 4 1HB LYS 4 0.393 -3.043 -7.487 31 HB3 LYS 4 2HB LYS 4 -0.839 -2.743 -8.705 32 HG2 LYS 4 1HG LYS 4 0.865 -2.190 -10.357 33 HG3 LYS 4 2HG LYS 4 2.136 -2.359 -9.138 34 HD2 LYS 4 1HD LYS 4 1.495 -4.742 -8.825 35 HD3 LYS 4 2HD LYS 4 0.271 -4.564 -10.090 36 HE2 LYS 4 1HE LYS 4 1.976 -4.075 -11.751 37 HE3 LYS 4 2HE LYS 4 3.235 -4.046 -10.513 38 HZ1 LYS 4 3HZ LYS 4 1.633 -6.399 -11.264 39 HZ2 LYS 4 1HZ LYS 4 3.201 -6.121 -11.689 40 HZ3 LYS 4 2HZ LYS 4 2.807 -6.372 -10.107 41 H GLY 5 H GLY 5 1.499 -1.735 -5.967 42 HA2 GLY 5 1HA GLY 5 3.979 -0.468 -6.925 43 HA3 GLY 5 2HA GLY 5 3.332 0.161 -5.392 44 H TYR 6 H TYR 6 5.622 -0.715 -4.865 45 HA TYR 6 HA TYR 6 5.126 -3.131 -3.277 46 HB2 TYR 6 1HB TYR 6 7.103 -4.351 -4.124 47 HB3 TYR 6 2HB TYR 6 5.853 -4.192 -5.351 48 HD1 TYR 6 1HD TYR 6 9.209 -3.136 -4.298 49 HD2 TYR 6 2HD TYR 6 6.174 -2.802 -7.311 50 HE1 TYR 6 1HE TYR 6 10.858 -2.146 -5.849 51 HE2 TYR 6 2HE TYR 6 7.823 -1.811 -8.863 52 HH TYR 6 HH TYR 6 9.924 -1.174 -9.153 53 H ILE 7 H ILE 7 6.493 -3.393 -1.560 54 HA ILE 7 HA ILE 7 8.270 -1.049 -1.000 55 HB ILE 7 HB ILE 7 7.197 -3.256 0.830 56 HG12 ILE 7 1HG1 ILE 7 6.424 -0.333 0.768 57 HG13 ILE 7 1HG2 ILE 7 5.512 -1.598 -0.042 58 HG21 ILE 7 2HG1 ILE 7 8.108 -1.874 2.652 59 HG22 ILE 7 2HG2 ILE 7 9.397 -2.401 1.545 60 HG23 ILE 7 2HG3 ILE 7 8.779 -0.735 1.459 61 HD11 ILE 7 1HD3 ILE 7 6.069 -1.448 2.929 62 HD12 ILE 7 1HD1 ILE 7 4.535 -1.058 2.118 63 HD13 ILE 7 1HD2 ILE 7 5.146 -2.729 2.109 64 H LEU 8 H LEU 8 10.302 -1.136 -1.363 65 HA LEU 8 HA LEU 8 11.699 -3.756 -1.247 66 HB2 LEU 8 1HB LEU 8 12.275 -2.218 -3.083 67 HB3 LEU 8 2HB LEU 8 12.654 -0.941 -1.921 68 HG LEU 8 HG LEU 8 14.537 -2.347 -1.058 69 HD11 LEU 8 1HD1 LEU 8 15.250 -4.280 -2.393 70 HD12 LEU 8 1HD2 LEU 8 13.639 -4.531 -1.680 71 HD13 LEU 8 1HD3 LEU 8 13.795 -4.117 -3.405 72 HD21 LEU 8 2HD3 LEU 8 14.882 -0.589 -2.762 73 HD22 LEU 8 2HD1 LEU 8 15.982 -1.964 -3.027 74 HD23 LEU 8 2HD2 LEU 8 14.537 -1.769 -4.050 75 H MET 9 H MET 9 12.474 -4.529 0.532 76 HA MET 9 HA MET 9 12.798 -2.736 2.874 77 HB2 MET 9 1HB MET 9 13.095 -5.753 2.664 78 HB3 MET 9 2HB MET 9 13.031 -4.809 4.145 79 HG2 MET 9 1HG MET 9 10.773 -5.094 2.141 80 HG3 MET 9 2HG MET 9 10.911 -5.951 3.678 81 HE1 MET 9 3HE MET 9 11.929 -3.894 5.751 82 HE2 MET 9 1HE MET 9 10.407 -3.174 6.329 83 HE3 MET 9 2HE MET 9 10.500 -4.924 6.012 84 H GLU 10 H GLU 10 14.642 -2.642 4.156 85 HA GLU 10 HA GLU 10 17.127 -2.477 2.713 86 HB2 GLU 10 1HB GLU 10 16.412 -2.457 5.666 87 HB3 GLU 10 2HB GLU 10 18.079 -2.359 5.114 88 HG2 GLU 10 1HG GLU 10 15.927 -0.423 4.248 89 HG3 GLU 10 2HG GLU 10 16.954 -0.176 5.658 90 H ASN 11 H ASN 11 15.481 -5.115 4.173 91 HA ASN 11 HA ASN 11 17.951 -6.739 4.406 92 HB2 ASN 11 1HB ASN 11 15.033 -7.371 4.927 93 HB3 ASN 11 2HB ASN 11 16.352 -8.516 5.130 94 HD21 ASN 11 2HD2 ASN 11 14.396 -6.473 6.743 95 HD22 ASN 11 2HD1 ASN 11 15.393 -6.108 8.111 96 H GLY 12 H GLY 12 16.028 -5.768 1.917 97 HA2 GLY 12 1HA GLY 12 16.458 -6.468 -0.320 98 HA3 GLY 12 2HA GLY 12 17.001 -8.049 0.288 99 H GLY 13 H GLY 13 14.282 -7.345 1.997 100 HA2 GLY 13 1HA GLY 13 12.704 -9.327 0.616 101 HA3 GLY 13 2HA GLY 13 12.178 -8.316 1.982 102 H LYS 14 H LYS 14 10.627 -9.055 -0.340 103 HA LYS 14 HA LYS 14 10.046 -6.300 -1.358 104 HB2 LYS 14 1HB LYS 14 11.227 -7.626 -3.122 105 HB3 LYS 14 2HB LYS 14 9.976 -8.857 -3.010 106 HG2 LYS 14 1HG LYS 14 8.287 -7.226 -3.753 107 HG3 LYS 14 2HG LYS 14 9.534 -5.974 -3.844 108 HD2 LYS 14 1HD LYS 14 10.746 -7.276 -5.545 109 HD3 LYS 14 2HD LYS 14 9.543 -8.569 -5.429 110 HE2 LYS 14 1HE LYS 14 7.786 -7.022 -6.201 111 HE3 LYS 14 2HE LYS 14 8.963 -5.709 -6.284 112 HZ1 LYS 14 3HZ LYS 14 9.056 -8.187 -7.871 113 HZ2 LYS 14 1HZ LYS 14 8.597 -6.701 -8.422 114 HZ3 LYS 14 2HZ LYS 14 10.156 -6.961 -7.948 115 H ILE 15 H ILE 15 8.096 -5.650 -0.965 116 HA ILE 15 HA ILE 15 5.931 -7.720 -0.658 117 HB ILE 15 HB ILE 15 6.207 -5.022 0.761 118 HG12 ILE 15 1HG1 ILE 15 6.302 -7.772 2.007 119 HG13 ILE 15 1HG2 ILE 15 7.742 -6.885 1.535 120 HG21 ILE 15 2HG1 ILE 15 4.196 -5.732 1.990 121 HG22 ILE 15 2HG2 ILE 15 3.872 -5.622 0.244 122 HG23 ILE 15 2HG3 ILE 15 4.112 -7.212 1.005 123 HD11 ILE 15 1HD3 ILE 15 5.663 -5.948 3.523 124 HD12 ILE 15 1HD1 ILE 15 7.273 -6.599 3.903 125 HD13 ILE 15 1HD2 ILE 15 7.121 -5.048 3.044 126 H GLU 16 H GLU 16 4.965 -7.788 -2.521 127 HA GLU 16 HA GLU 16 4.440 -5.243 -3.966 128 HB2 GLU 16 1HB GLU 16 5.352 -7.215 -5.205 129 HB3 GLU 16 2HB GLU 16 3.923 -8.138 -4.766 130 HG2 GLU 16 1HG GLU 16 2.510 -6.574 -6.021 131 HG3 GLU 16 2HG GLU 16 3.930 -5.620 -6.443 132 H PHE 17 H PHE 17 2.521 -4.351 -4.328 133 HA PHE 17 HA PHE 17 0.087 -5.665 -3.248 134 HB2 PHE 17 1HB PHE 17 -0.431 -3.727 -1.808 135 HB3 PHE 17 2HB PHE 17 1.036 -4.535 -1.276 136 HD1 PHE 17 1HD PHE 17 -0.350 -1.518 -2.831 137 HD2 PHE 17 2HD PHE 17 3.200 -3.467 -1.470 138 HE1 PHE 17 1HE PHE 17 0.869 0.630 -2.940 139 HE2 PHE 17 2HE PHE 17 4.421 -1.321 -1.575 140 HZ PHE 17 HZ PHE 17 3.256 0.728 -2.312 141 H GLU 18 H GLU 18 -1.845 -4.797 -3.929 142 HA GLU 18 HA GLU 18 -1.622 -2.970 -6.274 143 HB2 GLU 18 1HB GLU 18 -3.855 -3.677 -6.829 144 HB3 GLU 18 2HB GLU 18 -2.938 -5.125 -6.435 145 HG2 GLU 18 1HG GLU 18 -3.950 -5.178 -4.204 146 HG3 GLU 18 2HG GLU 18 -4.841 -3.700 -4.561 147 H LEU 19 H LEU 19 -3.163 -1.254 -6.556 148 HA LEU 19 HA LEU 19 -3.929 -0.003 -3.940 149 HB2 LEU 19 1HB LEU 19 -2.752 1.290 -6.433 150 HB3 LEU 19 2HB LEU 19 -3.467 2.197 -5.097 151 HG LEU 19 HG LEU 19 -1.062 0.367 -4.801 152 HD11 LEU 19 1HD1 LEU 19 0.261 2.435 -4.775 153 HD12 LEU 19 1HD2 LEU 19 -0.563 2.200 -6.335 154 HD13 LEU 19 1HD3 LEU 19 -1.201 3.374 -5.160 155 HD21 LEU 19 2HD3 LEU 19 -2.382 0.761 -2.747 156 HD22 LEU 19 2HD1 LEU 19 -0.807 1.589 -2.666 157 HD23 LEU 19 2HD2 LEU 19 -2.284 2.517 -3.021 158 H PHE 20 H PHE 20 -5.688 1.450 -3.963 159 HA PHE 20 HA PHE 20 -7.604 0.904 -6.208 160 HB2 PHE 20 1HB PHE 20 -8.259 1.163 -3.243 161 HB3 PHE 20 2HB PHE 20 -9.411 0.880 -4.538 162 HD1 PHE 20 2HD PHE 20 -9.270 -1.282 -5.845 163 HD2 PHE 20 1HD PHE 20 -7.112 -0.616 -2.218 164 HE1 PHE 20 2HE PHE 20 -8.981 -3.722 -5.571 165 HE2 PHE 20 1HE PHE 20 -6.819 -3.054 -1.942 166 HZ PHE 20 HZ PHE 20 -7.754 -4.608 -3.619 167 HA PRO 21 HA PRO 21 -7.104 5.445 -5.730 168 HB2 PRO 21 1HB PRO 21 -6.913 5.950 -8.432 169 HB3 PRO 21 2HB PRO 21 -5.492 5.455 -7.504 170 HG2 PRO 21 1HG PRO 21 -7.348 3.746 -9.216 171 HG3 PRO 21 2HG PRO 21 -5.582 3.785 -9.223 172 HD2 PRO 21 1HD PRO 21 -6.910 1.867 -7.848 173 HD3 PRO 21 2HD PRO 21 -5.396 2.600 -7.181 174 H ASN 22 H ASN 22 -9.268 3.274 -7.235 175 HA ASN 22 HA ASN 22 -11.223 5.424 -7.842 176 HB2 ASN 22 1HB ASN 22 -11.353 2.412 -8.153 177 HB3 ASN 22 2HB ASN 22 -12.647 3.521 -8.585 178 HD21 ASN 22 2HD2 ASN 22 -10.171 1.782 -9.801 179 HD22 ASN 22 2HD1 ASN 22 -9.813 2.711 -11.218 180 H GLU 23 H GLU 23 -10.230 3.752 -5.147 181 HA GLU 23 HA GLU 23 -12.960 3.958 -3.912 182 HB2 GLU 23 1HB GLU 23 -10.603 2.174 -3.165 183 HB3 GLU 23 2HB GLU 23 -12.096 2.301 -2.245 184 HG2 GLU 23 1HG GLU 23 -13.366 1.420 -4.143 185 HG3 GLU 23 2HG GLU 23 -11.892 1.334 -5.105 186 H ALA 24 H ALA 24 -9.525 4.684 -3.563 187 HA ALA 24 HA ALA 24 -10.296 6.865 -1.719 188 HB1 ALA 24 3HB ALA 24 -8.170 4.801 -1.041 189 HB2 ALA 24 1HB ALA 24 -8.504 6.288 -0.124 190 HB3 ALA 24 2HB ALA 24 -9.733 5.004 -0.216 191 HA PRO 25 HA PRO 25 -7.182 7.929 -4.988 192 HB2 PRO 25 1HB PRO 25 -8.486 10.289 -5.697 193 HB3 PRO 25 2HB PRO 25 -8.880 8.738 -6.449 194 HG2 PRO 25 1HG PRO 25 -10.265 10.147 -4.131 195 HG3 PRO 25 2HG PRO 25 -10.998 9.396 -5.551 196 HD2 PRO 25 1HD PRO 25 -10.926 8.053 -3.222 197 HD3 PRO 25 2HD PRO 25 -10.593 7.183 -4.773 198 H VAL 26 H VAL 26 -8.687 9.702 -2.359 199 HA VAL 26 HA VAL 26 -6.689 11.838 -2.317 200 HB VAL 26 HB VAL 26 -7.713 12.451 -0.210 201 HG11 VAL 26 1HG1 VAL 26 -10.085 12.586 -0.797 202 HG12 VAL 26 1HG2 VAL 26 -9.033 12.963 -2.182 203 HG13 VAL 26 1HG3 VAL 26 -9.836 11.378 -2.079 204 HG21 VAL 26 2HG3 VAL 26 -7.739 10.197 0.801 205 HG22 VAL 26 2HG1 VAL 26 -9.336 10.973 0.933 206 HG23 VAL 26 2HG2 VAL 26 -9.055 9.718 -0.297 207 H THR 27 H THR 27 -6.679 8.573 -1.296 208 HA THR 27 HA THR 27 -4.322 9.116 0.466 209 HB THR 27 HB THR 27 -5.983 6.577 0.138 210 HG1 THR 27 1HG THR 27 -7.078 8.289 1.236 211 HG21 THR 27 2HG3 THR 27 -3.779 7.306 2.105 212 HG22 THR 27 2HG1 THR 27 -4.737 5.808 2.120 213 HG23 THR 27 2HG2 THR 27 -3.633 6.145 0.765 214 H VAL 28 H VAL 28 -5.380 7.191 -2.325 215 HA VAL 28 HA VAL 28 -2.815 5.856 -2.678 216 HB VAL 28 HB VAL 28 -5.141 6.382 -4.591 217 HG11 VAL 28 1HG1 VAL 28 -4.156 4.646 -6.006 218 HG12 VAL 28 1HG2 VAL 28 -3.081 6.053 -5.833 219 HG13 VAL 28 1HG3 VAL 28 -2.748 4.561 -4.922 220 HG21 VAL 28 2HG3 VAL 28 -5.712 4.961 -2.653 221 HG22 VAL 28 2HG1 VAL 28 -5.679 4.007 -4.154 222 HG23 VAL 28 2HG2 VAL 28 -4.319 3.911 -3.010 223 H ALA 29 H ALA 29 -4.230 8.805 -4.033 224 HA ALA 29 HA ALA 29 -2.143 9.271 -5.925 225 HB1 ALA 29 3HB ALA 29 -3.921 11.261 -4.469 226 HB2 ALA 29 1HB ALA 29 -2.951 11.603 -5.920 227 HB3 ALA 29 2HB ALA 29 -4.300 10.446 -6.004 228 H ASN 30 H ASN 30 -2.564 10.420 -2.572 229 HA ASN 30 HA ASN 30 -0.060 11.891 -2.561 230 HB2 ASN 30 1HB ASN 30 -2.003 10.997 -0.438 231 HB3 ASN 30 2HB ASN 30 -0.460 11.720 -0.010 232 HD21 ASN 30 2HD2 ASN 30 -3.655 12.317 -0.751 233 HD22 ASN 30 2HD1 ASN 30 -3.546 14.015 -1.071 234 H PHE 31 H PHE 31 -1.022 8.634 -1.552 235 HA PHE 31 HA PHE 31 1.465 7.865 -0.379 236 HB2 PHE 31 1HB PHE 31 -0.662 6.534 -0.266 237 HB3 PHE 31 2HB PHE 31 -0.491 6.154 -1.973 238 HD1 PHE 31 1HD PHE 31 0.828 5.551 1.396 239 HD2 PHE 31 2HD PHE 31 1.171 4.578 -2.749 240 HE1 PHE 31 1HE PHE 31 2.217 3.590 1.973 241 HE2 PHE 31 2HE PHE 31 2.558 2.614 -2.176 242 HZ PHE 31 HZ PHE 31 3.083 2.121 0.187 243 H GLU 32 H GLU 32 0.320 7.433 -3.739 244 HA GLU 32 HA GLU 32 2.758 6.365 -4.758 245 HB2 GLU 32 1HB GLU 32 0.664 6.310 -6.042 246 HB3 GLU 32 2HB GLU 32 0.622 8.066 -6.111 247 HG2 GLU 32 1HG GLU 32 2.707 8.054 -7.438 248 HG3 GLU 32 2HG GLU 32 2.711 6.292 -7.391 249 H LYS 33 H LYS 33 1.638 9.752 -4.624 250 HA LYS 33 HA LYS 33 3.853 10.904 -5.960 251 HB2 LYS 33 1HB LYS 33 1.784 12.144 -5.398 252 HB3 LYS 33 2HB LYS 33 2.184 12.054 -3.688 253 HG2 LYS 33 1HG LYS 33 4.191 13.420 -4.065 254 HG3 LYS 33 2HG LYS 33 3.829 13.484 -5.796 255 HD2 LYS 33 1HD LYS 33 1.696 14.625 -5.323 256 HD3 LYS 33 2HD LYS 33 2.021 14.532 -3.585 257 HE2 LYS 33 1HE LYS 33 4.048 15.913 -3.887 258 HE3 LYS 33 2HE LYS 33 3.738 15.998 -5.623 259 HZ1 LYS 33 3HZ LYS 33 1.962 17.042 -3.519 260 HZ2 LYS 33 1HZ LYS 33 2.946 17.942 -4.489 261 HZ3 LYS 33 2HZ LYS 33 1.673 17.121 -5.141 262 H LEU 34 H LEU 34 3.400 10.527 -2.430 263 HA LEU 34 HA LEU 34 5.990 11.610 -1.806 264 HB2 LEU 34 1HB LEU 34 4.118 9.796 -0.233 265 HB3 LEU 34 2HB LEU 34 5.574 10.537 0.439 266 HG LEU 34 HG LEU 34 3.173 12.066 -0.628 267 HD11 LEU 34 1HD1 LEU 34 2.721 12.533 1.739 268 HD12 LEU 34 1HD2 LEU 34 2.637 10.791 1.384 269 HD13 LEU 34 1HD3 LEU 34 4.064 11.465 2.207 270 HD21 LEU 34 2HD3 LEU 34 5.323 13.273 -0.824 271 HD22 LEU 34 2HD1 LEU 34 4.297 13.991 0.441 272 HD23 LEU 34 2HD2 LEU 34 5.665 12.945 0.891 273 H ALA 35 H ALA 35 4.826 8.282 -2.218 274 HA ALA 35 HA ALA 35 7.188 6.949 -1.429 275 HB1 ALA 35 3HB ALA 35 5.217 6.189 -3.616 276 HB2 ALA 35 1HB ALA 35 6.397 5.097 -2.855 277 HB3 ALA 35 2HB ALA 35 5.072 5.787 -1.888 278 H ASN 36 H ASN 36 6.254 8.089 -4.689 279 HA ASN 36 HA ASN 36 8.741 7.097 -5.855 280 HB2 ASN 36 1HB ASN 36 6.493 8.825 -6.911 281 HB3 ASN 36 2HB ASN 36 7.911 8.401 -7.863 282 HD21 ASN 36 2HD2 ASN 36 5.289 7.721 -8.564 283 HD22 ASN 36 2HD1 ASN 36 5.137 5.997 -8.513 284 H GLU 37 H GLU 37 7.700 10.066 -4.387 285 HA GLU 37 HA GLU 37 10.037 11.553 -5.430 286 HB2 GLU 37 1HB GLU 37 7.810 12.249 -3.476 287 HB3 GLU 37 2HB GLU 37 9.151 13.330 -3.824 288 HG2 GLU 37 1HG GLU 37 8.497 13.423 -6.178 289 HG3 GLU 37 2HG GLU 37 7.184 12.288 -5.873 290 H GLY 38 H GLY 38 9.695 9.181 -3.191 291 HA2 GLY 38 1HA GLY 38 11.557 8.288 -2.092 292 HA3 GLY 38 2HA GLY 38 12.438 9.807 -2.379 293 H PHE 39 H PHE 39 9.287 10.139 -1.047 294 HA PHE 39 HA PHE 39 10.377 11.061 1.524 295 HB2 PHE 39 1HB PHE 39 7.590 10.884 0.328 296 HB3 PHE 39 2HB PHE 39 7.845 11.317 2.011 297 HD1 PHE 39 2HD PHE 39 8.987 13.412 2.608 298 HD2 PHE 39 1HD PHE 39 8.105 12.411 -1.450 299 HE1 PHE 39 2HE PHE 39 9.348 15.768 1.950 300 HE2 PHE 39 1HE PHE 39 8.467 14.765 -2.112 301 HZ PHE 39 HZ PHE 39 9.089 16.444 -0.411 302 H TYR 40 H TYR 40 9.096 8.131 0.233 303 HA TYR 40 HA TYR 40 8.739 7.028 2.988 304 HB2 TYR 40 1HB TYR 40 7.983 5.937 0.251 305 HB3 TYR 40 2HB TYR 40 7.790 5.050 1.756 306 HD1 TYR 40 1HD TYR 40 7.171 8.087 2.995 307 HD2 TYR 40 2HD TYR 40 5.482 5.412 0.096 308 HE1 TYR 40 1HE TYR 40 4.953 9.128 3.326 309 HE2 TYR 40 2HE TYR 40 3.265 6.453 0.427 310 HH TYR 40 HH TYR 40 2.809 9.113 2.745 311 H ASN 41 H ASN 41 11.343 7.705 1.655 312 HA ASN 41 HA ASN 41 12.543 4.987 1.415 313 HB2 ASN 41 1HB ASN 41 13.082 6.700 -0.295 314 HB3 ASN 41 2HB ASN 41 13.761 7.725 0.962 315 HD21 ASN 41 2HD2 ASN 41 14.548 5.641 -1.408 316 HD22 ASN 41 2HD1 ASN 41 16.058 5.044 -0.806 317 H GLY 42 H GLY 42 13.147 4.008 3.169 318 HA2 GLY 42 1HA GLY 42 14.746 3.685 4.877 319 HA3 GLY 42 2HA GLY 42 15.029 5.441 4.935 320 H LEU 43 H LEU 43 11.739 4.419 4.898 321 HA LEU 43 HA LEU 43 11.210 5.480 7.537 322 HB2 LEU 43 1HB LEU 43 9.545 3.728 5.683 323 HB3 LEU 43 2HB LEU 43 8.939 4.472 7.167 324 HG LEU 43 HG LEU 43 9.896 5.941 4.685 325 HD11 LEU 43 1HD1 LEU 43 7.531 6.575 4.491 326 HD12 LEU 43 1HD2 LEU 43 7.750 4.810 4.407 327 HD13 LEU 43 1HD3 LEU 43 7.145 5.562 5.902 328 HD21 LEU 43 2HD3 LEU 43 10.422 7.160 6.771 329 HD22 LEU 43 2HD1 LEU 43 9.103 7.955 5.880 330 HD23 LEU 43 2HD2 LEU 43 8.737 6.963 7.312 331 H THR 44 H THR 44 10.703 4.523 9.436 332 HA THR 44 HA THR 44 11.538 1.647 9.654 333 HB THR 44 HB THR 44 11.692 3.824 11.786 334 HG1 THR 44 1HG THR 44 13.968 3.607 11.394 335 HG21 THR 44 2HG3 THR 44 12.738 0.968 11.711 336 HG22 THR 44 2HG1 THR 44 12.997 2.140 13.023 337 HG23 THR 44 2HG2 THR 44 11.358 1.542 12.673 338 H PHE 45 H PHE 45 10.365 0.223 10.795 339 HA PHE 45 HA PHE 45 7.538 0.939 11.218 340 HB2 PHE 45 1HB PHE 45 9.154 -1.621 11.404 341 HB3 PHE 45 2HB PHE 45 7.509 -1.540 12.016 342 HD1 PHE 45 1HD PHE 45 9.618 -1.467 9.018 343 HD2 PHE 45 2HD PHE 45 5.619 -1.334 10.516 344 HE1 PHE 45 1HE PHE 45 8.753 -1.906 6.745 345 HE2 PHE 45 2HE PHE 45 4.751 -1.776 8.245 346 HZ PHE 45 HZ PHE 45 6.320 -2.059 6.357 347 H HIS 46 H HIS 46 6.382 0.381 13.172 348 HA HIS 46 HA HIS 46 8.030 1.226 15.535 349 HB2 HIS 46 1HB HIS 46 6.623 3.082 14.584 350 HB3 HIS 46 2HB HIS 46 5.192 2.095 14.838 351 HD2 HIS 46 2HD HIS 46 3.951 2.720 17.303 352 HE1 HIS 46 1HE HIS 46 7.476 4.102 19.229 353 H ARG 47 H ARG 47 4.983 -0.329 14.526 354 HA ARG 47 HA ARG 47 5.327 -2.213 16.815 355 HB2 ARG 47 1HB ARG 47 2.788 -0.693 16.109 356 HB3 ARG 47 2HB ARG 47 2.834 -2.086 17.178 357 HG2 ARG 47 1HG ARG 47 4.387 0.461 17.689 358 HG3 ARG 47 2HG ARG 47 2.759 0.128 18.329 359 HD2 ARG 47 1HD ARG 47 3.637 -1.885 19.418 360 HD3 ARG 47 2HD ARG 47 5.264 -1.462 18.836 361 HE ARG 47 HE ARG 47 3.738 -0.162 20.970 362 HH11 ARG 47 1HH1 ARG 47 6.532 -0.076 18.842 363 HH12 ARG 47 1HH2 ARG 47 7.421 1.045 19.849 364 HH21 ARG 47 2HH1 ARG 47 4.902 1.293 22.269 365 HH22 ARG 47 2HH2 ARG 47 6.500 1.820 21.788 366 H VAL 48 H VAL 48 6.058 -3.732 15.344 367 HA VAL 48 HA VAL 48 3.985 -4.764 13.422 368 HB VAL 48 HB VAL 48 6.944 -5.467 13.738 369 HG11 VAL 48 1HG1 VAL 48 6.669 -6.630 11.603 370 HG12 VAL 48 1HG2 VAL 48 5.624 -7.311 12.872 371 HG13 VAL 48 1HG3 VAL 48 4.931 -6.251 11.621 372 HG21 VAL 48 2HG3 VAL 48 6.622 -3.159 12.913 373 HG22 VAL 48 2HG1 VAL 48 7.242 -4.216 11.623 374 HG23 VAL 48 2HG2 VAL 48 5.522 -3.762 11.650 375 H ILE 49 H ILE 49 2.639 -6.135 14.186 376 HA ILE 49 HA ILE 49 3.704 -8.282 16.007 377 HB ILE 49 HB ILE 49 0.895 -7.071 15.900 378 HG12 ILE 49 1HG1 ILE 49 2.948 -6.906 18.116 379 HG13 ILE 49 1HG2 ILE 49 2.636 -5.624 16.957 380 HG21 ILE 49 2HG1 ILE 49 0.443 -8.531 17.830 381 HG22 ILE 49 2HG2 ILE 49 0.888 -9.486 16.397 382 HG23 ILE 49 2HG3 ILE 49 2.077 -9.222 17.694 383 HD11 ILE 49 1HD3 ILE 49 0.623 -6.776 18.903 384 HD12 ILE 49 1HD1 ILE 49 1.468 -5.217 19.050 385 HD13 ILE 49 1HD2 ILE 49 0.307 -5.478 17.727 386 HA PRO 50 HA PRO 50 2.825 -10.763 12.389 387 HB2 PRO 50 1HB PRO 50 3.771 -12.743 14.509 388 HB3 PRO 50 2HB PRO 50 4.246 -12.648 12.808 389 HG2 PRO 50 1HG PRO 50 5.958 -11.765 14.640 390 HG3 PRO 50 2HG PRO 50 5.716 -10.809 13.174 391 HD2 PRO 50 1HD PRO 50 4.564 -10.383 15.956 392 HD3 PRO 50 2HD PRO 50 5.208 -9.161 14.787 393 H GLY 51 H GLY 51 0.899 -11.321 11.927 394 HA2 GLY 51 1HA GLY 51 -1.031 -12.673 12.111 395 HA3 GLY 51 2HA GLY 51 -0.610 -13.032 13.802 396 H PHE 52 H PHE 52 -0.290 -9.737 13.116 397 HA PHE 52 HA PHE 52 -3.133 -9.103 13.755 398 HB2 PHE 52 1HB PHE 52 -1.878 -9.186 15.922 399 HB3 PHE 52 2HB PHE 52 -0.743 -8.002 15.295 400 HD1 PHE 52 1HD PHE 52 -4.476 -8.346 15.449 401 HD2 PHE 52 2HD PHE 52 -1.046 -5.885 16.105 402 HE1 PHE 52 1HE PHE 52 -5.939 -6.522 16.247 403 HE2 PHE 52 2HE PHE 52 -2.506 -4.059 16.907 404 HZ PHE 52 HZ PHE 52 -4.955 -4.378 16.976 405 H VAL 53 H VAL 53 -0.434 -6.879 14.002 406 HA VAL 53 HA VAL 53 -1.189 -5.607 11.403 407 HB VAL 53 HB VAL 53 -1.318 -4.250 14.140 408 HG11 VAL 53 1HG1 VAL 53 -1.879 -2.213 12.907 409 HG12 VAL 53 1HG2 VAL 53 -0.252 -2.807 12.505 410 HG13 VAL 53 1HG3 VAL 53 -1.600 -3.066 11.371 411 HG21 VAL 53 2HG3 VAL 53 -3.336 -5.559 13.574 412 HG22 VAL 53 2HG1 VAL 53 -3.674 -3.813 13.521 413 HG23 VAL 53 2HG2 VAL 53 -3.443 -4.721 12.007 414 H SER 54 H SER 54 0.434 -4.920 10.316 415 HA SER 54 HA SER 54 3.125 -4.655 11.625 416 HB2 SER 54 1HB SER 54 4.014 -4.614 9.487 417 HB3 SER 54 2HB SER 54 2.959 -6.006 9.681 418 HG SER 54 HG SER 54 2.653 -4.932 7.727 419 H GLN 55 H GLN 55 2.252 -2.653 12.791 420 HA GLN 55 HA GLN 55 1.656 -0.329 11.083 421 HB2 GLN 55 1HB GLN 55 0.444 -0.649 13.219 422 HB3 GLN 55 2HB GLN 55 1.962 -0.603 14.104 423 HG2 GLN 55 1HG GLN 55 2.319 1.713 13.452 424 HG3 GLN 55 2HG GLN 55 0.825 1.677 12.472 425 HE21 GLN 55 2HE2 GLN 55 2.150 1.551 15.756 426 HE22 GLN 55 2HE1 GLN 55 0.691 2.019 16.564 427 H GLY 56 H GLY 56 3.013 1.067 10.310 428 HA2 GLY 56 1HA GLY 56 5.231 2.128 11.742 429 HA3 GLY 56 2HA GLY 56 5.824 0.867 10.637 430 H GLY 57 H GLY 57 6.936 2.252 9.280 431 HA2 GLY 57 1HA GLY 57 7.080 3.555 7.338 432 HA3 GLY 57 2HA GLY 57 5.321 3.816 7.396 433 H CYS 58 H CYS 58 7.646 4.397 10.013 434 HA CYS 58 HA CYS 58 6.890 7.328 10.011 435 HB2 CYS 58 1HB CYS 58 6.276 6.133 11.985 436 HB3 CYS 58 2HB CYS 58 7.947 5.640 12.227 437 HG CYS 58 HG CYS 58 7.313 7.479 13.906 438 HA PRO 59 HA PRO 59 10.960 8.267 8.533 439 HB2 PRO 59 1HB PRO 59 10.482 10.703 10.316 440 HB3 PRO 59 2HB PRO 59 11.042 10.666 8.639 441 HG2 PRO 59 1HG PRO 59 8.516 11.353 9.102 442 HG3 PRO 59 2HG PRO 59 8.863 10.243 7.773 443 HD2 PRO 59 1HD PRO 59 7.808 9.635 10.557 444 HD3 PRO 59 2HD PRO 59 7.331 8.908 8.970 445 H ARG 60 H ARG 60 10.073 8.466 11.933 446 HA ARG 60 HA ARG 60 12.975 8.102 12.610 447 HB2 ARG 60 1HB ARG 60 10.734 9.332 14.262 448 HB3 ARG 60 2HB ARG 60 12.384 9.085 14.815 449 HG2 ARG 60 1HG ARG 60 13.191 10.643 13.072 450 HG3 ARG 60 2HG ARG 60 11.505 10.920 12.572 451 HD2 ARG 60 1HD ARG 60 11.005 11.683 14.858 452 HD3 ARG 60 2HD ARG 60 12.731 11.515 15.252 453 HE ARG 60 HE ARG 60 12.538 13.111 12.953 454 HH11 ARG 60 1HH1 ARG 60 11.619 13.237 16.341 455 HH12 ARG 60 1HH2 ARG 60 11.730 14.980 16.436 456 HH21 ARG 60 2HH1 ARG 60 12.679 15.374 13.089 457 HH22 ARG 60 2HH2 ARG 60 12.330 16.191 14.595 458 H GLY 61 H GLY 61 9.825 6.748 12.739 459 HA2 GLY 61 1HA GLY 61 9.211 4.605 13.425 460 HA3 GLY 61 2HA GLY 61 10.872 4.336 14.003 461 H ASN 62 H ASN 62 9.160 7.193 15.008 462 HA ASN 62 HA ASN 62 9.084 6.101 17.790 463 HB2 ASN 62 1HB ASN 62 9.101 8.928 16.707 464 HB3 ASN 62 2HB ASN 62 8.829 8.533 18.399 465 HD21 ASN 62 2HD2 ASN 62 10.972 10.078 17.242 466 HD22 ASN 62 2HD1 ASN 62 12.449 9.273 17.656 467 H GLY 63 H GLY 63 7.064 6.235 15.263 468 HA2 GLY 63 1HA GLY 63 4.783 5.651 15.355 469 HA3 GLY 63 2HA GLY 63 4.737 6.131 17.068 470 H THR 64 H THR 64 6.324 8.539 15.449 471 HA THR 64 HA THR 64 3.786 10.109 15.116 472 HB THR 64 HB THR 64 6.525 11.079 16.050 473 HG1 THR 64 1HG THR 64 5.337 11.457 18.007 474 HG21 THR 64 2HG3 THR 64 3.884 12.551 15.710 475 HG22 THR 64 2HG1 THR 64 5.377 13.232 16.394 476 HG23 THR 64 2HG2 THR 64 5.322 12.749 14.683 477 H GLY 65 H GLY 65 3.338 10.340 13.075 478 HA2 GLY 65 1HA GLY 65 5.192 10.210 10.931 479 HA3 GLY 65 2HA GLY 65 3.574 10.947 10.858 480 H ASP 66 H ASP 66 6.885 11.501 10.652 481 HA ASP 66 HA ASP 66 6.574 14.417 11.278 482 HB2 ASP 66 1HB ASP 66 9.075 12.684 11.080 483 HB3 ASP 66 2HB ASP 66 9.077 14.421 11.356 484 H ALA 67 H ALA 67 5.961 12.691 8.768 485 HA ALA 67 HA ALA 67 7.744 13.691 6.738 486 HB1 ALA 67 3HB ALA 67 4.885 12.683 6.522 487 HB2 ALA 67 1HB ALA 67 6.006 12.927 5.162 488 HB3 ALA 67 2HB ALA 67 6.357 11.692 6.394 489 H GLY 68 H GLY 68 4.837 14.939 8.259 490 HA2 GLY 68 1HA GLY 68 4.236 17.224 8.316 491 HA3 GLY 68 2HA GLY 68 5.339 17.542 6.957 492 H TYR 69 H TYR 69 3.367 14.790 6.525 493 HA TYR 69 HA TYR 69 1.441 16.377 4.856 494 HB2 TYR 69 1HB TYR 69 2.654 13.646 4.282 495 HB3 TYR 69 2HB TYR 69 1.378 14.401 3.339 496 HD1 TYR 69 2HD TYR 69 1.829 16.357 1.934 497 HD2 TYR 69 1HD TYR 69 4.945 14.387 4.129 498 HE1 TYR 69 2HE TYR 69 3.527 17.496 0.546 499 HE2 TYR 69 1HE TYR 69 6.643 15.527 2.741 500 HH TYR 69 HH TYR 69 5.687 17.778 0.143 501 H THR 70 H THR 70 -0.663 15.909 4.918 502 HA THR 70 HA THR 70 -1.497 13.717 6.787 503 HB THR 70 HB THR 70 -2.710 16.509 6.578 504 HG1 THR 70 1HG THR 70 -1.935 16.637 8.761 505 HG21 THR 70 2HG3 THR 70 -3.410 14.140 8.353 506 HG22 THR 70 2HG1 THR 70 -4.142 15.759 8.436 507 HG23 THR 70 2HG2 THR 70 -4.387 14.743 6.994 508 H ILE 71 H ILE 71 -3.137 12.465 6.221 509 HA ILE 71 HA ILE 71 -4.524 13.119 3.631 510 HB ILE 71 HB ILE 71 -3.664 10.401 4.743 511 HG12 ILE 71 1HG1 ILE 71 -2.792 11.826 2.219 512 HG13 ILE 71 1HG2 ILE 71 -1.857 11.757 3.705 513 HG21 ILE 71 2HG1 ILE 71 -4.638 9.479 2.679 514 HG22 ILE 71 2HG2 ILE 71 -5.876 10.297 3.660 515 HG23 ILE 71 2HG3 ILE 71 -5.210 11.100 2.220 516 HD11 ILE 71 1HD3 ILE 71 -2.700 9.378 2.034 517 HD12 ILE 71 1HD1 ILE 71 -1.077 10.105 2.099 518 HD13 ILE 71 1HD2 ILE 71 -1.754 9.306 3.540 519 HA PRO 72 HA PRO 72 -8.150 12.907 6.068 520 HB2 PRO 72 1HB PRO 72 -9.930 13.406 4.061 521 HB3 PRO 72 2HB PRO 72 -8.838 14.691 4.594 522 HG2 PRO 72 1HG PRO 72 -8.554 12.812 2.208 523 HG3 PRO 72 2HG PRO 72 -8.380 14.570 2.241 524 HD2 PRO 72 1HD PRO 72 -6.209 12.922 2.376 525 HD3 PRO 72 2HD PRO 72 -6.261 14.496 3.267 526 H CYS 73 H CYS 73 -10.200 11.767 6.094 527 HA CYS 73 HA CYS 73 -9.697 8.897 5.380 528 HB2 CYS 73 1HB CYS 73 -10.168 9.438 7.665 529 HB3 CYS 73 2HB CYS 73 -11.725 10.103 7.197 530 HG CYS 73 HG CYS 73 -12.050 7.819 8.321 531 H GLU 74 H GLU 74 -10.238 8.888 3.145 532 HA GLU 74 HA GLU 74 -12.484 10.047 1.917 533 HB2 GLU 74 1HB GLU 74 -10.644 8.815 0.734 534 HB3 GLU 74 2HB GLU 74 -11.296 7.300 1.340 535 HG2 GLU 74 1HG GLU 74 -12.062 7.498 -0.870 536 HG3 GLU 74 2HG GLU 74 -13.452 7.859 0.151 537 H THR 75 H THR 75 -14.479 10.055 2.578 538 HA THR 75 HA THR 75 -15.607 7.537 3.743 539 HB THR 75 HB THR 75 -16.664 10.397 3.881 540 HG1 THR 75 1HG THR 75 -14.658 9.741 5.104 541 HG21 THR 75 2HG3 THR 75 -17.527 7.848 5.300 542 HG22 THR 75 2HG1 THR 75 -18.196 9.473 5.576 543 HG23 THR 75 2HG2 THR 75 -18.427 8.670 4.004 544 H ASP 76 H ASP 76 -15.987 6.422 1.859 545 HA ASP 76 HA ASP 76 -18.448 7.282 0.453 546 HB2 ASP 76 1HB ASP 76 -17.487 7.012 -1.766 547 HB3 ASP 76 2HB ASP 76 -16.580 8.245 -0.901 548 H ASN 77 H ASN 77 -17.803 5.307 -1.682 549 HA ASN 77 HA ASN 77 -19.247 3.122 -0.529 550 HB2 ASN 77 1HB ASN 77 -17.623 3.382 -3.068 551 HB3 ASN 77 2HB ASN 77 -18.491 1.916 -2.636 552 HD21 ASN 77 2HD2 ASN 77 -18.994 3.427 -4.940 553 HD22 ASN 77 2HD1 ASN 77 -20.593 4.084 -4.825 554 H ASN 78 H ASN 78 -15.825 3.800 -0.728 555 HA ASN 78 HA ASN 78 -14.733 1.221 -0.468 556 HB2 ASN 78 1HB ASN 78 -13.485 3.402 -0.719 557 HB3 ASN 78 2HB ASN 78 -13.754 3.683 0.996 558 HD21 ASN 78 2HD2 ASN 78 -11.220 3.546 -0.049 559 HD22 ASN 78 2HD1 ASN 78 -10.432 2.114 0.525 560 HA PRO 79 HA PRO 79 -16.762 -0.027 3.301 561 HB2 PRO 79 1HB PRO 79 -15.015 -2.438 2.690 562 HB3 PRO 79 2HB PRO 79 -16.745 -2.401 3.054 563 HG2 PRO 79 1HG PRO 79 -15.999 -2.826 0.536 564 HG3 PRO 79 2HG PRO 79 -17.338 -1.720 0.850 565 HD2 PRO 79 1HD PRO 79 -14.418 -1.074 0.259 566 HD3 PRO 79 2HD PRO 79 -15.912 -0.305 -0.413 567 H HIS 80 H HIS 80 -13.370 0.094 2.528 568 HA HIS 80 HA HIS 80 -11.469 -0.022 3.859 569 HB2 HIS 80 1HB HIS 80 -13.367 1.109 5.962 570 HB3 HIS 80 2HB HIS 80 -11.613 1.112 6.061 571 HD2 HIS 80 2HD HIS 80 -14.227 3.562 5.203 572 HE1 HIS 80 1HE HIS 80 -10.967 4.592 2.658 573 H ARG 81 H ARG 81 -12.764 -2.426 3.588 574 HA ARG 81 HA ARG 81 -13.041 -3.756 6.156 575 HB2 ARG 81 1HB ARG 81 -14.048 -4.600 4.021 576 HB3 ARG 81 2HB ARG 81 -12.433 -4.922 3.411 577 HG2 ARG 81 1HG ARG 81 -12.067 -6.560 5.203 578 HG3 ARG 81 2HG ARG 81 -13.700 -6.230 5.831 579 HD2 ARG 81 1HD ARG 81 -13.104 -7.204 3.048 580 HD3 ARG 81 2HD ARG 81 -13.538 -8.248 4.421 581 HE ARG 81 HE ARG 81 -15.293 -6.520 2.880 582 HH11 ARG 81 1HH1 ARG 81 -14.836 -8.248 5.905 583 HH12 ARG 81 1HH2 ARG 81 -16.548 -8.337 6.257 584 HH21 ARG 81 2HH1 ARG 81 -17.512 -6.643 3.348 585 HH22 ARG 81 2HH2 ARG 81 -18.063 -7.429 4.810 586 H HIS 82 H HIS 82 -11.556 -4.227 7.549 587 HA HIS 82 HA HIS 82 -8.716 -4.307 6.626 588 HB2 HIS 82 1HB HIS 82 -9.989 -3.892 9.360 589 HB3 HIS 82 2HB HIS 82 -8.266 -4.157 9.139 590 HD2 HIS 82 2HD HIS 82 -6.796 -1.772 8.575 591 HE1 HIS 82 1HE HIS 82 -10.222 0.598 7.738 592 H VAL 83 H VAL 83 -8.902 -6.394 5.703 593 HA VAL 83 HA VAL 83 -8.657 -8.542 7.804 594 HB VAL 83 HB VAL 83 -9.599 -10.118 6.150 595 HG11 VAL 83 1HG1 VAL 83 -11.933 -9.383 6.192 596 HG12 VAL 83 1HG2 VAL 83 -11.120 -9.108 7.751 597 HG13 VAL 83 1HG3 VAL 83 -11.407 -7.745 6.645 598 HG21 VAL 83 2HG3 VAL 83 -8.897 -8.913 4.111 599 HG22 VAL 83 2HG1 VAL 83 -10.642 -9.261 4.077 600 HG23 VAL 83 2HG2 VAL 83 -10.070 -7.622 4.468 601 H THR 84 H THR 84 -7.744 -10.585 6.514 602 HA THR 84 HA THR 84 -4.985 -10.121 6.418 603 HB THR 84 HB THR 84 -6.499 -12.255 4.848 604 HG1 THR 84 1HG THR 84 -5.422 -12.374 7.490 605 HG21 THR 84 2HG3 THR 84 -3.657 -12.159 5.928 606 HG22 THR 84 2HG1 THR 84 -4.411 -13.539 5.100 607 HG23 THR 84 2HG2 THR 84 -4.121 -12.021 4.217 608 H GLY 85 H GLY 85 -3.854 -8.805 5.241 609 HA2 GLY 85 1HA GLY 85 -2.677 -8.708 3.100 610 HA3 GLY 85 2HA GLY 85 -4.229 -9.000 2.280 611 H ALA 86 H ALA 86 -5.554 -7.126 4.266 612 HA ALA 86 HA ALA 86 -5.645 -4.930 2.463 613 HB1 ALA 86 3HB ALA 86 -6.509 -5.067 5.374 614 HB2 ALA 86 1HB ALA 86 -6.995 -3.818 4.205 615 HB3 ALA 86 2HB ALA 86 -7.501 -5.507 3.966 616 H MET 87 H MET 87 -4.680 -3.010 2.326 617 HA MET 87 HA MET 87 -2.661 -2.337 4.447 618 HB2 MET 87 1HB MET 87 -1.694 -2.869 2.198 619 HB3 MET 87 2HB MET 87 -2.642 -1.561 1.507 620 HG2 MET 87 1HG MET 87 -1.452 0.059 2.944 621 HG3 MET 87 2HG MET 87 -0.494 -1.258 3.625 622 HE1 MET 87 3HE MET 87 0.505 -3.116 1.535 623 HE2 MET 87 1HE MET 87 1.923 -2.276 0.860 624 HE3 MET 87 2HE MET 87 1.601 -2.214 2.611 625 H SER 88 H SER 88 -2.932 -0.573 5.580 626 HA SER 88 HA SER 88 -5.043 1.412 4.702 627 HB2 SER 88 1HB SER 88 -6.190 -0.280 5.887 628 HB3 SER 88 2HB SER 88 -5.093 -0.116 7.250 629 HG SER 88 HG SER 88 -7.058 1.085 7.368 630 H MET 89 H MET 89 -4.746 3.445 5.491 631 HA MET 89 HA MET 89 -2.122 4.109 6.597 632 HB2 MET 89 1HB MET 89 -4.575 5.837 6.117 633 HB3 MET 89 2HB MET 89 -2.971 6.430 6.524 634 HG2 MET 89 1HG MET 89 -3.747 4.951 3.995 635 HG3 MET 89 2HG MET 89 -3.402 6.674 4.147 636 HE1 MET 89 3HE MET 89 -0.917 6.834 6.044 637 HE2 MET 89 1HE MET 89 0.421 6.752 4.874 638 HE3 MET 89 2HE MET 89 -1.033 7.708 4.496 639 H ALA 90 H ALA 90 -1.691 5.237 8.511 640 HA ALA 90 HA ALA 90 -3.390 4.303 10.743 641 HB1 ALA 90 3HB ALA 90 -0.703 5.724 10.730 642 HB2 ALA 90 1HB ALA 90 -1.530 5.081 12.168 643 HB3 ALA 90 2HB ALA 90 -0.959 3.972 10.898 644 H HIS 91 H HIS 91 -5.062 5.476 11.288 645 HA HIS 91 HA HIS 91 -4.845 8.454 11.094 646 HB2 HIS 91 1HB HIS 91 -7.234 6.570 11.221 647 HB3 HIS 91 2HB HIS 91 -7.380 8.312 11.407 648 HD2 HIS 91 2HD HIS 91 -6.359 5.735 8.460 649 HE1 HIS 91 1HE HIS 91 -7.392 9.541 6.880 650 H ARG 92 H ARG 92 -5.158 9.786 12.765 651 HA ARG 92 HA ARG 92 -5.848 8.560 15.405 652 HB2 ARG 92 1HB ARG 92 -3.631 10.587 14.908 653 HB3 ARG 92 2HB ARG 92 -4.152 9.999 16.481 654 HG2 ARG 92 1HG ARG 92 -2.999 8.212 14.328 655 HG3 ARG 92 2HG ARG 92 -2.043 8.980 15.618 656 HD2 ARG 92 1HD ARG 92 -3.485 7.866 17.276 657 HD3 ARG 92 2HD ARG 92 -4.302 7.020 15.942 658 HE ARG 92 HE ARG 92 -1.578 6.567 16.939 659 HH11 ARG 92 1HH1 ARG 92 -4.033 5.865 14.525 660 HH12 ARG 92 1HH2 ARG 92 -3.264 4.387 13.991 661 HH21 ARG 92 2HH1 ARG 92 -0.590 4.646 16.238 662 HH22 ARG 92 2HH2 ARG 92 -1.315 3.697 14.959 663 H GLY 93 H GLY 93 -7.781 9.662 13.962 664 HA2 GLY 93 1HA GLY 93 -9.224 11.383 15.328 665 HA3 GLY 93 2HA GLY 93 -7.976 12.519 14.766 666 H ARG 94 H ARG 94 -10.471 13.127 14.060 667 HA ARG 94 HA ARG 94 -11.525 11.887 11.712 668 HB2 ARG 94 1HB ARG 94 -12.738 13.524 13.200 669 HB3 ARG 94 2HB ARG 94 -11.739 14.808 12.537 670 HG2 ARG 94 1HG ARG 94 -12.664 14.400 10.303 671 HG3 ARG 94 2HG ARG 94 -13.659 13.076 10.958 672 HD2 ARG 94 1HD ARG 94 -13.781 15.953 11.831 673 HD3 ARG 94 2HD ARG 94 -14.902 15.159 10.702 674 HE ARG 94 HE ARG 94 -14.809 14.892 13.595 675 HH11 ARG 94 1HH1 ARG 94 -15.904 13.474 10.572 676 HH12 ARG 94 1HH2 ARG 94 -17.188 12.553 11.324 677 HH21 ARG 94 2HH1 ARG 94 -16.479 13.691 14.559 678 HH22 ARG 94 2HH2 ARG 94 -17.513 12.675 13.580 679 H ASP 95 H ASP 95 -10.761 11.700 9.776 680 HA ASP 95 HA ASP 95 -9.436 12.076 7.897 681 HB2 ASP 95 1HB ASP 95 -10.154 14.959 8.587 682 HB3 ASP 95 2HB ASP 95 -9.462 14.434 7.059 683 H THR 96 H THR 96 -8.073 11.885 10.450 684 HA THR 96 HA THR 96 -5.683 13.600 9.850 685 HB THR 96 HB THR 96 -6.558 12.475 12.547 686 HG1 THR 96 1HG THR 96 -7.805 14.297 11.626 687 HG21 THR 96 2HG3 THR 96 -4.319 14.383 11.773 688 HG22 THR 96 2HG1 THR 96 -4.751 13.898 13.429 689 HG23 THR 96 2HG2 THR 96 -4.111 12.692 12.287 690 H GLY 97 H GLY 97 -5.502 11.652 8.286 691 HA2 GLY 97 1HA GLY 97 -4.072 9.418 9.598 692 HA3 GLY 97 2HA GLY 97 -4.431 9.579 7.864 693 H SER 98 H SER 98 -1.926 9.235 9.747 694 HA SER 98 HA SER 98 -0.185 11.507 8.931 695 HB2 SER 98 1HB SER 98 1.438 10.583 10.218 696 HB3 SER 98 2HB SER 98 -0.063 10.467 11.122 697 HG SER 98 HG SER 98 -0.233 8.323 10.398 698 H CYS 99 H CYS 99 2.130 10.519 8.303 699 HA CYS 99 HA CYS 99 1.962 9.303 5.637 700 HB2 CYS 99 1HB CYS 99 4.286 9.383 5.605 701 HB3 CYS 99 2HB CYS 99 3.638 10.913 6.175 702 HG CYS 99 HG CYS 99 4.867 8.451 7.965 703 H GLN 100 H GLN 100 1.852 8.075 8.836 704 HA GLN 100 HA GLN 100 3.287 5.574 8.274 705 HB2 GLN 100 1HB GLN 100 1.449 6.226 10.611 706 HB3 GLN 100 2HB GLN 100 2.649 4.944 10.530 707 HG2 GLN 100 1HG GLN 100 4.453 6.538 10.546 708 HG3 GLN 100 2HG GLN 100 3.298 7.896 10.434 709 HE21 GLN 100 2HE2 GLN 100 1.965 8.393 12.239 710 HE22 GLN 100 2HE1 GLN 100 2.405 7.888 13.837 711 H PHE 101 H PHE 101 2.455 3.528 8.114 712 HA PHE 101 HA PHE 101 -0.479 3.182 7.982 713 HB2 PHE 101 1HB PHE 101 -0.449 2.205 5.749 714 HB3 PHE 101 2HB PHE 101 0.153 3.853 5.662 715 HD1 PHE 101 2HD PHE 101 2.555 4.291 5.312 716 HD2 PHE 101 1HD PHE 101 0.954 0.331 5.246 717 HE1 PHE 101 2HE PHE 101 4.602 3.485 4.185 718 HE2 PHE 101 1HE PHE 101 3.001 -0.480 4.120 719 HZ PHE 101 HZ PHE 101 4.825 1.097 3.590 720 H PHE 102 H PHE 102 -0.971 0.823 7.365 721 HA PHE 102 HA PHE 102 1.030 -1.050 8.488 722 HB2 PHE 102 1HB PHE 102 -0.480 -1.841 10.248 723 HB3 PHE 102 2HB PHE 102 -0.115 -0.141 10.496 724 HD1 PHE 102 2HD PHE 102 -1.812 1.573 10.154 725 HD2 PHE 102 1HD PHE 102 -2.701 -2.572 9.619 726 HE1 PHE 102 2HE PHE 102 -4.230 2.084 10.225 727 HE2 PHE 102 1HE PHE 102 -5.119 -2.064 9.687 728 HZ PHE 102 HZ PHE 102 -5.884 0.264 9.989 729 H ILE 103 H ILE 103 0.668 -3.185 8.052 730 HA ILE 103 HA ILE 103 -1.624 -3.748 6.190 731 HB ILE 103 HB ILE 103 0.980 -5.297 6.622 732 HG12 ILE 103 1HG1 ILE 103 0.223 -3.661 4.199 733 HG13 ILE 103 1HG2 ILE 103 1.183 -3.014 5.521 734 HG21 ILE 103 2HG1 ILE 103 0.273 -6.551 4.625 735 HG22 ILE 103 2HG2 ILE 103 -0.921 -6.707 5.934 736 HG23 ILE 103 2HG3 ILE 103 -1.239 -5.614 4.567 737 HD11 ILE 103 1HD3 ILE 103 1.905 -5.412 3.821 738 HD12 ILE 103 1HD1 ILE 103 2.600 -3.779 3.699 739 HD13 ILE 103 1HD2 ILE 103 2.876 -4.759 5.161 740 H VAL 104 H VAL 104 -3.146 -5.116 6.616 741 HA VAL 104 HA VAL 104 -3.252 -6.178 9.394 742 HB VAL 104 HB VAL 104 -5.290 -6.265 7.117 743 HG11 VAL 104 1HG1 VAL 104 -6.906 -6.792 8.877 744 HG12 VAL 104 1HG2 VAL 104 -5.629 -8.025 8.754 745 HG13 VAL 104 1HG3 VAL 104 -5.589 -6.831 10.074 746 HG21 VAL 104 2HG3 VAL 104 -4.772 -3.951 7.810 747 HG22 VAL 104 2HG1 VAL 104 -6.406 -4.423 8.335 748 HG23 VAL 104 2HG2 VAL 104 -5.068 -4.391 9.509 749 H HIS 105 H HIS 105 -2.965 -8.130 10.039 750 HA HIS 105 HA HIS 105 -2.196 -10.135 7.981 751 HB2 HIS 105 1HB HIS 105 -1.949 -10.227 11.020 752 HB3 HIS 105 2HB HIS 105 -1.295 -11.410 9.896 753 HD2 HIS 105 2HD HIS 105 -0.426 -8.273 8.170 754 HE1 HIS 105 1HE HIS 105 2.684 -8.772 11.040 755 H GLU 106 H GLU 106 -4.637 -9.516 10.421 756 HA GLU 106 HA GLU 106 -6.177 -11.828 9.340 757 HB2 GLU 106 1HB GLU 106 -5.673 -11.303 12.300 758 HB3 GLU 106 2HB GLU 106 -6.839 -12.457 11.668 759 HG2 GLU 106 1HG GLU 106 -4.995 -13.711 10.596 760 HG3 GLU 106 2HG GLU 106 -3.840 -12.568 11.278 761 HA PRO 107 HA PRO 107 -9.661 -9.162 9.278 762 HB2 PRO 107 1HB PRO 107 -11.002 -11.512 10.698 763 HB3 PRO 107 2HB PRO 107 -11.575 -10.614 9.287 764 HG2 PRO 107 1HG PRO 107 -10.533 -13.026 8.896 765 HG3 PRO 107 2HG PRO 107 -10.077 -11.719 7.799 766 HD2 PRO 107 1HD PRO 107 -8.529 -12.889 10.138 767 HD3 PRO 107 2HD PRO 107 -7.925 -12.361 8.516 768 H GLN 108 H GLN 108 -9.711 -7.521 10.526 769 HA GLN 108 HA GLN 108 -10.144 -8.001 13.455 770 HB2 GLN 108 1HB GLN 108 -8.479 -5.872 12.056 771 HB3 GLN 108 2HB GLN 108 -8.982 -5.739 13.734 772 HG2 GLN 108 1HG GLN 108 -7.291 -7.970 12.586 773 HG3 GLN 108 2HG GLN 108 -6.696 -6.568 13.520 774 HE21 GLN 108 2HE2 GLN 108 -6.794 -9.627 13.928 775 HE22 GLN 108 2HE1 GLN 108 -7.405 -9.797 15.540 776 HA PRO 109 HA PRO 109 -13.951 -5.835 12.322 777 HB2 PRO 109 1HB PRO 109 -14.392 -6.663 15.210 778 HB3 PRO 109 2HB PRO 109 -15.485 -6.858 13.834 779 HG2 PRO 109 1HG PRO 109 -14.223 -9.011 14.764 780 HG3 PRO 109 2HG PRO 109 -14.345 -8.780 13.018 781 HD2 PRO 109 1HD PRO 109 -11.999 -8.181 14.870 782 HD3 PRO 109 2HD PRO 109 -11.993 -8.992 13.252 783 H HIS 110 H HIS 110 -11.631 -5.507 14.895 784 HA HIS 110 HA HIS 110 -12.829 -2.996 15.860 785 HB2 HIS 110 1HB HIS 110 -10.187 -4.366 16.526 786 HB3 HIS 110 2HB HIS 110 -10.803 -2.927 17.325 787 HD2 HIS 110 2HD HIS 110 -10.959 -6.698 17.717 788 HE1 HIS 110 1HE HIS 110 -14.180 -5.121 20.019 789 H LEU 111 H LEU 111 -10.946 -3.855 13.235 790 HA LEU 111 HA LEU 111 -9.985 -1.021 13.010 791 HB2 LEU 111 1HB LEU 111 -8.962 -3.529 11.614 792 HB3 LEU 111 2HB LEU 111 -8.352 -1.890 11.361 793 HG LEU 111 HG LEU 111 -8.163 -3.453 13.962 794 HD11 LEU 111 1HD1 LEU 111 -5.775 -3.598 13.410 795 HD12 LEU 111 1HD2 LEU 111 -6.783 -4.408 12.188 796 HD13 LEU 111 1HD3 LEU 111 -6.088 -2.805 11.849 797 HD21 LEU 111 2HD3 LEU 111 -8.310 -1.004 14.271 798 HD22 LEU 111 2HD1 LEU 111 -6.672 -1.600 14.636 799 HD23 LEU 111 2HD2 LEU 111 -6.997 -0.777 13.091 800 H ASP 112 H ASP 112 -11.987 -3.509 11.685 801 HA ASP 112 HA ASP 112 -12.272 -2.589 9.014 802 HB2 ASP 112 1HB ASP 112 -13.228 -4.726 9.948 803 HB3 ASP 112 2HB ASP 112 -14.431 -3.776 10.809 804 H GLY 113 H GLY 113 -12.620 -0.611 8.382 805 HA2 GLY 113 1HA GLY 113 -14.092 1.140 7.851 806 HA3 GLY 113 2HA GLY 113 -15.182 0.607 9.153 807 H VAL 114 H VAL 114 -12.039 0.724 10.307 808 HA VAL 114 HA VAL 114 -12.643 3.248 11.794 809 HB VAL 114 HB VAL 114 -10.481 1.118 12.165 810 HG11 VAL 114 1HG1 VAL 114 -10.048 2.213 14.310 811 HG12 VAL 114 1HG2 VAL 114 -9.743 3.299 12.934 812 HG13 VAL 114 1HG3 VAL 114 -11.227 3.481 13.900 813 HG21 VAL 114 2HG3 VAL 114 -12.754 0.285 12.659 814 HG22 VAL 114 2HG1 VAL 114 -11.804 0.466 14.152 815 HG23 VAL 114 2HG2 VAL 114 -13.035 1.679 13.728 816 H HIS 115 H HIS 115 -10.057 1.827 9.811 817 HA HIS 115 HA HIS 115 -8.967 4.603 9.513 818 HB2 HIS 115 1HB HIS 115 -7.599 1.921 9.029 819 HB3 HIS 115 2HB HIS 115 -6.859 3.501 8.823 820 HD2 HIS 115 2HD HIS 115 -7.845 1.048 11.703 821 HE1 HIS 115 1HE HIS 115 -5.693 4.321 13.380 822 H THR 116 H THR 116 -7.466 4.361 7.301 823 HA THR 116 HA THR 116 -9.596 4.060 5.212 824 HB THR 116 HB THR 116 -7.104 5.822 5.251 825 HG1 THR 116 1HG THR 116 -8.839 6.583 6.555 826 HG21 THR 116 2HG3 THR 116 -9.323 5.554 3.187 827 HG22 THR 116 2HG1 THR 116 -7.995 6.737 3.145 828 HG23 THR 116 2HG2 THR 116 -7.645 4.999 2.985 829 H VAL 117 H VAL 117 -9.471 2.214 4.205 830 HA VAL 117 HA VAL 117 -6.836 0.989 3.568 831 HB VAL 117 HB VAL 117 -9.688 0.191 2.809 832 HG11 VAL 117 1HG1 VAL 117 -8.705 -1.975 2.237 833 HG12 VAL 117 1HG2 VAL 117 -8.040 -0.659 1.242 834 HG13 VAL 117 1HG3 VAL 117 -7.084 -1.330 2.584 835 HG21 VAL 117 2HG3 VAL 117 -9.301 0.108 5.247 836 HG22 VAL 117 2HG1 VAL 117 -9.431 -1.530 4.567 837 HG23 VAL 117 2HG2 VAL 117 -7.834 -0.864 4.984 838 H PHE 118 H PHE 118 -5.746 1.092 1.788 839 HA PHE 118 HA PHE 118 -6.980 2.578 -0.500 840 HB2 PHE 118 1HB PHE 118 -5.053 4.024 -0.663 841 HB3 PHE 118 2HB PHE 118 -5.673 4.149 0.976 842 HD1 PHE 118 2HD PHE 118 -4.473 3.082 2.852 843 HD2 PHE 118 1HD PHE 118 -2.888 3.111 -1.115 844 HE1 PHE 118 2HE PHE 118 -2.236 2.517 3.743 845 HE2 PHE 118 1HE PHE 118 -0.651 2.544 -0.228 846 HZ PHE 118 HZ PHE 118 -0.326 2.248 2.202 847 H GLY 119 H GLY 119 -5.071 0.016 0.661 848 HA2 GLY 119 1HA GLY 119 -4.602 -0.877 -2.108 849 HA3 GLY 119 2HA GLY 119 -3.148 -0.607 -1.120 850 H GLN 120 H GLN 120 -3.201 -3.044 -1.898 851 HA GLN 120 HA GLN 120 -3.750 -4.602 0.514 852 HB2 GLN 120 1HB GLN 120 -5.984 -4.641 -0.592 853 HB3 GLN 120 2HB GLN 120 -5.243 -5.258 -2.062 854 HG2 GLN 120 1HG GLN 120 -4.604 -7.308 -0.950 855 HG3 GLN 120 2HG GLN 120 -5.208 -6.677 0.609 856 HE21 GLN 120 2HE2 GLN 120 -6.255 -8.984 0.077 857 HE22 GLN 120 2HE1 GLN 120 -7.857 -8.878 -0.574 858 H VAL 121 H VAL 121 -2.246 -6.042 0.797 859 HA VAL 121 HA VAL 121 -0.106 -6.373 -1.133 860 HB VAL 121 HB VAL 121 -0.858 -8.033 1.323 861 HG11 VAL 121 1HG1 VAL 121 1.466 -8.795 1.275 862 HG12 VAL 121 1HG2 VAL 121 0.580 -9.267 -0.193 863 HG13 VAL 121 1HG3 VAL 121 1.727 -7.906 -0.243 864 HG21 VAL 121 2HG3 VAL 121 -0.427 -5.658 1.852 865 HG22 VAL 121 2HG1 VAL 121 0.886 -6.694 2.460 866 HG23 VAL 121 2HG2 VAL 121 1.119 -5.740 0.974 867 H THR 122 H THR 122 0.289 -7.713 -2.678 868 HA THR 122 HA THR 122 -1.737 -9.880 -3.143 869 HB THR 122 HB THR 122 -1.303 -9.601 -5.551 870 HG1 THR 122 1HG THR 122 0.018 -7.811 -6.206 871 HG21 THR 122 2HG3 THR 122 -1.920 -6.955 -4.183 872 HG22 THR 122 2HG1 THR 122 -2.316 -7.378 -5.866 873 HG23 THR 122 2HG2 THR 122 -3.094 -8.247 -4.522 874 H SER 123 H SER 123 1.609 -9.070 -2.801 875 HA SER 123 HA SER 123 2.320 -11.975 -2.822 876 HB2 SER 123 1HB SER 123 2.473 -11.477 -5.118 877 HB3 SER 123 2HB SER 123 3.517 -10.104 -4.791 878 HG SER 123 HG SER 123 4.659 -11.972 -5.302 879 H GLY 124 H GLY 124 4.014 -12.387 -1.497 880 HA2 GLY 124 1HA GLY 124 5.951 -11.887 -0.220 881 HA3 GLY 124 2HA GLY 124 5.695 -10.153 -0.524 882 H MET 125 H MET 125 2.823 -11.751 0.314 883 HA MET 125 HA MET 125 2.448 -10.401 2.795 884 HB2 MET 125 1HB MET 125 0.662 -11.461 1.349 885 HB3 MET 125 2HB MET 125 1.189 -13.030 1.938 886 HG2 MET 125 1HG MET 125 -0.705 -12.408 3.220 887 HG3 MET 125 2HG MET 125 0.696 -12.227 4.278 888 HE1 MET 125 3HE MET 125 -0.084 -10.613 6.043 889 HE2 MET 125 1HE MET 125 -1.205 -9.264 5.734 890 HE3 MET 125 2HE MET 125 -1.720 -10.939 5.418 891 H ASP 126 H ASP 126 3.969 -13.487 2.055 892 HA ASP 126 HA ASP 126 4.308 -14.451 4.710 893 HB2 ASP 126 1HB ASP 126 6.104 -14.618 2.257 894 HB3 ASP 126 2HB ASP 126 6.458 -15.452 3.764 895 H VAL 127 H VAL 127 6.384 -12.228 2.836 896 HA VAL 127 HA VAL 127 8.247 -11.699 4.976 897 HB VAL 127 HB VAL 127 7.330 -9.963 2.633 898 HG11 VAL 127 1HG1 VAL 127 9.391 -8.697 2.993 899 HG12 VAL 127 1HG2 VAL 127 8.299 -8.602 4.394 900 HG13 VAL 127 1HG3 VAL 127 9.729 -9.661 4.450 901 HG21 VAL 127 2HG3 VAL 127 8.359 -12.104 1.952 902 HG22 VAL 127 2HG1 VAL 127 9.432 -10.735 1.580 903 HG23 VAL 127 2HG2 VAL 127 9.761 -11.764 2.994 904 H VAL 128 H VAL 128 5.159 -10.194 4.122 905 HA VAL 128 HA VAL 128 5.244 -8.108 6.103 906 HB VAL 128 HB VAL 128 2.895 -9.692 4.954 907 HG11 VAL 128 1HG1 VAL 128 1.492 -7.840 5.722 908 HG12 VAL 128 1HG2 VAL 128 2.293 -8.675 7.075 909 HG13 VAL 128 1HG3 VAL 128 2.904 -7.100 6.513 910 HG21 VAL 128 2HG3 VAL 128 4.201 -8.455 3.262 911 HG22 VAL 128 2HG1 VAL 128 2.606 -7.706 3.508 912 HG23 VAL 128 2HG2 VAL 128 4.056 -6.970 4.233 913 H ARG 129 H ARG 129 4.009 -11.442 6.321 914 HA ARG 129 HA ARG 129 3.099 -10.991 9.062 915 HB2 ARG 129 1HB ARG 129 3.384 -13.508 7.376 916 HB3 ARG 129 2HB ARG 129 2.701 -13.482 8.995 917 HG2 ARG 129 1HG ARG 129 0.916 -11.956 8.196 918 HG3 ARG 129 2HG ARG 129 1.590 -12.080 6.552 919 HD2 ARG 129 1HD ARG 129 0.659 -14.414 8.203 920 HD3 ARG 129 2HD ARG 129 -0.318 -13.577 6.976 921 HE ARG 129 HE ARG 129 2.127 -14.328 5.795 922 HH11 ARG 129 1HH1 ARG 129 -0.766 -15.814 7.125 923 HH12 ARG 129 1HH2 ARG 129 -0.667 -17.224 6.094 924 HH21 ARG 129 2HH1 ARG 129 2.245 -16.163 4.463 925 HH22 ARG 129 2HH2 ARG 129 1.037 -17.422 4.587 926 H THR 130 H THR 130 6.036 -12.065 7.560 927 HA THR 130 HA THR 130 7.100 -12.914 10.219 928 HB THR 130 HB THR 130 9.064 -13.710 8.943 929 HG1 THR 130 1HG THR 130 8.937 -13.610 6.630 930 HG21 THR 130 2HG3 THR 130 6.425 -14.627 7.741 931 HG22 THR 130 2HG1 THR 130 7.961 -15.523 7.694 932 HG23 THR 130 2HG2 THR 130 7.145 -15.234 9.250 933 H MET 131 H MET 131 6.538 -10.091 8.923 934 HA MET 131 HA MET 131 9.095 -8.762 8.933 935 HB2 MET 131 1HB MET 131 6.941 -7.861 7.965 936 HB3 MET 131 2HB MET 131 6.371 -7.594 9.606 937 HG2 MET 131 1HG MET 131 8.248 -6.045 10.010 938 HG3 MET 131 2HG MET 131 8.821 -6.314 8.362 939 HE1 MET 131 3HE MET 131 6.323 -6.383 6.548 940 HE2 MET 131 1HE MET 131 6.104 -4.659 6.158 941 HE3 MET 131 2HE MET 131 7.741 -5.356 6.222 942 H LYS 132 H LYS 132 10.181 -7.616 10.443 943 HA LYS 132 HA LYS 132 9.436 -8.259 13.275 944 HB2 LYS 132 1HB LYS 132 12.135 -7.592 12.032 945 HB3 LYS 132 2HB LYS 132 11.853 -7.814 13.754 946 HG2 LYS 132 1HG LYS 132 11.176 -10.148 13.353 947 HG3 LYS 132 2HG LYS 132 11.442 -9.927 11.618 948 HD2 LYS 132 1HD LYS 132 13.824 -9.403 12.050 949 HD3 LYS 132 2HD LYS 132 13.556 -9.633 13.785 950 HE2 LYS 132 1HE LYS 132 12.893 -11.982 13.369 951 HE3 LYS 132 2HE LYS 132 13.169 -11.754 11.641 952 HZ1 LYS 132 3HZ LYS 132 15.216 -11.507 13.742 953 HZ2 LYS 132 1HZ LYS 132 15.042 -12.777 12.704 954 HZ3 LYS 132 2HZ LYS 132 15.474 -11.293 12.127 955 H ASN 133 H ASN 133 9.581 -6.726 14.880 956 HA ASN 133 HA ASN 133 8.795 -4.050 14.049 957 HB2 ASN 133 1HB ASN 133 7.956 -5.186 16.104 958 HB3 ASN 133 2HB ASN 133 9.567 -5.065 16.798 959 HD21 ASN 133 2HD2 ASN 133 7.101 -3.927 17.773 960 HD22 ASN 133 2HD1 ASN 133 7.332 -2.210 17.831 961 H GLY 134 H GLY 134 10.092 -2.623 13.233 962 HA2 GLY 134 1HA GLY 134 11.843 -0.982 13.887 963 HA3 GLY 134 2HA GLY 134 12.815 -2.360 14.453 964 H ASP 135 H ASP 135 11.311 -3.531 11.814 965 HA ASP 135 HA ASP 135 13.567 -3.461 10.068 966 HB2 ASP 135 1HB ASP 135 10.609 -3.981 9.601 967 HB3 ASP 135 2HB ASP 135 11.785 -4.052 8.295 968 H VAL 136 H VAL 136 13.888 -2.442 8.068 969 HA VAL 136 HA VAL 136 12.649 0.305 7.926 970 HB VAL 136 HB VAL 136 15.511 -0.540 7.263 971 HG11 VAL 136 1HG1 VAL 136 15.907 1.851 6.924 972 HG12 VAL 136 1HG2 VAL 136 14.686 1.212 5.798 973 HG13 VAL 136 1HG3 VAL 136 14.181 2.177 7.207 974 HG21 VAL 136 2HG3 VAL 136 15.098 -0.477 9.698 975 HG22 VAL 136 2HG1 VAL 136 16.140 0.873 9.193 976 HG23 VAL 136 2HG2 VAL 136 14.419 1.161 9.542 977 H MET 137 H MET 137 11.683 0.858 6.183 978 HA MET 137 HA MET 137 11.775 -0.931 3.838 979 HB2 MET 137 1HB MET 137 10.272 1.663 4.344 980 HB3 MET 137 2HB MET 137 10.080 0.642 2.928 981 HG2 MET 137 1HG MET 137 9.358 -1.221 4.468 982 HG3 MET 137 2HG MET 137 9.374 -0.049 5.789 983 HE1 MET 137 3HE MET 137 8.278 2.602 4.694 984 HE2 MET 137 1HE MET 137 6.522 2.400 4.908 985 HE3 MET 137 2HE MET 137 7.645 1.816 6.161 986 H LYS 138 H LYS 138 13.614 -0.851 2.748 987 HA LYS 138 HA LYS 138 15.389 1.311 2.543 988 HB2 LYS 138 1HB LYS 138 15.876 -1.020 1.798 989 HB3 LYS 138 2HB LYS 138 14.809 -0.792 0.419 990 HG2 LYS 138 1HG LYS 138 16.264 0.897 -0.515 991 HG3 LYS 138 2HG LYS 138 17.275 0.892 0.936 992 HD2 LYS 138 1HD LYS 138 17.881 -1.467 0.509 993 HD3 LYS 138 2HD LYS 138 16.864 -1.467 -0.939 994 HE2 LYS 138 1HE LYS 138 18.261 0.298 -1.939 995 HE3 LYS 138 2HE LYS 138 19.260 0.349 -0.485 996 HZ1 LYS 138 3HZ LYS 138 18.950 -1.978 -2.262 997 HZ2 LYS 138 1HZ LYS 138 20.261 -0.978 -2.196 998 HZ3 LYS 138 2HZ LYS 138 19.884 -1.930 -0.902 999 H GLU 139 H GLU 139 12.685 0.521 0.360 1000 HA GLU 139 HA GLU 139 12.191 3.314 -0.196 1001 HB2 GLU 139 1HB GLU 139 14.257 2.955 -1.588 1002 HB3 GLU 139 2HB GLU 139 13.419 1.677 -2.455 1003 HG2 GLU 139 1HG GLU 139 11.782 3.266 -3.299 1004 HG3 GLU 139 2HG GLU 139 12.512 4.560 -2.351 1005 H VAL 140 H VAL 140 10.158 3.577 -0.683 1006 HA VAL 140 HA VAL 140 8.603 1.216 -1.706 1007 HB VAL 140 HB VAL 140 7.648 3.891 -0.576 1008 HG11 VAL 140 1HG1 VAL 140 5.463 2.798 -0.452 1009 HG12 VAL 140 1HG2 VAL 140 6.071 2.884 -2.123 1010 HG13 VAL 140 1HG3 VAL 140 6.145 1.347 -1.226 1011 HG21 VAL 140 2HG3 VAL 140 8.803 2.540 1.140 1012 HG22 VAL 140 2HG1 VAL 140 7.051 2.590 1.442 1013 HG23 VAL 140 2HG2 VAL 140 7.788 1.138 0.724 1014 H LYS 141 H LYS 141 7.871 1.055 -3.638 1015 HA LYS 141 HA LYS 141 7.975 3.504 -5.371 1016 HB2 LYS 141 1HB LYS 141 8.792 0.654 -6.062 1017 HB3 LYS 141 2HB LYS 141 8.609 1.948 -7.239 1018 HG2 LYS 141 1HG LYS 141 10.391 3.233 -6.073 1019 HG3 LYS 141 2HG LYS 141 10.601 1.878 -4.954 1020 HD2 LYS 141 1HD LYS 141 11.169 0.394 -6.846 1021 HD3 LYS 141 2HD LYS 141 10.941 1.738 -7.973 1022 HE2 LYS 141 1HE LYS 141 12.754 2.989 -6.822 1023 HE3 LYS 141 2HE LYS 141 12.998 1.619 -5.736 1024 HZ1 LYS 141 3HZ LYS 141 13.330 1.560 -8.661 1025 HZ2 LYS 141 1HZ LYS 141 14.548 1.594 -7.550 1026 HZ3 LYS 141 2HZ LYS 141 13.557 0.280 -7.648 1027 H VAL 142 H VAL 142 6.352 3.887 -6.728 1028 HA VAL 142 HA VAL 142 4.191 1.810 -6.978 1029 HB VAL 142 HB VAL 142 3.799 4.797 -6.458 1030 HG11 VAL 142 1HG1 VAL 142 1.415 4.252 -6.389 1031 HG12 VAL 142 1HG2 VAL 142 2.136 3.884 -7.972 1032 HG13 VAL 142 1HG3 VAL 142 1.788 2.568 -6.826 1033 HG21 VAL 142 2HG3 VAL 142 4.488 3.578 -4.422 1034 HG22 VAL 142 2HG1 VAL 142 2.780 4.066 -4.325 1035 HG23 VAL 142 2HG2 VAL 142 3.202 2.379 -4.703 1036 H PHE 143 H PHE 143 3.378 1.489 -8.879 1037 HA PHE 143 HA PHE 143 4.009 3.472 -11.031 1038 HB2 PHE 143 1HB PHE 143 4.363 0.449 -11.218 1039 HB3 PHE 143 2HB PHE 143 4.548 1.583 -12.547 1040 HD1 PHE 143 2HD PHE 143 6.451 3.150 -12.599 1041 HD2 PHE 143 1HD PHE 143 6.072 0.168 -9.564 1042 HE1 PHE 143 2HE PHE 143 8.838 3.433 -12.028 1043 HE2 PHE 143 1HE PHE 143 8.460 0.451 -8.987 1044 HZ PHE 143 HZ PHE 143 9.842 2.084 -10.219 1045 H ASP 144 H ASP 144 2.619 3.559 -12.757 1046 HA ASP 144 HA ASP 144 -0.136 2.821 -12.100 1047 HB2 ASP 144 1HB ASP 144 0.534 4.957 -13.288 1048 HB3 ASP 144 2HB ASP 144 0.987 3.986 -14.682 1049 H GLU 145 H GLU 145 0.292 0.509 -11.936 1050 HA GLU 145 HA GLU 145 0.008 -0.764 -14.636 1051 HB2 GLU 145 1HB GLU 145 1.658 -1.681 -12.251 1052 HB3 GLU 145 2HB GLU 145 1.173 -2.772 -13.542 1053 HG2 GLU 145 1HG GLU 145 2.418 -1.503 -15.172 1054 HG3 GLU 145 2HG GLU 145 2.777 -0.249 -13.988 1055 HA PRO 146 HA PRO 146 -3.864 -1.852 -12.550 1056 HB2 PRO 146 1HB PRO 146 -4.118 -2.964 -15.378 1057 HB3 PRO 146 2HB PRO 146 -5.320 -2.067 -14.439 1058 HG2 PRO 146 1HG PRO 146 -4.043 -0.793 -16.394 1059 HG3 PRO 146 2HG PRO 146 -4.283 0.036 -14.853 1060 HD2 PRO 146 1HD PRO 146 -1.794 -1.354 -15.917 1061 HD3 PRO 146 2HD PRO 146 -1.933 0.211 -15.019 Start of MODEL 18 1 H MET 1 1H MET 1 -6.041 -0.354 -17.132 2 HA MET 1 HA MET 1 -3.629 -0.078 -15.809 3 HB2 MET 1 1HB MET 1 -5.895 1.811 -16.526 4 HB3 MET 1 2HB MET 1 -4.370 2.346 -15.836 5 HG2 MET 1 1HG MET 1 -3.154 1.492 -17.773 6 HG3 MET 1 2HG MET 1 -4.647 0.843 -18.455 7 HE1 MET 1 3HE MET 1 -6.876 2.761 -18.421 8 HE2 MET 1 1HE MET 1 -6.546 3.849 -19.791 9 HE3 MET 1 2HE MET 1 -6.220 2.104 -19.940 10 H ALA 2 H ALA 2 -3.247 -0.529 -13.788 11 HA ALA 2 HA ALA 2 -4.984 0.760 -11.759 12 HB1 ALA 2 3HB ALA 2 -4.158 -2.164 -11.672 13 HB2 ALA 2 1HB ALA 2 -4.980 -1.277 -10.366 14 HB3 ALA 2 2HB ALA 2 -5.810 -1.548 -11.917 15 H LYS 3 H LYS 3 -3.967 1.491 -9.978 16 HA LYS 3 HA LYS 3 -1.054 1.722 -10.160 17 HB2 LYS 3 1HB LYS 3 -3.058 2.669 -8.075 18 HB3 LYS 3 2HB LYS 3 -1.336 3.024 -8.025 19 HG2 LYS 3 1HG LYS 3 -1.510 4.239 -10.157 20 HG3 LYS 3 2HG LYS 3 -3.238 3.868 -10.229 21 HD2 LYS 3 1HD LYS 3 -3.509 5.043 -8.011 22 HD3 LYS 3 2HD LYS 3 -1.812 5.535 -8.127 23 HE2 LYS 3 1HE LYS 3 -3.954 6.187 -10.185 24 HE3 LYS 3 2HE LYS 3 -3.396 7.289 -8.923 25 HZ1 LYS 3 3HZ LYS 3 -1.720 6.155 -11.060 26 HZ2 LYS 3 1HZ LYS 3 -2.297 7.699 -11.000 27 HZ3 LYS 3 2HZ LYS 3 -1.199 7.183 -9.881 28 H LYS 4 H LYS 4 0.493 1.007 -8.759 29 HA LYS 4 HA LYS 4 -0.213 -0.650 -6.454 30 HB2 LYS 4 1HB LYS 4 0.861 -2.697 -7.227 31 HB3 LYS 4 2HB LYS 4 -0.479 -2.296 -8.292 32 HG2 LYS 4 1HG LYS 4 1.367 -1.146 -9.757 33 HG3 LYS 4 2HG LYS 4 2.471 -2.171 -8.831 34 HD2 LYS 4 1HD LYS 4 0.051 -3.164 -10.383 35 HD3 LYS 4 2HD LYS 4 1.727 -3.241 -10.946 36 HE2 LYS 4 1HE LYS 4 2.329 -4.698 -9.077 37 HE3 LYS 4 2HE LYS 4 0.705 -4.552 -8.400 38 HZ1 LYS 4 3HZ LYS 4 1.368 -5.763 -11.000 39 HZ2 LYS 4 1HZ LYS 4 0.972 -6.581 -9.625 40 HZ3 LYS 4 2HZ LYS 4 -0.148 -5.625 -10.369 41 H GLY 5 H GLY 5 1.583 -1.267 -5.174 42 HA2 GLY 5 1HA GLY 5 3.959 0.472 -5.706 43 HA3 GLY 5 2HA GLY 5 3.109 0.502 -4.143 44 H TYR 6 H TYR 6 5.907 -0.345 -5.144 45 HA TYR 6 HA TYR 6 5.927 -2.995 -3.733 46 HB2 TYR 6 1HB TYR 6 7.889 -1.826 -5.742 47 HB3 TYR 6 2HB TYR 6 8.150 -3.315 -4.845 48 HD1 TYR 6 1HD TYR 6 4.940 -3.835 -5.090 49 HD2 TYR 6 2HD TYR 6 8.208 -3.198 -7.796 50 HE1 TYR 6 1HE TYR 6 3.737 -5.099 -6.840 51 HE2 TYR 6 2HE TYR 6 7.004 -4.462 -9.546 52 HH TYR 6 HH TYR 6 5.169 -5.586 -10.071 53 H ILE 7 H ILE 7 6.961 -3.231 -1.894 54 HA ILE 7 HA ILE 7 8.899 -1.074 -1.084 55 HB ILE 7 HB ILE 7 7.087 -2.845 0.632 56 HG12 ILE 7 1HG1 ILE 7 7.196 0.171 0.425 57 HG13 ILE 7 1HG2 ILE 7 6.052 -0.835 -0.450 58 HG21 ILE 7 2HG1 ILE 7 8.110 -1.704 2.558 59 HG22 ILE 7 2HG2 ILE 7 9.326 -2.620 1.638 60 HG23 ILE 7 2HG3 ILE 7 9.227 -0.852 1.466 61 HD11 ILE 7 1HD3 ILE 7 6.310 -0.663 2.560 62 HD12 ILE 7 1HD1 ILE 7 5.047 0.091 1.561 63 HD13 ILE 7 1HD2 ILE 7 5.152 -1.682 1.673 64 H LEU 8 H LEU 8 10.798 -1.759 -1.697 65 HA LEU 8 HA LEU 8 11.667 -4.486 -0.952 66 HB2 LEU 8 1HB LEU 8 12.489 -3.469 -3.050 67 HB3 LEU 8 2HB LEU 8 13.161 -2.112 -2.140 68 HG LEU 8 HG LEU 8 14.687 -3.767 -0.978 69 HD11 LEU 8 1HD1 LEU 8 14.985 -5.953 -2.055 70 HD12 LEU 8 1HD2 LEU 8 13.350 -5.771 -1.375 71 HD13 LEU 8 1HD3 LEU 8 13.608 -5.611 -3.129 72 HD21 LEU 8 2HD3 LEU 8 15.417 -2.339 -2.860 73 HD22 LEU 8 2HD1 LEU 8 16.200 -3.936 -2.925 74 HD23 LEU 8 2HD2 LEU 8 14.841 -3.566 -4.014 75 H MET 9 H MET 9 12.468 -5.055 0.895 76 HA MET 9 HA MET 9 13.101 -2.936 2.881 77 HB2 MET 9 1HB MET 9 12.855 -5.951 3.179 78 HB3 MET 9 2HB MET 9 13.113 -4.812 4.492 79 HG2 MET 9 1HG MET 9 10.668 -4.916 2.701 80 HG3 MET 9 2HG MET 9 10.778 -5.537 4.351 81 HE1 MET 9 3HE MET 9 12.462 -3.379 5.889 82 HE2 MET 9 1HE MET 9 11.178 -2.297 6.483 83 HE3 MET 9 2HE MET 9 10.937 -4.062 6.504 84 H GLU 10 H GLU 10 14.971 -2.922 4.139 85 HA GLU 10 HA GLU 10 17.380 -3.306 2.594 86 HB2 GLU 10 1HB GLU 10 16.886 -2.681 5.531 87 HB3 GLU 10 2HB GLU 10 18.495 -2.779 4.832 88 HG2 GLU 10 1HG GLU 10 17.960 -0.948 3.296 89 HG3 GLU 10 2HG GLU 10 16.325 -0.865 3.946 90 H ASN 11 H ASN 11 15.551 -5.397 4.618 91 HA ASN 11 HA ASN 11 17.881 -7.203 5.050 92 HB2 ASN 11 1HB ASN 11 15.046 -7.175 6.105 93 HB3 ASN 11 2HB ASN 11 16.137 -8.534 6.338 94 HD21 ASN 11 2HD2 ASN 11 14.948 -6.838 8.340 95 HD22 ASN 11 2HD1 ASN 11 16.251 -6.094 9.205 96 H GLY 12 H GLY 12 16.077 -6.603 2.498 97 HA2 GLY 12 1HA GLY 12 16.304 -7.920 0.541 98 HA3 GLY 12 2HA GLY 12 16.558 -9.363 1.549 99 H GLY 13 H GLY 13 14.008 -7.678 2.848 100 HA2 GLY 13 1HA GLY 13 12.009 -9.532 1.880 101 HA3 GLY 13 2HA GLY 13 11.728 -8.102 2.900 102 H LYS 14 H LYS 14 10.040 -8.957 0.770 103 HA LYS 14 HA LYS 14 10.070 -6.484 -0.855 104 HB2 LYS 14 1HB LYS 14 11.412 -8.186 -2.148 105 HB3 LYS 14 2HB LYS 14 9.995 -9.228 -2.167 106 HG2 LYS 14 1HG LYS 14 8.742 -7.569 -3.448 107 HG3 LYS 14 2HG LYS 14 10.105 -6.444 -3.362 108 HD2 LYS 14 1HD LYS 14 11.517 -8.154 -4.546 109 HD3 LYS 14 2HD LYS 14 10.069 -9.153 -4.738 110 HE2 LYS 14 1HE LYS 14 8.978 -7.381 -6.029 111 HE3 LYS 14 2HE LYS 14 10.358 -6.310 -5.776 112 HZ1 LYS 14 3HZ LYS 14 10.425 -8.866 -7.236 113 HZ2 LYS 14 1HZ LYS 14 10.440 -7.363 -7.914 114 HZ3 LYS 14 2HZ LYS 14 11.716 -7.866 -6.998 115 H ILE 15 H ILE 15 8.214 -5.735 -0.094 116 HA ILE 15 HA ILE 15 5.827 -7.546 -0.129 117 HB ILE 15 HB ILE 15 6.221 -4.752 1.057 118 HG12 ILE 15 1HG1 ILE 15 5.943 -7.388 2.513 119 HG13 ILE 15 1HG2 ILE 15 7.484 -6.613 2.178 120 HG21 ILE 15 2HG1 ILE 15 4.034 -5.144 2.116 121 HG22 ILE 15 2HG2 ILE 15 3.900 -5.178 0.343 122 HG23 ILE 15 2HG3 ILE 15 3.896 -6.700 1.265 123 HD11 ILE 15 1HD3 ILE 15 5.227 -5.428 3.809 124 HD12 ILE 15 1HD1 ILE 15 6.733 -6.132 4.440 125 HD13 ILE 15 1HD2 ILE 15 6.787 -4.642 3.468 126 H GLU 16 H GLU 16 4.575 -7.625 -1.758 127 HA GLU 16 HA GLU 16 4.442 -5.214 -3.544 128 HB2 GLU 16 1HB GLU 16 4.005 -8.154 -4.224 129 HB3 GLU 16 2HB GLU 16 3.855 -6.811 -5.348 130 HG2 GLU 16 1HG GLU 16 6.254 -6.293 -5.024 131 HG3 GLU 16 2HG GLU 16 6.390 -7.678 -3.943 132 H PHE 17 H PHE 17 2.620 -4.191 -3.765 133 HA PHE 17 HA PHE 17 0.065 -5.561 -3.098 134 HB2 PHE 17 1HB PHE 17 -0.570 -3.689 -1.579 135 HB3 PHE 17 2HB PHE 17 0.760 -4.644 -0.945 136 HD1 PHE 17 2HD PHE 17 3.030 -3.738 -0.859 137 HD2 PHE 17 1HD PHE 17 -0.255 -1.399 -2.269 138 HE1 PHE 17 2HE PHE 17 4.385 -1.686 -0.604 139 HE2 PHE 17 1HE PHE 17 1.097 0.655 -2.018 140 HZ PHE 17 HZ PHE 17 3.417 0.511 -1.185 141 H GLU 18 H GLU 18 -1.779 -4.593 -3.883 142 HA GLU 18 HA GLU 18 -1.270 -2.581 -6.034 143 HB2 GLU 18 1HB GLU 18 -3.635 -4.429 -5.501 144 HB3 GLU 18 2HB GLU 18 -3.570 -3.245 -6.800 145 HG2 GLU 18 1HG GLU 18 -1.617 -4.415 -7.758 146 HG3 GLU 18 2HG GLU 18 -1.716 -5.613 -6.469 147 H LEU 19 H LEU 19 -2.900 -0.933 -6.411 148 HA LEU 19 HA LEU 19 -3.922 0.124 -3.795 149 HB2 LEU 19 1HB LEU 19 -2.756 1.672 -6.145 150 HB3 LEU 19 2HB LEU 19 -3.419 2.384 -4.672 151 HG LEU 19 HG LEU 19 -0.969 0.588 -4.755 152 HD11 LEU 19 1HD1 LEU 19 0.298 2.666 -4.439 153 HD12 LEU 19 1HD2 LEU 19 -0.590 2.665 -5.982 154 HD13 LEU 19 1HD3 LEU 19 -1.203 3.606 -4.602 155 HD21 LEU 19 2HD3 LEU 19 -2.203 0.592 -2.611 156 HD22 LEU 19 2HD1 LEU 19 -0.648 1.448 -2.459 157 HD23 LEU 19 2HD2 LEU 19 -2.164 2.371 -2.593 158 H PHE 20 H PHE 20 -5.731 1.516 -3.862 159 HA PHE 20 HA PHE 20 -7.486 1.000 -6.242 160 HB2 PHE 20 1HB PHE 20 -8.339 0.992 -3.316 161 HB3 PHE 20 2HB PHE 20 -9.373 0.700 -4.706 162 HD1 PHE 20 2HD PHE 20 -8.865 -1.337 -6.170 163 HD2 PHE 20 1HD PHE 20 -7.206 -0.764 -2.275 164 HE1 PHE 20 2HE PHE 20 -8.386 -3.758 -6.020 165 HE2 PHE 20 1HE PHE 20 -6.723 -3.184 -2.123 166 HZ PHE 20 HZ PHE 20 -7.312 -4.681 -3.996 167 HA PRO 21 HA PRO 21 -7.338 5.530 -5.393 168 HB2 PRO 21 1HB PRO 21 -7.074 6.216 -8.056 169 HB3 PRO 21 2HB PRO 21 -5.658 5.818 -7.074 170 HG2 PRO 21 1HG PRO 21 -7.230 4.029 -8.977 171 HG3 PRO 21 2HG PRO 21 -5.480 4.246 -8.875 172 HD2 PRO 21 1HD PRO 21 -6.661 2.126 -7.685 173 HD3 PRO 21 2HD PRO 21 -5.286 2.980 -6.879 174 H ASN 22 H ASN 22 -9.204 3.294 -7.199 175 HA ASN 22 HA ASN 22 -11.304 5.190 -7.931 176 HB2 ASN 22 1HB ASN 22 -11.194 2.169 -7.795 177 HB3 ASN 22 2HB ASN 22 -12.631 3.063 -8.273 178 HD21 ASN 22 2HD2 ASN 22 -11.244 1.212 -9.890 179 HD22 ASN 22 2HD1 ASN 22 -10.614 2.065 -11.259 180 H GLU 23 H GLU 23 -10.456 3.400 -5.083 181 HA GLU 23 HA GLU 23 -13.123 4.080 -3.887 182 HB2 GLU 23 1HB GLU 23 -11.094 2.009 -2.951 183 HB3 GLU 23 2HB GLU 23 -12.700 2.279 -2.287 184 HG2 GLU 23 1HG GLU 23 -12.144 1.341 -5.110 185 HG3 GLU 23 2HG GLU 23 -12.517 0.284 -3.750 186 H ALA 24 H ALA 24 -9.716 4.638 -3.748 187 HA ALA 24 HA ALA 24 -10.284 6.672 -1.667 188 HB1 ALA 24 3HB ALA 24 -7.965 4.712 -1.528 189 HB2 ALA 24 1HB ALA 24 -8.209 6.109 -0.453 190 HB3 ALA 24 2HB ALA 24 -9.366 4.756 -0.433 191 HA PRO 25 HA PRO 25 -8.057 8.135 -5.480 192 HB2 PRO 25 1HB PRO 25 -9.699 10.537 -4.536 193 HB3 PRO 25 2HB PRO 25 -9.389 10.009 -6.194 194 HG2 PRO 25 1HG PRO 25 -11.772 9.484 -5.141 195 HG3 PRO 25 2HG PRO 25 -10.960 8.220 -6.069 196 HD2 PRO 25 1HD PRO 25 -11.200 8.539 -3.059 197 HD3 PRO 25 2HD PRO 25 -11.262 7.032 -4.059 198 H VAL 26 H VAL 26 -8.713 10.052 -2.527 199 HA VAL 26 HA VAL 26 -6.360 11.719 -2.977 200 HB VAL 26 HB VAL 26 -8.101 11.271 -0.504 201 HG11 VAL 26 1HG1 VAL 26 -7.140 13.361 0.330 202 HG12 VAL 26 1HG2 VAL 26 -5.904 12.100 0.111 203 HG13 VAL 26 1HG3 VAL 26 -6.049 13.419 -1.075 204 HG21 VAL 26 2HG3 VAL 26 -9.331 12.206 -2.432 205 HG22 VAL 26 2HG1 VAL 26 -9.129 13.426 -1.154 206 HG23 VAL 26 2HG2 VAL 26 -8.099 13.478 -2.605 207 H THR 27 H THR 27 -7.052 9.073 -0.697 208 HA THR 27 HA THR 27 -4.529 9.182 0.626 209 HB THR 27 HB THR 27 -6.314 6.756 0.144 210 HG1 THR 27 1HG THR 27 -7.486 8.296 1.239 211 HG21 THR 27 2HG3 THR 27 -4.188 7.311 2.247 212 HG22 THR 27 2HG1 THR 27 -5.229 5.872 2.172 213 HG23 THR 27 2HG2 THR 27 -4.032 6.173 0.889 214 H VAL 28 H VAL 28 -5.561 7.202 -2.156 215 HA VAL 28 HA VAL 28 -2.988 5.889 -2.463 216 HB VAL 28 HB VAL 28 -5.290 6.378 -4.413 217 HG11 VAL 28 1HG1 VAL 28 -4.276 4.634 -5.798 218 HG12 VAL 28 1HG2 VAL 28 -3.214 6.051 -5.629 219 HG13 VAL 28 1HG3 VAL 28 -2.881 4.572 -4.697 220 HG21 VAL 28 2HG3 VAL 28 -5.871 4.973 -2.465 221 HG22 VAL 28 2HG1 VAL 28 -5.815 4.004 -3.957 222 HG23 VAL 28 2HG2 VAL 28 -4.468 3.930 -2.797 223 H ALA 29 H ALA 29 -4.416 8.762 -3.981 224 HA ALA 29 HA ALA 29 -2.322 9.228 -5.828 225 HB1 ALA 29 3HB ALA 29 -4.058 11.246 -4.362 226 HB2 ALA 29 1HB ALA 29 -3.098 11.570 -5.824 227 HB3 ALA 29 2HB ALA 29 -4.464 10.431 -5.889 228 H ASN 30 H ASN 30 -2.706 10.451 -2.494 229 HA ASN 30 HA ASN 30 -0.209 11.908 -2.516 230 HB2 ASN 30 1HB ASN 30 -2.102 10.981 -0.360 231 HB3 ASN 30 2HB ASN 30 -0.553 11.709 0.047 232 HD21 ASN 30 2HD2 ASN 30 -3.744 12.330 -0.467 233 HD22 ASN 30 2HD1 ASN 30 -3.657 14.019 -0.835 234 H PHE 31 H PHE 31 -1.115 8.659 -1.401 235 HA PHE 31 HA PHE 31 1.382 7.902 -0.291 236 HB2 PHE 31 1HB PHE 31 -0.718 6.538 -0.185 237 HB3 PHE 31 2HB PHE 31 -0.558 6.184 -1.898 238 HD1 PHE 31 1HD PHE 31 0.906 5.625 1.438 239 HD2 PHE 31 2HD PHE 31 1.007 4.563 -2.699 240 HE1 PHE 31 1HE PHE 31 2.324 3.672 1.975 241 HE2 PHE 31 2HE PHE 31 2.423 2.607 -2.166 242 HZ PHE 31 HZ PHE 31 3.083 2.164 0.173 243 H GLU 32 H GLU 32 0.256 7.590 -3.665 244 HA GLU 32 HA GLU 32 2.701 6.471 -4.661 245 HB2 GLU 32 1HB GLU 32 0.635 6.371 -5.966 246 HB3 GLU 32 2HB GLU 32 0.534 8.126 -6.022 247 HG2 GLU 32 1HG GLU 32 2.485 8.262 -7.428 248 HG3 GLU 32 2HG GLU 32 2.799 6.538 -7.244 249 H LYS 33 H LYS 33 1.563 9.852 -4.551 250 HA LYS 33 HA LYS 33 3.817 10.950 -5.921 251 HB2 LYS 33 1HB LYS 33 1.887 12.146 -3.899 252 HB3 LYS 33 2HB LYS 33 3.129 13.087 -4.713 253 HG2 LYS 33 1HG LYS 33 2.126 12.569 -6.894 254 HG3 LYS 33 2HG LYS 33 0.894 11.578 -6.099 255 HD2 LYS 33 1HD LYS 33 0.119 13.572 -4.838 256 HD3 LYS 33 2HD LYS 33 1.333 14.557 -5.668 257 HE2 LYS 33 1HE LYS 33 0.287 14.006 -7.844 258 HE3 LYS 33 2HE LYS 33 -0.930 13.032 -7.013 259 HZ1 LYS 33 3HZ LYS 33 -0.519 15.926 -6.652 260 HZ2 LYS 33 1HZ LYS 33 -1.740 15.221 -7.509 261 HZ3 LYS 33 2HZ LYS 33 -1.654 15.016 -5.874 262 H LEU 34 H LEU 34 3.250 10.352 -2.468 263 HA LEU 34 HA LEU 34 5.706 11.585 -1.591 264 HB2 LEU 34 1HB LEU 34 3.892 9.471 -0.370 265 HB3 LEU 34 2HB LEU 34 5.313 10.114 0.459 266 HG LEU 34 HG LEU 34 2.963 11.813 -0.448 267 HD11 LEU 34 1HD1 LEU 34 2.303 11.798 1.916 268 HD12 LEU 34 1HD2 LEU 34 2.255 10.166 1.211 269 HD13 LEU 34 1HD3 LEU 34 3.603 10.637 2.273 270 HD21 LEU 34 2HD3 LEU 34 5.118 13.001 -0.210 271 HD22 LEU 34 2HD1 LEU 34 3.984 13.466 1.082 272 HD23 LEU 34 2HD2 LEU 34 5.309 12.328 1.427 273 H ALA 35 H ALA 35 4.848 8.186 -2.259 274 HA ALA 35 HA ALA 35 7.369 7.111 -1.512 275 HB1 ALA 35 3HB ALA 35 5.378 6.091 -3.571 276 HB2 ALA 35 1HB ALA 35 6.701 5.146 -2.847 277 HB3 ALA 35 2HB ALA 35 5.363 5.729 -1.829 278 H ASN 36 H ASN 36 6.215 8.414 -4.598 279 HA ASN 36 HA ASN 36 8.664 7.595 -6.004 280 HB2 ASN 36 1HB ASN 36 6.259 9.251 -6.797 281 HB3 ASN 36 2HB ASN 36 7.638 8.991 -7.855 282 HD21 ASN 36 2HD2 ASN 36 5.024 8.199 -8.458 283 HD22 ASN 36 2HD1 ASN 36 4.979 6.469 -8.537 284 H GLU 37 H GLU 37 7.919 10.068 -3.878 285 HA GLU 37 HA GLU 37 10.134 11.751 -4.986 286 HB2 GLU 37 1HB GLU 37 8.038 12.271 -2.841 287 HB3 GLU 37 2HB GLU 37 9.401 13.340 -3.136 288 HG2 GLU 37 1HG GLU 37 8.622 13.747 -5.416 289 HG3 GLU 37 2HG GLU 37 7.284 12.625 -5.176 290 H GLY 38 H GLY 38 9.837 9.103 -3.136 291 HA2 GLY 38 1HA GLY 38 11.635 8.062 -2.049 292 HA3 GLY 38 2HA GLY 38 12.504 9.614 -2.022 293 H PHE 39 H PHE 39 9.267 9.813 -0.952 294 HA PHE 39 HA PHE 39 10.047 10.457 1.770 295 HB2 PHE 39 1HB PHE 39 8.079 11.493 0.676 296 HB3 PHE 39 2HB PHE 39 7.310 9.919 0.541 297 HD1 PHE 39 1HD PHE 39 8.339 12.576 2.868 298 HD2 PHE 39 2HD PHE 39 6.266 8.867 2.430 299 HE1 PHE 39 1HE PHE 39 7.320 12.885 5.099 300 HE2 PHE 39 2HE PHE 39 5.242 9.172 4.659 301 HZ PHE 39 HZ PHE 39 5.771 11.183 5.994 302 H TYR 40 H TYR 40 8.078 7.782 0.434 303 HA TYR 40 HA TYR 40 8.158 6.324 2.958 304 HB2 TYR 40 1HB TYR 40 7.210 5.689 0.155 305 HB3 TYR 40 2HB TYR 40 7.294 4.438 1.387 306 HD1 TYR 40 2HD TYR 40 5.921 4.631 3.461 307 HD2 TYR 40 1HD TYR 40 5.486 7.325 0.150 308 HE1 TYR 40 2HE TYR 40 3.708 5.324 4.316 309 HE2 TYR 40 1HE TYR 40 3.273 8.018 1.005 310 HH TYR 40 HH TYR 40 2.106 6.980 4.144 311 H ASN 41 H ASN 41 10.250 6.590 0.225 312 HA ASN 41 HA ASN 41 11.657 4.079 0.625 313 HB2 ASN 41 1HB ASN 41 11.713 5.409 -1.485 314 HB3 ASN 41 2HB ASN 41 12.639 6.648 -0.648 315 HD21 ASN 41 2HD2 ASN 41 13.475 5.179 -2.931 316 HD22 ASN 41 2HD1 ASN 41 14.878 4.268 -2.482 317 H GLY 42 H GLY 42 11.878 3.988 2.901 318 HA2 GLY 42 1HA GLY 42 14.160 3.769 3.973 319 HA3 GLY 42 2HA GLY 42 14.289 5.532 3.776 320 H LEU 43 H LEU 43 11.127 4.432 4.454 321 HA LEU 43 HA LEU 43 11.219 5.578 7.162 322 HB2 LEU 43 1HB LEU 43 8.982 4.232 5.589 323 HB3 LEU 43 2HB LEU 43 8.785 5.014 7.160 324 HG LEU 43 HG LEU 43 9.466 6.348 4.520 325 HD11 LEU 43 1HD1 LEU 43 7.326 7.488 4.904 326 HD12 LEU 43 1HD2 LEU 43 7.125 5.722 4.817 327 HD13 LEU 43 1HD3 LEU 43 7.092 6.546 6.395 328 HD21 LEU 43 2HD3 LEU 43 10.749 7.363 6.374 329 HD22 LEU 43 2HD1 LEU 43 9.457 8.452 5.816 330 HD23 LEU 43 2HD2 LEU 43 9.253 7.525 7.322 331 H THR 44 H THR 44 10.057 4.404 8.941 332 HA THR 44 HA THR 44 11.312 1.682 9.099 333 HB THR 44 HB THR 44 10.788 3.647 11.372 334 HG1 THR 44 1HG THR 44 13.095 3.883 11.295 335 HG21 THR 44 2HG3 THR 44 12.362 1.048 11.237 336 HG22 THR 44 2HG1 THR 44 12.224 2.111 12.656 337 HG23 THR 44 2HG2 THR 44 10.786 1.266 12.032 338 H PHE 45 H PHE 45 10.277 0.017 10.108 339 HA PHE 45 HA PHE 45 7.335 0.341 10.425 340 HB2 PHE 45 1HB PHE 45 9.203 -2.056 10.343 341 HB3 PHE 45 2HB PHE 45 7.526 -2.200 10.845 342 HD1 PHE 45 1HD PHE 45 9.714 -1.184 8.024 343 HD2 PHE 45 2HD PHE 45 5.787 -2.318 9.266 344 HE1 PHE 45 1HE PHE 45 9.027 -1.388 5.658 345 HE2 PHE 45 2HE PHE 45 5.097 -2.526 6.901 346 HZ PHE 45 HZ PHE 45 6.717 -2.059 5.096 347 H HIS 46 H HIS 46 6.652 1.107 12.267 348 HA HIS 46 HA HIS 46 8.321 1.114 14.627 349 HB2 HIS 46 1HB HIS 46 6.664 2.908 14.119 350 HB3 HIS 46 2HB HIS 46 5.355 1.752 14.318 351 HD2 HIS 46 2HD HIS 46 4.244 1.991 16.906 352 HE1 HIS 46 1HE HIS 46 7.829 3.242 18.812 353 H ARG 47 H ARG 47 5.532 -0.816 13.612 354 HA ARG 47 HA ARG 47 6.195 -2.746 15.783 355 HB2 ARG 47 1HB ARG 47 3.456 -1.536 15.257 356 HB3 ARG 47 2HB ARG 47 3.707 -3.000 16.194 357 HG2 ARG 47 1HG ARG 47 4.967 -0.346 16.912 358 HG3 ARG 47 2HG ARG 47 3.391 -0.900 17.526 359 HD2 ARG 47 1HD ARG 47 4.477 -2.888 18.446 360 HD3 ARG 47 2HD ARG 47 6.046 -2.268 17.884 361 HE ARG 47 HE ARG 47 4.435 -1.282 20.125 362 HH11 ARG 47 1HH1 ARG 47 7.194 -0.797 18.006 363 HH12 ARG 47 1HH2 ARG 47 7.996 0.312 19.096 364 HH21 ARG 47 2HH1 ARG 47 5.484 0.159 21.531 365 HH22 ARG 47 2HH2 ARG 47 7.028 0.854 21.091 366 H VAL 48 H VAL 48 7.083 -4.047 14.185 367 HA VAL 48 HA VAL 48 5.330 -5.162 12.083 368 HB VAL 48 HB VAL 48 8.025 -6.094 13.184 369 HG11 VAL 48 1HG1 VAL 48 8.186 -7.392 11.117 370 HG12 VAL 48 1HG2 VAL 48 6.796 -7.891 12.110 371 HG13 VAL 48 1HG3 VAL 48 6.542 -6.879 10.668 372 HG21 VAL 48 2HG3 VAL 48 8.140 -3.839 12.183 373 HG22 VAL 48 2HG1 VAL 48 8.961 -5.036 11.154 374 HG23 VAL 48 2HG2 VAL 48 7.340 -4.449 10.714 375 H ILE 49 H ILE 49 3.650 -6.278 12.588 376 HA ILE 49 HA ILE 49 3.998 -8.514 14.560 377 HB ILE 49 HB ILE 49 1.511 -6.754 14.333 378 HG12 ILE 49 1HG1 ILE 49 3.652 -6.664 16.470 379 HG13 ILE 49 1HG2 ILE 49 3.407 -5.451 15.224 380 HG21 ILE 49 2HG1 ILE 49 0.862 -7.906 16.410 381 HG22 ILE 49 2HG2 ILE 49 1.130 -9.068 15.091 382 HG23 ILE 49 2HG3 ILE 49 2.364 -8.858 16.356 383 HD11 ILE 49 1HD3 ILE 49 1.410 -6.211 17.367 384 HD12 ILE 49 1HD1 ILE 49 2.426 -4.752 17.335 385 HD13 ILE 49 1HD2 ILE 49 1.161 -4.983 16.103 386 HA PRO 50 HA PRO 50 2.343 -10.299 10.739 387 HB2 PRO 50 1HB PRO 50 3.812 -12.614 10.954 388 HB3 PRO 50 2HB PRO 50 4.535 -11.154 10.268 389 HG2 PRO 50 1HG PRO 50 4.738 -12.232 13.112 390 HG3 PRO 50 2HG PRO 50 6.041 -11.670 12.062 391 HD2 PRO 50 1HD PRO 50 4.978 -10.037 13.950 392 HD3 PRO 50 2HD PRO 50 5.488 -9.387 12.340 393 H GLY 51 H GLY 51 0.701 -11.619 10.546 394 HA2 GLY 51 1HA GLY 51 -0.763 -13.369 11.209 395 HA3 GLY 51 2HA GLY 51 0.021 -13.411 12.805 396 H PHE 52 H PHE 52 -0.259 -10.260 12.452 397 HA PHE 52 HA PHE 52 -3.171 -10.065 13.104 398 HB2 PHE 52 1HB PHE 52 -0.877 -8.841 14.696 399 HB3 PHE 52 2HB PHE 52 -2.573 -8.438 14.917 400 HD1 PHE 52 2HD PHE 52 -4.165 -10.193 15.731 401 HD2 PHE 52 1HD PHE 52 0.066 -10.783 15.664 402 HE1 PHE 52 2HE PHE 52 -4.401 -12.057 17.338 403 HE2 PHE 52 1HE PHE 52 -0.166 -12.649 17.269 404 HZ PHE 52 HZ PHE 52 -2.401 -13.285 18.106 405 H VAL 53 H VAL 53 -1.200 -7.346 13.717 406 HA VAL 53 HA VAL 53 -1.549 -6.256 10.951 407 HB VAL 53 HB VAL 53 -2.453 -4.828 13.498 408 HG11 VAL 53 1HG1 VAL 53 -3.262 -3.100 11.967 409 HG12 VAL 53 1HG2 VAL 53 -1.503 -3.330 11.842 410 HG13 VAL 53 1HG3 VAL 53 -2.579 -3.999 10.591 411 HG21 VAL 53 2HG3 VAL 53 -4.027 -6.620 12.853 412 HG22 VAL 53 2HG1 VAL 53 -4.730 -5.014 12.548 413 HG23 VAL 53 2HG2 VAL 53 -4.086 -5.976 11.195 414 H SER 54 H SER 54 0.263 -5.583 10.243 415 HA SER 54 HA SER 54 2.455 -4.782 12.120 416 HB2 SER 54 1HB SER 54 3.064 -6.302 10.486 417 HB3 SER 54 2HB SER 54 2.384 -5.315 9.202 418 HG SER 54 HG SER 54 4.603 -5.041 9.437 419 H GLN 55 H GLN 55 2.568 -2.711 12.725 420 HA GLN 55 HA GLN 55 1.529 -0.594 10.901 421 HB2 GLN 55 1HB GLN 55 0.791 -0.547 13.276 422 HB3 GLN 55 2HB GLN 55 2.466 -0.459 13.800 423 HG2 GLN 55 1HG GLN 55 2.722 1.708 12.697 424 HG3 GLN 55 2HG GLN 55 1.031 1.617 12.131 425 HE21 GLN 55 2HE2 GLN 55 1.792 3.795 13.568 426 HE22 GLN 55 2HE1 GLN 55 1.104 3.744 15.156 427 H GLY 56 H GLY 56 2.755 0.620 9.706 428 HA2 GLY 56 1HA GLY 56 5.543 1.165 10.476 429 HA3 GLY 56 2HA GLY 56 5.331 0.184 9.008 430 H GLY 57 H GLY 57 6.609 2.632 8.903 431 HA2 GLY 57 1HA GLY 57 6.278 4.089 6.922 432 HA3 GLY 57 2HA GLY 57 4.591 4.299 7.447 433 H CYS 58 H CYS 58 7.298 4.221 9.691 434 HA CYS 58 HA CYS 58 6.603 6.990 10.624 435 HB2 CYS 58 1HB CYS 58 8.243 4.863 11.911 436 HB3 CYS 58 2HB CYS 58 7.884 6.457 12.557 437 HG CYS 58 HG CYS 58 5.770 4.091 11.715 438 HA PRO 59 HA PRO 59 10.359 8.455 8.748 439 HB2 PRO 59 1HB PRO 59 10.307 10.993 9.753 440 HB3 PRO 59 2HB PRO 59 9.083 10.493 8.578 441 HG2 PRO 59 1HG PRO 59 8.879 10.617 11.618 442 HG3 PRO 59 2HG PRO 59 7.742 11.244 10.420 443 HD2 PRO 59 1HD PRO 59 7.367 8.817 11.618 444 HD3 PRO 59 2HD PRO 59 6.878 9.116 9.902 445 H ARG 60 H ARG 60 9.821 8.038 12.096 446 HA ARG 60 HA ARG 60 12.777 8.157 12.528 447 HB2 ARG 60 1HB ARG 60 10.652 9.276 14.397 448 HB3 ARG 60 2HB ARG 60 12.363 9.136 14.772 449 HG2 ARG 60 1HG ARG 60 11.289 10.802 12.488 450 HG3 ARG 60 2HG ARG 60 11.610 11.424 14.124 451 HD2 ARG 60 1HD ARG 60 13.941 10.704 13.904 452 HD3 ARG 60 2HD ARG 60 13.598 10.182 12.238 453 HE ARG 60 HE ARG 60 13.866 12.918 13.230 454 HH11 ARG 60 1HH1 ARG 60 12.846 10.813 10.610 455 HH12 ARG 60 1HH2 ARG 60 12.933 12.071 9.398 456 HH21 ARG 60 2HH1 ARG 60 13.976 14.543 11.648 457 HH22 ARG 60 2HH2 ARG 60 13.572 14.183 9.984 458 H GLY 61 H GLY 61 9.950 6.412 12.636 459 HA2 GLY 61 1HA GLY 61 9.604 4.230 13.353 460 HA3 GLY 61 2HA GLY 61 11.270 4.204 13.978 461 H ASN 62 H ASN 62 9.229 6.817 14.967 462 HA ASN 62 HA ASN 62 9.215 5.678 17.732 463 HB2 ASN 62 1HB ASN 62 8.980 8.512 16.690 464 HB3 ASN 62 2HB ASN 62 8.729 8.066 18.372 465 HD21 ASN 62 2HD2 ASN 62 10.739 9.811 17.209 466 HD22 ASN 62 2HD1 ASN 62 12.277 9.147 17.651 467 H GLY 63 H GLY 63 7.208 5.858 15.127 468 HA2 GLY 63 1HA GLY 63 4.984 5.085 15.111 469 HA3 GLY 63 2HA GLY 63 4.886 5.347 16.867 470 H THR 64 H THR 64 6.274 8.045 15.499 471 HA THR 64 HA THR 64 3.626 9.413 15.173 472 HB THR 64 HB THR 64 4.512 11.361 16.375 473 HG1 THR 64 1HG THR 64 6.566 11.145 17.430 474 HG21 THR 64 2HG3 THR 64 4.902 8.793 17.959 475 HG22 THR 64 2HG1 THR 64 4.632 10.411 18.646 476 HG23 THR 64 2HG2 THR 64 3.351 9.624 17.694 477 H GLY 65 H GLY 65 3.718 11.459 14.049 478 HA2 GLY 65 1HA GLY 65 5.104 12.970 12.657 479 HA3 GLY 65 2HA GLY 65 5.970 11.529 12.077 480 H ASP 66 H ASP 66 4.802 13.394 10.345 481 HA ASP 66 HA ASP 66 2.882 11.609 8.947 482 HB2 ASP 66 1HB ASP 66 1.319 13.429 8.496 483 HB3 ASP 66 2HB ASP 66 1.472 13.213 10.234 484 H ALA 67 H ALA 67 2.196 13.430 6.937 485 HA ALA 67 HA ALA 67 4.786 13.358 5.477 486 HB1 ALA 67 3HB ALA 67 1.931 13.571 4.456 487 HB2 ALA 67 1HB ALA 67 3.390 13.456 3.445 488 HB3 ALA 67 2HB ALA 67 2.922 12.095 4.492 489 H GLY 68 H GLY 68 3.702 15.511 7.381 490 HA2 GLY 68 1HA GLY 68 4.166 17.822 7.418 491 HA3 GLY 68 2HA GLY 68 4.386 17.800 5.652 492 H TYR 69 H TYR 69 1.609 16.106 6.429 493 HA TYR 69 HA TYR 69 -0.274 18.287 6.743 494 HB2 TYR 69 1HB TYR 69 -1.306 18.136 4.501 495 HB3 TYR 69 2HB TYR 69 0.326 18.786 4.432 496 HD1 TYR 69 1HD TYR 69 -1.741 15.776 3.807 497 HD2 TYR 69 2HD TYR 69 2.058 17.687 3.234 498 HE1 TYR 69 1HE TYR 69 -1.127 14.058 2.139 499 HE2 TYR 69 2HE TYR 69 2.671 15.970 1.566 500 HH TYR 69 HH TYR 69 2.030 14.150 0.478 501 H THR 70 H THR 70 -2.556 17.517 6.190 502 HA THR 70 HA THR 70 -2.772 14.590 6.825 503 HB THR 70 HB THR 70 -4.812 15.111 8.117 504 HG1 THR 70 1HG THR 70 -5.260 17.345 8.547 505 HG21 THR 70 2HG3 THR 70 -2.421 16.777 8.989 506 HG22 THR 70 2HG1 THR 70 -3.749 16.229 10.038 507 HG23 THR 70 2HG2 THR 70 -2.646 15.041 9.304 508 H ILE 71 H ILE 71 -4.735 13.554 6.163 509 HA ILE 71 HA ILE 71 -6.003 14.853 3.769 510 HB ILE 71 HB ILE 71 -6.001 12.617 2.669 511 HG12 ILE 71 1HG1 ILE 71 -4.251 11.698 4.960 512 HG13 ILE 71 1HG2 ILE 71 -5.960 11.322 4.805 513 HG21 ILE 71 2HG1 ILE 71 -3.601 12.482 2.139 514 HG22 ILE 71 2HG2 ILE 71 -4.152 14.172 2.182 515 HG23 ILE 71 2HG3 ILE 71 -3.228 13.504 3.546 516 HD11 ILE 71 1HD3 ILE 71 -3.794 10.549 2.836 517 HD12 ILE 71 1HD1 ILE 71 -4.581 9.479 4.021 518 HD13 ILE 71 1HD2 ILE 71 -5.526 10.169 2.679 519 HA PRO 72 HA PRO 72 -9.822 13.766 5.511 520 HB2 PRO 72 1HB PRO 72 -11.324 13.444 3.223 521 HB3 PRO 72 2HB PRO 72 -10.772 15.048 3.723 522 HG2 PRO 72 1HG PRO 72 -9.533 13.149 1.684 523 HG3 PRO 72 2HG PRO 72 -9.872 14.874 1.507 524 HD2 PRO 72 1HD PRO 72 -7.384 14.017 2.150 525 HD3 PRO 72 2HD PRO 72 -8.060 15.526 2.885 526 H CYS 73 H CYS 73 -11.219 12.116 5.929 527 HA CYS 73 HA CYS 73 -10.140 9.402 5.566 528 HB2 CYS 73 1HB CYS 73 -11.192 10.090 7.609 529 HB3 CYS 73 2HB CYS 73 -12.719 10.293 6.761 530 HG CYS 73 HG CYS 73 -12.776 8.151 8.176 531 H GLU 74 H GLU 74 -10.786 7.862 4.170 532 HA GLU 74 HA GLU 74 -13.068 8.496 2.328 533 HB2 GLU 74 1HB GLU 74 -10.376 7.267 1.594 534 HB3 GLU 74 2HB GLU 74 -11.750 7.418 0.508 535 HG2 GLU 74 1HG GLU 74 -11.630 9.863 0.672 536 HG3 GLU 74 2HG GLU 74 -10.272 9.727 1.787 537 H THR 75 H THR 75 -13.992 7.178 4.224 538 HA THR 75 HA THR 75 -13.802 4.278 3.468 539 HB THR 75 HB THR 75 -14.569 3.772 5.770 540 HG1 THR 75 1HG THR 75 -14.604 5.532 7.280 541 HG21 THR 75 2HG3 THR 75 -12.140 5.602 5.699 542 HG22 THR 75 2HG1 THR 75 -12.510 4.408 6.964 543 HG23 THR 75 2HG2 THR 75 -12.144 3.867 5.309 544 H ASP 76 H ASP 76 -15.792 7.059 3.645 545 HA ASP 76 HA ASP 76 -18.337 5.917 4.156 546 HB2 ASP 76 1HB ASP 76 -17.493 8.280 2.432 547 HB3 ASP 76 2HB ASP 76 -19.178 7.860 2.714 548 H ASN 77 H ASN 77 -16.536 6.180 1.107 549 HA ASN 77 HA ASN 77 -18.535 4.277 -0.079 550 HB2 ASN 77 1HB ASN 77 -16.966 6.490 -1.433 551 HB3 ASN 77 2HB ASN 77 -17.908 5.267 -2.277 552 HD21 ASN 77 2HD2 ASN 77 -17.951 8.317 -0.918 553 HD22 ASN 77 2HD1 ASN 77 -19.665 8.559 -0.857 554 H ASN 78 H ASN 78 -16.421 3.353 1.452 555 HA ASN 78 HA ASN 78 -14.665 2.162 -0.675 556 HB2 ASN 78 1HB ASN 78 -13.412 3.730 0.765 557 HB3 ASN 78 2HB ASN 78 -13.920 2.830 2.188 558 HD21 ASN 78 2HD2 ASN 78 -11.501 2.796 2.380 559 HD22 ASN 78 2HD1 ASN 78 -10.674 1.455 1.659 560 HA PRO 79 HA PRO 79 -17.020 -1.320 0.913 561 HB2 PRO 79 1HB PRO 79 -15.618 -2.525 -1.499 562 HB3 PRO 79 2HB PRO 79 -17.332 -2.609 -1.072 563 HG2 PRO 79 1HG PRO 79 -16.598 -0.997 -3.062 564 HG3 PRO 79 2HG PRO 79 -17.791 -0.424 -1.892 565 HD2 PRO 79 1HD PRO 79 -14.805 0.169 -2.035 566 HD3 PRO 79 2HD PRO 79 -16.177 1.304 -1.713 567 H HIS 80 H HIS 80 -13.642 -0.947 0.215 568 HA HIS 80 HA HIS 80 -12.835 -3.616 0.948 569 HB2 HIS 80 1HB HIS 80 -11.281 -0.993 0.941 570 HB3 HIS 80 2HB HIS 80 -10.559 -2.580 1.165 571 HD2 HIS 80 2HD HIS 80 -11.244 -0.186 -1.777 572 HE1 HIS 80 1HE HIS 80 -10.956 -4.109 -3.383 573 H ARG 81 H ARG 81 -12.157 -4.521 2.784 574 HA ARG 81 HA ARG 81 -12.651 -2.916 5.274 575 HB2 ARG 81 1HB ARG 81 -13.139 -5.888 4.846 576 HB3 ARG 81 2HB ARG 81 -13.458 -4.981 6.316 577 HG2 ARG 81 1HG ARG 81 -15.221 -3.725 5.216 578 HG3 ARG 81 2HG ARG 81 -14.856 -4.526 3.668 579 HD2 ARG 81 1HD ARG 81 -16.755 -5.560 4.676 580 HD3 ARG 81 2HD ARG 81 -15.380 -6.688 4.718 581 HE ARG 81 HE ARG 81 -15.432 -5.230 7.137 582 HH11 ARG 81 1HH1 ARG 81 -17.292 -7.666 5.419 583 HH12 ARG 81 1HH2 ARG 81 -17.918 -8.398 6.879 584 HH21 ARG 81 2HH1 ARG 81 -16.252 -6.190 9.026 585 HH22 ARG 81 2HH2 ARG 81 -17.329 -7.564 8.921 586 H HIS 82 H HIS 82 -11.630 -3.861 7.226 587 HA HIS 82 HA HIS 82 -8.766 -4.179 6.614 588 HB2 HIS 82 1HB HIS 82 -10.303 -3.921 9.232 589 HB3 HIS 82 2HB HIS 82 -8.556 -4.089 9.136 590 HD2 HIS 82 2HD HIS 82 -7.171 -1.756 8.552 591 HE1 HIS 82 1HE HIS 82 -10.602 0.715 8.013 592 H VAL 83 H VAL 83 -9.152 -6.268 5.532 593 HA VAL 83 HA VAL 83 -9.012 -8.491 7.569 594 HB VAL 83 HB VAL 83 -9.923 -9.970 5.828 595 HG11 VAL 83 1HG1 VAL 83 -12.217 -9.124 5.715 596 HG12 VAL 83 1HG2 VAL 83 -11.509 -8.914 7.333 597 HG13 VAL 83 1HG3 VAL 83 -11.650 -7.519 6.235 598 HG21 VAL 83 2HG3 VAL 83 -9.018 -8.768 3.868 599 HG22 VAL 83 2HG1 VAL 83 -10.770 -9.032 3.700 600 HG23 VAL 83 2HG2 VAL 83 -10.152 -7.428 4.164 601 H THR 84 H THR 84 -8.101 -10.511 6.218 602 HA THR 84 HA THR 84 -5.312 -10.107 6.168 603 HB THR 84 HB THR 84 -6.903 -12.199 4.616 604 HG1 THR 84 1HG THR 84 -5.723 -12.377 7.210 605 HG21 THR 84 2HG3 THR 84 -4.022 -12.166 5.594 606 HG22 THR 84 2HG1 THR 84 -4.834 -13.526 4.786 607 HG23 THR 84 2HG2 THR 84 -4.546 -12.010 3.901 608 H GLY 85 H GLY 85 -4.102 -8.890 4.974 609 HA2 GLY 85 1HA GLY 85 -3.025 -8.695 2.791 610 HA3 GLY 85 2HA GLY 85 -4.623 -8.881 2.031 611 H ALA 86 H ALA 86 -5.791 -7.087 4.181 612 HA ALA 86 HA ALA 86 -5.908 -4.829 2.451 613 HB1 ALA 86 3HB ALA 86 -6.702 -5.062 5.376 614 HB2 ALA 86 1HB ALA 86 -7.201 -3.766 4.265 615 HB3 ALA 86 2HB ALA 86 -7.734 -5.440 3.977 616 H MET 87 H MET 87 -4.897 -2.931 2.343 617 HA MET 87 HA MET 87 -2.988 -2.253 4.560 618 HB2 MET 87 1HB MET 87 -1.833 -2.796 2.424 619 HB3 MET 87 2HB MET 87 -2.772 -1.555 1.607 620 HG2 MET 87 1HG MET 87 -1.744 0.173 3.019 621 HG3 MET 87 2HG MET 87 -0.826 -1.063 3.882 622 HE1 MET 87 3HE MET 87 0.523 -2.987 2.145 623 HE2 MET 87 1HE MET 87 1.944 -2.115 1.519 624 HE3 MET 87 2HE MET 87 1.434 -1.888 3.211 625 H SER 88 H SER 88 -3.425 -0.526 5.689 626 HA SER 88 HA SER 88 -5.613 1.309 4.655 627 HB2 SER 88 1HB SER 88 -6.492 -0.312 6.157 628 HB3 SER 88 2HB SER 88 -5.336 0.174 7.387 629 HG SER 88 HG SER 88 -6.169 2.306 7.141 630 H MET 89 H MET 89 -5.183 3.419 4.809 631 HA MET 89 HA MET 89 -2.669 4.359 5.987 632 HB2 MET 89 1HB MET 89 -3.635 5.352 3.920 633 HB3 MET 89 2HB MET 89 -5.028 5.901 4.841 634 HG2 MET 89 1HG MET 89 -3.537 7.748 4.539 635 HG3 MET 89 2HG MET 89 -3.501 7.291 6.244 636 HE1 MET 89 3HE MET 89 -1.587 7.376 2.844 637 HE2 MET 89 1HE MET 89 -0.144 6.394 3.192 638 HE3 MET 89 2HE MET 89 -1.745 5.621 3.101 639 H ALA 90 H ALA 90 -2.275 5.115 7.910 640 HA ALA 90 HA ALA 90 -4.371 4.963 9.924 641 HB1 ALA 90 3HB ALA 90 -1.502 5.950 10.107 642 HB2 ALA 90 1HB ALA 90 -2.582 5.634 11.485 643 HB3 ALA 90 2HB ALA 90 -2.063 4.294 10.435 644 H HIS 91 H HIS 91 -5.190 6.588 11.227 645 HA HIS 91 HA HIS 91 -4.479 9.392 10.521 646 HB2 HIS 91 1HB HIS 91 -6.819 10.072 10.446 647 HB3 HIS 91 2HB HIS 91 -6.541 8.834 9.230 648 HD2 HIS 91 2HD HIS 91 -8.397 6.847 9.306 649 HE1 HIS 91 1HE HIS 91 -9.696 7.412 13.326 650 H ARG 92 H ARG 92 -5.452 10.956 12.088 651 HA ARG 92 HA ARG 92 -5.416 9.741 14.833 652 HB2 ARG 92 1HB ARG 92 -4.529 12.504 13.915 653 HB3 ARG 92 2HB ARG 92 -4.590 11.971 15.588 654 HG2 ARG 92 1HG ARG 92 -2.924 10.182 15.006 655 HG3 ARG 92 2HG ARG 92 -2.777 10.936 13.401 656 HD2 ARG 92 1HD ARG 92 -2.048 12.994 14.393 657 HD3 ARG 92 2HD ARG 92 -2.298 12.329 16.025 658 HE ARG 92 HE ARG 92 -0.548 10.617 14.625 659 HH11 ARG 92 1HH1 ARG 92 -0.627 13.873 15.940 660 HH12 ARG 92 1HH2 ARG 92 1.098 13.933 16.228 661 HH21 ARG 92 2HH1 ARG 92 1.689 10.706 15.005 662 HH22 ARG 92 2HH2 ARG 92 2.409 12.141 15.699 663 H GLY 93 H GLY 93 -7.735 10.022 13.108 664 HA2 GLY 93 1HA GLY 93 -9.840 10.505 14.544 665 HA3 GLY 93 2HA GLY 93 -9.232 12.177 14.529 666 H ARG 94 H ARG 94 -11.523 12.335 13.576 667 HA ARG 94 HA ARG 94 -12.096 11.364 10.949 668 HB2 ARG 94 1HB ARG 94 -13.769 12.333 12.571 669 HB3 ARG 94 2HB ARG 94 -13.095 13.924 12.255 670 HG2 ARG 94 1HG ARG 94 -13.762 13.768 9.906 671 HG3 ARG 94 2HG ARG 94 -14.410 12.136 10.195 672 HD2 ARG 94 1HD ARG 94 -15.330 14.649 11.569 673 HD3 ARG 94 2HD ARG 94 -16.137 13.860 10.195 674 HE ARG 94 HE ARG 94 -16.147 13.026 12.979 675 HH11 ARG 94 1HH1 ARG 94 -16.649 12.042 9.646 676 HH12 ARG 94 1HH2 ARG 94 -17.687 10.698 10.067 677 HH21 ARG 94 2HH1 ARG 94 -17.495 11.279 13.515 678 HH22 ARG 94 2HH2 ARG 94 -18.165 10.265 12.257 679 H ASP 95 H ASP 95 -11.272 11.786 9.074 680 HA ASP 95 HA ASP 95 -10.139 12.895 7.371 681 HB2 ASP 95 1HB ASP 95 -11.412 15.319 8.714 682 HB3 ASP 95 2HB ASP 95 -10.688 15.313 7.112 683 H THR 96 H THR 96 -8.585 12.259 9.604 684 HA THR 96 HA THR 96 -6.570 14.466 9.436 685 HB THR 96 HB THR 96 -7.224 12.890 11.965 686 HG1 THR 96 1HG THR 96 -8.821 14.491 11.406 687 HG21 THR 96 2HG3 THR 96 -5.362 15.240 11.445 688 HG22 THR 96 2HG1 THR 96 -5.675 14.487 13.025 689 HG23 THR 96 2HG2 THR 96 -4.856 13.562 11.745 690 H GLY 97 H GLY 97 -6.430 12.483 7.681 691 HA2 GLY 97 1HA GLY 97 -5.001 10.160 8.568 692 HA3 GLY 97 2HA GLY 97 -5.059 10.789 6.904 693 H SER 98 H SER 98 -2.789 9.623 8.286 694 HA SER 98 HA SER 98 -0.893 11.990 8.400 695 HB2 SER 98 1HB SER 98 0.495 10.787 9.770 696 HB3 SER 98 2HB SER 98 -1.118 10.790 10.467 697 HG SER 98 HG SER 98 -1.414 8.734 9.515 698 H CYS 99 H CYS 99 1.007 9.484 8.454 699 HA CYS 99 HA CYS 99 1.131 8.982 5.465 700 HB2 CYS 99 1HB CYS 99 3.379 9.309 5.365 701 HB3 CYS 99 2HB CYS 99 2.698 10.735 6.136 702 HG CYS 99 HG CYS 99 4.083 8.150 7.615 703 H GLN 100 H GLN 100 1.224 7.831 8.728 704 HA GLN 100 HA GLN 100 2.625 5.336 8.189 705 HB2 GLN 100 1HB GLN 100 0.712 6.138 10.424 706 HB3 GLN 100 2HB GLN 100 1.633 4.641 10.385 707 HG2 GLN 100 1HG GLN 100 3.731 5.937 10.401 708 HG3 GLN 100 2HG GLN 100 2.772 7.442 10.497 709 HE21 GLN 100 2HE2 GLN 100 2.425 8.238 12.459 710 HE22 GLN 100 2HE1 GLN 100 2.491 7.345 13.943 711 H PHE 101 H PHE 101 1.740 3.232 8.201 712 HA PHE 101 HA PHE 101 -1.118 3.000 7.425 713 HB2 PHE 101 1HB PHE 101 -0.575 1.751 5.384 714 HB3 PHE 101 2HB PHE 101 0.073 3.380 5.284 715 HD1 PHE 101 2HD PHE 101 2.468 3.789 5.356 716 HD2 PHE 101 1HD PHE 101 0.888 -0.175 5.585 717 HE1 PHE 101 2HE PHE 101 4.709 2.869 4.862 718 HE2 PHE 101 1HE PHE 101 3.127 -1.098 5.094 719 HZ PHE 101 HZ PHE 101 5.038 0.424 4.733 720 H PHE 102 H PHE 102 -1.946 0.887 7.462 721 HA PHE 102 HA PHE 102 -0.287 -0.975 9.131 722 HB2 PHE 102 1HB PHE 102 -3.315 -0.784 8.832 723 HB3 PHE 102 2HB PHE 102 -2.462 -1.952 9.828 724 HD1 PHE 102 2HD PHE 102 -1.198 -1.189 11.832 725 HD2 PHE 102 1HD PHE 102 -3.691 1.443 9.572 726 HE1 PHE 102 2HE PHE 102 -1.240 0.394 13.729 727 HE2 PHE 102 1HE PHE 102 -3.733 3.031 11.467 728 HZ PHE 102 HZ PHE 102 -2.507 2.507 13.545 729 H ILE 103 H ILE 103 0.402 -2.790 8.295 730 HA ILE 103 HA ILE 103 -1.055 -3.956 5.953 731 HB ILE 103 HB ILE 103 1.553 -4.781 7.327 732 HG12 ILE 103 1HG1 ILE 103 1.147 -3.449 4.640 733 HG13 ILE 103 1HG2 ILE 103 1.658 -2.617 6.101 734 HG21 ILE 103 2HG1 ILE 103 1.826 -6.287 5.399 735 HG22 ILE 103 2HG2 ILE 103 0.355 -6.684 6.318 736 HG23 ILE 103 2HG3 ILE 103 0.232 -5.793 4.783 737 HD11 ILE 103 1HD3 ILE 103 3.150 -4.868 4.735 738 HD12 ILE 103 1HD1 ILE 103 3.559 -3.138 4.677 739 HD13 ILE 103 1HD2 ILE 103 3.667 -4.027 6.216 740 H VAL 104 H VAL 104 -2.787 -5.008 6.412 741 HA VAL 104 HA VAL 104 -3.015 -6.409 9.032 742 HB VAL 104 HB VAL 104 -5.013 -6.070 6.743 743 HG11 VAL 104 1HG1 VAL 104 -6.689 -6.711 8.407 744 HG12 VAL 104 1HG2 VAL 104 -5.490 -7.998 8.140 745 HG13 VAL 104 1HG3 VAL 104 -5.398 -6.985 9.601 746 HG21 VAL 104 2HG3 VAL 104 -4.366 -3.900 7.730 747 HG22 VAL 104 2HG1 VAL 104 -6.034 -4.330 8.176 748 HG23 VAL 104 2HG2 VAL 104 -4.716 -4.532 9.356 749 H HIS 105 H HIS 105 -2.649 -8.407 9.389 750 HA HIS 105 HA HIS 105 -2.673 -10.283 7.051 751 HB2 HIS 105 1HB HIS 105 -1.296 -10.570 9.756 752 HB3 HIS 105 2HB HIS 105 -1.257 -11.755 8.457 753 HD2 HIS 105 2HD HIS 105 0.846 -8.696 9.634 754 HE1 HIS 105 1HE HIS 105 1.885 -9.536 5.602 755 H GLU 106 H GLU 106 -4.029 -9.577 10.188 756 HA GLU 106 HA GLU 106 -6.024 -11.745 9.636 757 HB2 GLU 106 1HB GLU 106 -4.560 -12.415 11.536 758 HB3 GLU 106 2HB GLU 106 -4.937 -10.909 12.359 759 HG2 GLU 106 1HG GLU 106 -7.304 -11.562 12.487 760 HG3 GLU 106 2HG GLU 106 -6.937 -13.066 11.647 761 HA PRO 107 HA PRO 107 -9.012 -8.503 9.553 762 HB2 PRO 107 1HB PRO 107 -10.622 -10.787 10.799 763 HB3 PRO 107 2HB PRO 107 -11.099 -9.701 9.487 764 HG2 PRO 107 1HG PRO 107 -10.347 -12.175 8.863 765 HG3 PRO 107 2HG PRO 107 -9.759 -10.834 7.875 766 HD2 PRO 107 1HD PRO 107 -8.321 -12.399 10.040 767 HD3 PRO 107 2HD PRO 107 -7.677 -11.744 8.481 768 H GLN 108 H GLN 108 -9.488 -6.976 10.889 769 HA GLN 108 HA GLN 108 -9.263 -7.583 13.815 770 HB2 GLN 108 1HB GLN 108 -7.128 -6.609 12.974 771 HB3 GLN 108 2HB GLN 108 -8.012 -5.234 12.327 772 HG2 GLN 108 1HG GLN 108 -6.859 -4.823 14.498 773 HG3 GLN 108 2HG GLN 108 -8.612 -4.477 14.512 774 HE21 GLN 108 2HE2 GLN 108 -6.099 -6.778 15.505 775 HE22 GLN 108 2HE1 GLN 108 -7.014 -7.512 16.780 776 HA PRO 109 HA PRO 109 -13.296 -5.604 13.381 777 HB2 PRO 109 1HB PRO 109 -13.120 -6.375 16.329 778 HB3 PRO 109 2HB PRO 109 -14.482 -6.586 15.220 779 HG2 PRO 109 1HG PRO 109 -13.030 -8.724 15.846 780 HG3 PRO 109 2HG PRO 109 -13.508 -8.486 14.162 781 HD2 PRO 109 1HD PRO 109 -10.835 -7.920 15.498 782 HD3 PRO 109 2HD PRO 109 -11.170 -8.636 13.869 783 H HIS 110 H HIS 110 -10.763 -5.105 15.790 784 HA HIS 110 HA HIS 110 -11.947 -2.696 16.869 785 HB2 HIS 110 1HB HIS 110 -9.114 -3.813 16.948 786 HB3 HIS 110 2HB HIS 110 -9.592 -2.338 17.777 787 HD2 HIS 110 2HD HIS 110 -11.097 -2.757 20.241 788 HE1 HIS 110 1HE HIS 110 -10.894 -6.991 19.965 789 H LEU 111 H LEU 111 -10.153 -3.371 14.012 790 HA LEU 111 HA LEU 111 -9.814 -0.422 13.577 791 HB2 LEU 111 1HB LEU 111 -8.338 -2.763 12.301 792 HB3 LEU 111 2HB LEU 111 -8.088 -1.059 11.911 793 HG LEU 111 HG LEU 111 -7.505 -2.345 14.602 794 HD11 LEU 111 1HD1 LEU 111 -5.156 -2.045 13.958 795 HD12 LEU 111 1HD2 LEU 111 -6.010 -3.135 12.840 796 HD13 LEU 111 1HD3 LEU 111 -5.669 -1.454 12.360 797 HD21 LEU 111 2HD3 LEU 111 -8.144 0.039 14.746 798 HD22 LEU 111 2HD1 LEU 111 -6.409 -0.182 15.079 799 HD23 LEU 111 2HD2 LEU 111 -6.941 0.436 13.496 800 H ASP 112 H ASP 112 -11.873 -2.856 12.913 801 HA ASP 112 HA ASP 112 -11.976 -2.851 10.032 802 HB2 ASP 112 1HB ASP 112 -12.918 -4.664 11.493 803 HB3 ASP 112 2HB ASP 112 -14.164 -3.550 12.037 804 H GLY 113 H GLY 113 -12.178 -1.001 8.989 805 HA2 GLY 113 1HA GLY 113 -13.568 0.554 7.909 806 HA3 GLY 113 2HA GLY 113 -14.828 0.263 9.132 807 H VAL 114 H VAL 114 -11.913 0.704 10.694 808 HA VAL 114 HA VAL 114 -12.677 3.408 11.614 809 HB VAL 114 HB VAL 114 -10.281 1.616 12.246 810 HG11 VAL 114 1HG1 VAL 114 -9.898 3.115 14.141 811 HG12 VAL 114 1HG2 VAL 114 -9.747 3.960 12.582 812 HG13 VAL 114 1HG3 VAL 114 -11.212 4.170 13.573 813 HG21 VAL 114 2HG3 VAL 114 -12.441 0.673 12.988 814 HG22 VAL 114 2HG1 VAL 114 -11.469 1.209 14.378 815 HG23 VAL 114 2HG2 VAL 114 -12.830 2.204 13.808 816 H HIS 115 H HIS 115 -9.797 2.026 10.021 817 HA HIS 115 HA HIS 115 -9.086 4.798 9.172 818 HB2 HIS 115 1HB HIS 115 -7.492 2.204 8.989 819 HB3 HIS 115 2HB HIS 115 -6.910 3.801 8.537 820 HD2 HIS 115 2HD HIS 115 -7.237 1.580 11.669 821 HE1 HIS 115 1HE HIS 115 -5.909 5.422 12.954 822 H THR 116 H THR 116 -7.787 4.617 6.943 823 HA THR 116 HA THR 116 -9.969 3.831 5.056 824 HB THR 116 HB THR 116 -7.695 5.847 4.778 825 HG1 THR 116 1HG THR 116 -9.422 6.571 6.078 826 HG21 THR 116 2HG3 THR 116 -9.944 5.125 2.858 827 HG22 THR 116 2HG1 THR 116 -8.769 6.444 2.642 828 HG23 THR 116 2HG2 THR 116 -8.219 4.751 2.627 829 H VAL 117 H VAL 117 -9.659 1.816 4.414 830 HA VAL 117 HA VAL 117 -7.047 0.753 3.629 831 HB VAL 117 HB VAL 117 -9.872 -0.132 2.868 832 HG11 VAL 117 1HG1 VAL 117 -8.831 -2.292 2.381 833 HG12 VAL 117 1HG2 VAL 117 -8.181 -0.992 1.354 834 HG13 VAL 117 1HG3 VAL 117 -7.230 -1.599 2.732 835 HG21 VAL 117 2HG3 VAL 117 -9.521 -0.128 5.315 836 HG22 VAL 117 2HG1 VAL 117 -9.602 -1.790 4.686 837 HG23 VAL 117 2HG2 VAL 117 -8.028 -1.073 5.104 838 H PHE 118 H PHE 118 -5.886 1.148 1.963 839 HA PHE 118 HA PHE 118 -7.230 2.439 -0.391 840 HB2 PHE 118 1HB PHE 118 -5.437 4.030 -0.546 841 HB3 PHE 118 2HB PHE 118 -6.019 4.084 1.110 842 HD1 PHE 118 2HD PHE 118 -4.682 3.148 2.941 843 HD2 PHE 118 1HD PHE 118 -3.235 3.222 -1.078 844 HE1 PHE 118 2HE PHE 118 -2.386 2.739 3.762 845 HE2 PHE 118 1HE PHE 118 -0.938 2.809 -0.260 846 HZ PHE 118 HZ PHE 118 -0.514 2.567 2.160 847 H GLY 119 H GLY 119 -5.187 -0.001 0.780 848 HA2 GLY 119 1HA GLY 119 -4.601 -0.799 -2.011 849 HA3 GLY 119 2HA GLY 119 -3.217 -0.585 -0.914 850 H GLN 120 H GLN 120 -3.302 -2.994 -1.875 851 HA GLN 120 HA GLN 120 -3.937 -4.636 0.472 852 HB2 GLN 120 1HB GLN 120 -6.098 -4.674 -0.763 853 HB3 GLN 120 2HB GLN 120 -5.262 -5.212 -2.213 854 HG2 GLN 120 1HG GLN 120 -4.585 -7.277 -1.061 855 HG3 GLN 120 2HG GLN 120 -5.468 -6.733 0.393 856 HE21 GLN 120 2HE2 GLN 120 -6.217 -9.106 -0.481 857 HE22 GLN 120 2HE1 GLN 120 -7.722 -9.045 -1.338 858 H VAL 121 H VAL 121 -2.384 -6.003 0.811 859 HA VAL 121 HA VAL 121 -0.219 -6.379 -1.105 860 HB VAL 121 HB VAL 121 -0.945 -7.932 1.427 861 HG11 VAL 121 1HG1 VAL 121 1.395 -8.645 1.414 862 HG12 VAL 121 1HG2 VAL 121 0.523 -9.197 -0.035 863 HG13 VAL 121 1HG3 VAL 121 1.639 -7.815 -0.140 864 HG21 VAL 121 2HG3 VAL 121 -0.567 -5.528 1.857 865 HG22 VAL 121 2HG1 VAL 121 0.765 -6.509 2.509 866 HG23 VAL 121 2HG2 VAL 121 0.982 -5.614 0.985 867 H THR 122 H THR 122 0.134 -7.755 -2.619 868 HA THR 122 HA THR 122 -1.866 -9.972 -2.939 869 HB THR 122 HB THR 122 -1.521 -9.767 -5.371 870 HG1 THR 122 1HG THR 122 -0.269 -7.967 -6.129 871 HG21 THR 122 2HG3 THR 122 -2.156 -7.093 -4.067 872 HG22 THR 122 2HG1 THR 122 -2.600 -7.580 -5.719 873 HG23 THR 122 2HG2 THR 122 -3.309 -8.423 -4.322 874 H SER 123 H SER 123 1.456 -9.109 -2.665 875 HA SER 123 HA SER 123 2.207 -12.010 -2.691 876 HB2 SER 123 1HB SER 123 2.393 -11.475 -4.977 877 HB3 SER 123 2HB SER 123 3.409 -10.089 -4.613 878 HG SER 123 HG SER 123 4.589 -11.931 -5.129 879 H GLY 124 H GLY 124 3.999 -12.419 -1.462 880 HA2 GLY 124 1HA GLY 124 5.880 -11.981 -0.142 881 HA3 GLY 124 2HA GLY 124 5.768 -10.260 -0.578 882 H MET 125 H MET 125 2.912 -11.859 0.569 883 HA MET 125 HA MET 125 2.676 -10.119 2.872 884 HB2 MET 125 1HB MET 125 0.672 -11.377 3.364 885 HB3 MET 125 2HB MET 125 0.733 -11.074 1.634 886 HG2 MET 125 1HG MET 125 1.555 -13.377 1.266 887 HG3 MET 125 2HG MET 125 1.469 -13.678 3.003 888 HE1 MET 125 3HE MET 125 -1.124 -12.368 4.028 889 HE2 MET 125 1HE MET 125 -2.321 -13.659 3.766 890 HE3 MET 125 2HE MET 125 -0.689 -14.063 4.355 891 H ASP 126 H ASP 126 4.274 -13.118 2.334 892 HA ASP 126 HA ASP 126 4.398 -13.705 5.248 893 HB2 ASP 126 1HB ASP 126 5.535 -15.760 4.573 894 HB3 ASP 126 2HB ASP 126 4.046 -15.585 3.655 895 H VAL 127 H VAL 127 5.895 -11.598 3.279 896 HA VAL 127 HA VAL 127 8.664 -11.913 4.187 897 HB VAL 127 HB VAL 127 7.097 -9.524 3.099 898 HG11 VAL 127 1HG1 VAL 127 9.273 -8.454 2.772 899 HG12 VAL 127 1HG2 VAL 127 8.936 -8.767 4.491 900 HG13 VAL 127 1HG3 VAL 127 10.066 -9.815 3.599 901 HG21 VAL 127 2HG3 VAL 127 7.383 -11.378 1.491 902 HG22 VAL 127 2HG1 VAL 127 8.376 -9.975 1.030 903 HG23 VAL 127 2HG2 VAL 127 9.135 -11.385 1.808 904 H VAL 128 H VAL 128 5.903 -9.960 5.284 905 HA VAL 128 HA VAL 128 7.241 -8.617 7.423 906 HB VAL 128 HB VAL 128 4.370 -9.652 7.233 907 HG11 VAL 128 1HG1 VAL 128 3.851 -8.002 8.965 908 HG12 VAL 128 1HG2 VAL 128 4.997 -9.236 9.542 909 HG13 VAL 128 1HG3 VAL 128 5.580 -7.611 9.110 910 HG21 VAL 128 2HG3 VAL 128 4.985 -8.076 5.434 911 HG22 VAL 128 2HG1 VAL 128 3.850 -7.323 6.579 912 HG23 VAL 128 2HG2 VAL 128 5.582 -6.918 6.647 913 H ARG 129 H ARG 129 6.072 -11.913 7.194 914 HA ARG 129 HA ARG 129 6.266 -12.523 9.998 915 HB2 ARG 129 1HB ARG 129 6.554 -14.274 7.528 916 HB3 ARG 129 2HB ARG 129 6.501 -14.896 9.170 917 HG2 ARG 129 1HG ARG 129 4.237 -14.100 9.463 918 HG3 ARG 129 2HG ARG 129 4.280 -13.295 7.875 919 HD2 ARG 129 1HD ARG 129 4.606 -15.466 6.807 920 HD3 ARG 129 2HD ARG 129 4.501 -16.250 8.401 921 HE ARG 129 HE ARG 129 2.204 -14.705 8.153 922 HH11 ARG 129 1HH1 ARG 129 3.697 -17.382 6.436 923 HH12 ARG 129 1HH2 ARG 129 2.172 -18.047 5.894 924 HH21 ARG 129 2HH1 ARG 129 0.232 -15.579 7.444 925 HH22 ARG 129 2HH2 ARG 129 0.210 -17.028 6.464 926 H THR 130 H THR 130 8.651 -12.274 7.450 927 HA THR 130 HA THR 130 10.711 -13.511 9.217 928 HB THR 130 HB THR 130 12.152 -13.484 7.228 929 HG1 THR 130 1HG THR 130 11.245 -12.701 5.242 930 HG21 THR 130 2HG3 THR 130 9.358 -14.497 6.582 931 HG22 THR 130 2HG1 THR 130 10.863 -15.006 5.782 932 HG23 THR 130 2HG2 THR 130 10.596 -15.383 7.501 933 H MET 131 H MET 131 9.594 -10.444 8.082 934 HA MET 131 HA MET 131 12.027 -8.969 8.689 935 HB2 MET 131 1HB MET 131 9.122 -8.102 8.474 936 HB3 MET 131 2HB MET 131 10.474 -6.998 8.679 937 HG2 MET 131 1HG MET 131 10.118 -8.882 6.330 938 HG3 MET 131 2HG MET 131 9.694 -7.168 6.340 939 HE1 MET 131 3HE MET 131 12.064 -9.471 4.946 940 HE2 MET 131 1HE MET 131 13.707 -9.000 5.445 941 HE3 MET 131 2HE MET 131 12.615 -9.791 6.608 942 H LYS 132 H LYS 132 12.541 -7.705 10.430 943 HA LYS 132 HA LYS 132 11.172 -8.498 12.973 944 HB2 LYS 132 1HB LYS 132 13.935 -7.307 12.502 945 HB3 LYS 132 2HB LYS 132 13.252 -7.700 14.074 946 HG2 LYS 132 1HG LYS 132 13.151 -10.087 13.429 947 HG3 LYS 132 2HG LYS 132 13.867 -9.682 11.863 948 HD2 LYS 132 1HD LYS 132 15.879 -8.814 12.989 949 HD3 LYS 132 2HD LYS 132 15.161 -9.171 14.568 950 HE2 LYS 132 1HE LYS 132 15.071 -11.578 13.974 951 HE3 LYS 132 2HE LYS 132 15.810 -11.216 12.411 952 HZ1 LYS 132 3HZ LYS 132 17.051 -10.738 15.039 953 HZ2 LYS 132 1HZ LYS 132 17.425 -11.963 14.000 954 HZ3 LYS 132 2HZ LYS 132 17.741 -10.399 13.579 955 H ASN 133 H ASN 133 10.993 -6.894 14.659 956 HA ASN 133 HA ASN 133 9.648 -4.530 13.695 957 HB2 ASN 133 1HB ASN 133 9.296 -5.805 15.903 958 HB3 ASN 133 2HB ASN 133 10.699 -4.926 16.496 959 HD21 ASN 133 2HD2 ASN 133 9.416 -3.883 18.044 960 HD22 ASN 133 2HD1 ASN 133 8.349 -2.587 17.615 961 H GLY 134 H GLY 134 10.258 -2.535 13.329 962 HA2 GLY 134 1HA GLY 134 11.562 -0.590 13.580 963 HA3 GLY 134 2HA GLY 134 12.788 -1.532 14.460 964 H ASP 135 H ASP 135 11.810 -3.146 11.666 965 HA ASP 135 HA ASP 135 14.314 -2.732 10.284 966 HB2 ASP 135 1HB ASP 135 11.671 -4.029 9.567 967 HB3 ASP 135 2HB ASP 135 12.919 -3.814 8.349 968 H VAL 136 H VAL 136 14.787 -1.693 8.381 969 HA VAL 136 HA VAL 136 13.011 0.688 7.855 970 HB VAL 136 HB VAL 136 16.038 0.397 7.546 971 HG11 VAL 136 1HG1 VAL 136 16.006 2.807 7.124 972 HG12 VAL 136 1HG2 VAL 136 15.064 1.905 5.913 973 HG13 VAL 136 1HG3 VAL 136 14.229 2.797 7.207 974 HG21 VAL 136 2HG3 VAL 136 15.350 0.456 9.918 975 HG22 VAL 136 2HG1 VAL 136 16.165 1.968 9.454 976 HG23 VAL 136 2HG2 VAL 136 14.392 1.924 9.606 977 H MET 137 H MET 137 12.578 1.364 5.863 978 HA MET 137 HA MET 137 12.580 -0.717 3.821 979 HB2 MET 137 1HB MET 137 11.804 2.219 3.663 980 HB3 MET 137 2HB MET 137 11.467 1.005 2.437 981 HG2 MET 137 1HG MET 137 9.999 -0.195 3.963 982 HG3 MET 137 2HG MET 137 10.408 0.912 5.276 983 HE1 MET 137 3HE MET 137 8.046 1.680 5.890 984 HE2 MET 137 1HE MET 137 6.785 2.081 4.699 985 HE3 MET 137 2HE MET 137 7.440 0.426 4.782 986 H LYS 138 H LYS 138 13.554 -0.758 1.836 987 HA LYS 138 HA LYS 138 16.117 0.786 1.727 988 HB2 LYS 138 1HB LYS 138 16.318 -1.689 1.720 989 HB3 LYS 138 2HB LYS 138 15.285 -1.771 0.299 990 HG2 LYS 138 1HG LYS 138 16.954 -0.546 -1.017 991 HG3 LYS 138 2HG LYS 138 17.986 -0.395 0.413 992 HD2 LYS 138 1HD LYS 138 18.118 -2.875 0.559 993 HD3 LYS 138 2HD LYS 138 17.127 -3.000 -0.901 994 HE2 LYS 138 1HE LYS 138 18.836 -1.813 -2.199 995 HE3 LYS 138 2HE LYS 138 19.814 -1.584 -0.747 996 HZ1 LYS 138 3HZ LYS 138 19.116 -4.183 -1.943 997 HZ2 LYS 138 1HZ LYS 138 20.581 -3.433 -2.044 998 HZ3 LYS 138 2HZ LYS 138 20.027 -3.969 -0.585 999 H GLU 139 H GLU 139 13.411 -0.295 -0.333 1000 HA GLU 139 HA GLU 139 13.671 2.185 -1.921 1001 HB2 GLU 139 1HB GLU 139 15.258 0.650 -3.041 1002 HB3 GLU 139 2HB GLU 139 14.012 -0.584 -3.149 1003 HG2 GLU 139 1HG GLU 139 12.701 0.817 -4.647 1004 HG3 GLU 139 2HG GLU 139 13.864 2.130 -4.478 1005 H VAL 140 H VAL 140 11.723 2.964 -1.865 1006 HA VAL 140 HA VAL 140 9.421 1.089 -2.403 1007 HB VAL 140 HB VAL 140 9.434 3.680 -0.783 1008 HG11 VAL 140 1HG1 VAL 140 7.149 3.047 -0.183 1009 HG12 VAL 140 1HG2 VAL 140 7.337 3.279 -1.937 1010 HG13 VAL 140 1HG3 VAL 140 7.257 1.635 -1.259 1011 HG21 VAL 140 2HG3 VAL 140 10.614 1.862 0.403 1012 HG22 VAL 140 2HG1 VAL 140 9.051 2.216 1.175 1013 HG23 VAL 140 2HG2 VAL 140 9.224 0.783 0.135 1014 H LYS 141 H LYS 141 8.273 1.379 -4.098 1015 HA LYS 141 HA LYS 141 8.127 4.073 -5.339 1016 HB2 LYS 141 1HB LYS 141 9.240 1.605 -6.725 1017 HB3 LYS 141 2HB LYS 141 8.655 3.021 -7.589 1018 HG2 LYS 141 1HG LYS 141 10.363 4.415 -6.524 1019 HG3 LYS 141 2HG LYS 141 10.928 3.028 -5.581 1020 HD2 LYS 141 1HD LYS 141 11.553 1.844 -7.634 1021 HD3 LYS 141 2HD LYS 141 10.903 3.163 -8.619 1022 HE2 LYS 141 1HE LYS 141 12.604 4.665 -7.934 1023 HE3 LYS 141 2HE LYS 141 13.068 3.656 -6.563 1024 HZ1 LYS 141 3HZ LYS 141 13.456 2.966 -9.399 1025 HZ2 LYS 141 1HZ LYS 141 14.628 3.477 -8.357 1026 HZ3 LYS 141 2HZ LYS 141 13.888 2.022 -8.117 1027 H VAL 142 H VAL 142 6.412 4.403 -6.710 1028 HA VAL 142 HA VAL 142 4.396 2.173 -6.872 1029 HB VAL 142 HB VAL 142 3.841 5.103 -6.199 1030 HG11 VAL 142 1HG1 VAL 142 1.524 4.369 -5.915 1031 HG12 VAL 142 1HG2 VAL 142 2.108 4.105 -7.575 1032 HG13 VAL 142 1HG3 VAL 142 1.977 2.733 -6.448 1033 HG21 VAL 142 2HG3 VAL 142 4.821 3.883 -4.286 1034 HG22 VAL 142 2HG1 VAL 142 3.100 4.233 -4.003 1035 HG23 VAL 142 2HG2 VAL 142 3.609 2.595 -4.483 1036 H PHE 143 H PHE 143 3.227 1.987 -8.645 1037 HA PHE 143 HA PHE 143 3.515 3.990 -10.801 1038 HB2 PHE 143 1HB PHE 143 4.496 2.411 -12.384 1039 HB3 PHE 143 2HB PHE 143 5.573 2.599 -11.009 1040 HD1 PHE 143 2HD PHE 143 5.705 0.808 -9.281 1041 HD2 PHE 143 1HD PHE 143 3.520 0.314 -12.919 1042 HE1 PHE 143 2HE PHE 143 5.721 -1.643 -8.955 1043 HE2 PHE 143 1HE PHE 143 3.531 -2.137 -12.594 1044 HZ PHE 143 HZ PHE 143 4.631 -3.116 -10.612 1045 H ASP 144 H ASP 144 2.287 3.442 -12.724 1046 HA ASP 144 HA ASP 144 -0.152 1.879 -11.980 1047 HB2 ASP 144 1HB ASP 144 -0.484 4.248 -12.683 1048 HB3 ASP 144 2HB ASP 144 0.311 3.904 -14.213 1049 H GLU 145 H GLU 145 -0.218 -0.123 -12.588 1050 HA GLU 145 HA GLU 145 1.314 -0.994 -14.978 1051 HB2 GLU 145 1HB GLU 145 1.421 -2.325 -12.866 1052 HB3 GLU 145 2HB GLU 145 -0.315 -2.588 -12.953 1053 HG2 GLU 145 1HG GLU 145 -0.010 -3.774 -15.105 1054 HG3 GLU 145 2HG GLU 145 1.731 -3.546 -14.965 1055 HA PRO 146 HA PRO 146 -2.194 -0.586 -17.669 1056 HB2 PRO 146 1HB PRO 146 -0.476 -2.658 -19.110 1057 HB3 PRO 146 2HB PRO 146 -1.242 -1.213 -19.780 1058 HG2 PRO 146 1HG PRO 146 1.378 -1.151 -19.339 1059 HG3 PRO 146 2HG PRO 146 0.408 0.252 -18.883 1060 HD2 PRO 146 1HD PRO 146 1.504 -1.975 -17.127 1061 HD3 PRO 146 2HD PRO 146 1.412 -0.199 -16.795 Start of MODEL 19 1 H MET 1 1H MET 1 -6.761 4.833 -14.514 2 HA MET 1 HA MET 1 -8.108 2.634 -13.513 3 HB2 MET 1 1HB MET 1 -5.468 2.995 -14.975 4 HB3 MET 1 2HB MET 1 -6.242 1.440 -14.699 5 HG2 MET 1 1HG MET 1 -8.194 2.177 -16.017 6 HG3 MET 1 2HG MET 1 -7.416 3.737 -16.294 7 HE1 MET 1 3HE MET 1 -7.743 0.052 -17.321 8 HE2 MET 1 1HE MET 1 -6.205 -0.306 -18.145 9 HE3 MET 1 2HE MET 1 -6.236 -0.068 -16.380 10 H ALA 2 H ALA 2 -7.042 0.747 -12.556 11 HA ALA 2 HA ALA 2 -6.044 1.432 -9.955 12 HB1 ALA 2 3HB ALA 2 -6.015 -1.230 -11.420 13 HB2 ALA 2 1HB ALA 2 -5.732 -1.000 -9.678 14 HB3 ALA 2 2HB ALA 2 -7.323 -0.622 -10.381 15 H LYS 3 H LYS 3 -4.045 0.902 -8.978 16 HA LYS 3 HA LYS 3 -1.747 0.722 -10.892 17 HB2 LYS 3 1HB LYS 3 -1.888 2.539 -8.454 18 HB3 LYS 3 2HB LYS 3 -0.518 2.357 -9.540 19 HG2 LYS 3 1HG LYS 3 -1.940 3.254 -11.400 20 HG3 LYS 3 2HG LYS 3 -3.219 3.554 -10.215 21 HD2 LYS 3 1HD LYS 3 -1.709 5.033 -8.942 22 HD3 LYS 3 2HD LYS 3 -0.410 4.715 -10.100 23 HE2 LYS 3 1HE LYS 3 -1.847 5.666 -11.914 24 HE3 LYS 3 2HE LYS 3 -3.069 6.062 -10.702 25 HZ1 LYS 3 3HZ LYS 3 -0.314 7.101 -10.752 26 HZ2 LYS 3 1HZ LYS 3 -1.670 7.932 -11.188 27 HZ3 LYS 3 2HZ LYS 3 -1.455 7.469 -9.620 28 H LYS 4 H LYS 4 0.353 0.439 -9.520 29 HA LYS 4 HA LYS 4 -0.160 -1.461 -7.274 30 HB2 LYS 4 1HB LYS 4 0.112 -2.774 -9.399 31 HB3 LYS 4 2HB LYS 4 1.695 -2.040 -9.617 32 HG2 LYS 4 1HG LYS 4 2.445 -3.053 -7.480 33 HG3 LYS 4 2HG LYS 4 0.861 -3.823 -7.311 34 HD2 LYS 4 1HD LYS 4 1.199 -5.085 -9.369 35 HD3 LYS 4 2HD LYS 4 2.718 -4.231 -9.682 36 HE2 LYS 4 1HE LYS 4 3.543 -5.149 -7.442 37 HE3 LYS 4 2HE LYS 4 2.115 -6.187 -7.444 38 HZ1 LYS 4 3HZ LYS 4 4.194 -6.140 -9.528 39 HZ2 LYS 4 1HZ LYS 4 4.013 -7.297 -8.367 40 HZ3 LYS 4 2HZ LYS 4 2.859 -7.109 -9.529 41 H GLY 5 H GLY 5 1.258 -1.434 -5.662 42 HA2 GLY 5 1HA GLY 5 3.449 0.588 -5.909 43 HA3 GLY 5 2HA GLY 5 2.575 0.212 -4.405 44 H TYR 6 H TYR 6 5.457 0.171 -4.927 45 HA TYR 6 HA TYR 6 5.965 -2.700 -4.226 46 HB2 TYR 6 1HB TYR 6 7.685 -0.873 -5.947 47 HB3 TYR 6 2HB TYR 6 8.191 -2.443 -5.338 48 HD1 TYR 6 1HD TYR 6 5.834 -0.710 -7.601 49 HD2 TYR 6 2HD TYR 6 7.472 -4.474 -6.354 50 HE1 TYR 6 1HE TYR 6 4.834 -1.801 -9.582 51 HE2 TYR 6 2HE TYR 6 6.473 -5.565 -8.334 52 HH TYR 6 HH TYR 6 4.526 -3.717 -10.668 53 H ILE 7 H ILE 7 6.780 -2.999 -2.311 54 HA ILE 7 HA ILE 7 8.638 -0.893 -1.231 55 HB ILE 7 HB ILE 7 6.697 -2.741 0.241 56 HG12 ILE 7 1HG1 ILE 7 6.941 0.269 0.360 57 HG13 ILE 7 1HG2 ILE 7 5.838 -0.572 -0.718 58 HG21 ILE 7 2HG1 ILE 7 7.659 -1.826 2.315 59 HG22 ILE 7 2HG2 ILE 7 8.885 -2.713 1.379 60 HG23 ILE 7 2HG3 ILE 7 8.869 -0.934 1.365 61 HD11 ILE 7 1HD3 ILE 7 5.843 -0.757 2.303 62 HD12 ILE 7 1HD1 ILE 7 4.701 0.167 1.300 63 HD13 ILE 7 1HD2 ILE 7 4.727 -1.611 1.212 64 H LEU 8 H LEU 8 10.623 -1.432 -1.362 65 HA LEU 8 HA LEU 8 11.343 -4.310 -0.995 66 HB2 LEU 8 1HB LEU 8 12.221 -3.249 -3.034 67 HB3 LEU 8 2HB LEU 8 12.920 -1.939 -2.079 68 HG LEU 8 HG LEU 8 14.428 -3.624 -0.981 69 HD11 LEU 8 1HD1 LEU 8 14.648 -5.825 -2.044 70 HD12 LEU 8 1HD2 LEU 8 13.033 -5.596 -1.335 71 HD13 LEU 8 1HD3 LEU 8 13.260 -5.457 -3.094 72 HD21 LEU 8 2HD3 LEU 8 15.156 -2.231 -2.890 73 HD22 LEU 8 2HD1 LEU 8 15.897 -3.848 -2.957 74 HD23 LEU 8 2HD2 LEU 8 14.526 -3.452 -4.022 75 H MET 9 H MET 9 12.136 -5.018 0.808 76 HA MET 9 HA MET 9 12.772 -3.053 2.938 77 HB2 MET 9 1HB MET 9 12.646 -6.084 3.077 78 HB3 MET 9 2HB MET 9 12.698 -4.967 4.433 79 HG2 MET 9 1HG MET 9 10.432 -5.241 2.440 80 HG3 MET 9 2HG MET 9 10.452 -5.849 4.096 81 HE1 MET 9 3HE MET 9 11.717 -3.632 5.840 82 HE2 MET 9 1HE MET 9 10.300 -2.639 6.257 83 HE3 MET 9 2HE MET 9 10.166 -4.415 6.225 84 H GLU 10 H GLU 10 14.647 -2.967 4.102 85 HA GLU 10 HA GLU 10 17.074 -3.375 2.608 86 HB2 GLU 10 1HB GLU 10 16.717 -1.665 4.446 87 HB3 GLU 10 2HB GLU 10 16.761 -2.980 5.612 88 HG2 GLU 10 1HG GLU 10 18.899 -1.870 5.520 89 HG3 GLU 10 2HG GLU 10 19.053 -3.525 4.934 90 H ASN 11 H ASN 11 15.227 -5.443 4.677 91 HA ASN 11 HA ASN 11 17.423 -7.264 5.302 92 HB2 ASN 11 1HB ASN 11 14.412 -7.523 5.480 93 HB3 ASN 11 2HB ASN 11 15.528 -8.793 5.960 94 HD21 ASN 11 2HD2 ASN 11 13.685 -7.561 7.679 95 HD22 ASN 11 2HD1 ASN 11 14.568 -6.705 8.899 96 H GLY 12 H GLY 12 15.691 -6.613 2.489 97 HA2 GLY 12 1HA GLY 12 16.319 -7.698 0.426 98 HA3 GLY 12 2HA GLY 12 16.625 -9.198 1.334 99 H GLY 13 H GLY 13 13.915 -8.078 2.714 100 HA2 GLY 13 1HA GLY 13 12.192 -9.951 1.326 101 HA3 GLY 13 2HA GLY 13 11.724 -8.842 2.636 102 H LYS 14 H LYS 14 10.181 -9.451 0.293 103 HA LYS 14 HA LYS 14 10.076 -6.723 -0.941 104 HB2 LYS 14 1HB LYS 14 11.107 -8.386 -2.520 105 HB3 LYS 14 2HB LYS 14 9.644 -9.353 -2.410 106 HG2 LYS 14 1HG LYS 14 9.530 -8.083 -4.425 107 HG3 LYS 14 2HG LYS 14 8.352 -7.393 -3.301 108 HD2 LYS 14 1HD LYS 14 9.921 -5.595 -2.716 109 HD3 LYS 14 2HD LYS 14 11.151 -6.304 -3.774 110 HE2 LYS 14 1HE LYS 14 8.470 -5.151 -4.616 111 HE3 LYS 14 2HE LYS 14 10.066 -4.467 -4.933 112 HZ1 LYS 14 3HZ LYS 14 9.068 -7.032 -5.980 113 HZ2 LYS 14 1HZ LYS 14 9.210 -5.628 -6.833 114 HZ3 LYS 14 2HZ LYS 14 10.560 -6.395 -6.275 115 H ILE 15 H ILE 15 8.211 -5.755 -0.848 116 HA ILE 15 HA ILE 15 5.755 -7.437 -0.407 117 HB ILE 15 HB ILE 15 6.383 -4.652 0.697 118 HG12 ILE 15 1HG1 ILE 15 6.032 -7.259 2.194 119 HG13 ILE 15 1HG2 ILE 15 7.584 -6.524 1.825 120 HG21 ILE 15 2HG1 ILE 15 4.224 -4.878 1.858 121 HG22 ILE 15 2HG2 ILE 15 4.010 -4.940 0.093 122 HG23 ILE 15 2HG3 ILE 15 3.948 -6.439 1.048 123 HD11 ILE 15 1HD3 ILE 15 5.394 -5.277 3.501 124 HD12 ILE 15 1HD1 ILE 15 6.896 -6.019 4.101 125 HD13 ILE 15 1HD2 ILE 15 6.967 -4.532 3.125 126 H GLU 16 H GLU 16 4.635 -7.548 -2.139 127 HA GLU 16 HA GLU 16 4.380 -5.060 -3.801 128 HB2 GLU 16 1HB GLU 16 4.136 -7.985 -4.628 129 HB3 GLU 16 2HB GLU 16 3.864 -6.606 -5.685 130 HG2 GLU 16 1HG GLU 16 6.235 -5.914 -5.308 131 HG3 GLU 16 2HG GLU 16 6.476 -7.391 -4.377 132 H PHE 17 H PHE 17 2.468 -4.199 -4.168 133 HA PHE 17 HA PHE 17 0.032 -5.643 -3.268 134 HB2 PHE 17 1HB PHE 17 -0.567 -3.737 -1.761 135 HB3 PHE 17 2HB PHE 17 0.816 -4.657 -1.189 136 HD1 PHE 17 2HD PHE 17 3.124 -3.732 -1.487 137 HD2 PHE 17 1HD PHE 17 -0.388 -1.437 -2.287 138 HE1 PHE 17 2HE PHE 17 4.456 -1.653 -1.357 139 HE2 PHE 17 1HE PHE 17 0.941 0.645 -2.160 140 HZ PHE 17 HZ PHE 17 3.363 0.536 -1.695 141 H GLU 18 H GLU 18 -1.897 -4.785 -3.953 142 HA GLU 18 HA GLU 18 -1.639 -2.978 -6.297 143 HB2 GLU 18 1HB GLU 18 -3.994 -4.575 -5.202 144 HB3 GLU 18 2HB GLU 18 -4.041 -3.587 -6.656 145 HG2 GLU 18 1HG GLU 18 -2.287 -6.016 -6.226 146 HG3 GLU 18 2HG GLU 18 -3.785 -5.967 -7.154 147 H LEU 19 H LEU 19 -2.907 -1.152 -6.623 148 HA LEU 19 HA LEU 19 -3.751 0.162 -4.064 149 HB2 LEU 19 1HB LEU 19 -2.806 1.364 -6.698 150 HB3 LEU 19 2HB LEU 19 -3.387 2.297 -5.316 151 HG LEU 19 HG LEU 19 -0.900 0.548 -5.338 152 HD11 LEU 19 1HD1 LEU 19 0.298 2.690 -5.277 153 HD12 LEU 19 1HD2 LEU 19 -0.681 2.526 -6.754 154 HD13 LEU 19 1HD3 LEU 19 -1.247 3.559 -5.420 155 HD21 LEU 19 2HD3 LEU 19 -2.001 0.691 -3.128 156 HD22 LEU 19 2HD1 LEU 19 -0.476 1.611 -3.147 157 HD23 LEU 19 2HD2 LEU 19 -2.034 2.466 -3.259 158 H PHE 20 H PHE 20 -5.633 1.312 -3.936 159 HA PHE 20 HA PHE 20 -7.600 0.754 -6.127 160 HB2 PHE 20 1HB PHE 20 -8.088 0.355 -3.145 161 HB3 PHE 20 2HB PHE 20 -9.261 0.113 -4.430 162 HD1 PHE 20 2HD PHE 20 -8.728 -1.676 -6.201 163 HD2 PHE 20 1HD PHE 20 -6.725 -1.396 -2.438 164 HE1 PHE 20 2HE PHE 20 -8.024 -4.038 -6.402 165 HE2 PHE 20 1HE PHE 20 -6.018 -3.756 -2.637 166 HZ PHE 20 HZ PHE 20 -6.667 -5.078 -4.619 167 HA PRO 21 HA PRO 21 -7.938 5.184 -4.972 168 HB2 PRO 21 1HB PRO 21 -8.383 5.970 -7.581 169 HB3 PRO 21 2HB PRO 21 -6.740 5.775 -6.959 170 HG2 PRO 21 1HG PRO 21 -8.418 3.808 -8.575 171 HG3 PRO 21 2HG PRO 21 -6.743 4.298 -8.847 172 HD2 PRO 21 1HD PRO 21 -7.295 1.987 -7.557 173 HD3 PRO 21 2HD PRO 21 -5.916 3.030 -7.021 174 H ASN 22 H ASN 22 -9.809 2.739 -6.509 175 HA ASN 22 HA ASN 22 -12.308 4.237 -6.504 176 HB2 ASN 22 1HB ASN 22 -11.661 1.281 -6.576 177 HB3 ASN 22 2HB ASN 22 -13.304 1.908 -6.583 178 HD21 ASN 22 2HD2 ASN 22 -12.168 0.348 -8.629 179 HD22 ASN 22 2HD1 ASN 22 -12.094 1.313 -10.066 180 H GLU 23 H GLU 23 -10.434 2.563 -4.101 181 HA GLU 23 HA GLU 23 -12.676 2.650 -2.158 182 HB2 GLU 23 1HB GLU 23 -9.778 1.738 -1.910 183 HB3 GLU 23 2HB GLU 23 -10.951 1.685 -0.602 184 HG2 GLU 23 1HG GLU 23 -12.329 0.111 -1.859 185 HG3 GLU 23 2HG GLU 23 -11.223 0.207 -3.227 186 H ALA 24 H ALA 24 -9.541 4.211 -2.742 187 HA ALA 24 HA ALA 24 -10.505 6.543 -1.223 188 HB1 ALA 24 3HB ALA 24 -7.969 5.063 -0.439 189 HB2 ALA 24 1HB ALA 24 -8.494 6.636 0.203 190 HB3 ALA 24 2HB ALA 24 -9.457 5.176 0.529 191 HA PRO 25 HA PRO 25 -8.354 7.713 -5.078 192 HB2 PRO 25 1HB PRO 25 -9.915 10.205 -4.258 193 HB3 PRO 25 2HB PRO 25 -9.745 9.499 -5.870 194 HG2 PRO 25 1HG PRO 25 -12.040 9.137 -4.573 195 HG3 PRO 25 2HG PRO 25 -11.326 7.772 -5.435 196 HD2 PRO 25 1HD PRO 25 -11.281 8.400 -2.462 197 HD3 PRO 25 2HD PRO 25 -11.492 6.805 -3.290 198 H VAL 26 H VAL 26 -8.867 9.928 -2.308 199 HA VAL 26 HA VAL 26 -6.491 11.474 -2.990 200 HB VAL 26 HB VAL 26 -8.143 11.310 -0.423 201 HG11 VAL 26 1HG1 VAL 26 -7.110 13.449 0.162 202 HG12 VAL 26 1HG2 VAL 26 -5.908 12.145 0.022 203 HG13 VAL 26 1HG3 VAL 26 -6.077 13.345 -1.283 204 HG21 VAL 26 2HG3 VAL 26 -9.433 12.078 -2.385 205 HG22 VAL 26 2HG1 VAL 26 -9.155 13.414 -1.242 206 HG23 VAL 26 2HG2 VAL 26 -8.185 13.299 -2.730 207 H THR 27 H THR 27 -7.132 8.854 -0.707 208 HA THR 27 HA THR 27 -4.623 9.108 0.684 209 HB THR 27 HB THR 27 -6.380 6.638 0.328 210 HG1 THR 27 1HG THR 27 -7.469 8.446 1.280 211 HG21 THR 27 2HG3 THR 27 -4.294 7.354 2.422 212 HG22 THR 27 2HG1 THR 27 -5.312 5.896 2.420 213 HG23 THR 27 2HG2 THR 27 -4.101 6.138 1.139 214 H VAL 28 H VAL 28 -5.637 7.010 -2.016 215 HA VAL 28 HA VAL 28 -3.065 5.768 -2.422 216 HB VAL 28 HB VAL 28 -5.339 6.421 -4.358 217 HG11 VAL 28 1HG1 VAL 28 -4.313 4.790 -5.866 218 HG12 VAL 28 1HG2 VAL 28 -3.248 6.185 -5.571 219 HG13 VAL 28 1HG3 VAL 28 -2.931 4.634 -4.756 220 HG21 VAL 28 2HG3 VAL 28 -5.948 4.868 -2.537 221 HG22 VAL 28 2HG1 VAL 28 -5.877 4.021 -4.100 222 HG23 VAL 28 2HG2 VAL 28 -4.543 3.849 -2.933 223 H ALA 29 H ALA 29 -4.462 8.742 -3.776 224 HA ALA 29 HA ALA 29 -2.294 9.346 -5.498 225 HB1 ALA 29 3HB ALA 29 -4.122 11.245 -3.984 226 HB2 ALA 29 1HB ALA 29 -3.101 11.675 -5.375 227 HB3 ALA 29 2HB ALA 29 -4.446 10.529 -5.580 228 H ASN 30 H ASN 30 -2.839 10.300 -2.102 229 HA ASN 30 HA ASN 30 -0.431 11.851 -1.871 230 HB2 ASN 30 1HB ASN 30 -2.195 10.471 0.162 231 HB3 ASN 30 2HB ASN 30 -0.772 11.402 0.613 232 HD21 ASN 30 2HD2 ASN 30 -3.343 12.042 1.455 233 HD22 ASN 30 2HD1 ASN 30 -3.802 13.556 0.749 234 H PHE 31 H PHE 31 -1.133 8.455 -1.036 235 HA PHE 31 HA PHE 31 1.451 7.798 -0.046 236 HB2 PHE 31 1HB PHE 31 -0.548 6.313 0.122 237 HB3 PHE 31 2HB PHE 31 -0.494 6.050 -1.614 238 HD1 PHE 31 1HD PHE 31 1.277 5.444 1.570 239 HD2 PHE 31 2HD PHE 31 1.036 4.513 -2.594 240 HE1 PHE 31 1HE PHE 31 2.819 3.542 1.907 241 HE2 PHE 31 2HE PHE 31 2.577 2.609 -2.259 242 HZ PHE 31 HZ PHE 31 3.470 2.125 -0.008 243 H GLU 32 H GLU 32 0.190 7.633 -3.378 244 HA GLU 32 HA GLU 32 2.589 6.646 -4.573 245 HB2 GLU 32 1HB GLU 32 0.435 6.698 -5.769 246 HB3 GLU 32 2HB GLU 32 0.412 8.454 -5.707 247 HG2 GLU 32 1HG GLU 32 2.418 8.539 -7.123 248 HG3 GLU 32 2HG GLU 32 2.460 6.778 -7.175 249 H LYS 33 H LYS 33 1.474 10.000 -4.081 250 HA LYS 33 HA LYS 33 3.667 11.220 -5.449 251 HB2 LYS 33 1HB LYS 33 1.825 12.223 -3.249 252 HB3 LYS 33 2HB LYS 33 3.040 13.236 -4.014 253 HG2 LYS 33 1HG LYS 33 1.954 12.929 -6.195 254 HG3 LYS 33 2HG LYS 33 0.749 11.868 -5.454 255 HD2 LYS 33 1HD LYS 33 0.025 13.730 -3.982 256 HD3 LYS 33 2HD LYS 33 1.215 14.790 -4.753 257 HE2 LYS 33 1HE LYS 33 0.093 14.453 -6.937 258 HE3 LYS 33 2HE LYS 33 -1.100 13.409 -6.161 259 HZ1 LYS 33 3HZ LYS 33 -0.657 16.252 -5.539 260 HZ2 LYS 33 1HZ LYS 33 -1.911 15.637 -6.417 261 HZ3 LYS 33 2HZ LYS 33 -1.772 15.277 -4.812 262 H LEU 34 H LEU 34 3.253 10.304 -2.046 263 HA LEU 34 HA LEU 34 5.780 11.421 -1.191 264 HB2 LEU 34 1HB LEU 34 3.995 9.238 -0.043 265 HB3 LEU 34 2HB LEU 34 5.445 9.842 0.767 266 HG LEU 34 HG LEU 34 3.025 11.546 0.076 267 HD11 LEU 34 1HD1 LEU 34 2.523 11.415 2.476 268 HD12 LEU 34 1HD2 LEU 34 2.463 9.814 1.702 269 HD13 LEU 34 1HD3 LEU 34 3.868 10.271 2.694 270 HD21 LEU 34 2HD3 LEU 34 5.166 12.775 0.225 271 HD22 LEU 34 2HD1 LEU 34 4.110 13.156 1.607 272 HD23 LEU 34 2HD2 LEU 34 5.479 12.038 1.814 273 H ALA 35 H ALA 35 4.786 8.117 -2.096 274 HA ALA 35 HA ALA 35 7.281 6.894 -1.537 275 HB1 ALA 35 3HB ALA 35 5.210 6.147 -3.633 276 HB2 ALA 35 1HB ALA 35 6.511 5.090 -3.037 277 HB3 ALA 35 2HB ALA 35 5.218 5.619 -1.934 278 H ASN 36 H ASN 36 6.083 8.424 -4.516 279 HA ASN 36 HA ASN 36 8.526 7.653 -5.978 280 HB2 ASN 36 1HB ASN 36 6.029 9.193 -6.707 281 HB3 ASN 36 2HB ASN 36 7.413 9.082 -7.786 282 HD21 ASN 36 2HD2 ASN 36 4.789 8.103 -8.291 283 HD22 ASN 36 2HD1 ASN 36 4.900 6.385 -8.482 284 H GLU 37 H GLU 37 7.935 9.952 -3.714 285 HA GLU 37 HA GLU 37 10.094 11.673 -4.890 286 HB2 GLU 37 1HB GLU 37 8.132 12.156 -2.610 287 HB3 GLU 37 2HB GLU 37 9.506 13.202 -2.943 288 HG2 GLU 37 1HG GLU 37 8.604 13.706 -5.166 289 HG3 GLU 37 2HG GLU 37 7.243 12.627 -4.870 290 H GLY 38 H GLY 38 9.820 8.950 -3.161 291 HA2 GLY 38 1HA GLY 38 11.535 7.803 -2.079 292 HA3 GLY 38 2HA GLY 38 12.537 9.271 -2.160 293 H PHE 39 H PHE 39 9.332 9.536 -0.864 294 HA PHE 39 HA PHE 39 10.316 10.453 1.705 295 HB2 PHE 39 1HB PHE 39 8.213 11.314 0.768 296 HB3 PHE 39 2HB PHE 39 7.523 9.699 0.746 297 HD1 PHE 39 1HD PHE 39 8.708 12.416 2.962 298 HD2 PHE 39 2HD PHE 39 6.526 8.754 2.673 299 HE1 PHE 39 1HE PHE 39 7.828 12.763 5.246 300 HE2 PHE 39 2HE PHE 39 5.642 9.099 4.956 301 HZ PHE 39 HZ PHE 39 6.294 11.104 6.243 302 H TYR 40 H TYR 40 8.441 7.549 0.777 303 HA TYR 40 HA TYR 40 8.602 6.454 3.465 304 HB2 TYR 40 1HB TYR 40 7.699 5.366 0.785 305 HB3 TYR 40 2HB TYR 40 7.786 4.343 2.212 306 HD1 TYR 40 2HD TYR 40 6.516 5.157 4.324 307 HD2 TYR 40 1HD TYR 40 5.797 6.631 0.359 308 HE1 TYR 40 2HE TYR 40 4.274 5.933 5.018 309 HE2 TYR 40 1HE TYR 40 3.557 7.407 1.054 310 HH TYR 40 HH TYR 40 2.482 7.145 4.428 311 H ASN 41 H ASN 41 10.631 6.308 0.643 312 HA ASN 41 HA ASN 41 12.275 4.094 1.354 313 HB2 ASN 41 1HB ASN 41 12.474 5.329 -0.767 314 HB3 ASN 41 2HB ASN 41 13.067 6.738 0.101 315 HD21 ASN 41 2HD2 ASN 41 14.436 5.361 -1.961 316 HD22 ASN 41 2HD1 ASN 41 15.892 4.709 -1.286 317 H GLY 42 H GLY 42 12.960 3.688 3.313 318 HA2 GLY 42 1HA GLY 42 14.951 4.014 4.679 319 HA3 GLY 42 2HA GLY 42 14.730 5.772 4.518 320 H LEU 43 H LEU 43 11.689 4.714 4.858 321 HA LEU 43 HA LEU 43 11.629 5.373 7.733 322 HB2 LEU 43 1HB LEU 43 9.390 4.663 5.792 323 HB3 LEU 43 2HB LEU 43 9.177 5.284 7.432 324 HG LEU 43 HG LEU 43 10.226 6.756 5.002 325 HD11 LEU 43 1HD1 LEU 43 8.362 8.261 5.533 326 HD12 LEU 43 1HD2 LEU 43 7.803 6.595 5.252 327 HD13 LEU 43 1HD3 LEU 43 7.920 7.226 6.911 328 HD21 LEU 43 2HD3 LEU 43 11.668 7.272 6.943 329 HD22 LEU 43 2HD1 LEU 43 10.633 8.659 6.525 330 HD23 LEU 43 2HD2 LEU 43 10.223 7.631 7.920 331 H THR 44 H THR 44 10.582 4.126 9.327 332 HA THR 44 HA THR 44 11.092 1.206 8.843 333 HB THR 44 HB THR 44 11.830 1.040 11.156 334 HG1 THR 44 1HG THR 44 11.236 3.832 11.317 335 HG21 THR 44 2HG3 THR 44 13.106 3.452 9.812 336 HG22 THR 44 2HG1 THR 44 13.836 2.470 11.102 337 HG23 THR 44 2HG2 THR 44 13.524 1.751 9.505 338 H PHE 45 H PHE 45 9.969 -0.274 10.298 339 HA PHE 45 HA PHE 45 7.191 0.679 10.856 340 HB2 PHE 45 1HB PHE 45 8.401 -2.110 10.641 341 HB3 PHE 45 2HB PHE 45 6.746 -1.799 11.144 342 HD1 PHE 45 1HD PHE 45 9.130 -1.454 8.329 343 HD2 PHE 45 2HD PHE 45 5.042 -1.361 9.569 344 HE1 PHE 45 1HE PHE 45 8.414 -1.444 5.963 345 HE2 PHE 45 2HE PHE 45 4.322 -1.353 7.203 346 HZ PHE 45 HZ PHE 45 6.011 -1.393 5.400 347 H HIS 46 H HIS 46 6.884 1.488 12.785 348 HA HIS 46 HA HIS 46 8.848 0.942 14.890 349 HB2 HIS 46 1HB HIS 46 7.776 2.714 16.100 350 HB3 HIS 46 2HB HIS 46 7.836 3.227 14.419 351 HD2 HIS 46 2HD HIS 46 5.188 3.311 13.075 352 HE1 HIS 46 1HE HIS 46 3.117 2.798 16.749 353 H ARG 47 H ARG 47 5.877 -0.417 13.948 354 HA ARG 47 HA ARG 47 5.762 -1.992 16.451 355 HB2 ARG 47 1HB ARG 47 4.340 0.029 16.876 356 HB3 ARG 47 2HB ARG 47 3.388 -0.369 15.455 357 HG2 ARG 47 1HG ARG 47 2.693 -2.483 16.501 358 HG3 ARG 47 2HG ARG 47 3.653 -2.074 17.943 359 HD2 ARG 47 1HD ARG 47 1.380 -0.444 16.832 360 HD3 ARG 47 2HD ARG 47 1.285 -1.562 18.212 361 HE ARG 47 HE ARG 47 2.445 1.102 18.162 362 HH11 ARG 47 1HH1 ARG 47 2.322 -1.989 19.826 363 HH12 ARG 47 1HH2 ARG 47 2.856 -1.329 21.355 364 HH21 ARG 47 2HH1 ARG 47 3.136 1.948 20.152 365 HH22 ARG 47 2HH2 ARG 47 3.317 0.900 21.541 366 H VAL 48 H VAL 48 6.532 -3.498 14.799 367 HA VAL 48 HA VAL 48 4.478 -4.510 12.911 368 HB VAL 48 HB VAL 48 7.182 -5.644 13.776 369 HG11 VAL 48 1HG1 VAL 48 6.997 -7.047 11.780 370 HG12 VAL 48 1HG2 VAL 48 5.685 -7.362 12.940 371 HG13 VAL 48 1HG3 VAL 48 5.368 -6.399 11.477 372 HG21 VAL 48 2HG3 VAL 48 7.391 -3.459 12.641 373 HG22 VAL 48 2HG1 VAL 48 7.983 -4.776 11.601 374 HG23 VAL 48 2HG2 VAL 48 6.383 -4.058 11.301 375 H ILE 49 H ILE 49 2.883 -5.717 13.395 376 HA ILE 49 HA ILE 49 3.230 -7.737 15.588 377 HB ILE 49 HB ILE 49 0.719 -6.073 15.053 378 HG12 ILE 49 1HG1 ILE 49 2.631 -5.891 17.394 379 HG13 ILE 49 1HG2 ILE 49 2.558 -4.745 16.064 380 HG21 ILE 49 2HG1 ILE 49 -0.110 -7.144 17.109 381 HG22 ILE 49 2HG2 ILE 49 0.278 -8.358 15.867 382 HG23 ILE 49 2HG3 ILE 49 1.393 -8.089 17.229 383 HD11 ILE 49 1HD3 ILE 49 0.309 -5.355 17.996 384 HD12 ILE 49 1HD1 ILE 49 1.353 -3.914 18.005 385 HD13 ILE 49 1HD2 ILE 49 0.235 -4.195 16.648 386 HA PRO 50 HA PRO 50 1.938 -10.077 11.983 387 HB2 PRO 50 1HB PRO 50 3.235 -12.372 12.747 388 HB3 PRO 50 2HB PRO 50 4.137 -11.046 12.003 389 HG2 PRO 50 1HG PRO 50 3.818 -11.717 14.960 390 HG3 PRO 50 2HG PRO 50 5.303 -11.355 14.077 391 HD2 PRO 50 1HD PRO 50 4.035 -9.436 15.523 392 HD3 PRO 50 2HD PRO 50 4.850 -9.039 13.956 393 H GLY 51 H GLY 51 0.278 -11.365 11.725 394 HA2 GLY 51 1HA GLY 51 -1.399 -12.904 12.412 395 HA3 GLY 51 2HA GLY 51 -0.877 -12.707 14.101 396 H PHE 52 H PHE 52 -0.841 -9.658 13.269 397 HA PHE 52 HA PHE 52 -3.797 -9.202 13.411 398 HB2 PHE 52 1HB PHE 52 -1.647 -7.883 15.119 399 HB3 PHE 52 2HB PHE 52 -3.301 -7.308 14.999 400 HD1 PHE 52 2HD PHE 52 -5.155 -8.613 15.947 401 HD2 PHE 52 1HD PHE 52 -1.088 -9.842 16.394 402 HE1 PHE 52 2HE PHE 52 -5.820 -10.141 17.772 403 HE2 PHE 52 1HE PHE 52 -1.750 -11.375 18.217 404 HZ PHE 52 HZ PHE 52 -4.117 -11.524 18.906 405 H VAL 53 H VAL 53 -1.324 -6.744 13.721 406 HA VAL 53 HA VAL 53 -1.376 -5.971 10.888 407 HB VAL 53 HB VAL 53 -3.620 -5.149 11.675 408 HG11 VAL 53 1HG1 VAL 53 -3.731 -3.381 13.364 409 HG12 VAL 53 1HG2 VAL 53 -3.110 -4.907 14.036 410 HG13 VAL 53 1HG3 VAL 53 -1.990 -3.571 13.676 411 HG21 VAL 53 2HG3 VAL 53 -2.359 -3.900 9.957 412 HG22 VAL 53 2HG1 VAL 53 -3.287 -2.793 10.994 413 HG23 VAL 53 2HG2 VAL 53 -1.533 -2.974 11.231 414 H SER 54 H SER 54 0.394 -5.042 10.355 415 HA SER 54 HA SER 54 2.282 -4.089 12.476 416 HB2 SER 54 1HB SER 54 3.211 -5.547 10.960 417 HB3 SER 54 2HB SER 54 2.589 -4.653 9.582 418 HG SER 54 HG SER 54 4.733 -4.170 10.035 419 H GLN 55 H GLN 55 2.391 -2.004 13.007 420 HA GLN 55 HA GLN 55 1.494 0.040 11.011 421 HB2 GLN 55 1HB GLN 55 0.394 0.081 13.267 422 HB3 GLN 55 2HB GLN 55 1.969 0.322 14.009 423 HG2 GLN 55 1HG GLN 55 2.222 2.453 12.844 424 HG3 GLN 55 2HG GLN 55 0.642 2.206 12.049 425 HE21 GLN 55 2HE2 GLN 55 1.020 4.497 13.456 426 HE22 GLN 55 2HE1 GLN 55 0.118 4.459 14.933 427 H GLY 56 H GLY 56 2.830 1.402 10.098 428 HA2 GLY 56 1HA GLY 56 5.493 1.896 11.255 429 HA3 GLY 56 2HA GLY 56 5.473 1.008 9.713 430 H GLY 57 H GLY 57 6.800 3.116 9.327 431 HA2 GLY 57 1HA GLY 57 6.437 4.746 7.497 432 HA3 GLY 57 2HA GLY 57 4.908 5.194 8.291 433 H CYS 58 H CYS 58 7.751 4.505 10.197 434 HA CYS 58 HA CYS 58 7.801 7.395 11.101 435 HB2 CYS 58 1HB CYS 58 8.507 4.919 12.598 436 HB3 CYS 58 2HB CYS 58 8.687 6.575 13.159 437 HG CYS 58 HG CYS 58 6.165 7.201 12.909 438 HA PRO 59 HA PRO 59 11.898 7.499 9.271 439 HB2 PRO 59 1HB PRO 59 12.039 9.887 11.149 440 HB3 PRO 59 2HB PRO 59 12.422 9.824 9.424 441 HG2 PRO 59 1HG PRO 59 10.148 10.988 10.168 442 HG3 PRO 59 2HG PRO 59 10.136 9.913 8.767 443 HD2 PRO 59 1HD PRO 59 9.273 9.337 11.631 444 HD3 PRO 59 2HD PRO 59 8.454 8.887 10.083 445 H ARG 60 H ARG 60 11.141 7.699 12.702 446 HA ARG 60 HA ARG 60 13.964 6.863 13.285 447 HB2 ARG 60 1HB ARG 60 11.950 8.335 15.030 448 HB3 ARG 60 2HB ARG 60 13.542 7.808 15.554 449 HG2 ARG 60 1HG ARG 60 14.590 9.308 13.912 450 HG3 ARG 60 2HG ARG 60 12.977 9.841 13.381 451 HD2 ARG 60 1HD ARG 60 12.512 10.643 15.633 452 HD3 ARG 60 2HD ARG 60 14.141 10.135 16.140 453 HE ARG 60 HE ARG 60 14.431 11.808 13.905 454 HH11 ARG 60 1HH1 ARG 60 13.297 12.004 17.224 455 HH12 ARG 60 1HH2 ARG 60 13.730 13.689 17.405 456 HH21 ARG 60 2HH1 ARG 60 14.988 13.996 14.152 457 HH22 ARG 60 2HH2 ARG 60 14.687 14.817 15.666 458 H GLY 61 H GLY 61 10.665 5.950 13.414 459 HA2 GLY 61 1HA GLY 61 9.790 3.865 13.994 460 HA3 GLY 61 2HA GLY 61 11.397 3.368 14.569 461 H ASN 62 H ASN 62 10.043 6.374 15.679 462 HA ASN 62 HA ASN 62 9.772 5.188 18.411 463 HB2 ASN 62 1HB ASN 62 10.151 8.035 17.449 464 HB3 ASN 62 2HB ASN 62 9.800 7.606 19.118 465 HD21 ASN 62 2HD2 ASN 62 12.135 8.929 18.057 466 HD22 ASN 62 2HD1 ASN 62 13.497 7.936 18.460 467 H GLY 63 H GLY 63 7.834 5.605 15.874 468 HA2 GLY 63 1HA GLY 63 5.488 5.326 15.933 469 HA3 GLY 63 2HA GLY 63 5.473 5.861 17.628 470 H THR 64 H THR 64 7.425 7.948 15.937 471 HA THR 64 HA THR 64 5.148 9.844 15.449 472 HB THR 64 HB THR 64 7.992 10.469 16.360 473 HG1 THR 64 1HG THR 64 6.862 11.153 18.267 474 HG21 THR 64 2HG3 THR 64 5.596 12.280 15.878 475 HG22 THR 64 2HG1 THR 64 7.169 12.784 16.537 476 HG23 THR 64 2HG2 THR 64 7.054 12.194 14.862 477 H GLY 65 H GLY 65 4.781 10.278 13.441 478 HA2 GLY 65 1HA GLY 65 6.819 9.733 11.400 479 HA3 GLY 65 2HA GLY 65 5.145 10.268 11.125 480 H ASP 66 H ASP 66 6.841 11.459 9.539 481 HA ASP 66 HA ASP 66 6.977 14.228 10.613 482 HB2 ASP 66 1HB ASP 66 9.253 13.147 10.920 483 HB3 ASP 66 2HB ASP 66 9.320 12.912 9.179 484 H ALA 67 H ALA 67 5.106 14.445 9.297 485 HA ALA 67 HA ALA 67 5.869 15.160 6.535 486 HB1 ALA 67 3HB ALA 67 3.587 13.251 7.156 487 HB2 ALA 67 1HB ALA 67 3.945 13.958 5.565 488 HB3 ALA 67 2HB ALA 67 5.102 12.836 6.320 489 H GLY 68 H GLY 68 4.452 16.603 5.504 490 HA2 GLY 68 1HA GLY 68 2.609 18.002 7.388 491 HA3 GLY 68 2HA GLY 68 3.339 18.711 5.929 492 H TYR 69 H TYR 69 1.923 15.483 6.064 493 HA TYR 69 HA TYR 69 -0.257 16.445 4.236 494 HB2 TYR 69 1HB TYR 69 1.310 13.839 4.115 495 HB3 TYR 69 2HB TYR 69 -0.075 14.236 3.108 496 HD1 TYR 69 1HD TYR 69 3.449 15.048 3.844 497 HD2 TYR 69 2HD TYR 69 0.110 15.715 1.233 498 HE1 TYR 69 1HE TYR 69 4.951 16.116 2.197 499 HE2 TYR 69 2HE TYR 69 1.612 16.783 -0.414 500 HH TYR 69 HH TYR 69 5.099 17.106 0.214 501 H THR 70 H THR 70 -2.265 15.636 4.435 502 HA THR 70 HA THR 70 -2.721 13.846 6.802 503 HB THR 70 HB THR 70 -4.875 15.031 7.140 504 HG1 THR 70 1HG THR 70 -5.282 16.914 5.938 505 HG21 THR 70 2HG3 THR 70 -2.475 16.900 7.062 506 HG22 THR 70 2HG1 THR 70 -3.959 17.146 8.011 507 HG23 THR 70 2HG2 THR 70 -2.878 15.783 8.386 508 H ILE 71 H ILE 71 -4.691 12.601 6.758 509 HA ILE 71 HA ILE 71 -5.355 11.754 3.947 510 HB ILE 71 HB ILE 71 -5.130 10.026 6.463 511 HG12 ILE 71 1HG1 ILE 71 -2.931 10.716 5.684 512 HG13 ILE 71 1HG2 ILE 71 -3.195 9.003 5.405 513 HG21 ILE 71 2HG1 ILE 71 -5.491 8.149 4.913 514 HG22 ILE 71 2HG2 ILE 71 -6.874 9.266 4.898 515 HG23 ILE 71 2HG3 ILE 71 -5.694 9.295 3.567 516 HD11 ILE 71 1HD3 ILE 71 -3.417 11.187 3.322 517 HD12 ILE 71 1HD1 ILE 71 -2.074 10.038 3.512 518 HD13 ILE 71 1HD2 ILE 71 -3.687 9.450 3.040 519 HA PRO 72 HA PRO 72 -9.357 13.150 5.420 520 HB2 PRO 72 1HB PRO 72 -9.818 12.575 2.469 521 HB3 PRO 72 2HB PRO 72 -10.293 14.005 3.396 522 HG2 PRO 72 1HG PRO 72 -8.234 14.212 1.721 523 HG3 PRO 72 2HG PRO 72 -8.114 14.956 3.318 524 HD2 PRO 72 1HD PRO 72 -6.973 12.302 2.349 525 HD3 PRO 72 2HD PRO 72 -6.184 13.580 3.360 526 H CYS 73 H CYS 73 -11.102 12.076 5.978 527 HA CYS 73 HA CYS 73 -11.141 9.156 5.845 528 HB2 CYS 73 1HB CYS 73 -12.013 10.309 7.722 529 HB3 CYS 73 2HB CYS 73 -13.231 11.089 6.722 530 HG CYS 73 HG CYS 73 -14.316 9.266 8.167 531 H GLU 74 H GLU 74 -11.290 8.363 3.758 532 HA GLU 74 HA GLU 74 -13.416 9.405 1.966 533 HB2 GLU 74 1HB GLU 74 -11.251 7.290 1.621 534 HB3 GLU 74 2HB GLU 74 -12.466 7.643 0.400 535 HG2 GLU 74 1HG GLU 74 -10.423 9.600 1.478 536 HG3 GLU 74 2HG GLU 74 -10.329 8.742 -0.060 537 H THR 75 H THR 75 -15.197 8.358 1.321 538 HA THR 75 HA THR 75 -15.746 5.711 2.622 539 HB THR 75 HB THR 75 -18.108 6.380 2.855 540 HG1 THR 75 1HG THR 75 -18.638 8.600 2.446 541 HG21 THR 75 2HG3 THR 75 -16.206 8.422 4.068 542 HG22 THR 75 2HG1 THR 75 -17.848 8.055 4.644 543 HG23 THR 75 2HG2 THR 75 -16.574 6.817 4.742 544 H ASP 76 H ASP 76 -15.831 7.706 -0.203 545 HA ASP 76 HA ASP 76 -17.207 5.495 -1.694 546 HB2 ASP 76 1HB ASP 76 -16.892 8.451 -2.367 547 HB3 ASP 76 2HB ASP 76 -17.592 7.254 -3.448 548 H ASN 77 H ASN 77 -14.702 4.936 -4.039 549 HA ASN 77 HA ASN 77 -17.607 5.221 -3.410 550 HB2 ASN 77 1HB ASN 77 -16.119 3.979 -5.736 551 HB3 ASN 77 2HB ASN 77 -17.855 3.821 -5.498 552 HD21 ASN 77 2HD2 ASN 77 -15.409 5.662 -6.855 553 HD22 ASN 77 2HD1 ASN 77 -16.323 7.087 -7.220 554 H ASN 78 H ASN 78 -14.935 2.976 -3.213 555 HA ASN 78 HA ASN 78 -16.799 0.793 -2.394 556 HB2 ASN 78 1HB ASN 78 -13.854 0.822 -3.096 557 HB3 ASN 78 2HB ASN 78 -14.684 -0.581 -2.439 558 HD21 ASN 78 2HD2 ASN 78 -13.382 -0.359 -4.980 559 HD22 ASN 78 2HD1 ASN 78 -14.585 -0.633 -6.196 560 HA PRO 79 HA PRO 79 -15.873 1.369 1.831 561 HB2 PRO 79 1HB PRO 79 -16.630 -1.065 2.808 562 HB3 PRO 79 2HB PRO 79 -17.846 0.005 2.100 563 HG2 PRO 79 1HG PRO 79 -16.387 -2.344 0.813 564 HG3 PRO 79 2HG PRO 79 -18.119 -2.003 0.815 565 HD2 PRO 79 1HD PRO 79 -16.532 -1.308 -1.294 566 HD3 PRO 79 2HD PRO 79 -17.942 -0.292 -0.793 567 H HIS 80 H HIS 80 -14.811 0.181 3.706 568 HA HIS 80 HA HIS 80 -12.129 -0.639 2.654 569 HB2 HIS 80 1HB HIS 80 -12.849 0.587 5.351 570 HB3 HIS 80 2HB HIS 80 -11.228 0.224 4.773 571 HD2 HIS 80 2HD HIS 80 -13.871 3.032 4.542 572 HE1 HIS 80 1HE HIS 80 -10.622 4.101 1.999 573 H ARG 81 H ARG 81 -11.050 -2.365 3.413 574 HA ARG 81 HA ARG 81 -12.442 -4.117 5.382 575 HB2 ARG 81 1HB ARG 81 -11.611 -4.938 2.572 576 HB3 ARG 81 2HB ARG 81 -12.060 -6.065 3.843 577 HG2 ARG 81 1HG ARG 81 -13.916 -3.910 2.816 578 HG3 ARG 81 2HG ARG 81 -13.850 -5.566 2.163 579 HD2 ARG 81 1HD ARG 81 -14.337 -6.428 4.408 580 HD3 ARG 81 2HD ARG 81 -14.500 -4.753 4.986 581 HE ARG 81 HE ARG 81 -16.361 -6.245 3.292 582 HH11 ARG 81 1HH1 ARG 81 -15.407 -3.137 4.623 583 HH12 ARG 81 1HH2 ARG 81 -16.978 -2.408 4.376 584 HH21 ARG 81 2HH1 ARG 81 -18.395 -5.287 2.976 585 HH22 ARG 81 2HH2 ARG 81 -18.670 -3.624 3.443 586 H HIS 82 H HIS 82 -10.887 -3.848 6.886 587 HA HIS 82 HA HIS 82 -8.065 -4.257 6.276 588 HB2 HIS 82 1HB HIS 82 -9.664 -4.080 8.855 589 HB3 HIS 82 2HB HIS 82 -7.944 -4.447 8.847 590 HD2 HIS 82 2HD HIS 82 -6.235 -2.145 8.571 591 HE1 HIS 82 1HE HIS 82 -9.429 0.567 7.870 592 H VAL 83 H VAL 83 -8.546 -6.266 5.027 593 HA VAL 83 HA VAL 83 -8.535 -8.655 6.864 594 HB VAL 83 HB VAL 83 -9.090 -9.953 4.854 595 HG11 VAL 83 1HG1 VAL 83 -11.335 -9.095 4.393 596 HG12 VAL 83 1HG2 VAL 83 -10.944 -9.040 6.128 597 HG13 VAL 83 1HG3 VAL 83 -10.900 -7.549 5.158 598 HG21 VAL 83 2HG3 VAL 83 -7.854 -8.573 3.220 599 HG22 VAL 83 2HG1 VAL 83 -9.539 -8.816 2.703 600 HG23 VAL 83 2HG2 VAL 83 -9.044 -7.265 3.422 601 H THR 84 H THR 84 -7.354 -10.523 5.490 602 HA THR 84 HA THR 84 -4.604 -10.085 5.983 603 HB THR 84 HB THR 84 -5.899 -12.075 4.067 604 HG1 THR 84 1HG THR 84 -5.058 -12.352 6.785 605 HG21 THR 84 2HG3 THR 84 -3.148 -12.055 5.366 606 HG22 THR 84 2HG1 THR 84 -3.823 -13.365 4.371 607 HG23 THR 84 2HG2 THR 84 -3.484 -11.778 3.641 608 H GLY 85 H GLY 85 -3.249 -8.750 5.113 609 HA2 GLY 85 1HA GLY 85 -1.807 -8.255 3.252 610 HA3 GLY 85 2HA GLY 85 -3.145 -8.624 2.140 611 H ALA 86 H ALA 86 -4.913 -7.035 4.131 612 HA ALA 86 HA ALA 86 -5.143 -4.827 2.373 613 HB1 ALA 86 3HB ALA 86 -6.151 -5.109 5.225 614 HB2 ALA 86 1HB ALA 86 -6.714 -3.909 4.039 615 HB3 ALA 86 2HB ALA 86 -7.001 -5.642 3.758 616 H MET 87 H MET 87 -4.467 -2.773 2.349 617 HA MET 87 HA MET 87 -2.634 -1.915 4.568 618 HB2 MET 87 1HB MET 87 -2.351 -1.448 1.579 619 HB3 MET 87 2HB MET 87 -1.383 -0.641 2.804 620 HG2 MET 87 1HG MET 87 -0.528 -2.855 3.548 621 HG3 MET 87 2HG MET 87 -1.451 -3.621 2.253 622 HE1 MET 87 3HE MET 87 1.606 -1.413 3.223 623 HE2 MET 87 1HE MET 87 2.155 -0.791 1.648 624 HE3 MET 87 2HE MET 87 0.613 -0.228 2.339 625 H SER 88 H SER 88 -3.021 -0.065 5.509 626 HA SER 88 HA SER 88 -4.984 1.858 4.232 627 HB2 SER 88 1HB SER 88 -6.185 2.081 6.201 628 HB3 SER 88 2HB SER 88 -6.222 0.413 5.652 629 HG SER 88 HG SER 88 -5.832 0.398 7.785 630 H MET 89 H MET 89 -4.951 3.963 5.256 631 HA MET 89 HA MET 89 -2.324 4.591 6.569 632 HB2 MET 89 1HB MET 89 -4.060 6.266 4.722 633 HB3 MET 89 2HB MET 89 -2.698 6.904 5.632 634 HG2 MET 89 1HG MET 89 -1.291 5.097 4.445 635 HG3 MET 89 2HG MET 89 -2.671 4.920 3.359 636 HE1 MET 89 3HE MET 89 0.320 7.101 4.507 637 HE2 MET 89 1HE MET 89 -0.041 8.693 3.797 638 HE3 MET 89 2HE MET 89 -1.028 8.074 5.144 639 H ALA 90 H ALA 90 -2.237 5.911 8.309 640 HA ALA 90 HA ALA 90 -4.571 5.782 10.016 641 HB1 ALA 90 3HB ALA 90 -1.928 7.237 10.383 642 HB2 ALA 90 1HB ALA 90 -3.147 6.961 11.650 643 HB3 ALA 90 2HB ALA 90 -2.295 5.580 10.919 644 H HIS 91 H HIS 91 -6.055 7.238 10.534 645 HA HIS 91 HA HIS 91 -5.665 10.082 9.840 646 HB2 HIS 91 1HB HIS 91 -7.582 10.276 8.426 647 HB3 HIS 91 2HB HIS 91 -6.640 8.943 7.773 648 HD2 HIS 91 2HD HIS 91 -8.099 6.972 10.361 649 HE1 HIS 91 1HE HIS 91 -11.376 7.425 7.675 650 H ARG 92 H ARG 92 -7.478 11.438 10.568 651 HA ARG 92 HA ARG 92 -9.032 10.212 12.799 652 HB2 ARG 92 1HB ARG 92 -7.270 12.684 13.028 653 HB3 ARG 92 2HB ARG 92 -8.433 12.166 14.239 654 HG2 ARG 92 1HG ARG 92 -6.083 10.479 13.350 655 HG3 ARG 92 2HG ARG 92 -6.062 11.585 14.746 656 HD2 ARG 92 1HD ARG 92 -7.987 10.344 15.675 657 HD3 ARG 92 2HD ARG 92 -7.820 9.179 14.341 658 HE ARG 92 HE ARG 92 -6.097 9.473 16.673 659 HH11 ARG 92 1HH1 ARG 92 -6.447 8.161 13.433 660 HH12 ARG 92 1HH2 ARG 92 -5.224 6.932 13.663 661 HH21 ARG 92 2HH1 ARG 92 -4.510 7.874 16.959 662 HH22 ARG 92 2HH2 ARG 92 -4.127 6.768 15.658 663 H GLY 93 H GLY 93 -9.630 11.213 10.070 664 HA2 GLY 93 1HA GLY 93 -12.094 11.959 10.017 665 HA3 GLY 93 2HA GLY 93 -11.492 13.424 10.827 666 H ARG 94 H ARG 94 -12.610 14.304 8.812 667 HA ARG 94 HA ARG 94 -11.370 13.976 6.228 668 HB2 ARG 94 1HB ARG 94 -13.107 16.179 7.400 669 HB3 ARG 94 2HB ARG 94 -12.579 16.151 5.725 670 HG2 ARG 94 1HG ARG 94 -14.289 14.037 7.061 671 HG3 ARG 94 2HG ARG 94 -14.863 15.326 5.974 672 HD2 ARG 94 1HD ARG 94 -12.884 13.178 5.249 673 HD3 ARG 94 2HD ARG 94 -14.617 13.176 4.849 674 HE ARG 94 HE ARG 94 -13.578 15.588 3.904 675 HH11 ARG 94 1HH1 ARG 94 -13.114 12.154 3.330 676 HH12 ARG 94 1HH2 ARG 94 -12.651 12.368 1.657 677 HH21 ARG 94 2HH1 ARG 94 -12.978 15.854 1.730 678 HH22 ARG 94 2HH2 ARG 94 -12.575 14.462 0.750 679 H ASP 95 H ASP 95 -9.725 14.894 5.257 680 HA ASP 95 HA ASP 95 -7.711 16.048 5.071 681 HB2 ASP 95 1HB ASP 95 -9.382 18.199 6.441 682 HB3 ASP 95 2HB ASP 95 -7.825 18.477 5.674 683 H THR 96 H THR 96 -8.107 14.385 7.429 684 HA THR 96 HA THR 96 -5.974 15.600 9.110 685 HB THR 96 HB THR 96 -8.553 14.467 10.280 686 HG1 THR 96 1HG THR 96 -8.930 16.538 9.473 687 HG21 THR 96 2HG3 THR 96 -6.132 15.781 11.571 688 HG22 THR 96 2HG1 THR 96 -7.602 15.245 12.415 689 HG23 THR 96 2HG2 THR 96 -6.535 14.050 11.642 690 H GLY 97 H GLY 97 -4.388 14.253 9.270 691 HA2 GLY 97 1HA GLY 97 -4.562 11.641 10.284 692 HA3 GLY 97 2HA GLY 97 -4.595 11.492 8.512 693 H SER 98 H SER 98 -2.567 10.327 8.782 694 HA SER 98 HA SER 98 -0.181 12.177 8.928 695 HB2 SER 98 1HB SER 98 0.978 10.942 10.397 696 HB3 SER 98 2HB SER 98 -0.606 11.157 11.125 697 HG SER 98 HG SER 98 -1.155 9.105 10.314 698 H CYS 99 H CYS 99 1.819 10.761 8.386 699 HA CYS 99 HA CYS 99 1.390 9.509 5.732 700 HB2 CYS 99 1HB CYS 99 3.692 9.449 5.531 701 HB3 CYS 99 2HB CYS 99 3.208 11.034 6.114 702 HG CYS 99 HG CYS 99 3.760 10.582 8.612 703 H GLN 100 H GLN 100 1.407 8.473 9.001 704 HA GLN 100 HA GLN 100 2.748 5.933 8.688 705 HB2 GLN 100 1HB GLN 100 0.711 6.936 10.719 706 HB3 GLN 100 2HB GLN 100 1.495 5.365 10.823 707 HG2 GLN 100 1HG GLN 100 3.696 6.485 10.938 708 HG3 GLN 100 2HG GLN 100 2.860 8.063 10.909 709 HE21 GLN 100 2HE2 GLN 100 4.230 8.132 12.979 710 HE22 GLN 100 2HE1 GLN 100 3.435 7.617 14.430 711 H PHE 101 H PHE 101 1.936 3.856 8.558 712 HA PHE 101 HA PHE 101 -0.828 3.575 7.497 713 HB2 PHE 101 1HB PHE 101 -0.070 2.504 5.448 714 HB3 PHE 101 2HB PHE 101 0.615 4.120 5.528 715 HD1 PHE 101 2HD PHE 101 3.010 4.433 6.091 716 HD2 PHE 101 1HD PHE 101 1.313 0.563 5.465 717 HE1 PHE 101 2HE PHE 101 5.276 3.492 5.779 718 HE2 PHE 101 1HE PHE 101 3.576 -0.382 5.155 719 HZ PHE 101 HZ PHE 101 5.557 1.082 5.312 720 H PHE 102 H PHE 102 -1.231 1.225 6.876 721 HA PHE 102 HA PHE 102 0.007 -0.495 8.998 722 HB2 PHE 102 1HB PHE 102 -2.954 -0.305 8.301 723 HB3 PHE 102 2HB PHE 102 -2.240 -1.396 9.478 724 HD1 PHE 102 1HD PHE 102 -3.070 2.114 8.744 725 HD2 PHE 102 2HD PHE 102 -1.598 -0.638 11.661 726 HE1 PHE 102 1HE PHE 102 -3.358 3.827 10.503 727 HE2 PHE 102 2HE PHE 102 -1.887 1.071 13.423 728 HZ PHE 102 HZ PHE 102 -2.765 3.305 12.842 729 H ILE 103 H ILE 103 0.405 -2.562 8.519 730 HA ILE 103 HA ILE 103 -0.820 -3.651 5.994 731 HB ILE 103 HB ILE 103 1.845 -4.398 7.301 732 HG12 ILE 103 1HG1 ILE 103 1.325 -2.991 4.672 733 HG13 ILE 103 1HG2 ILE 103 1.883 -2.211 6.142 734 HG21 ILE 103 2HG1 ILE 103 2.136 -5.846 5.331 735 HG22 ILE 103 2HG2 ILE 103 0.696 -6.317 6.264 736 HG23 ILE 103 2HG3 ILE 103 0.514 -5.393 4.754 737 HD11 ILE 103 1HD3 ILE 103 3.352 -4.380 4.626 738 HD12 ILE 103 1HD1 ILE 103 3.731 -2.642 4.621 739 HD13 ILE 103 1HD2 ILE 103 3.917 -3.589 6.117 740 H VAL 104 H VAL 104 -2.394 -4.942 6.348 741 HA VAL 104 HA VAL 104 -2.691 -6.108 9.073 742 HB VAL 104 HB VAL 104 -4.562 -6.092 6.654 743 HG11 VAL 104 1HG1 VAL 104 -6.294 -6.739 8.257 744 HG12 VAL 104 1HG2 VAL 104 -4.995 -7.952 8.154 745 HG13 VAL 104 1HG3 VAL 104 -5.067 -6.839 9.542 746 HG21 VAL 104 2HG3 VAL 104 -4.125 -3.821 7.520 747 HG22 VAL 104 2HG1 VAL 104 -5.785 -4.337 7.896 748 HG23 VAL 104 2HG2 VAL 104 -4.537 -4.365 9.164 749 H HIS 105 H HIS 105 -2.770 -8.155 9.630 750 HA HIS 105 HA HIS 105 -1.728 -10.057 7.571 751 HB2 HIS 105 1HB HIS 105 -1.697 -10.220 10.616 752 HB3 HIS 105 2HB HIS 105 -1.029 -11.428 9.526 753 HD2 HIS 105 2HD HIS 105 1.574 -10.736 8.382 754 HE1 HIS 105 1HE HIS 105 1.869 -7.118 10.589 755 H GLU 106 H GLU 106 -4.230 -9.655 10.045 756 HA GLU 106 HA GLU 106 -5.736 -11.870 8.706 757 HB2 GLU 106 1HB GLU 106 -5.412 -11.412 11.702 758 HB3 GLU 106 2HB GLU 106 -6.582 -12.513 10.988 759 HG2 GLU 106 1HG GLU 106 -4.714 -13.796 9.972 760 HG3 GLU 106 2HG GLU 106 -3.571 -12.720 10.774 761 HA PRO 107 HA PRO 107 -9.281 -9.302 8.508 762 HB2 PRO 107 1HB PRO 107 -10.630 -11.550 10.076 763 HB3 PRO 107 2HB PRO 107 -11.193 -10.753 8.601 764 HG2 PRO 107 1HG PRO 107 -10.141 -13.184 8.388 765 HG3 PRO 107 2HG PRO 107 -9.681 -11.955 7.205 766 HD2 PRO 107 1HD PRO 107 -8.147 -12.956 9.630 767 HD3 PRO 107 2HD PRO 107 -7.531 -12.535 7.982 768 H GLN 108 H GLN 108 -9.413 -7.579 9.629 769 HA GLN 108 HA GLN 108 -9.831 -7.857 12.587 770 HB2 GLN 108 1HB GLN 108 -8.274 -5.746 11.040 771 HB3 GLN 108 2HB GLN 108 -8.743 -5.564 12.724 772 HG2 GLN 108 1HG GLN 108 -7.005 -7.796 11.651 773 HG3 GLN 108 2HG GLN 108 -6.416 -6.306 12.443 774 HE21 GLN 108 2HE2 GLN 108 -6.537 -9.386 13.046 775 HE22 GLN 108 2HE1 GLN 108 -7.013 -9.423 14.712 776 HA PRO 109 HA PRO 109 -13.608 -5.829 11.036 777 HB2 PRO 109 1HB PRO 109 -15.162 -6.863 13.074 778 HB3 PRO 109 2HB PRO 109 -14.826 -7.806 11.617 779 HG2 PRO 109 1HG PRO 109 -13.417 -7.898 14.319 780 HG3 PRO 109 2HG PRO 109 -14.015 -9.248 13.351 781 HD2 PRO 109 1HD PRO 109 -11.403 -8.569 13.262 782 HD3 PRO 109 2HD PRO 109 -12.267 -9.074 11.754 783 H HIS 110 H HIS 110 -11.794 -5.866 13.980 784 HA HIS 110 HA HIS 110 -13.257 -3.658 15.208 785 HB2 HIS 110 1HB HIS 110 -10.472 -4.777 15.743 786 HB3 HIS 110 2HB HIS 110 -11.272 -3.563 16.730 787 HD2 HIS 110 2HD HIS 110 -10.970 -7.343 16.534 788 HE1 HIS 110 1HE HIS 110 -14.377 -6.534 18.963 789 H LEU 111 H LEU 111 -11.023 -3.906 12.657 790 HA LEU 111 HA LEU 111 -10.378 -0.992 12.904 791 HB2 LEU 111 1HB LEU 111 -9.119 -3.177 11.195 792 HB3 LEU 111 2HB LEU 111 -8.641 -1.477 11.183 793 HG LEU 111 HG LEU 111 -8.386 -3.360 13.555 794 HD11 LEU 111 1HD1 LEU 111 -5.981 -3.223 13.082 795 HD12 LEU 111 1HD2 LEU 111 -6.880 -3.936 11.722 796 HD13 LEU 111 1HD3 LEU 111 -6.322 -2.248 11.633 797 HD21 LEU 111 2HD3 LEU 111 -8.760 -1.000 14.190 798 HD22 LEU 111 2HD1 LEU 111 -7.086 -1.499 14.534 799 HD23 LEU 111 2HD2 LEU 111 -7.442 -0.499 13.105 800 H ASP 112 H ASP 112 -12.700 -2.856 11.634 801 HA ASP 112 HA ASP 112 -12.702 -2.097 8.851 802 HB2 ASP 112 1HB ASP 112 -13.975 -4.044 9.789 803 HB3 ASP 112 2HB ASP 112 -15.033 -2.922 10.635 804 H GLY 113 H GLY 113 -12.492 -0.002 8.413 805 HA2 GLY 113 1HA GLY 113 -13.680 1.967 7.775 806 HA3 GLY 113 2HA GLY 113 -14.856 1.667 9.075 807 H VAL 114 H VAL 114 -12.015 1.047 10.514 808 HA VAL 114 HA VAL 114 -11.964 3.613 11.944 809 HB VAL 114 HB VAL 114 -10.131 1.168 12.031 810 HG11 VAL 114 1HG1 VAL 114 -9.283 2.097 14.129 811 HG12 VAL 114 1HG2 VAL 114 -8.950 3.164 12.744 812 HG13 VAL 114 1HG3 VAL 114 -10.265 3.559 13.878 813 HG21 VAL 114 2HG3 VAL 114 -12.445 0.712 12.768 814 HG22 VAL 114 2HG1 VAL 114 -11.318 0.677 14.145 815 HG23 VAL 114 2HG2 VAL 114 -12.363 2.094 13.885 816 H HIS 115 H HIS 115 -9.773 1.966 9.678 817 HA HIS 115 HA HIS 115 -8.511 4.653 9.233 818 HB2 HIS 115 1HB HIS 115 -7.254 1.900 8.850 819 HB3 HIS 115 2HB HIS 115 -6.471 3.446 8.550 820 HD2 HIS 115 2HD HIS 115 -6.792 0.928 11.353 821 HE1 HIS 115 1HE HIS 115 -5.608 4.588 13.187 822 H THR 116 H THR 116 -7.423 4.765 7.033 823 HA THR 116 HA THR 116 -9.600 4.121 5.094 824 HB THR 116 HB THR 116 -7.305 6.121 4.886 825 HG1 THR 116 1HG THR 116 -9.045 7.631 5.207 826 HG21 THR 116 2HG3 THR 116 -9.771 5.687 3.159 827 HG22 THR 116 2HG1 THR 116 -8.570 6.983 2.957 828 HG23 THR 116 2HG2 THR 116 -8.099 5.287 2.701 829 H VAL 117 H VAL 117 -9.336 2.249 4.146 830 HA VAL 117 HA VAL 117 -6.675 1.164 3.508 831 HB VAL 117 HB VAL 117 -9.486 0.308 2.661 832 HG11 VAL 117 1HG1 VAL 117 -8.447 -1.828 2.073 833 HG12 VAL 117 1HG2 VAL 117 -7.798 -0.482 1.106 834 HG13 VAL 117 1HG3 VAL 117 -6.845 -1.152 2.452 835 HG21 VAL 117 2HG3 VAL 117 -9.133 0.198 5.104 836 HG22 VAL 117 2HG1 VAL 117 -9.215 -1.434 4.399 837 HG23 VAL 117 2HG2 VAL 117 -7.639 -0.737 4.848 838 H PHE 118 H PHE 118 -5.547 1.171 1.734 839 HA PHE 118 HA PHE 118 -6.675 2.735 -0.563 840 HB2 PHE 118 1HB PHE 118 -4.659 4.022 -0.724 841 HB3 PHE 118 2HB PHE 118 -5.187 4.136 0.947 842 HD1 PHE 118 2HD PHE 118 -3.967 2.995 2.731 843 HD2 PHE 118 1HD PHE 118 -2.641 2.843 -1.326 844 HE1 PHE 118 2HE PHE 118 -1.751 2.204 3.488 845 HE2 PHE 118 1HE PHE 118 -0.423 2.049 -0.574 846 HZ PHE 118 HZ PHE 118 0.022 1.730 1.834 847 H GLY 119 H GLY 119 -4.985 0.003 0.569 848 HA2 GLY 119 1HA GLY 119 -4.651 -0.987 -2.163 849 HA3 GLY 119 2HA GLY 119 -3.118 -0.660 -1.319 850 H GLN 120 H GLN 120 -3.236 -3.140 -1.970 851 HA GLN 120 HA GLN 120 -3.453 -4.508 0.608 852 HB2 GLN 120 1HB GLN 120 -5.783 -4.722 -0.267 853 HB3 GLN 120 2HB GLN 120 -5.156 -5.451 -1.739 854 HG2 GLN 120 1HG GLN 120 -4.257 -7.329 -0.436 855 HG3 GLN 120 2HG GLN 120 -4.905 -6.588 1.054 856 HE21 GLN 120 2HE2 GLN 120 -5.956 -8.778 1.143 857 HE22 GLN 120 2HE1 GLN 120 -7.492 -8.954 0.361 858 H VAL 121 H VAL 121 -1.859 -5.858 0.846 859 HA VAL 121 HA VAL 121 0.041 -6.381 -1.286 860 HB VAL 121 HB VAL 121 -0.381 -7.813 1.383 861 HG11 VAL 121 1HG1 VAL 121 1.954 -8.504 1.139 862 HG12 VAL 121 1HG2 VAL 121 0.934 -9.127 -0.179 863 HG13 VAL 121 1HG3 VAL 121 2.012 -7.739 -0.466 864 HG21 VAL 121 2HG3 VAL 121 0.008 -5.389 1.665 865 HG22 VAL 121 2HG1 VAL 121 1.419 -6.328 2.206 866 HG23 VAL 121 2HG2 VAL 121 1.452 -5.498 0.632 867 H THR 122 H THR 122 0.220 -7.839 -2.754 868 HA THR 122 HA THR 122 -1.720 -10.129 -2.664 869 HB THR 122 HB THR 122 -1.758 -10.059 -5.129 870 HG1 THR 122 1HG THR 122 -0.738 -8.250 -6.163 871 HG21 THR 122 2HG3 THR 122 -2.339 -7.344 -3.884 872 HG22 THR 122 2HG1 THR 122 -2.998 -7.950 -5.421 873 HG23 THR 122 2HG2 THR 122 -3.440 -8.741 -3.889 874 H SER 123 H SER 123 1.551 -9.119 -2.900 875 HA SER 123 HA SER 123 2.411 -12.003 -3.137 876 HB2 SER 123 1HB SER 123 2.467 -11.198 -5.355 877 HB3 SER 123 2HB SER 123 3.449 -9.825 -4.869 878 HG SER 123 HG SER 123 4.669 -11.547 -5.645 879 H GLY 124 H GLY 124 4.188 -12.467 -1.939 880 HA2 GLY 124 1HA GLY 124 6.198 -11.997 -0.764 881 HA3 GLY 124 2HA GLY 124 5.811 -10.262 -0.809 882 H MET 125 H MET 125 3.168 -12.251 0.034 883 HA MET 125 HA MET 125 2.897 -11.195 2.679 884 HB2 MET 125 1HB MET 125 1.708 -13.624 1.305 885 HB3 MET 125 2HB MET 125 1.288 -13.166 2.948 886 HG2 MET 125 1HG MET 125 0.878 -11.462 0.475 887 HG3 MET 125 2HG MET 125 -0.367 -12.367 1.339 888 HE1 MET 125 3HE MET 125 0.576 -11.899 4.385 889 HE2 MET 125 1HE MET 125 -0.428 -10.491 4.809 890 HE3 MET 125 2HE MET 125 -1.120 -11.821 3.847 891 H ASP 126 H ASP 126 4.575 -14.027 1.455 892 HA ASP 126 HA ASP 126 5.096 -15.334 3.929 893 HB2 ASP 126 1HB ASP 126 6.755 -15.069 1.390 894 HB3 ASP 126 2HB ASP 126 7.240 -16.075 2.749 895 H VAL 127 H VAL 127 6.591 -12.493 2.464 896 HA VAL 127 HA VAL 127 8.568 -12.230 4.650 897 HB VAL 127 HB VAL 127 7.658 -10.313 2.448 898 HG11 VAL 127 1HG1 VAL 127 9.658 -9.018 3.005 899 HG12 VAL 127 1HG2 VAL 127 8.519 -9.105 4.370 900 HG13 VAL 127 1HG3 VAL 127 9.986 -10.114 4.369 901 HG21 VAL 127 2HG3 VAL 127 8.788 -12.337 1.592 902 HG22 VAL 127 2HG1 VAL 127 9.820 -10.899 1.395 903 HG23 VAL 127 2HG2 VAL 127 10.144 -12.054 2.710 904 H VAL 128 H VAL 128 5.521 -10.649 3.725 905 HA VAL 128 HA VAL 128 5.474 -8.675 5.772 906 HB VAL 128 HB VAL 128 3.194 -10.296 4.541 907 HG11 VAL 128 1HG1 VAL 128 1.717 -8.512 5.328 908 HG12 VAL 128 1HG2 VAL 128 2.511 -9.361 6.675 909 HG13 VAL 128 1HG3 VAL 128 3.086 -7.753 6.174 910 HG21 VAL 128 2HG3 VAL 128 4.500 -8.969 2.918 911 HG22 VAL 128 2HG1 VAL 128 2.876 -8.277 3.147 912 HG23 VAL 128 2HG2 VAL 128 4.285 -7.519 3.927 913 H ARG 129 H ARG 129 4.533 -12.087 5.947 914 HA ARG 129 HA ARG 129 3.432 -11.722 8.642 915 HB2 ARG 129 1HB ARG 129 3.992 -14.205 6.972 916 HB3 ARG 129 2HB ARG 129 3.210 -14.225 8.546 917 HG2 ARG 129 1HG ARG 129 1.352 -12.890 7.657 918 HG3 ARG 129 2HG ARG 129 2.145 -12.856 6.064 919 HD2 ARG 129 1HD ARG 129 1.359 -15.365 7.522 920 HD3 ARG 129 2HD ARG 129 0.365 -14.554 6.290 921 HE ARG 129 HE ARG 129 2.883 -14.944 5.155 922 HH11 ARG 129 1HH1 ARG 129 0.275 -16.919 6.433 923 HH12 ARG 129 1HH2 ARG 129 0.614 -18.272 5.378 924 HH21 ARG 129 2HH1 ARG 129 3.313 -16.707 3.789 925 HH22 ARG 129 2HH2 ARG 129 2.333 -18.153 3.881 926 H THR 130 H THR 130 6.534 -12.052 7.401 927 HA THR 130 HA THR 130 7.507 -13.156 10.019 928 HB THR 130 HB THR 130 9.550 -13.860 8.787 929 HG1 THR 130 1HG THR 130 8.268 -13.497 6.323 930 HG21 THR 130 2HG3 THR 130 6.967 -14.891 7.552 931 HG22 THR 130 2HG1 THR 130 8.539 -15.723 7.530 932 HG23 THR 130 2HG2 THR 130 7.691 -15.462 9.073 933 H MET 131 H MET 131 6.861 -10.333 8.944 934 HA MET 131 HA MET 131 9.389 -8.922 8.975 935 HB2 MET 131 1HB MET 131 6.523 -8.050 9.466 936 HB3 MET 131 2HB MET 131 7.882 -6.936 9.492 937 HG2 MET 131 1HG MET 131 8.389 -7.458 7.155 938 HG3 MET 131 2HG MET 131 7.082 -8.644 7.117 939 HE1 MET 131 3HE MET 131 8.100 -4.908 7.027 940 HE2 MET 131 1HE MET 131 6.570 -4.059 7.351 941 HE3 MET 131 2HE MET 131 7.368 -4.982 8.648 942 H LYS 132 H LYS 132 10.262 -7.576 10.562 943 HA LYS 132 HA LYS 132 9.382 -8.202 13.360 944 HB2 LYS 132 1HB LYS 132 12.229 -7.960 12.309 945 HB3 LYS 132 2HB LYS 132 11.796 -8.033 14.012 946 HG2 LYS 132 1HG LYS 132 10.821 -10.284 13.659 947 HG3 LYS 132 2HG LYS 132 11.305 -10.209 11.959 948 HD2 LYS 132 1HD LYS 132 13.674 -9.964 12.649 949 HD3 LYS 132 2HD LYS 132 13.183 -10.055 14.347 950 HE2 LYS 132 1HE LYS 132 12.267 -12.321 13.959 951 HE3 LYS 132 2HE LYS 132 12.758 -12.231 12.266 952 HZ1 LYS 132 3HZ LYS 132 14.577 -12.125 14.579 953 HZ2 LYS 132 1HZ LYS 132 14.350 -13.421 13.585 954 HZ3 LYS 132 2HZ LYS 132 15.036 -12.041 12.997 955 H ASN 133 H ASN 133 9.713 -6.612 14.919 956 HA ASN 133 HA ASN 133 9.095 -3.963 13.963 957 HB2 ASN 133 1HB ASN 133 8.369 -4.940 16.158 958 HB3 ASN 133 2HB ASN 133 10.027 -4.786 16.726 959 HD21 ASN 133 2HD2 ASN 133 7.627 -3.525 17.747 960 HD22 ASN 133 2HD1 ASN 133 7.888 -1.816 17.647 961 H GLY 134 H GLY 134 10.283 -2.351 13.347 962 HA2 GLY 134 1HA GLY 134 12.186 -0.883 13.661 963 HA3 GLY 134 2HA GLY 134 13.142 -2.282 14.203 964 H ASP 135 H ASP 135 11.471 -3.562 11.765 965 HA ASP 135 HA ASP 135 13.570 -3.537 9.825 966 HB2 ASP 135 1HB ASP 135 10.615 -4.211 9.719 967 HB3 ASP 135 2HB ASP 135 11.593 -4.223 8.258 968 H VAL 136 H VAL 136 13.851 -2.514 7.885 969 HA VAL 136 HA VAL 136 12.443 0.144 7.667 970 HB VAL 136 HB VAL 136 14.743 0.369 8.668 971 HG11 VAL 136 1HG1 VAL 136 16.703 -0.179 7.310 972 HG12 VAL 136 1HG2 VAL 136 15.748 -1.625 7.717 973 HG13 VAL 136 1HG3 VAL 136 15.647 -0.921 6.085 974 HG21 VAL 136 2HG3 VAL 136 13.817 2.150 7.228 975 HG22 VAL 136 2HG1 VAL 136 15.579 2.013 7.019 976 HG23 VAL 136 2HG2 VAL 136 14.482 1.337 5.791 977 H MET 137 H MET 137 11.902 0.890 5.760 978 HA MET 137 HA MET 137 11.944 -1.046 3.539 979 HB2 MET 137 1HB MET 137 10.801 1.762 3.765 980 HB3 MET 137 2HB MET 137 10.596 0.701 2.380 981 HG2 MET 137 1HG MET 137 9.386 -0.917 3.790 982 HG3 MET 137 2HG MET 137 9.603 0.138 5.189 983 HE1 MET 137 3HE MET 137 9.019 2.982 4.534 984 HE2 MET 137 1HE MET 137 7.241 3.075 4.602 985 HE3 MET 137 2HE MET 137 8.128 2.090 5.792 986 H LYS 138 H LYS 138 13.794 -1.310 2.533 987 HA LYS 138 HA LYS 138 15.883 0.554 2.245 988 HB2 LYS 138 1HB LYS 138 16.069 -1.862 1.695 989 HB3 LYS 138 2HB LYS 138 15.038 -1.623 0.292 990 HG2 LYS 138 1HG LYS 138 16.702 -0.196 -0.758 991 HG3 LYS 138 2HG LYS 138 17.719 -0.266 0.688 992 HD2 LYS 138 1HD LYS 138 17.954 -2.715 0.405 993 HD3 LYS 138 2HD LYS 138 16.940 -2.642 -1.043 994 HE2 LYS 138 1HE LYS 138 18.586 -1.149 -2.124 995 HE3 LYS 138 2HE LYS 138 19.599 -1.212 -0.680 996 HZ1 LYS 138 3HZ LYS 138 18.884 -3.517 -2.366 997 HZ2 LYS 138 1HZ LYS 138 20.342 -2.749 -2.346 998 HZ3 LYS 138 2HZ LYS 138 19.828 -3.578 -1.015 999 H GLU 139 H GLU 139 13.121 -0.002 0.061 1000 HA GLU 139 HA GLU 139 13.098 2.843 -0.597 1001 HB2 GLU 139 1HB GLU 139 13.443 2.612 -2.997 1002 HB3 GLU 139 2HB GLU 139 14.869 2.024 -2.154 1003 HG2 GLU 139 1HG GLU 139 14.067 -0.301 -2.462 1004 HG3 GLU 139 2HG GLU 139 12.681 0.316 -3.357 1005 H VAL 140 H VAL 140 11.264 3.516 -1.722 1006 HA VAL 140 HA VAL 140 9.143 1.443 -2.169 1007 HB VAL 140 HB VAL 140 8.750 4.035 -0.601 1008 HG11 VAL 140 1HG1 VAL 140 6.506 3.157 -0.175 1009 HG12 VAL 140 1HG2 VAL 140 6.815 3.381 -1.913 1010 HG13 VAL 140 1HG3 VAL 140 6.862 1.750 -1.203 1011 HG21 VAL 140 2HG3 VAL 140 10.021 2.382 0.724 1012 HG22 VAL 140 2HG1 VAL 140 8.368 2.569 1.355 1013 HG23 VAL 140 2HG2 VAL 140 8.788 1.148 0.369 1014 H LYS 141 H LYS 141 8.100 1.635 -3.947 1015 HA LYS 141 HA LYS 141 7.923 4.324 -5.232 1016 HB2 LYS 141 1HB LYS 141 8.880 1.780 -6.603 1017 HB3 LYS 141 2HB LYS 141 8.476 3.278 -7.428 1018 HG2 LYS 141 1HG LYS 141 10.292 4.433 -6.194 1019 HG3 LYS 141 2HG LYS 141 10.712 2.901 -5.415 1020 HD2 LYS 141 1HD LYS 141 11.146 1.895 -7.640 1021 HD3 LYS 141 2HD LYS 141 10.741 3.436 -8.410 1022 HE2 LYS 141 1HE LYS 141 12.594 4.522 -7.133 1023 HE3 LYS 141 2HE LYS 141 13.026 2.945 -6.464 1024 HZ1 LYS 141 3HZ LYS 141 13.035 3.647 -9.324 1025 HZ2 LYS 141 1HZ LYS 141 14.365 3.496 -8.360 1026 HZ3 LYS 141 2HZ LYS 141 13.437 2.174 -8.699 1027 H VAL 142 H VAL 142 6.319 4.493 -6.884 1028 HA VAL 142 HA VAL 142 4.273 2.297 -6.911 1029 HB VAL 142 HB VAL 142 3.736 5.281 -6.522 1030 HG11 VAL 142 1HG1 VAL 142 1.371 4.658 -6.480 1031 HG12 VAL 142 1HG2 VAL 142 2.132 4.279 -8.043 1032 HG13 VAL 142 1HG3 VAL 142 1.808 2.978 -6.872 1033 HG21 VAL 142 2HG3 VAL 142 4.430 4.132 -4.448 1034 HG22 VAL 142 2HG1 VAL 142 2.706 4.565 -4.390 1035 HG23 VAL 142 2HG2 VAL 142 3.191 2.884 -4.722 1036 H PHE 143 H PHE 143 3.472 1.785 -8.771 1037 HA PHE 143 HA PHE 143 4.008 3.631 -11.072 1038 HB2 PHE 143 1HB PHE 143 4.388 0.607 -11.043 1039 HB3 PHE 143 2HB PHE 143 4.570 1.651 -12.445 1040 HD1 PHE 143 2HD PHE 143 6.471 3.200 -12.615 1041 HD2 PHE 143 1HD PHE 143 6.090 0.464 -9.355 1042 HE1 PHE 143 2HE PHE 143 8.857 3.532 -12.059 1043 HE2 PHE 143 1HE PHE 143 8.475 0.796 -8.796 1044 HZ PHE 143 HZ PHE 143 9.858 2.330 -10.148 1045 H ASP 144 H ASP 144 2.616 3.524 -12.813 1046 HA ASP 144 HA ASP 144 -0.131 2.840 -12.069 1047 HB2 ASP 144 1HB ASP 144 0.503 4.850 -13.466 1048 HB3 ASP 144 2HB ASP 144 0.984 3.754 -14.754 1049 H GLU 145 H GLU 145 0.247 0.569 -11.676 1050 HA GLU 145 HA GLU 145 0.052 -0.981 -14.239 1051 HB2 GLU 145 1HB GLU 145 1.378 -1.813 -11.624 1052 HB3 GLU 145 2HB GLU 145 1.110 -2.878 -12.996 1053 HG2 GLU 145 1HG GLU 145 2.557 -1.429 -14.384 1054 HG3 GLU 145 2HG GLU 145 2.850 -0.402 -12.983 1055 HA PRO 146 HA PRO 146 -3.989 -1.612 -12.197 1056 HB2 PRO 146 1HB PRO 146 -4.301 -2.648 -15.046 1057 HB3 PRO 146 2HB PRO 146 -5.433 -1.667 -14.107 1058 HG2 PRO 146 1HG PRO 146 -4.024 -0.475 -16.024 1059 HG3 PRO 146 2HG PRO 146 -4.212 0.345 -14.471 1060 HD2 PRO 146 1HD PRO 146 -1.840 -1.239 -15.530 1061 HD3 PRO 146 2HD PRO 146 -1.853 0.319 -14.609 Start of MODEL 20 1 H MET 1 1H MET 1 -4.841 2.512 -17.046 2 HA MET 1 HA MET 1 -4.955 -0.080 -16.091 3 HB2 MET 1 1HB MET 1 -2.730 1.978 -16.310 4 HB3 MET 1 2HB MET 1 -2.477 0.280 -15.934 5 HG2 MET 1 1HG MET 1 -3.338 -0.382 -18.107 6 HG3 MET 1 2HG MET 1 -3.767 1.288 -18.486 7 HE1 MET 1 3HE MET 1 -2.471 1.357 -20.731 8 HE2 MET 1 1HE MET 1 -0.802 0.771 -20.935 9 HE3 MET 1 2HE MET 1 -2.103 -0.372 -20.516 10 H ALA 2 H ALA 2 -4.543 -1.016 -14.194 11 HA ALA 2 HA ALA 2 -5.204 0.517 -11.834 12 HB1 ALA 2 3HB ALA 2 -4.114 -2.306 -12.114 13 HB2 ALA 2 1HB ALA 2 -4.804 -1.602 -10.634 14 HB3 ALA 2 2HB ALA 2 -5.832 -1.847 -12.065 15 H LYS 3 H LYS 3 -3.992 1.141 -10.112 16 HA LYS 3 HA LYS 3 -1.072 1.385 -10.636 17 HB2 LYS 3 1HB LYS 3 -2.909 2.671 -8.579 18 HB3 LYS 3 2HB LYS 3 -1.168 2.909 -8.624 19 HG2 LYS 3 1HG LYS 3 -1.366 3.883 -10.893 20 HG3 LYS 3 2HG LYS 3 -3.121 3.672 -10.813 21 HD2 LYS 3 1HD LYS 3 -3.241 5.158 -8.865 22 HD3 LYS 3 2HD LYS 3 -1.479 5.321 -8.856 23 HE2 LYS 3 1HE LYS 3 -1.590 6.316 -11.141 24 HE3 LYS 3 2HE LYS 3 -3.351 6.219 -11.076 25 HZ1 LYS 3 3HZ LYS 3 -1.658 7.766 -9.231 26 HZ2 LYS 3 1HZ LYS 3 -2.564 8.385 -10.461 27 HZ3 LYS 3 2HZ LYS 3 -3.304 7.675 -9.169 28 H LYS 4 H LYS 4 0.515 0.631 -9.353 29 HA LYS 4 HA LYS 4 -0.287 -1.020 -6.995 30 HB2 LYS 4 1HB LYS 4 1.632 -1.902 -9.189 31 HB3 LYS 4 2HB LYS 4 1.336 -2.762 -7.685 32 HG2 LYS 4 1HG LYS 4 -1.021 -3.105 -8.346 33 HG3 LYS 4 2HG LYS 4 -0.710 -2.253 -9.864 34 HD2 LYS 4 1HD LYS 4 1.005 -3.944 -10.455 35 HD3 LYS 4 2HD LYS 4 0.673 -4.800 -8.943 36 HE2 LYS 4 1HE LYS 4 -1.716 -5.059 -9.686 37 HE3 LYS 4 2HE LYS 4 -1.267 -4.346 -11.237 38 HZ1 LYS 4 3HZ LYS 4 -0.133 -6.814 -10.101 39 HZ2 LYS 4 1HZ LYS 4 -1.239 -6.730 -11.321 40 HZ3 LYS 4 2HZ LYS 4 0.287 -6.147 -11.549 41 H GLY 5 H GLY 5 1.533 -1.580 -5.597 42 HA2 GLY 5 1HA GLY 5 3.729 0.442 -5.753 43 HA3 GLY 5 2HA GLY 5 2.820 0.191 -4.245 44 H TYR 6 H TYR 6 5.604 -0.108 -4.417 45 HA TYR 6 HA TYR 6 5.889 -3.002 -3.785 46 HB2 TYR 6 1HB TYR 6 6.539 -2.866 -6.141 47 HB3 TYR 6 2HB TYR 6 7.607 -1.511 -5.805 48 HD1 TYR 6 1HD TYR 6 7.031 -5.079 -4.839 49 HD2 TYR 6 2HD TYR 6 9.848 -1.885 -5.356 50 HE1 TYR 6 1HE TYR 6 8.891 -6.650 -4.411 51 HE2 TYR 6 2HE TYR 6 11.708 -3.454 -4.929 52 HH TYR 6 HH TYR 6 12.284 -5.552 -4.507 53 H ILE 7 H ILE 7 6.965 -3.341 -2.010 54 HA ILE 7 HA ILE 7 8.895 -1.221 -1.091 55 HB ILE 7 HB ILE 7 7.136 -3.111 0.552 56 HG12 ILE 7 1HG1 ILE 7 7.148 -0.088 0.493 57 HG13 ILE 7 1HG2 ILE 7 6.034 -1.080 -0.434 58 HG21 ILE 7 2HG1 ILE 7 8.148 -2.024 2.516 59 HG22 ILE 7 2HG2 ILE 7 9.381 -2.860 1.541 60 HG23 ILE 7 2HG3 ILE 7 9.223 -1.090 1.448 61 HD11 ILE 7 1HD3 ILE 7 6.295 -1.063 2.581 62 HD12 ILE 7 1HD1 ILE 7 5.005 -0.297 1.625 63 HD13 ILE 7 1HD2 ILE 7 5.167 -2.069 1.642 64 H LEU 8 H LEU 8 10.827 -1.821 -1.641 65 HA LEU 8 HA LEU 8 11.702 -4.586 -1.011 66 HB2 LEU 8 1HB LEU 8 12.580 -3.539 -3.051 67 HB3 LEU 8 2HB LEU 8 13.162 -2.154 -2.123 68 HG LEU 8 HG LEU 8 14.728 -3.729 -0.913 69 HD11 LEU 8 1HD1 LEU 8 15.149 -5.910 -1.957 70 HD12 LEU 8 1HD2 LEU 8 13.491 -5.794 -1.323 71 HD13 LEU 8 1HD3 LEU 8 13.789 -5.640 -3.071 72 HD21 LEU 8 2HD3 LEU 8 15.444 -2.289 -2.792 73 HD22 LEU 8 2HD1 LEU 8 16.298 -3.851 -2.818 74 HD23 LEU 8 2HD2 LEU 8 14.954 -3.553 -3.946 75 H MET 9 H MET 9 12.647 -5.219 0.760 76 HA MET 9 HA MET 9 13.288 -3.136 2.808 77 HB2 MET 9 1HB MET 9 12.758 -6.119 3.039 78 HB3 MET 9 2HB MET 9 13.259 -5.100 4.380 79 HG2 MET 9 1HG MET 9 11.216 -3.824 4.264 80 HG3 MET 9 2HG MET 9 10.735 -4.632 2.770 81 HE1 MET 9 3HE MET 9 8.464 -4.683 4.568 82 HE2 MET 9 1HE MET 9 8.461 -5.749 5.994 83 HE3 MET 9 2HE MET 9 9.472 -4.283 5.981 84 H GLU 10 H GLU 10 15.161 -3.253 4.060 85 HA GLU 10 HA GLU 10 17.556 -3.726 2.569 86 HB2 GLU 10 1HB GLU 10 17.010 -3.347 5.536 87 HB3 GLU 10 2HB GLU 10 18.635 -3.570 4.902 88 HG2 GLU 10 1HG GLU 10 16.778 -1.373 3.973 89 HG3 GLU 10 2HG GLU 10 17.912 -1.195 5.311 90 H ASN 11 H ASN 11 15.606 -5.833 4.535 91 HA ASN 11 HA ASN 11 17.781 -7.819 4.818 92 HB2 ASN 11 1HB ASN 11 16.211 -9.082 6.119 93 HB3 ASN 11 2HB ASN 11 16.163 -7.408 6.656 94 HD21 ASN 11 2HD2 ASN 11 14.091 -8.595 7.478 95 HD22 ASN 11 2HD1 ASN 11 12.684 -8.343 6.500 96 H GLY 12 H GLY 12 15.949 -6.919 2.295 97 HA2 GLY 12 1HA GLY 12 16.186 -8.061 0.212 98 HA3 GLY 12 2HA GLY 12 16.353 -9.601 1.087 99 H GLY 13 H GLY 13 13.906 -8.026 2.600 100 HA2 GLY 13 1HA GLY 13 11.856 -9.748 1.616 101 HA3 GLY 13 2HA GLY 13 11.611 -8.301 2.622 102 H LYS 14 H LYS 14 10.264 -9.512 0.133 103 HA LYS 14 HA LYS 14 10.247 -6.979 -1.472 104 HB2 LYS 14 1HB LYS 14 10.145 -9.829 -2.540 105 HB3 LYS 14 2HB LYS 14 9.918 -8.375 -3.502 106 HG2 LYS 14 1HG LYS 14 12.254 -7.670 -2.823 107 HG3 LYS 14 2HG LYS 14 12.447 -9.277 -2.108 108 HD2 LYS 14 1HD LYS 14 11.967 -10.316 -4.298 109 HD3 LYS 14 2HD LYS 14 11.756 -8.713 -5.015 110 HE2 LYS 14 1HE LYS 14 14.072 -8.148 -4.609 111 HE3 LYS 14 2HE LYS 14 14.317 -9.611 -3.652 112 HZ1 LYS 14 3HZ LYS 14 13.692 -9.537 -6.529 113 HZ2 LYS 14 1HZ LYS 14 15.168 -9.851 -5.868 114 HZ3 LYS 14 2HZ LYS 14 13.921 -10.904 -5.635 115 H ILE 15 H ILE 15 8.431 -6.127 -0.655 116 HA ILE 15 HA ILE 15 5.951 -7.812 -0.727 117 HB ILE 15 HB ILE 15 6.531 -5.116 0.600 118 HG12 ILE 15 1HG1 ILE 15 6.022 -7.807 1.886 119 HG13 ILE 15 1HG2 ILE 15 7.617 -7.111 1.647 120 HG21 ILE 15 2HG1 ILE 15 4.299 -5.374 1.607 121 HG22 ILE 15 2HG2 ILE 15 4.196 -5.301 -0.167 122 HG23 ILE 15 2HG3 ILE 15 4.043 -6.864 0.669 123 HD11 ILE 15 1HD3 ILE 15 5.386 -5.893 3.290 124 HD12 ILE 15 1HD1 ILE 15 6.826 -6.731 3.914 125 HD13 ILE 15 1HD2 ILE 15 7.001 -5.187 3.046 126 H GLU 16 H GLU 16 4.570 -7.683 -2.248 127 HA GLU 16 HA GLU 16 4.439 -5.124 -3.814 128 HB2 GLU 16 1HB GLU 16 5.437 -7.073 -5.088 129 HB3 GLU 16 2HB GLU 16 3.926 -7.940 -4.856 130 HG2 GLU 16 1HG GLU 16 2.722 -6.212 -6.109 131 HG3 GLU 16 2HG GLU 16 4.218 -5.304 -6.313 132 H PHE 17 H PHE 17 2.545 -4.194 -4.116 133 HA PHE 17 HA PHE 17 0.072 -5.628 -3.304 134 HB2 PHE 17 1HB PHE 17 -0.542 -3.788 -1.750 135 HB3 PHE 17 2HB PHE 17 0.863 -4.681 -1.191 136 HD1 PHE 17 2HD PHE 17 3.122 -3.685 -1.354 137 HD2 PHE 17 1HD PHE 17 -0.400 -1.480 -2.347 138 HE1 PHE 17 2HE PHE 17 4.397 -1.573 -1.181 139 HE2 PHE 17 1HE PHE 17 0.872 0.633 -2.176 140 HZ PHE 17 HZ PHE 17 3.271 0.586 -1.594 141 H GLU 18 H GLU 18 -1.874 -4.521 -3.813 142 HA GLU 18 HA GLU 18 -1.511 -2.749 -6.192 143 HB2 GLU 18 1HB GLU 18 -3.916 -4.356 -5.229 144 HB3 GLU 18 2HB GLU 18 -3.891 -3.344 -6.665 145 HG2 GLU 18 1HG GLU 18 -2.122 -4.775 -7.630 146 HG3 GLU 18 2HG GLU 18 -2.187 -5.801 -6.198 147 H LEU 19 H LEU 19 -2.802 -0.922 -6.515 148 HA LEU 19 HA LEU 19 -3.832 0.272 -3.963 149 HB2 LEU 19 1HB LEU 19 -2.745 1.633 -6.465 150 HB3 LEU 19 2HB LEU 19 -3.407 2.468 -5.057 151 HG LEU 19 HG LEU 19 -0.931 0.710 -4.989 152 HD11 LEU 19 1HD1 LEU 19 0.311 2.826 -4.903 153 HD12 LEU 19 1HD2 LEU 19 -0.591 2.654 -6.427 154 HD13 LEU 19 1HD3 LEU 19 -1.206 3.726 -5.146 155 HD21 LEU 19 2HD3 LEU 19 -2.143 0.920 -2.845 156 HD22 LEU 19 2HD1 LEU 19 -0.600 1.807 -2.798 157 HD23 LEU 19 2HD2 LEU 19 -2.130 2.692 -3.010 158 H PHE 20 H PHE 20 -5.729 1.434 -3.958 159 HA PHE 20 HA PHE 20 -7.519 0.889 -6.299 160 HB2 PHE 20 1HB PHE 20 -8.218 0.458 -3.364 161 HB3 PHE 20 2HB PHE 20 -9.302 0.237 -4.729 162 HD1 PHE 20 2HD PHE 20 -8.817 -1.585 -6.398 163 HD2 PHE 20 1HD PHE 20 -6.743 -1.248 -2.678 164 HE1 PHE 20 2HE PHE 20 -8.105 -3.946 -6.583 165 HE2 PHE 20 1HE PHE 20 -6.027 -3.607 -2.861 166 HZ PHE 20 HZ PHE 20 -6.707 -4.956 -4.814 167 HA PRO 21 HA PRO 21 -7.845 5.371 -5.275 168 HB2 PRO 21 1HB PRO 21 -8.695 5.096 -8.185 169 HB3 PRO 21 2HB PRO 21 -7.677 6.343 -7.454 170 HG2 PRO 21 1HG PRO 21 -6.504 4.469 -8.934 171 HG3 PRO 21 2HG PRO 21 -5.751 4.944 -7.409 172 HD2 PRO 21 1HD PRO 21 -7.472 2.508 -8.019 173 HD3 PRO 21 2HD PRO 21 -5.953 2.614 -7.044 174 H ASN 22 H ASN 22 -9.888 2.951 -6.803 175 HA ASN 22 HA ASN 22 -12.350 4.410 -6.630 176 HB2 ASN 22 1HB ASN 22 -11.718 1.451 -6.615 177 HB3 ASN 22 2HB ASN 22 -13.361 2.077 -6.566 178 HD21 ASN 22 2HD2 ASN 22 -12.345 0.448 -8.609 179 HD22 ASN 22 2HD1 ASN 22 -12.333 1.362 -10.079 180 H GLU 23 H GLU 23 -10.501 2.618 -4.244 181 HA GLU 23 HA GLU 23 -12.703 2.778 -2.274 182 HB2 GLU 23 1HB GLU 23 -9.839 1.755 -2.076 183 HB3 GLU 23 2HB GLU 23 -11.005 1.704 -0.762 184 HG2 GLU 23 1HG GLU 23 -12.452 0.228 -2.072 185 HG3 GLU 23 2HG GLU 23 -11.330 0.312 -3.428 186 H ALA 24 H ALA 24 -9.537 4.264 -2.865 187 HA ALA 24 HA ALA 24 -10.413 6.562 -1.238 188 HB1 ALA 24 3HB ALA 24 -7.865 5.024 -0.619 189 HB2 ALA 24 1HB ALA 24 -8.339 6.580 0.101 190 HB3 ALA 24 2HB ALA 24 -9.306 5.121 0.417 191 HA PRO 25 HA PRO 25 -8.398 7.760 -5.166 192 HB2 PRO 25 1HB PRO 25 -9.970 10.234 -4.313 193 HB3 PRO 25 2HB PRO 25 -9.834 9.526 -5.927 194 HG2 PRO 25 1HG PRO 25 -12.088 9.137 -4.572 195 HG3 PRO 25 2HG PRO 25 -11.375 7.775 -5.443 196 HD2 PRO 25 1HD PRO 25 -11.262 8.426 -2.476 197 HD3 PRO 25 2HD PRO 25 -11.478 6.823 -3.286 198 H VAL 26 H VAL 26 -8.821 9.862 -2.302 199 HA VAL 26 HA VAL 26 -6.487 11.475 -3.061 200 HB VAL 26 HB VAL 26 -8.098 11.318 -0.468 201 HG11 VAL 26 1HG1 VAL 26 -7.101 13.491 0.054 202 HG12 VAL 26 1HG2 VAL 26 -5.873 12.211 -0.091 203 HG13 VAL 26 1HG3 VAL 26 -6.100 13.382 -1.412 204 HG21 VAL 26 2HG3 VAL 26 -9.451 12.021 -2.412 205 HG22 VAL 26 2HG1 VAL 26 -9.178 13.383 -1.301 206 HG23 VAL 26 2HG2 VAL 26 -8.239 13.263 -2.809 207 H THR 27 H THR 27 -7.110 8.915 -0.691 208 HA THR 27 HA THR 27 -4.583 9.133 0.639 209 HB THR 27 HB THR 27 -6.314 6.650 0.251 210 HG1 THR 27 1HG THR 27 -7.425 8.429 1.235 211 HG21 THR 27 2HG3 THR 27 -4.231 7.364 2.351 212 HG22 THR 27 2HG1 THR 27 -5.229 5.892 2.329 213 HG23 THR 27 2HG2 THR 27 -4.025 6.170 1.048 214 H VAL 28 H VAL 28 -5.604 7.082 -2.092 215 HA VAL 28 HA VAL 28 -3.045 5.814 -2.494 216 HB VAL 28 HB VAL 28 -5.311 6.492 -4.431 217 HG11 VAL 28 1HG1 VAL 28 -4.296 4.860 -5.946 218 HG12 VAL 28 1HG2 VAL 28 -3.223 6.247 -5.645 219 HG13 VAL 28 1HG3 VAL 28 -2.915 4.691 -4.838 220 HG21 VAL 28 2HG3 VAL 28 -5.930 4.935 -2.616 221 HG22 VAL 28 2HG1 VAL 28 -5.864 4.093 -4.183 222 HG23 VAL 28 2HG2 VAL 28 -4.532 3.908 -3.016 223 H ALA 29 H ALA 29 -4.408 8.800 -3.854 224 HA ALA 29 HA ALA 29 -2.217 9.355 -5.577 225 HB1 ALA 29 3HB ALA 29 -4.072 11.289 -4.141 226 HB2 ALA 29 1HB ALA 29 -3.027 11.686 -5.525 227 HB3 ALA 29 2HB ALA 29 -4.369 10.532 -5.724 228 H ASN 30 H ASN 30 -2.790 10.281 -2.186 229 HA ASN 30 HA ASN 30 -0.387 11.888 -1.993 230 HB2 ASN 30 1HB ASN 30 -2.246 10.663 0.053 231 HB3 ASN 30 2HB ASN 30 -0.814 11.581 0.504 232 HD21 ASN 30 2HD2 ASN 30 -3.417 12.315 1.201 233 HD22 ASN 30 2HD1 ASN 30 -3.800 13.806 0.405 234 H PHE 31 H PHE 31 -1.159 8.521 -1.165 235 HA PHE 31 HA PHE 31 1.382 7.866 -0.025 236 HB2 PHE 31 1HB PHE 31 -0.658 6.416 0.095 237 HB3 PHE 31 2HB PHE 31 -0.512 6.092 -1.625 238 HD1 PHE 31 1HD PHE 31 1.117 5.615 1.661 239 HD2 PHE 31 2HD PHE 31 1.016 4.481 -2.456 240 HE1 PHE 31 1HE PHE 31 2.623 3.715 2.150 241 HE2 PHE 31 2HE PHE 31 2.519 2.579 -1.971 242 HZ PHE 31 HZ PHE 31 3.323 2.198 0.332 243 H GLU 32 H GLU 32 0.219 7.578 -3.390 244 HA GLU 32 HA GLU 32 2.666 6.675 -4.526 245 HB2 GLU 32 1HB GLU 32 0.543 6.736 -5.783 246 HB3 GLU 32 2HB GLU 32 0.518 8.492 -5.698 247 HG2 GLU 32 1HG GLU 32 2.567 8.597 -7.048 248 HG3 GLU 32 2HG GLU 32 2.611 6.837 -7.123 249 H LYS 33 H LYS 33 1.494 10.012 -4.042 250 HA LYS 33 HA LYS 33 3.691 11.384 -5.144 251 HB2 LYS 33 1HB LYS 33 1.669 12.535 -4.370 252 HB3 LYS 33 2HB LYS 33 2.011 12.085 -2.705 253 HG2 LYS 33 1HG LYS 33 4.026 13.475 -2.709 254 HG3 LYS 33 2HG LYS 33 3.756 13.886 -4.409 255 HD2 LYS 33 1HD LYS 33 1.810 15.141 -3.921 256 HD3 LYS 33 2HD LYS 33 1.636 14.415 -2.317 257 HE2 LYS 33 1HE LYS 33 2.475 16.664 -2.047 258 HE3 LYS 33 2HE LYS 33 3.767 15.537 -1.626 259 HZ1 LYS 33 3HZ LYS 33 3.492 16.934 -4.203 260 HZ2 LYS 33 1HZ LYS 33 4.561 17.314 -3.006 261 HZ3 LYS 33 2HZ LYS 33 4.698 15.879 -3.810 262 H LEU 34 H LEU 34 3.315 10.286 -1.764 263 HA LEU 34 HA LEU 34 5.866 11.283 -0.920 264 HB2 LEU 34 1HB LEU 34 4.122 9.033 0.163 265 HB3 LEU 34 2HB LEU 34 5.553 9.662 0.987 266 HG LEU 34 HG LEU 34 3.071 11.295 0.348 267 HD11 LEU 34 1HD1 LEU 34 2.599 11.098 2.749 268 HD12 LEU 34 1HD2 LEU 34 2.592 9.511 1.945 269 HD13 LEU 34 1HD3 LEU 34 3.989 10.003 2.932 270 HD21 LEU 34 2HD3 LEU 34 5.164 12.602 0.501 271 HD22 LEU 34 2HD1 LEU 34 4.108 12.915 1.900 272 HD23 LEU 34 2HD2 LEU 34 5.521 11.846 2.071 273 H ALA 35 H ALA 35 4.860 8.020 -1.954 274 HA ALA 35 HA ALA 35 7.361 6.787 -1.402 275 HB1 ALA 35 3HB ALA 35 5.268 6.046 -3.477 276 HB2 ALA 35 1HB ALA 35 6.575 4.989 -2.898 277 HB3 ALA 35 2HB ALA 35 5.293 5.514 -1.781 278 H ASN 36 H ASN 36 6.135 8.339 -4.356 279 HA ASN 36 HA ASN 36 8.577 7.594 -5.838 280 HB2 ASN 36 1HB ASN 36 6.060 9.107 -6.555 281 HB3 ASN 36 2HB ASN 36 7.438 8.998 -7.642 282 HD21 ASN 36 2HD2 ASN 36 4.850 8.010 -8.181 283 HD22 ASN 36 2HD1 ASN 36 4.958 6.289 -8.344 284 H GLU 37 H GLU 37 7.957 9.879 -3.568 285 HA GLU 37 HA GLU 37 10.052 11.666 -4.758 286 HB2 GLU 37 1HB GLU 37 8.105 12.075 -2.452 287 HB3 GLU 37 2HB GLU 37 9.439 13.167 -2.799 288 HG2 GLU 37 1HG GLU 37 8.493 13.658 -5.002 289 HG3 GLU 37 2HG GLU 37 7.177 12.525 -4.704 290 H GLY 38 H GLY 38 9.905 8.923 -3.062 291 HA2 GLY 38 1HA GLY 38 11.680 7.834 -2.017 292 HA3 GLY 38 2HA GLY 38 12.615 9.346 -2.075 293 H PHE 39 H PHE 39 9.419 9.482 -0.759 294 HA PHE 39 HA PHE 39 10.373 10.403 1.810 295 HB2 PHE 39 1HB PHE 39 8.206 11.127 0.847 296 HB3 PHE 39 2HB PHE 39 7.606 9.478 0.928 297 HD1 PHE 39 1HD PHE 39 8.592 12.420 2.913 298 HD2 PHE 39 2HD PHE 39 6.840 8.524 2.985 299 HE1 PHE 39 1HE PHE 39 7.767 12.836 5.206 300 HE2 PHE 39 2HE PHE 39 6.010 8.938 5.277 301 HZ PHE 39 HZ PHE 39 6.476 11.093 6.388 302 H TYR 40 H TYR 40 8.632 7.416 0.884 303 HA TYR 40 HA TYR 40 8.977 6.288 3.554 304 HB2 TYR 40 1HB TYR 40 7.989 5.144 0.918 305 HB3 TYR 40 2HB TYR 40 8.096 4.195 2.394 306 HD1 TYR 40 2HD TYR 40 6.912 5.257 4.506 307 HD2 TYR 40 1HD TYR 40 6.021 6.244 0.426 308 HE1 TYR 40 2HE TYR 40 4.680 6.067 5.189 309 HE2 TYR 40 1HE TYR 40 3.788 7.054 1.110 310 HH TYR 40 HH TYR 40 2.808 7.074 4.535 311 H ASN 41 H ASN 41 10.804 6.271 0.597 312 HA ASN 41 HA ASN 41 12.434 3.969 1.110 313 HB2 ASN 41 1HB ASN 41 12.361 5.176 -1.051 314 HB3 ASN 41 2HB ASN 41 13.160 6.552 -0.302 315 HD21 ASN 41 2HD2 ASN 41 14.079 4.981 -2.522 316 HD22 ASN 41 2HD1 ASN 41 15.594 4.281 -2.054 317 H GLY 42 H GLY 42 13.404 3.573 2.938 318 HA2 GLY 42 1HA GLY 42 15.521 3.929 4.097 319 HA3 GLY 42 2HA GLY 42 15.264 5.683 3.948 320 H LEU 43 H LEU 43 12.278 4.747 4.582 321 HA LEU 43 HA LEU 43 12.543 5.323 7.467 322 HB2 LEU 43 1HB LEU 43 10.098 4.895 5.700 323 HB3 LEU 43 2HB LEU 43 10.059 5.410 7.389 324 HG LEU 43 HG LEU 43 11.073 6.975 4.998 325 HD11 LEU 43 1HD1 LEU 43 9.326 8.549 5.704 326 HD12 LEU 43 1HD2 LEU 43 8.655 6.942 5.334 327 HD13 LEU 43 1HD3 LEU 43 8.870 7.449 7.026 328 HD21 LEU 43 2HD3 LEU 43 12.612 7.268 6.913 329 HD22 LEU 43 2HD1 LEU 43 11.651 8.740 6.629 330 HD23 LEU 43 2HD2 LEU 43 11.228 7.644 7.967 331 H THR 44 H THR 44 11.144 4.133 9.008 332 HA THR 44 HA THR 44 11.335 1.190 8.446 333 HB THR 44 HB THR 44 11.923 0.832 10.780 334 HG1 THR 44 1HG THR 44 12.215 2.682 12.151 335 HG21 THR 44 2HG3 THR 44 13.599 3.081 9.601 336 HG22 THR 44 2HG1 THR 44 14.114 1.956 10.879 337 HG23 THR 44 2HG2 THR 44 13.784 1.349 9.239 338 H PHE 45 H PHE 45 10.134 0.139 10.571 339 HA PHE 45 HA PHE 45 7.341 1.210 10.381 340 HB2 PHE 45 1HB PHE 45 8.431 -1.551 11.058 341 HB3 PHE 45 2HB PHE 45 6.747 -1.100 11.274 342 HD1 PHE 45 1HD PHE 45 9.399 -1.750 8.814 343 HD2 PHE 45 2HD PHE 45 5.265 -0.844 9.396 344 HE1 PHE 45 1HE PHE 45 8.939 -2.347 6.459 345 HE2 PHE 45 2HE PHE 45 4.800 -1.441 7.042 346 HZ PHE 45 HZ PHE 45 6.639 -2.191 5.574 347 H HIS 46 H HIS 46 6.005 1.241 12.220 348 HA HIS 46 HA HIS 46 7.569 2.141 14.583 349 HB2 HIS 46 1HB HIS 46 5.830 3.655 13.627 350 HB3 HIS 46 2HB HIS 46 4.606 2.426 13.920 351 HD2 HIS 46 2HD HIS 46 6.909 2.547 16.940 352 HE1 HIS 46 1HE HIS 46 3.678 5.195 17.783 353 H ARG 47 H ARG 47 4.318 0.742 14.563 354 HA ARG 47 HA ARG 47 5.244 -1.217 16.623 355 HB2 ARG 47 1HB ARG 47 2.420 -0.481 15.760 356 HB3 ARG 47 2HB ARG 47 2.860 -1.520 17.106 357 HG2 ARG 47 1HG ARG 47 3.926 0.408 18.233 358 HG3 ARG 47 2HG ARG 47 3.414 1.449 16.882 359 HD2 ARG 47 1HD ARG 47 1.502 -0.208 18.498 360 HD3 ARG 47 2HD ARG 47 1.952 1.460 18.917 361 HE ARG 47 HE ARG 47 1.183 1.565 16.265 362 HH11 ARG 47 1HH1 ARG 47 -0.297 0.552 19.286 363 HH12 ARG 47 1HH2 ARG 47 -1.918 0.968 18.776 364 HH21 ARG 47 2HH1 ARG 47 -0.926 2.101 15.615 365 HH22 ARG 47 2HH2 ARG 47 -2.275 1.845 16.698 366 H VAL 48 H VAL 48 5.962 -3.038 15.846 367 HA VAL 48 HA VAL 48 4.700 -4.146 13.350 368 HB VAL 48 HB VAL 48 7.355 -4.806 14.714 369 HG11 VAL 48 1HG1 VAL 48 7.845 -6.060 12.670 370 HG12 VAL 48 1HG2 VAL 48 6.420 -6.701 13.519 371 HG13 VAL 48 1HG3 VAL 48 6.213 -5.703 12.060 372 HG21 VAL 48 2HG3 VAL 48 7.347 -2.539 13.731 373 HG22 VAL 48 2HG1 VAL 48 8.380 -3.639 12.787 374 HG23 VAL 48 2HG2 VAL 48 6.761 -3.208 12.190 375 H ILE 49 H ILE 49 3.379 -5.725 13.426 376 HA ILE 49 HA ILE 49 3.688 -7.748 15.622 377 HB ILE 49 HB ILE 49 1.008 -6.770 14.535 378 HG12 ILE 49 1HG1 ILE 49 2.322 -5.956 17.137 379 HG13 ILE 49 1HG2 ILE 49 2.167 -4.931 15.719 380 HG21 ILE 49 2HG1 ILE 49 0.121 -7.953 16.503 381 HG22 ILE 49 2HG2 ILE 49 1.057 -9.053 15.464 382 HG23 ILE 49 2HG3 ILE 49 1.772 -8.426 16.968 383 HD11 ILE 49 1HD3 ILE 49 -0.125 -6.105 17.309 384 HD12 ILE 49 1HD1 ILE 49 0.448 -4.421 17.361 385 HD13 ILE 49 1HD2 ILE 49 -0.282 -5.068 15.872 386 HA PRO 50 HA PRO 50 4.084 -9.764 11.624 387 HB2 PRO 50 1HB PRO 50 5.320 -11.801 13.520 388 HB3 PRO 50 2HB PRO 50 5.955 -11.211 11.980 389 HG2 PRO 50 1HG PRO 50 7.067 -10.318 14.227 390 HG3 PRO 50 2HG PRO 50 6.744 -9.172 12.922 391 HD2 PRO 50 1HD PRO 50 5.144 -9.690 15.459 392 HD3 PRO 50 2HD PRO 50 5.564 -8.113 14.679 393 H GLY 51 H GLY 51 2.591 -10.860 10.710 394 HA2 GLY 51 1HA GLY 51 1.250 -12.765 10.362 395 HA3 GLY 51 2HA GLY 51 1.512 -13.251 12.054 396 H PHE 52 H PHE 52 0.768 -10.008 12.021 397 HA PHE 52 HA PHE 52 -2.190 -10.462 12.073 398 HB2 PHE 52 1HB PHE 52 -0.515 -9.001 14.158 399 HB3 PHE 52 2HB PHE 52 -2.264 -8.878 14.044 400 HD1 PHE 52 2HD PHE 52 -3.694 -10.802 14.574 401 HD2 PHE 52 1HD PHE 52 0.550 -10.969 15.037 402 HE1 PHE 52 2HE PHE 52 -3.930 -12.811 15.994 403 HE2 PHE 52 1HE PHE 52 0.318 -12.980 16.456 404 HZ PHE 52 HZ PHE 52 -1.923 -13.901 16.935 405 H VAL 53 H VAL 53 -0.450 -7.548 12.992 406 HA VAL 53 HA VAL 53 -0.744 -6.269 10.362 407 HB VAL 53 HB VAL 53 -3.097 -6.162 11.247 408 HG11 VAL 53 1HG1 VAL 53 -3.573 -4.834 13.246 409 HG12 VAL 53 1HG2 VAL 53 -2.598 -6.275 13.620 410 HG13 VAL 53 1HG3 VAL 53 -1.828 -4.671 13.552 411 HG21 VAL 53 2HG3 VAL 53 -2.204 -4.344 9.833 412 HG22 VAL 53 2HG1 VAL 53 -3.338 -3.708 11.047 413 HG23 VAL 53 2HG2 VAL 53 -1.584 -3.518 11.283 414 H SER 54 H SER 54 0.691 -4.796 10.060 415 HA SER 54 HA SER 54 2.233 -3.803 12.478 416 HB2 SER 54 1HB SER 54 3.231 -4.491 9.766 417 HB3 SER 54 2HB SER 54 4.140 -3.697 11.044 418 HG SER 54 HG SER 54 4.407 -5.942 10.996 419 H GLN 55 H GLN 55 2.865 -1.672 12.494 420 HA GLN 55 HA GLN 55 1.501 0.081 10.480 421 HB2 GLN 55 1HB GLN 55 0.681 0.263 12.854 422 HB3 GLN 55 2HB GLN 55 2.302 0.730 13.347 423 HG2 GLN 55 1HG GLN 55 2.182 2.723 11.936 424 HG3 GLN 55 2HG GLN 55 0.545 2.245 11.406 425 HE21 GLN 55 2HE2 GLN 55 0.275 4.557 12.295 426 HE22 GLN 55 2HE1 GLN 55 -0.189 4.672 13.961 427 H GLY 56 H GLY 56 2.584 1.502 9.331 428 HA2 GLY 56 1HA GLY 56 5.444 1.359 9.184 429 HA3 GLY 56 2HA GLY 56 4.408 2.566 8.387 430 H GLY 57 H GLY 57 6.898 3.253 9.384 431 HA2 GLY 57 1HA GLY 57 6.337 4.637 11.966 432 HA3 GLY 57 2HA GLY 57 7.948 4.315 11.283 433 H CYS 58 H CYS 58 8.664 6.430 11.337 434 HA CYS 58 HA CYS 58 7.463 8.344 9.357 435 HB2 CYS 58 1HB CYS 58 7.175 10.092 10.861 436 HB3 CYS 58 2HB CYS 58 6.166 8.730 11.325 437 HG CYS 58 HG CYS 58 7.760 7.844 13.181 438 HA PRO 59 HA PRO 59 11.717 9.488 8.992 439 HB2 PRO 59 1HB PRO 59 11.432 12.116 8.190 440 HB3 PRO 59 2HB PRO 59 11.010 10.784 7.107 441 HG2 PRO 59 1HG PRO 59 9.184 12.432 8.907 442 HG3 PRO 59 2HG PRO 59 8.962 12.029 7.203 443 HD2 PRO 59 1HD PRO 59 7.702 10.593 9.109 444 HD3 PRO 59 2HD PRO 59 8.395 9.770 7.654 445 H ARG 60 H ARG 60 9.565 11.130 11.145 446 HA ARG 60 HA ARG 60 11.634 12.735 12.429 447 HB2 ARG 60 1HB ARG 60 8.854 11.860 13.299 448 HB3 ARG 60 2HB ARG 60 9.887 12.907 14.261 449 HG2 ARG 60 1HG ARG 60 9.902 14.549 12.385 450 HG3 ARG 60 2HG ARG 60 8.743 13.508 11.524 451 HD2 ARG 60 1HD ARG 60 7.154 13.749 13.310 452 HD3 ARG 60 2HD ARG 60 8.319 14.707 14.252 453 HE ARG 60 HE ARG 60 6.691 15.592 12.021 454 HH11 ARG 60 1HH1 ARG 60 9.591 16.197 13.908 455 HH12 ARG 60 1HH2 ARG 60 9.656 17.897 13.498 456 HH21 ARG 60 2HH1 ARG 60 6.786 17.799 11.495 457 HH22 ARG 60 2HH2 ARG 60 8.068 18.804 12.132 458 H GLY 61 H GLY 61 10.449 9.465 12.755 459 HA2 GLY 61 1HA GLY 61 11.423 7.690 13.896 460 HA3 GLY 61 2HA GLY 61 12.731 8.780 14.416 461 H ASN 62 H ASN 62 9.557 9.927 15.022 462 HA ASN 62 HA ASN 62 9.957 9.401 17.938 463 HB2 ASN 62 1HB ASN 62 8.287 11.445 16.450 464 HB3 ASN 62 2HB ASN 62 8.230 11.207 18.191 465 HD21 ASN 62 2HD2 ASN 62 9.034 13.547 16.645 466 HD22 ASN 62 2HD1 ASN 62 10.653 13.915 17.136 467 H GLY 63 H GLY 63 8.211 8.253 15.306 468 HA2 GLY 63 1HA GLY 63 6.746 6.382 15.472 469 HA3 GLY 63 2HA GLY 63 6.385 6.826 17.156 470 H THR 64 H THR 64 6.290 9.684 15.627 471 HA THR 64 HA THR 64 3.341 9.476 15.149 472 HB THR 64 HB THR 64 5.069 11.909 15.787 473 HG1 THR 64 1HG THR 64 3.867 11.806 17.768 474 HG21 THR 64 2HG3 THR 64 2.057 11.619 15.474 475 HG22 THR 64 2HG1 THR 64 2.917 13.091 15.981 476 HG23 THR 64 2HG2 THR 64 3.144 12.450 14.337 477 H GLY 65 H GLY 65 2.803 9.205 13.140 478 HA2 GLY 65 1HA GLY 65 4.460 9.692 10.902 479 HA3 GLY 65 2HA GLY 65 2.691 9.516 10.853 480 H ASP 66 H ASP 66 4.818 11.386 9.581 481 HA ASP 66 HA ASP 66 3.053 13.754 9.672 482 HB2 ASP 66 1HB ASP 66 4.767 14.137 11.483 483 HB3 ASP 66 2HB ASP 66 6.032 13.981 10.273 484 H ALA 67 H ALA 67 2.495 13.492 7.596 485 HA ALA 67 HA ALA 67 4.619 13.195 5.567 486 HB1 ALA 67 3HB ALA 67 1.598 13.390 5.293 487 HB2 ALA 67 1HB ALA 67 2.740 13.034 3.976 488 HB3 ALA 67 2HB ALA 67 2.552 11.888 5.325 489 H GLY 68 H GLY 68 3.473 15.723 7.287 490 HA2 GLY 68 1HA GLY 68 3.823 18.022 6.871 491 HA3 GLY 68 2HA GLY 68 4.060 17.667 5.145 492 H TYR 69 H TYR 69 1.380 15.997 6.243 493 HA TYR 69 HA TYR 69 -0.636 18.070 6.160 494 HB2 TYR 69 1HB TYR 69 -1.636 17.411 3.968 495 HB3 TYR 69 2HB TYR 69 -0.096 18.244 3.811 496 HD1 TYR 69 1HD TYR 69 -1.696 14.889 3.753 497 HD2 TYR 69 2HD TYR 69 1.737 17.248 2.720 498 HE1 TYR 69 1HE TYR 69 -0.824 13.024 2.385 499 HE2 TYR 69 2HE TYR 69 2.608 15.383 1.353 500 HH TYR 69 HH TYR 69 0.838 12.309 1.095 501 H THR 70 H THR 70 -2.855 17.002 5.598 502 HA THR 70 HA THR 70 -2.891 14.304 6.915 503 HB THR 70 HB THR 70 -5.122 14.932 7.830 504 HG1 THR 70 1HG THR 70 -5.839 16.527 6.496 505 HG21 THR 70 2HG3 THR 70 -2.907 16.895 8.536 506 HG22 THR 70 2HG1 THR 70 -4.320 16.510 9.545 507 HG23 THR 70 2HG2 THR 70 -3.098 15.259 9.210 508 H ILE 71 H ILE 71 -4.707 12.945 6.404 509 HA ILE 71 HA ILE 71 -5.493 13.303 3.519 510 HB ILE 71 HB ILE 71 -4.865 10.725 5.047 511 HG12 ILE 71 1HG1 ILE 71 -3.114 10.738 3.011 512 HG13 ILE 71 1HG2 ILE 71 -3.244 12.471 3.269 513 HG21 ILE 71 2HG1 ILE 71 -5.155 9.635 2.859 514 HG22 ILE 71 2HG2 ILE 71 -6.651 10.450 3.370 515 HG23 ILE 71 2HG3 ILE 71 -5.609 11.197 2.136 516 HD11 ILE 71 1HD3 ILE 71 -2.516 10.421 5.373 517 HD12 ILE 71 1HD1 ILE 71 -1.400 11.530 4.544 518 HD13 ILE 71 1HD2 ILE 71 -2.650 12.177 5.634 519 HA PRO 72 HA PRO 72 -9.638 13.409 5.108 520 HB2 PRO 72 1HB PRO 72 -9.985 12.964 2.109 521 HB3 PRO 72 2HB PRO 72 -10.832 14.114 3.152 522 HG2 PRO 72 1HG PRO 72 -8.927 15.038 1.539 523 HG3 PRO 72 2HG PRO 72 -9.003 15.636 3.200 524 HD2 PRO 72 1HD PRO 72 -7.157 13.542 1.997 525 HD3 PRO 72 2HD PRO 72 -6.779 14.846 3.193 526 H CYS 73 H CYS 73 -10.918 11.883 5.745 527 HA CYS 73 HA CYS 73 -10.231 9.071 5.316 528 HB2 CYS 73 1HB CYS 73 -11.062 9.824 7.406 529 HB3 CYS 73 2HB CYS 73 -12.578 10.314 6.665 530 HG CYS 73 HG CYS 73 -12.923 8.175 8.040 531 H GLU 74 H GLU 74 -10.823 7.852 3.641 532 HA GLU 74 HA GLU 74 -13.146 8.738 1.970 533 HB2 GLU 74 1HB GLU 74 -10.872 6.825 1.291 534 HB3 GLU 74 2HB GLU 74 -12.144 7.350 0.198 535 HG2 GLU 74 1HG GLU 74 -10.027 9.123 1.436 536 HG3 GLU 74 2HG GLU 74 -10.037 8.510 -0.217 537 H THR 75 H THR 75 -12.631 6.789 4.496 538 HA THR 75 HA THR 75 -13.824 4.304 3.663 539 HB THR 75 HB THR 75 -13.830 5.649 6.402 540 HG1 THR 75 1HG THR 75 -12.107 3.917 6.612 541 HG21 THR 75 2HG3 THR 75 -14.310 2.759 5.585 542 HG22 THR 75 2HG1 THR 75 -14.222 3.370 7.253 543 HG23 THR 75 2HG2 THR 75 -15.548 3.887 6.184 544 H ASP 76 H ASP 76 -15.193 7.364 4.794 545 HA ASP 76 HA ASP 76 -17.926 6.399 4.861 546 HB2 ASP 76 1HB ASP 76 -16.700 9.176 4.651 547 HB3 ASP 76 2HB ASP 76 -18.437 8.904 4.695 548 H ASN 77 H ASN 77 -15.841 7.697 2.350 549 HA ASN 77 HA ASN 77 -18.039 8.086 0.454 550 HB2 ASN 77 1HB ASN 77 -15.025 8.103 0.185 551 HB3 ASN 77 2HB ASN 77 -16.112 8.321 -1.181 552 HD21 ASN 77 2HD2 ASN 77 -14.212 10.205 -0.247 553 HD22 ASN 77 2HD1 ASN 77 -15.075 11.611 0.277 554 H ASN 78 H ASN 78 -15.727 5.532 1.191 555 HA ASN 78 HA ASN 78 -17.452 3.688 -0.374 556 HB2 ASN 78 1HB ASN 78 -15.542 4.466 -1.848 557 HB3 ASN 78 2HB ASN 78 -14.445 3.689 -0.714 558 HD21 ASN 78 2HD2 ASN 78 -14.612 2.968 -3.389 559 HD22 ASN 78 2HD1 ASN 78 -15.246 1.360 -3.499 560 HA PRO 79 HA PRO 79 -16.600 1.990 3.778 561 HB2 PRO 79 1HB PRO 79 -19.026 0.449 2.766 562 HB3 PRO 79 2HB PRO 79 -18.755 1.135 4.373 563 HG2 PRO 79 1HG PRO 79 -20.434 2.390 2.734 564 HG3 PRO 79 2HG PRO 79 -19.286 3.347 3.675 565 HD2 PRO 79 1HD PRO 79 -19.141 2.504 0.755 566 HD3 PRO 79 2HD PRO 79 -18.724 4.097 1.505 567 H HIS 80 H HIS 80 -15.678 0.139 4.370 568 HA HIS 80 HA HIS 80 -15.374 -2.070 2.470 569 HB2 HIS 80 1HB HIS 80 -12.922 -1.774 2.203 570 HB3 HIS 80 2HB HIS 80 -13.829 -0.481 1.431 571 HD2 HIS 80 2HD HIS 80 -11.474 -0.916 4.682 572 HE1 HIS 80 1HE HIS 80 -11.994 3.188 3.719 573 H ARG 81 H ARG 81 -13.371 -3.446 3.261 574 HA ARG 81 HA ARG 81 -13.558 -3.590 6.251 575 HB2 ARG 81 1HB ARG 81 -13.667 -5.896 4.267 576 HB3 ARG 81 2HB ARG 81 -13.556 -6.070 6.012 577 HG2 ARG 81 1HG ARG 81 -15.850 -4.627 4.674 578 HG3 ARG 81 2HG ARG 81 -15.844 -6.381 4.982 579 HD2 ARG 81 1HD ARG 81 -15.548 -5.975 7.349 580 HD3 ARG 81 2HD ARG 81 -15.522 -4.221 7.052 581 HE ARG 81 HE ARG 81 -17.891 -5.381 5.968 582 HH11 ARG 81 1HH1 ARG 81 -16.395 -4.484 9.017 583 HH12 ARG 81 1HH2 ARG 81 -17.920 -4.231 9.834 584 HH21 ARG 81 2HH1 ARG 81 -19.865 -5.049 7.040 585 HH22 ARG 81 2HH2 ARG 81 -19.885 -4.551 8.717 586 H HIS 82 H HIS 82 -11.800 -4.255 7.368 587 HA HIS 82 HA HIS 82 -9.243 -4.195 5.857 588 HB2 HIS 82 1HB HIS 82 -9.839 -4.203 8.848 589 HB3 HIS 82 2HB HIS 82 -8.227 -4.143 8.150 590 HD2 HIS 82 2HD HIS 82 -7.302 -1.485 7.758 591 HE1 HIS 82 1HE HIS 82 -11.148 0.314 7.872 592 H VAL 83 H VAL 83 -9.469 -6.196 4.789 593 HA VAL 83 HA VAL 83 -9.483 -8.620 6.574 594 HB VAL 83 HB VAL 83 -10.169 -9.838 4.548 595 HG11 VAL 83 1HG1 VAL 83 -12.389 -8.867 4.210 596 HG12 VAL 83 1HG2 VAL 83 -11.924 -8.887 5.929 597 HG13 VAL 83 1HG3 VAL 83 -11.853 -7.367 5.003 598 HG21 VAL 83 2HG3 VAL 83 -8.940 -8.461 2.905 599 HG22 VAL 83 2HG1 VAL 83 -10.655 -8.612 2.454 600 HG23 VAL 83 2HG2 VAL 83 -10.059 -7.109 3.198 601 H THR 84 H THR 84 -8.517 -10.452 4.802 602 HA THR 84 HA THR 84 -5.766 -10.394 5.421 603 HB THR 84 HB THR 84 -7.104 -11.822 3.078 604 HG1 THR 84 1HG THR 84 -7.209 -13.551 4.622 605 HG21 THR 84 2HG3 THR 84 -4.522 -12.388 4.584 606 HG22 THR 84 2HG1 THR 84 -5.219 -13.393 3.294 607 HG23 THR 84 2HG2 THR 84 -4.639 -11.752 2.927 608 H GLY 85 H GLY 85 -4.319 -8.955 4.899 609 HA2 GLY 85 1HA GLY 85 -2.637 -8.401 3.305 610 HA3 GLY 85 2HA GLY 85 -3.809 -8.659 1.991 611 H ALA 86 H ALA 86 -5.602 -7.008 4.088 612 HA ALA 86 HA ALA 86 -5.768 -4.759 2.394 613 HB1 ALA 86 3HB ALA 86 -6.595 -5.002 5.308 614 HB2 ALA 86 1HB ALA 86 -7.147 -3.749 4.174 615 HB3 ALA 86 2HB ALA 86 -7.583 -5.452 3.899 616 H MET 87 H MET 87 -4.852 -2.823 2.266 617 HA MET 87 HA MET 87 -2.942 -2.047 4.450 618 HB2 MET 87 1HB MET 87 -1.795 -2.653 2.321 619 HB3 MET 87 2HB MET 87 -2.738 -1.433 1.478 620 HG2 MET 87 1HG MET 87 -1.718 0.321 2.896 621 HG3 MET 87 2HG MET 87 -0.751 -0.912 3.708 622 HE1 MET 87 3HE MET 87 0.201 -2.887 1.540 623 HE2 MET 87 1HE MET 87 1.704 -2.119 0.972 624 HE3 MET 87 2HE MET 87 1.300 -2.112 2.708 625 H SER 88 H SER 88 -3.479 -0.348 5.555 626 HA SER 88 HA SER 88 -5.501 1.582 4.367 627 HB2 SER 88 1HB SER 88 -6.583 1.714 6.410 628 HB3 SER 88 2HB SER 88 -6.565 0.053 5.839 629 HG SER 88 HG SER 88 -6.065 0.244 8.026 630 H MET 89 H MET 89 -5.311 3.718 4.984 631 HA MET 89 HA MET 89 -2.686 4.531 6.108 632 HB2 MET 89 1HB MET 89 -3.585 5.639 4.064 633 HB3 MET 89 2HB MET 89 -4.974 6.193 4.988 634 HG2 MET 89 1HG MET 89 -3.396 7.993 4.774 635 HG3 MET 89 2HG MET 89 -3.446 7.484 6.464 636 HE1 MET 89 3HE MET 89 -1.385 7.686 3.172 637 HE2 MET 89 1HE MET 89 0.001 6.621 3.507 638 HE3 MET 89 2HE MET 89 -1.624 5.926 3.293 639 H ALA 90 H ALA 90 -2.319 5.366 8.026 640 HA ALA 90 HA ALA 90 -4.345 4.947 10.053 641 HB1 ALA 90 3HB ALA 90 -1.624 6.289 10.222 642 HB2 ALA 90 1HB ALA 90 -2.628 5.799 11.606 643 HB3 ALA 90 2HB ALA 90 -1.960 4.567 10.509 644 H HIS 91 H HIS 91 -5.822 6.259 10.826 645 HA HIS 91 HA HIS 91 -5.204 9.089 11.222 646 HB2 HIS 91 1HB HIS 91 -7.094 9.989 9.975 647 HB3 HIS 91 2HB HIS 91 -6.049 9.105 8.870 648 HD2 HIS 91 2HD HIS 91 -7.317 7.148 7.424 649 HE1 HIS 91 1HE HIS 91 -10.956 7.110 9.641 650 H ARG 92 H ARG 92 -7.413 10.194 11.974 651 HA ARG 92 HA ARG 92 -8.781 8.280 13.826 652 HB2 ARG 92 1HB ARG 92 -7.649 11.011 14.556 653 HB3 ARG 92 2HB ARG 92 -8.661 10.023 15.599 654 HG2 ARG 92 1HG ARG 92 -5.957 9.146 14.558 655 HG3 ARG 92 2HG ARG 92 -6.232 9.936 16.130 656 HD2 ARG 92 1HD ARG 92 -7.774 8.114 16.723 657 HD3 ARG 92 2HD ARG 92 -7.357 7.309 15.193 658 HE ARG 92 HE ARG 92 -5.734 7.502 17.600 659 HH11 ARG 92 1HH1 ARG 92 -5.763 6.886 14.142 660 HH12 ARG 92 1HH2 ARG 92 -4.274 5.967 14.166 661 HH21 ARG 92 2HH1 ARG 92 -3.803 6.309 17.620 662 HH22 ARG 92 2HH2 ARG 92 -3.164 5.640 16.134 663 H GLY 93 H GLY 93 -9.634 9.374 11.296 664 HA2 GLY 93 1HA GLY 93 -12.177 9.865 11.292 665 HA3 GLY 93 2HA GLY 93 -11.704 11.342 12.164 666 H ARG 94 H ARG 94 -12.848 12.312 10.262 667 HA ARG 94 HA ARG 94 -11.669 12.089 7.618 668 HB2 ARG 94 1HB ARG 94 -13.576 14.116 8.845 669 HB3 ARG 94 2HB ARG 94 -13.106 14.115 7.153 670 HG2 ARG 94 1HG ARG 94 -14.129 11.920 6.838 671 HG3 ARG 94 2HG ARG 94 -14.557 11.861 8.565 672 HD2 ARG 94 1HD ARG 94 -15.900 13.892 8.261 673 HD3 ARG 94 2HD ARG 94 -15.531 13.843 6.522 674 HE ARG 94 HE ARG 94 -16.568 11.338 7.223 675 HH11 ARG 94 1HH1 ARG 94 -17.628 14.684 7.116 676 HH12 ARG 94 1HH2 ARG 94 -19.303 14.275 6.819 677 HH21 ARG 94 2HH1 ARG 94 -18.745 10.819 6.839 678 HH22 ARG 94 2HH2 ARG 94 -19.936 12.088 6.663 679 H ASP 95 H ASP 95 -9.813 12.829 6.989 680 HA ASP 95 HA ASP 95 -8.174 14.405 6.492 681 HB2 ASP 95 1HB ASP 95 -10.340 15.934 6.499 682 HB3 ASP 95 2HB ASP 95 -9.688 16.524 8.023 683 H THR 96 H THR 96 -7.934 12.747 8.740 684 HA THR 96 HA THR 96 -6.089 14.489 10.331 685 HB THR 96 HB THR 96 -6.596 13.125 12.340 686 HG1 THR 96 1HG THR 96 -8.576 11.966 10.637 687 HG21 THR 96 2HG3 THR 96 -9.071 14.356 11.071 688 HG22 THR 96 2HG1 THR 96 -8.838 14.031 12.805 689 HG23 THR 96 2HG2 THR 96 -7.823 15.238 11.981 690 H GLY 97 H GLY 97 -5.643 12.826 7.965 691 HA2 GLY 97 1HA GLY 97 -4.598 10.267 8.863 692 HA3 GLY 97 2HA GLY 97 -4.471 10.957 7.228 693 H SER 98 H SER 98 -2.434 9.559 8.804 694 HA SER 98 HA SER 98 -0.327 11.740 8.941 695 HB2 SER 98 1HB SER 98 0.863 10.526 10.426 696 HB3 SER 98 2HB SER 98 -0.792 10.540 11.016 697 HG SER 98 HG SER 98 -0.167 8.507 11.170 698 H CYS 99 H CYS 99 1.900 10.432 8.662 699 HA CYS 99 HA CYS 99 2.009 9.410 5.890 700 HB2 CYS 99 1HB CYS 99 4.230 9.532 6.016 701 HB3 CYS 99 2HB CYS 99 3.700 10.879 7.014 702 HG CYS 99 HG CYS 99 5.825 9.871 8.013 703 H GLN 100 H GLN 100 1.351 8.067 8.969 704 HA GLN 100 HA GLN 100 2.730 5.505 8.457 705 HB2 GLN 100 1HB GLN 100 0.933 6.442 10.734 706 HB3 GLN 100 2HB GLN 100 1.713 4.868 10.665 707 HG2 GLN 100 1HG GLN 100 3.909 5.907 10.724 708 HG3 GLN 100 2HG GLN 100 3.157 7.527 10.702 709 HE21 GLN 100 2HE2 GLN 100 4.082 4.797 12.618 710 HE22 GLN 100 2HE1 GLN 100 3.551 5.408 14.150 711 H PHE 101 H PHE 101 1.760 3.505 8.280 712 HA PHE 101 HA PHE 101 -1.147 3.401 7.734 713 HB2 PHE 101 1HB PHE 101 -0.867 2.476 5.493 714 HB3 PHE 101 2HB PHE 101 -0.146 4.077 5.553 715 HD1 PHE 101 2HD PHE 101 2.312 4.340 5.589 716 HD2 PHE 101 1HD PHE 101 0.455 0.525 5.098 717 HE1 PHE 101 2HE PHE 101 4.440 3.417 4.733 718 HE2 PHE 101 1HE PHE 101 2.580 -0.403 4.244 719 HZ PHE 101 HZ PHE 101 4.574 1.043 4.062 720 H PHE 102 H PHE 102 -1.995 1.297 7.554 721 HA PHE 102 HA PHE 102 -0.325 -0.632 9.117 722 HB2 PHE 102 1HB PHE 102 -3.337 -0.361 8.741 723 HB3 PHE 102 2HB PHE 102 -2.577 -1.712 9.567 724 HD1 PHE 102 1HD PHE 102 -3.174 1.930 9.694 725 HD2 PHE 102 2HD PHE 102 -1.775 -1.515 11.798 726 HE1 PHE 102 1HE PHE 102 -3.188 3.216 11.805 727 HE2 PHE 102 2HE PHE 102 -1.790 -0.233 13.912 728 HZ PHE 102 HZ PHE 102 -2.495 2.134 13.915 729 H ILE 103 H ILE 103 0.510 -2.323 8.188 730 HA ILE 103 HA ILE 103 -0.810 -3.449 5.748 731 HB ILE 103 HB ILE 103 1.831 -4.156 7.124 732 HG12 ILE 103 1HG1 ILE 103 1.347 -2.655 4.540 733 HG13 ILE 103 1HG2 ILE 103 1.818 -1.919 6.064 734 HG21 ILE 103 2HG1 ILE 103 2.258 -5.501 5.106 735 HG22 ILE 103 2HG2 ILE 103 0.807 -6.073 5.961 736 HG23 ILE 103 2HG3 ILE 103 0.641 -5.091 4.487 737 HD11 ILE 103 1HD3 ILE 103 3.432 -3.955 4.512 738 HD12 ILE 103 1HD1 ILE 103 3.738 -2.205 4.599 739 HD13 ILE 103 1HD2 ILE 103 3.909 -3.211 6.057 740 H VAL 104 H VAL 104 -2.399 -4.739 6.024 741 HA VAL 104 HA VAL 104 -2.543 -6.380 8.521 742 HB VAL 104 HB VAL 104 -4.564 -5.960 6.267 743 HG11 VAL 104 1HG1 VAL 104 -6.178 -6.921 7.834 744 HG12 VAL 104 1HG2 VAL 104 -4.873 -8.065 7.436 745 HG13 VAL 104 1HG3 VAL 104 -4.867 -7.216 9.002 746 HG21 VAL 104 2HG3 VAL 104 -4.101 -3.866 7.493 747 HG22 VAL 104 2HG1 VAL 104 -5.726 -4.482 7.875 748 HG23 VAL 104 2HG2 VAL 104 -4.397 -4.702 9.037 749 H HIS 105 H HIS 105 -1.930 -8.342 8.650 750 HA HIS 105 HA HIS 105 -1.613 -9.928 6.149 751 HB2 HIS 105 1HB HIS 105 0.204 -9.809 7.971 752 HB3 HIS 105 2HB HIS 105 -0.883 -10.747 8.985 753 HD2 HIS 105 2HD HIS 105 1.663 -11.360 6.017 754 HE1 HIS 105 1HE HIS 105 -0.320 -15.001 6.951 755 H GLU 106 H GLU 106 -3.148 -10.229 9.363 756 HA GLU 106 HA GLU 106 -5.032 -12.213 8.137 757 HB2 GLU 106 1HB GLU 106 -4.391 -11.643 11.063 758 HB3 GLU 106 2HB GLU 106 -5.556 -12.829 10.490 759 HG2 GLU 106 1HG GLU 106 -2.570 -12.879 10.004 760 HG3 GLU 106 2HG GLU 106 -3.463 -13.876 11.150 761 HA PRO 107 HA PRO 107 -8.418 -9.480 8.116 762 HB2 PRO 107 1HB PRO 107 -9.844 -11.783 9.528 763 HB3 PRO 107 2HB PRO 107 -10.371 -10.878 8.103 764 HG2 PRO 107 1HG PRO 107 -9.387 -13.322 7.744 765 HG3 PRO 107 2HG PRO 107 -8.886 -12.035 6.643 766 HD2 PRO 107 1HD PRO 107 -7.395 -13.228 9.007 767 HD3 PRO 107 2HD PRO 107 -6.758 -12.723 7.390 768 H GLN 108 H GLN 108 -8.913 -7.878 9.325 769 HA GLN 108 HA GLN 108 -9.113 -8.328 12.278 770 HB2 GLN 108 1HB GLN 108 -7.628 -6.099 10.829 771 HB3 GLN 108 2HB GLN 108 -8.049 -6.036 12.534 772 HG2 GLN 108 1HG GLN 108 -6.397 -8.268 11.349 773 HG3 GLN 108 2HG GLN 108 -5.697 -6.751 11.982 774 HE21 GLN 108 2HE2 GLN 108 -7.732 -9.553 12.851 775 HE22 GLN 108 2HE1 GLN 108 -7.305 -9.566 14.530 776 HA PRO 109 HA PRO 109 -12.856 -6.078 11.067 777 HB2 PRO 109 1HB PRO 109 -14.598 -7.537 12.542 778 HB3 PRO 109 2HB PRO 109 -13.966 -8.233 11.044 779 HG2 PRO 109 1HG PRO 109 -13.034 -8.706 13.910 780 HG3 PRO 109 2HG PRO 109 -13.411 -9.909 12.673 781 HD2 PRO 109 1HD PRO 109 -10.843 -9.074 13.158 782 HD3 PRO 109 2HD PRO 109 -11.402 -9.566 11.508 783 H HIS 110 H HIS 110 -11.067 -4.857 12.528 784 HA HIS 110 HA HIS 110 -12.626 -3.972 14.913 785 HB2 HIS 110 1HB HIS 110 -9.633 -4.548 14.956 786 HB3 HIS 110 2HB HIS 110 -10.595 -3.927 16.289 787 HD2 HIS 110 2HD HIS 110 -9.442 -7.394 14.922 788 HE1 HIS 110 1HE HIS 110 -12.638 -8.036 17.646 789 H LEU 111 H LEU 111 -10.458 -3.330 12.293 790 HA LEU 111 HA LEU 111 -10.262 -0.467 13.115 791 HB2 LEU 111 1HB LEU 111 -8.910 -1.954 10.827 792 HB3 LEU 111 2HB LEU 111 -8.585 -0.291 11.329 793 HG LEU 111 HG LEU 111 -8.002 -2.777 12.977 794 HD11 LEU 111 1HD1 LEU 111 -5.657 -2.239 12.491 795 HD12 LEU 111 1HD2 LEU 111 -6.575 -2.586 11.006 796 HD13 LEU 111 1HD3 LEU 111 -6.182 -0.904 11.438 797 HD21 LEU 111 2HD3 LEU 111 -8.551 -0.789 14.341 798 HD22 LEU 111 2HD1 LEU 111 -6.818 -1.186 14.451 799 HD23 LEU 111 2HD2 LEU 111 -7.360 0.166 13.426 800 H ASP 112 H ASP 112 -12.412 -2.334 11.563 801 HA ASP 112 HA ASP 112 -12.927 -0.864 9.142 802 HB2 ASP 112 1HB ASP 112 -14.773 -2.494 10.937 803 HB3 ASP 112 2HB ASP 112 -15.234 -1.859 9.364 804 H GLY 113 H GLY 113 -13.285 1.198 8.996 805 HA2 GLY 113 1HA GLY 113 -14.672 3.114 9.276 806 HA3 GLY 113 2HA GLY 113 -15.311 2.422 10.784 807 H VAL 114 H VAL 114 -12.194 1.795 11.145 808 HA VAL 114 HA VAL 114 -11.646 4.334 12.633 809 HB VAL 114 HB VAL 114 -10.181 1.651 12.591 810 HG11 VAL 114 1HG1 VAL 114 -9.013 2.498 14.567 811 HG12 VAL 114 1HG2 VAL 114 -8.710 3.505 13.131 812 HG13 VAL 114 1HG3 VAL 114 -9.843 4.061 14.386 813 HG21 VAL 114 2HG3 VAL 114 -12.439 1.476 13.577 814 HG22 VAL 114 2HG1 VAL 114 -11.185 1.326 14.829 815 HG23 VAL 114 2HG2 VAL 114 -12.081 2.852 14.648 816 H HIS 115 H HIS 115 -10.254 2.295 10.088 817 HA HIS 115 HA HIS 115 -8.647 4.696 9.291 818 HB2 HIS 115 1HB HIS 115 -7.773 1.778 9.143 819 HB3 HIS 115 2HB HIS 115 -6.865 3.150 8.523 820 HD2 HIS 115 2HD HIS 115 -6.869 1.035 11.589 821 HE1 HIS 115 1HE HIS 115 -5.421 4.831 12.878 822 H THR 116 H THR 116 -7.681 4.147 6.973 823 HA THR 116 HA THR 116 -10.063 3.401 5.307 824 HB THR 116 HB THR 116 -8.149 5.734 4.854 825 HG1 THR 116 1HG THR 116 -10.945 5.769 5.431 826 HG21 THR 116 2HG3 THR 116 -10.602 4.812 3.310 827 HG22 THR 116 2HG1 THR 116 -9.652 6.278 2.978 828 HG23 THR 116 2HG2 THR 116 -8.916 4.671 2.760 829 H VAL 117 H VAL 117 -9.593 1.578 4.355 830 HA VAL 117 HA VAL 117 -6.916 0.815 3.490 831 HB VAL 117 HB VAL 117 -9.685 -0.163 2.637 832 HG11 VAL 117 1HG1 VAL 117 -8.523 -2.140 1.784 833 HG12 VAL 117 1HG2 VAL 117 -8.017 -0.655 0.943 834 HG13 VAL 117 1HG3 VAL 117 -6.958 -1.386 2.173 835 HG21 VAL 117 2HG3 VAL 117 -9.212 -0.498 5.039 836 HG22 VAL 117 2HG1 VAL 117 -9.210 -2.049 4.167 837 HG23 VAL 117 2HG2 VAL 117 -7.670 -1.285 4.628 838 H PHE 118 H PHE 118 -5.788 1.225 1.799 839 HA PHE 118 HA PHE 118 -7.161 2.532 -0.525 840 HB2 PHE 118 1HB PHE 118 -5.329 4.090 -0.751 841 HB3 PHE 118 2HB PHE 118 -5.934 4.216 0.893 842 HD1 PHE 118 2HD PHE 118 -4.621 3.419 2.780 843 HD2 PHE 118 1HD PHE 118 -3.143 3.156 -1.220 844 HE1 PHE 118 2HE PHE 118 -2.342 3.017 3.651 845 HE2 PHE 118 1HE PHE 118 -0.863 2.751 -0.352 846 HZ PHE 118 HZ PHE 118 -0.463 2.681 2.084 847 H GLY 119 H GLY 119 -5.135 0.087 0.644 848 HA2 GLY 119 1HA GLY 119 -4.681 -0.805 -2.135 849 HA3 GLY 119 2HA GLY 119 -3.232 -0.551 -1.135 850 H GLN 120 H GLN 120 -3.269 -2.978 -1.912 851 HA GLN 120 HA GLN 120 -3.800 -4.504 0.527 852 HB2 GLN 120 1HB GLN 120 -6.013 -4.599 -0.681 853 HB3 GLN 120 2HB GLN 120 -5.195 -5.325 -2.057 854 HG2 GLN 120 1HG GLN 120 -4.516 -7.227 -0.636 855 HG3 GLN 120 2HG GLN 120 -5.414 -6.497 0.723 856 HE21 GLN 120 2HE2 GLN 120 -6.493 -8.663 0.617 857 HE22 GLN 120 2HE1 GLN 120 -7.860 -8.825 -0.435 858 H VAL 121 H VAL 121 -2.220 -5.842 0.866 859 HA VAL 121 HA VAL 121 -0.135 -6.292 -1.120 860 HB VAL 121 HB VAL 121 -0.739 -7.713 1.520 861 HG11 VAL 121 1HG1 VAL 121 1.597 -8.433 1.438 862 HG12 VAL 121 1HG2 VAL 121 0.657 -9.062 0.065 863 HG13 VAL 121 1HG3 VAL 121 1.769 -7.692 -0.170 864 HG21 VAL 121 2HG3 VAL 121 -0.340 -5.290 1.796 865 HG22 VAL 121 2HG1 VAL 121 1.021 -6.237 2.440 866 HG23 VAL 121 2HG2 VAL 121 1.167 -5.429 0.860 867 H THR 122 H THR 122 0.218 -7.779 -2.536 868 HA THR 122 HA THR 122 -1.719 -10.072 -2.624 869 HB THR 122 HB THR 122 -1.478 -10.047 -5.074 870 HG1 THR 122 1HG THR 122 -0.325 -8.270 -6.022 871 HG21 THR 122 2HG3 THR 122 -2.165 -7.300 -3.960 872 HG22 THR 122 2HG1 THR 122 -2.651 -7.933 -5.550 873 HG23 THR 122 2HG2 THR 122 -3.275 -8.686 -4.063 874 H SER 123 H SER 123 1.580 -9.048 -2.608 875 HA SER 123 HA SER 123 2.447 -11.932 -2.517 876 HB2 SER 123 1HB SER 123 2.629 -11.381 -4.804 877 HB3 SER 123 2HB SER 123 3.591 -9.961 -4.422 878 HG SER 123 HG SER 123 4.843 -11.757 -4.929 879 H GLY 124 H GLY 124 4.290 -12.248 -1.316 880 HA2 GLY 124 1HA GLY 124 6.229 -11.597 -0.108 881 HA3 GLY 124 2HA GLY 124 5.736 -9.893 -0.249 882 H MET 125 H MET 125 3.173 -11.962 0.613 883 HA MET 125 HA MET 125 2.849 -10.914 3.262 884 HB2 MET 125 1HB MET 125 1.756 -13.401 1.905 885 HB3 MET 125 2HB MET 125 1.285 -12.898 3.523 886 HG2 MET 125 1HG MET 125 0.429 -10.768 2.606 887 HG3 MET 125 2HG MET 125 0.887 -11.290 0.984 888 HE1 MET 125 3HE MET 125 -1.552 -11.722 3.989 889 HE2 MET 125 1HE MET 125 -2.441 -13.204 3.561 890 HE3 MET 125 2HE MET 125 -0.721 -13.297 4.011 891 H ASP 126 H ASP 126 4.658 -13.650 2.021 892 HA ASP 126 HA ASP 126 5.237 -14.891 4.542 893 HB2 ASP 126 1HB ASP 126 6.779 -14.734 1.924 894 HB3 ASP 126 2HB ASP 126 7.347 -15.658 3.307 895 H VAL 127 H VAL 127 6.487 -12.017 2.988 896 HA VAL 127 HA VAL 127 8.677 -11.695 4.954 897 HB VAL 127 HB VAL 127 7.461 -9.769 2.915 898 HG11 VAL 127 1HG1 VAL 127 9.493 -8.448 3.249 899 HG12 VAL 127 1HG2 VAL 127 8.540 -8.593 4.745 900 HG13 VAL 127 1HG3 VAL 127 10.012 -9.571 4.530 901 HG21 VAL 127 2HG3 VAL 127 8.507 -11.747 1.867 902 HG22 VAL 127 2HG1 VAL 127 9.480 -10.285 1.581 903 HG23 VAL 127 2HG2 VAL 127 9.989 -11.466 2.811 904 H VAL 128 H VAL 128 5.461 -10.296 4.403 905 HA VAL 128 HA VAL 128 5.521 -8.404 6.550 906 HB VAL 128 HB VAL 128 3.209 -10.063 5.435 907 HG11 VAL 128 1HG1 VAL 128 1.746 -8.364 6.416 908 HG12 VAL 128 1HG2 VAL 128 2.686 -9.231 7.655 909 HG13 VAL 128 1HG3 VAL 128 3.159 -7.585 7.168 910 HG21 VAL 128 2HG3 VAL 128 4.319 -8.631 3.756 911 HG22 VAL 128 2HG1 VAL 128 2.700 -8.008 4.153 912 HG23 VAL 128 2HG2 VAL 128 4.145 -7.226 4.836 913 H ARG 129 H ARG 129 4.554 -11.827 6.582 914 HA ARG 129 HA ARG 129 3.849 -11.768 9.392 915 HB2 ARG 129 1HB ARG 129 3.687 -14.170 9.199 916 HB3 ARG 129 2HB ARG 129 2.997 -13.462 7.747 917 HG2 ARG 129 1HG ARG 129 5.149 -13.921 6.560 918 HG3 ARG 129 2HG ARG 129 5.709 -14.772 8.020 919 HD2 ARG 129 1HD ARG 129 4.841 -16.343 6.436 920 HD3 ARG 129 2HD ARG 129 3.769 -16.261 7.853 921 HE ARG 129 HE ARG 129 2.700 -14.457 6.070 922 HH11 ARG 129 1HH1 ARG 129 3.510 -17.874 5.982 923 HH12 ARG 129 1HH2 ARG 129 2.245 -18.273 4.841 924 HH21 ARG 129 2HH1 ARG 129 1.061 -14.987 4.590 925 HH22 ARG 129 2HH2 ARG 129 0.858 -16.640 4.053 926 H THR 130 H THR 130 6.831 -11.719 7.793 927 HA THR 130 HA THR 130 8.176 -12.519 10.356 928 HB THR 130 HB THR 130 10.179 -13.051 8.978 929 HG1 THR 130 1HG THR 130 8.582 -12.995 6.656 930 HG21 THR 130 2HG3 THR 130 7.660 -14.505 8.085 931 HG22 THR 130 2HG1 THR 130 9.322 -15.126 7.964 932 HG23 THR 130 2HG2 THR 130 8.589 -14.850 9.562 933 H MET 131 H MET 131 7.047 -9.900 9.286 934 HA MET 131 HA MET 131 9.195 -8.150 8.618 935 HB2 MET 131 1HB MET 131 6.719 -7.651 8.465 936 HB3 MET 131 2HB MET 131 6.701 -7.463 10.212 937 HG2 MET 131 1HG MET 131 8.324 -5.610 10.029 938 HG3 MET 131 2HG MET 131 8.333 -5.796 8.273 939 HE1 MET 131 3HE MET 131 5.331 -6.408 7.553 940 HE2 MET 131 1HE MET 131 4.706 -4.764 7.272 941 HE3 MET 131 2HE MET 131 6.329 -5.211 6.692 942 H LYS 132 H LYS 132 10.749 -7.171 9.670 943 HA LYS 132 HA LYS 132 11.249 -7.966 12.456 944 HB2 LYS 132 1HB LYS 132 12.782 -6.196 10.513 945 HB3 LYS 132 2HB LYS 132 13.325 -6.571 12.142 946 HG2 LYS 132 1HG LYS 132 13.407 -8.972 11.565 947 HG3 LYS 132 2HG LYS 132 12.872 -8.587 9.923 948 HD2 LYS 132 1HD LYS 132 14.875 -7.204 9.570 949 HD3 LYS 132 2HD LYS 132 15.403 -7.522 11.230 950 HE2 LYS 132 1HE LYS 132 15.543 -9.940 10.722 951 HE3 LYS 132 2HE LYS 132 15.020 -9.624 9.066 952 HZ1 LYS 132 3HZ LYS 132 17.478 -8.583 10.307 953 HZ2 LYS 132 1HZ LYS 132 17.391 -9.819 9.219 954 HZ3 LYS 132 2HZ LYS 132 16.988 -8.287 8.760 955 H ASN 133 H ASN 133 11.576 -6.599 14.207 956 HA ASN 133 HA ASN 133 9.733 -4.380 14.424 957 HB2 ASN 133 1HB ASN 133 10.510 -5.827 16.322 958 HB3 ASN 133 2HB ASN 133 12.085 -5.054 16.210 959 HD21 ASN 133 2HD2 ASN 133 10.282 -5.049 18.443 960 HD22 ASN 133 2HD1 ASN 133 9.872 -3.397 18.761 961 H GLY 134 H GLY 134 9.909 -2.559 13.384 962 HA2 GLY 134 1HA GLY 134 10.864 -0.592 12.584 963 HA3 GLY 134 2HA GLY 134 12.359 -0.989 13.464 964 H ASP 135 H ASP 135 10.809 -3.203 11.212 965 HA ASP 135 HA ASP 135 13.114 -3.789 9.715 966 HB2 ASP 135 1HB ASP 135 10.721 -4.882 9.706 967 HB3 ASP 135 2HB ASP 135 10.374 -3.722 8.432 968 H VAL 136 H VAL 136 14.365 -2.716 8.423 969 HA VAL 136 HA VAL 136 13.628 0.037 7.655 970 HB VAL 136 HB VAL 136 16.101 -1.631 6.990 971 HG11 VAL 136 1HG1 VAL 136 17.165 0.531 6.563 972 HG12 VAL 136 1HG2 VAL 136 15.780 0.245 5.482 973 HG13 VAL 136 1HG3 VAL 136 15.617 1.353 6.866 974 HG21 VAL 136 2HG3 VAL 136 15.793 -1.385 9.429 975 HG22 VAL 136 2HG1 VAL 136 17.167 -0.410 8.859 976 HG23 VAL 136 2HG2 VAL 136 15.615 0.375 9.230 977 H MET 137 H MET 137 12.631 0.658 5.963 978 HA MET 137 HA MET 137 12.320 -1.181 3.668 979 HB2 MET 137 1HB MET 137 11.229 1.594 4.253 980 HB3 MET 137 2HB MET 137 10.887 0.689 2.785 981 HG2 MET 137 1HG MET 137 9.822 -1.088 4.124 982 HG3 MET 137 2HG MET 137 10.168 -0.182 5.599 983 HE1 MET 137 3HE MET 137 9.486 2.673 5.404 984 HE2 MET 137 1HE MET 137 7.718 2.722 5.609 985 HE3 MET 137 2HE MET 137 8.696 1.593 6.579 986 H LYS 138 H LYS 138 13.723 -1.323 2.115 987 HA LYS 138 HA LYS 138 15.910 0.629 1.998 988 HB2 LYS 138 1HB LYS 138 16.327 -1.809 1.779 989 HB3 LYS 138 2HB LYS 138 15.346 -1.848 0.321 990 HG2 LYS 138 1HG LYS 138 16.931 -0.428 -0.851 991 HG3 LYS 138 2HG LYS 138 17.881 -0.215 0.627 992 HD2 LYS 138 1HD LYS 138 18.329 -2.653 0.685 993 HD3 LYS 138 2HD LYS 138 17.391 -2.856 -0.802 994 HE2 LYS 138 1HE LYS 138 18.966 -1.366 -1.998 995 HE3 LYS 138 2HE LYS 138 19.903 -1.165 -0.515 996 HZ1 LYS 138 3HZ LYS 138 19.461 -3.713 -1.923 997 HZ2 LYS 138 1HZ LYS 138 20.851 -2.825 -1.941 998 HZ3 LYS 138 2HZ LYS 138 20.337 -3.526 -0.539 999 H GLU 139 H GLU 139 13.197 -0.329 -0.073 1000 HA GLU 139 HA GLU 139 13.401 2.252 -1.487 1001 HB2 GLU 139 1HB GLU 139 14.958 0.816 -2.778 1002 HB3 GLU 139 2HB GLU 139 13.705 -0.405 -2.951 1003 HG2 GLU 139 1HG GLU 139 12.350 1.116 -4.281 1004 HG3 GLU 139 2HG GLU 139 13.519 2.413 -4.037 1005 H VAL 140 H VAL 140 11.441 2.966 -1.154 1006 HA VAL 140 HA VAL 140 9.141 1.162 -1.893 1007 HB VAL 140 HB VAL 140 9.141 3.730 -0.238 1008 HG11 VAL 140 1HG1 VAL 140 6.849 3.089 0.325 1009 HG12 VAL 140 1HG2 VAL 140 7.061 3.337 -1.424 1010 HG13 VAL 140 1HG3 VAL 140 6.975 1.686 -0.764 1011 HG21 VAL 140 2HG3 VAL 140 10.309 1.904 0.947 1012 HG22 VAL 140 2HG1 VAL 140 8.735 2.247 1.701 1013 HG23 VAL 140 2HG2 VAL 140 8.924 0.824 0.650 1014 H LYS 141 H LYS 141 7.945 1.537 -3.550 1015 HA LYS 141 HA LYS 141 7.922 4.224 -4.795 1016 HB2 LYS 141 1HB LYS 141 8.654 3.421 -6.968 1017 HB3 LYS 141 2HB LYS 141 9.914 3.107 -5.783 1018 HG2 LYS 141 1HG LYS 141 9.201 0.746 -5.647 1019 HG3 LYS 141 2HG LYS 141 7.942 1.064 -6.849 1020 HD2 LYS 141 1HD LYS 141 9.679 1.742 -8.483 1021 HD3 LYS 141 2HD LYS 141 10.933 1.406 -7.281 1022 HE2 LYS 141 1HE LYS 141 10.276 -0.955 -7.210 1023 HE3 LYS 141 2HE LYS 141 8.950 -0.645 -8.335 1024 HZ1 LYS 141 3HZ LYS 141 11.813 -0.305 -8.935 1025 HZ2 LYS 141 1HZ LYS 141 10.856 -1.548 -9.447 1026 HZ3 LYS 141 2HZ LYS 141 10.574 -0.014 -9.985 1027 H VAL 142 H VAL 142 6.351 4.478 -6.450 1028 HA VAL 142 HA VAL 142 4.303 2.278 -6.597 1029 HB VAL 142 HB VAL 142 3.817 5.277 -6.249 1030 HG11 VAL 142 1HG1 VAL 142 1.436 4.721 -6.350 1031 HG12 VAL 142 1HG2 VAL 142 2.278 4.326 -7.868 1032 HG13 VAL 142 1HG3 VAL 142 1.847 3.032 -6.724 1033 HG21 VAL 142 2HG3 VAL 142 4.352 4.101 -4.143 1034 HG22 VAL 142 2HG1 VAL 142 2.640 4.583 -4.185 1035 HG23 VAL 142 2HG2 VAL 142 3.096 2.891 -4.497 1036 H PHE 143 H PHE 143 3.325 1.919 -8.465 1037 HA PHE 143 HA PHE 143 4.134 3.577 -10.800 1038 HB2 PHE 143 1HB PHE 143 4.947 1.573 -12.007 1039 HB3 PHE 143 2HB PHE 143 5.944 1.927 -10.605 1040 HD1 PHE 143 2HD PHE 143 5.809 0.516 -8.584 1041 HD2 PHE 143 1HD PHE 143 3.659 -0.439 -12.151 1042 HE1 PHE 143 2HE PHE 143 5.481 -1.794 -7.766 1043 HE2 PHE 143 1HE PHE 143 3.328 -2.748 -11.335 1044 HZ PHE 143 HZ PHE 143 4.239 -3.426 -9.142 1045 H ASP 144 H ASP 144 3.193 2.608 -12.856 1046 HA ASP 144 HA ASP 144 0.401 1.694 -12.234 1047 HB2 ASP 144 1HB ASP 144 0.590 4.054 -13.112 1048 HB3 ASP 144 2HB ASP 144 1.338 3.414 -14.568 1049 H GLU 145 H GLU 145 -0.244 -0.147 -13.014 1050 HA GLU 145 HA GLU 145 1.289 -1.354 -15.284 1051 HB2 GLU 145 1HB GLU 145 2.208 -2.225 -13.132 1052 HB3 GLU 145 2HB GLU 145 0.594 -2.736 -12.658 1053 HG2 GLU 145 1HG GLU 145 0.512 -4.304 -14.533 1054 HG3 GLU 145 2HG GLU 145 2.101 -3.764 -15.072 1055 HA PRO 146 HA PRO 146 -2.827 -2.239 -16.619 1056 HB2 PRO 146 1HB PRO 146 -2.135 -3.570 -18.909 1057 HB3 PRO 146 2HB PRO 146 -1.903 -1.821 -18.801 1058 HG2 PRO 146 1HG PRO 146 0.133 -4.048 -18.371 1059 HG3 PRO 146 2HG PRO 146 0.300 -2.589 -19.352 1060 HD2 PRO 146 1HD PRO 146 1.303 -2.716 -16.821 1061 HD3 PRO 146 2HD PRO 146 0.606 -1.183 -17.485
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