NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
633614 | 5z4e | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1HT MET 1 1.162 13.378 -5.762 2 H2 MET 1 2HT MET 1 1.440 14.018 -7.311 3 H3 MET 1 3HT MET 1 1.647 14.993 -5.936 4 HA MET 1 HA MET 1 3.812 14.471 -6.394 5 HB2 MET 1 2HB MET 1 2.597 13.166 -4.215 6 HB3 MET 1 1HB MET 1 3.659 11.963 -4.947 7 HG2 MET 1 2HG MET 1 4.958 13.205 -3.328 8 HG3 MET 1 1HG MET 1 5.496 13.688 -4.936 9 HE1 MET 1 1HE MET 1 6.576 15.367 -3.259 10 HE2 MET 1 2HE MET 1 5.539 15.351 -1.835 11 HE3 MET 1 3HE MET 1 5.803 16.859 -2.706 12 HA PRO 2 HA PRO 2 3.746 10.252 -8.580 13 HB2 PRO 2 2HB PRO 2 1.419 8.827 -8.651 14 HB3 PRO 2 1HB PRO 2 2.568 8.734 -7.305 15 HG2 PRO 2 2HG PRO 2 -0.073 9.971 -7.412 16 HG3 PRO 2 1HG PRO 2 0.892 9.488 -6.011 17 HD2 PRO 2 2HD PRO 2 0.566 12.135 -7.124 18 HD3 PRO 2 1HD PRO 2 1.482 11.658 -5.678 19 H GLU 3 H GLU 3 2.952 9.419 -10.767 20 HA GLU 3 HA GLU 3 2.371 11.433 -12.584 21 HB2 GLU 3 2HB GLU 3 1.341 8.589 -12.738 22 HB3 GLU 3 1HB GLU 3 1.534 9.689 -14.100 23 HG2 GLU 3 2HG GLU 3 3.976 9.818 -13.600 24 HG3 GLU 3 1HG GLU 3 3.749 8.619 -12.325 25 H GLU 4 H GLU 4 0.357 12.201 -13.533 26 HA GLU 4 HA GLU 4 -1.680 12.862 -11.747 27 HB2 GLU 4 2HB GLU 4 -1.988 12.369 -14.726 28 HB3 GLU 4 1HB GLU 4 -3.113 13.279 -13.717 29 HG2 GLU 4 2HG GLU 4 -1.282 14.860 -13.143 30 HG3 GLU 4 1HG GLU 4 -0.206 13.979 -14.227 31 H ILE 5 H ILE 5 -3.833 11.983 -11.423 32 HA ILE 5 HA ILE 5 -4.005 9.327 -10.729 33 HB ILE 5 HB ILE 5 -6.170 11.134 -11.831 34 HG12 ILE 5 2HG1 ILE 5 -5.666 10.172 -9.004 35 HG13 ILE 5 1HG1 ILE 5 -4.986 11.670 -9.640 36 HG21 ILE 5 1HG2 ILE 5 -7.709 9.454 -10.659 37 HG22 ILE 5 2HG2 ILE 5 -6.336 8.347 -10.669 38 HG23 ILE 5 3HG2 ILE 5 -7.010 8.933 -12.191 39 HD11 ILE 5 1HD1 ILE 5 -7.892 10.962 -9.227 40 HD12 ILE 5 2HD1 ILE 5 -7.405 12.281 -10.290 41 HD13 ILE 5 3HD1 ILE 5 -7.000 12.336 -8.575 42 HA PRO 6 HA PRO 6 -3.933 7.680 -15.000 43 HB2 PRO 6 2HB PRO 6 -2.679 5.356 -14.472 44 HB3 PRO 6 1HB PRO 6 -1.797 6.896 -14.507 45 HG2 PRO 6 2HG PRO 6 -2.669 5.269 -12.188 46 HG3 PRO 6 1HG PRO 6 -1.225 6.272 -12.388 47 HD2 PRO 6 2HD PRO 6 -3.581 7.017 -11.024 48 HD3 PRO 6 1HD PRO 6 -2.269 8.105 -11.522 49 H ASP 7 H ASP 7 -5.274 6.106 -16.033 50 HA ASP 7 HA ASP 7 -7.531 5.156 -14.523 51 HB2 ASP 7 2HB ASP 7 -6.520 4.421 -17.291 52 HB3 ASP 7 1HB ASP 7 -8.077 3.921 -16.636 53 H VAL 8 H VAL 8 -7.113 2.487 -16.246 54 HA VAL 8 HA VAL 8 -6.623 0.754 -14.087 55 HB VAL 8 HB VAL 8 -5.881 0.255 -16.987 56 HG11 VAL 8 1HG1 VAL 8 -6.956 -1.967 -15.449 57 HG12 VAL 8 2HG1 VAL 8 -5.501 -1.313 -14.697 58 HG13 VAL 8 3HG1 VAL 8 -5.454 -1.872 -16.369 59 HG21 VAL 8 1HG2 VAL 8 -8.402 -0.862 -16.073 60 HG22 VAL 8 2HG2 VAL 8 -8.084 0.166 -17.471 61 HG23 VAL 8 3HG2 VAL 8 -8.390 0.893 -15.893 62 H ARG 9 H ARG 9 -4.763 0.025 -13.085 63 HA ARG 9 HA ARG 9 -2.261 1.391 -13.832 64 HB2 ARG 9 2HB ARG 9 -2.985 -0.333 -11.455 65 HB3 ARG 9 1HB ARG 9 -1.402 0.401 -11.692 66 HG2 ARG 9 2HG ARG 9 -2.518 2.637 -11.816 67 HG3 ARG 9 1HG ARG 9 -4.047 1.854 -11.419 68 HD2 ARG 9 2HD ARG 9 -2.947 0.952 -9.334 69 HD3 ARG 9 1HD ARG 9 -1.554 1.968 -9.703 70 HE ARG 9 HE ARG 9 -4.128 3.384 -9.583 71 HH11 ARG 9 1HH1 ARG 9 -4.248 4.957 -7.963 72 HH12 ARG 9 2HH1 ARG 9 -3.032 5.007 -6.732 73 HH21 ARG 9 1HH2 ARG 9 -1.261 2.308 -7.997 74 HH22 ARG 9 2HH2 ARG 9 -1.340 3.508 -6.751 75 H LYS 10 H LYS 10 -0.513 -0.689 -12.751 76 HA LYS 10 HA LYS 10 -0.701 -2.665 -14.983 77 HB2 LYS 10 2HB LYS 10 1.701 -1.291 -13.769 78 HB3 LYS 10 1HB LYS 10 1.814 -2.663 -14.864 79 HG2 LYS 10 2HG LYS 10 0.515 -1.385 -16.554 80 HG3 LYS 10 1HG LYS 10 0.526 0.006 -15.469 81 HD2 LYS 10 2HD LYS 10 3.024 -0.051 -15.489 82 HD3 LYS 10 1HD LYS 10 2.952 -1.352 -16.678 83 HE2 LYS 10 2HE LYS 10 1.871 0.071 -18.289 84 HE3 LYS 10 1HE LYS 10 1.634 1.343 -17.090 85 HZ1 LYS 10 1HZ LYS 10 4.023 1.594 -16.921 86 HZ2 LYS 10 2HZ LYS 10 3.521 1.807 -18.530 87 HZ3 LYS 10 3HZ LYS 10 4.263 0.354 -18.054 88 H SER 11 H SER 11 1.205 -4.403 -14.370 89 HA SER 11 HA SER 11 0.549 -5.391 -11.619 90 HB2 SER 11 2HB SER 11 0.458 -7.637 -12.469 91 HB3 SER 11 1HB SER 11 -0.547 -6.655 -13.529 92 HG SER 11 HG SER 11 0.815 -6.969 -15.106 93 H VAL 12 H VAL 12 2.263 -6.575 -10.572 94 HA VAL 12 HA VAL 12 4.907 -6.502 -11.921 95 HB VAL 12 HB VAL 12 4.209 -5.185 -9.314 96 HG11 VAL 12 1HG1 VAL 12 6.859 -6.295 -10.242 97 HG12 VAL 12 2HG1 VAL 12 6.067 -6.527 -8.682 98 HG13 VAL 12 3HG1 VAL 12 6.765 -4.960 -9.094 99 HG21 VAL 12 1HG2 VAL 12 6.072 -4.222 -11.472 100 HG22 VAL 12 2HG2 VAL 12 5.158 -3.270 -10.301 101 HG23 VAL 12 3HG2 VAL 12 4.328 -4.040 -11.653 102 H VAL 13 H VAL 13 6.415 -8.027 -11.063 103 HA VAL 13 HA VAL 13 5.098 -10.213 -9.521 104 HB VAL 13 HB VAL 13 7.685 -10.261 -11.110 105 HG11 VAL 13 1HG1 VAL 13 6.556 -12.048 -9.192 106 HG12 VAL 13 2HG1 VAL 13 7.996 -12.285 -10.181 107 HG13 VAL 13 3HG1 VAL 13 6.421 -12.809 -10.778 108 HG21 VAL 13 1HG2 VAL 13 6.501 -10.984 -12.956 109 HG22 VAL 13 2HG2 VAL 13 5.269 -9.950 -12.236 110 HG23 VAL 13 3HG2 VAL 13 5.215 -11.693 -11.982 111 H VAL 14 H VAL 14 5.826 -10.698 -7.476 112 HA VAL 14 HA VAL 14 8.357 -9.388 -6.571 113 HB VAL 14 HB VAL 14 7.319 -8.869 -4.443 114 HG11 VAL 14 1HG1 VAL 14 5.779 -7.177 -5.146 115 HG12 VAL 14 2HG1 VAL 14 5.334 -8.088 -6.589 116 HG13 VAL 14 3HG1 VAL 14 6.936 -7.362 -6.464 117 HG21 VAL 14 1HG2 VAL 14 5.794 -10.494 -3.870 118 HG22 VAL 14 2HG2 VAL 14 5.209 -10.674 -5.525 119 HG23 VAL 14 3HG2 VAL 14 4.664 -9.317 -4.538 120 H ALA 15 H ALA 15 9.442 -10.538 -4.800 121 HA ALA 15 HA ALA 15 9.021 -13.445 -5.023 122 HB1 ALA 15 1HB ALA 15 11.090 -12.049 -3.326 123 HB2 ALA 15 2HB ALA 15 11.317 -12.333 -5.052 124 HB3 ALA 15 3HB ALA 15 11.128 -13.699 -3.950 125 H ALA 16 H ALA 16 7.127 -13.839 -3.841 126 HA ALA 16 HA ALA 16 7.444 -14.004 -0.961 127 HB1 ALA 16 1HB ALA 16 6.478 -11.565 -1.881 128 HB2 ALA 16 2HB ALA 16 6.253 -12.209 -0.254 129 HB3 ALA 16 3HB ALA 16 5.010 -12.457 -1.481 130 H SER 17 H SER 17 5.867 -15.434 -0.074 131 HA SER 17 HA SER 17 4.595 -17.185 -1.994 132 HB2 SER 17 2HB SER 17 3.871 -18.452 -0.102 133 HB3 SER 17 1HB SER 17 5.455 -17.816 0.331 134 HG SER 17 HG SER 17 3.019 -16.502 0.946 135 H VAL 18 H VAL 18 2.271 -17.543 -2.190 136 HA VAL 18 HA VAL 18 0.758 -15.149 -2.473 137 HB VAL 18 HB VAL 18 -0.840 -17.584 -2.019 138 HG11 VAL 18 1HG1 VAL 18 -1.968 -16.849 -3.919 139 HG12 VAL 18 2HG1 VAL 18 -0.520 -16.136 -4.628 140 HG13 VAL 18 3HG1 VAL 18 -1.337 -15.327 -3.293 141 HG21 VAL 18 1HG2 VAL 18 1.027 -18.821 -2.802 142 HG22 VAL 18 2HG2 VAL 18 1.485 -17.560 -3.950 143 HG23 VAL 18 3HG2 VAL 18 0.053 -18.545 -4.246 144 H GLU 19 H GLU 19 0.801 -17.605 0.093 145 HA GLU 19 HA GLU 19 -1.291 -16.546 1.691 146 HB2 GLU 19 2HB GLU 19 -0.141 -18.740 2.080 147 HB3 GLU 19 1HB GLU 19 1.259 -17.853 2.683 148 HG2 GLU 19 2HG GLU 19 -0.200 -16.789 4.403 149 HG3 GLU 19 1HG GLU 19 -1.544 -17.783 3.839 150 H HIS 20 H HIS 20 2.130 -15.677 1.449 151 HA HIS 20 HA HIS 20 2.248 -13.897 3.657 152 HB2 HIS 20 2HB HIS 20 4.209 -14.755 2.345 153 HB3 HIS 20 1HB HIS 20 3.745 -13.672 1.032 154 HD1 HIS 20 1HD HIS 20 4.449 -13.415 4.773 155 HD2 HIS 20 2HD HIS 20 4.906 -11.177 1.281 156 HE1 HIS 20 1HE HIS 20 5.643 -11.289 5.434 157 HE2 HIS 20 2HE HIS 20 5.929 -9.921 3.320 158 H CYS 21 H CYS 21 1.311 -13.377 0.261 159 HA CYS 21 HA CYS 21 1.124 -10.577 0.253 160 HB2 CYS 21 2HB CYS 21 -0.632 -12.640 -1.112 161 HB3 CYS 21 1HB CYS 21 -0.650 -10.919 -1.491 162 HG CYS 21 HG CYS 21 1.341 -12.841 -2.584 163 H PHE 22 H PHE 22 -1.588 -12.834 0.905 164 HA PHE 22 HA PHE 22 -3.318 -10.715 1.819 165 HB2 PHE 22 2HB PHE 22 -3.628 -13.600 2.621 166 HB3 PHE 22 1HB PHE 22 -4.884 -12.413 2.260 167 HD1 PHE 22 1HD PHE 22 -5.185 -11.608 -0.128 168 HD2 PHE 22 2HD PHE 22 -2.635 -14.900 0.914 169 HE1 PHE 22 1HE PHE 22 -5.164 -12.345 -2.496 170 HE2 PHE 22 2HE PHE 22 -2.616 -15.640 -1.446 171 HZ PHE 22 HZ PHE 22 -3.876 -14.364 -3.155 172 H GLU 23 H GLU 23 -1.130 -12.955 3.438 173 HA GLU 23 HA GLU 23 -1.980 -12.349 6.116 174 HB2 GLU 23 2HB GLU 23 -0.659 -14.367 5.440 175 HB3 GLU 23 1HB GLU 23 0.733 -13.315 5.199 176 HG2 GLU 23 2HG GLU 23 0.543 -12.575 7.570 177 HG3 GLU 23 1HG GLU 23 -0.763 -13.737 7.791 178 H VAL 24 H VAL 24 0.596 -10.989 4.056 179 HA VAL 24 HA VAL 24 1.812 -9.396 6.055 180 HB VAL 24 HB VAL 24 2.491 -9.845 3.542 181 HG11 VAL 24 1HG1 VAL 24 2.025 -8.034 2.064 182 HG12 VAL 24 2HG1 VAL 24 1.310 -7.073 3.355 183 HG13 VAL 24 3HG1 VAL 24 0.479 -8.503 2.756 184 HG21 VAL 24 1HG2 VAL 24 3.864 -8.738 5.301 185 HG22 VAL 24 2HG2 VAL 24 3.056 -7.212 4.938 186 HG23 VAL 24 3HG2 VAL 24 4.070 -7.985 3.720 187 H PHE 25 H PHE 25 -0.925 -8.570 3.891 188 HA PHE 25 HA PHE 25 -1.176 -5.863 4.762 189 HB2 PHE 25 2HB PHE 25 -3.601 -7.557 4.215 190 HB3 PHE 25 1HB PHE 25 -3.316 -5.869 3.799 191 HD1 PHE 25 1HD PHE 25 -0.614 -6.030 2.558 192 HD2 PHE 25 2HD PHE 25 -4.038 -8.590 2.186 193 HE1 PHE 25 1HE PHE 25 0.164 -6.733 0.308 194 HE2 PHE 25 2HE PHE 25 -3.264 -9.298 -0.070 195 HZ PHE 25 HZ PHE 25 -1.163 -8.368 -1.005 196 H THR 26 H THR 26 -2.643 -8.849 6.002 197 HA THR 26 HA THR 26 -3.921 -7.438 8.218 198 HB THR 26 HB THR 26 -4.768 -9.623 8.829 199 HG1 THR 26 1HG THR 26 -3.978 -11.466 7.827 200 HG21 THR 26 1HG2 THR 26 -5.949 -8.664 6.983 201 HG22 THR 26 2HG2 THR 26 -5.690 -10.361 6.579 202 HG23 THR 26 3HG2 THR 26 -4.674 -9.116 5.850 203 H SER 27 H SER 27 -0.850 -8.982 7.692 204 HA SER 27 HA SER 27 -0.309 -9.732 10.415 205 HB2 SER 27 2HB SER 27 1.027 -10.539 8.482 206 HB3 SER 27 1HB SER 27 1.664 -8.913 8.277 207 HG SER 27 HG SER 27 3.027 -10.283 9.543 208 H ARG 28 H ARG 28 0.888 -6.891 8.576 209 HA ARG 28 HA ARG 28 0.318 -4.955 10.544 210 HB2 ARG 28 2HB ARG 28 2.802 -4.726 11.369 211 HB3 ARG 28 1HB ARG 28 1.731 -5.881 12.161 212 HG2 ARG 28 2HG ARG 28 2.777 -7.713 11.217 213 HG3 ARG 28 1HG ARG 28 3.274 -6.819 9.780 214 HD2 ARG 28 2HD ARG 28 5.238 -7.303 11.149 215 HD3 ARG 28 1HD ARG 28 4.921 -5.567 11.176 216 HE ARG 28 HE ARG 28 3.570 -6.419 13.393 217 HH11 ARG 28 1HH1 ARG 28 4.502 -6.706 15.432 218 HH12 ARG 28 2HH1 ARG 28 6.193 -7.064 15.554 219 HH21 ARG 28 1HH2 ARG 28 6.720 -7.020 12.127 220 HH22 ARG 28 2HH2 ARG 28 7.448 -7.242 13.683 221 HA PRO 29 HA PRO 29 1.864 -3.566 6.379 222 HB2 PRO 29 2HB PRO 29 -0.085 -1.428 7.067 223 HB3 PRO 29 1HB PRO 29 0.113 -2.329 5.553 224 HG2 PRO 29 2HG PRO 29 -1.916 -2.827 7.204 225 HG3 PRO 29 1HG PRO 29 -1.116 -4.120 6.296 226 HD2 PRO 29 2HD PRO 29 -0.879 -3.437 9.200 227 HD3 PRO 29 1HD PRO 29 -0.820 -5.026 8.404 228 H ALA 30 H ALA 30 1.728 -2.106 9.531 229 HA ALA 30 HA ALA 30 3.007 0.387 8.947 230 HB1 ALA 30 1HB ALA 30 2.257 -1.122 11.295 231 HB2 ALA 30 2HB ALA 30 2.510 0.615 11.130 232 HB3 ALA 30 3HB ALA 30 3.872 -0.444 11.500 233 H ASP 31 H ASP 31 4.184 -2.844 8.988 234 HA ASP 31 HA ASP 31 6.900 -2.467 9.692 235 HB2 ASP 31 2HB ASP 31 5.755 -4.674 9.246 236 HB3 ASP 31 1HB ASP 31 5.883 -4.321 7.523 237 H TRP 32 H TRP 32 5.186 -1.700 6.702 238 HA TRP 32 HA TRP 32 7.671 -0.354 5.753 239 HB2 TRP 32 2HB TRP 32 6.823 -1.173 3.383 240 HB3 TRP 32 1HB TRP 32 7.840 -2.214 4.377 241 HD1 TRP 32 HD TRP 32 6.902 -4.501 4.966 242 HE1 TRP 32 1HE TRP 32 4.613 -5.659 4.774 243 HE3 TRP 32 3HE TRP 32 4.056 -0.554 3.456 244 HZ2 TRP 32 2HZ TRP 32 1.930 -4.996 4.075 245 HZ3 TRP 32 3HZ TRP 32 1.630 -0.840 3.035 246 HH2 TRP 32 HH TRP 32 0.562 -3.058 3.341 247 H TRP 33 H TRP 33 4.754 0.290 6.781 248 HA TRP 33 HA TRP 33 3.493 1.635 4.569 249 HB2 TRP 33 2HB TRP 33 2.448 0.942 6.832 250 HB3 TRP 33 1HB TRP 33 3.103 2.462 7.441 251 HD1 TRP 33 HD TRP 33 2.054 4.711 6.559 252 HE1 TRP 33 1HE TRP 33 -0.104 5.235 5.251 253 HE3 TRP 33 3HE TRP 33 0.810 0.013 4.990 254 HZ2 TRP 33 2HZ TRP 33 -2.093 3.845 3.739 255 HZ3 TRP 33 3HZ TRP 33 -1.218 -0.358 3.618 256 HH2 TRP 33 HH TRP 33 -2.672 1.549 2.990 257 HA PRO 34 HA PRO 34 5.794 5.484 6.112 258 HB2 PRO 34 2HB PRO 34 7.781 5.223 7.940 259 HB3 PRO 34 1HB PRO 34 6.070 5.330 8.393 260 HG2 PRO 34 2HG PRO 34 7.879 3.027 8.459 261 HG3 PRO 34 1HG PRO 34 6.373 3.307 9.341 262 HD2 PRO 34 2HD PRO 34 6.764 1.720 6.964 263 HD3 PRO 34 1HD PRO 34 5.258 1.982 7.866 264 HA PRO 35 HA PRO 35 9.257 4.307 3.351 265 HB2 PRO 35 2HB PRO 35 9.019 6.366 1.608 266 HB3 PRO 35 1HB PRO 35 7.927 4.968 1.571 267 HG2 PRO 35 2HG PRO 35 7.462 7.704 2.611 268 HG3 PRO 35 1HG PRO 35 6.341 6.587 1.818 269 HD2 PRO 35 2HD PRO 35 6.502 7.030 4.581 270 HD3 PRO 35 1HD PRO 35 5.713 5.644 3.803 271 H SER 36 H SER 36 8.818 7.838 3.723 272 HA SER 36 HA SER 36 11.336 8.054 5.232 273 HB2 SER 36 2HB SER 36 11.417 9.951 3.034 274 HB3 SER 36 1HB SER 36 12.650 8.807 3.559 275 HG SER 36 HG SER 36 11.577 8.576 1.369 276 H HIS 37 H HIS 37 9.256 10.181 3.245 277 HA HIS 37 HA HIS 37 8.742 11.798 5.713 278 HB2 HIS 37 2HB HIS 37 8.838 12.717 2.820 279 HB3 HIS 37 1HB HIS 37 8.466 13.741 4.206 280 HD1 HIS 37 1HD HIS 37 10.468 13.693 6.139 281 HD2 HIS 37 2HD HIS 37 11.539 12.667 2.240 282 HE1 HIS 37 1HE HIS 37 12.989 13.923 6.002 283 HE2 HIS 37 2HE HIS 37 13.650 13.302 3.634 284 H VAL 38 H VAL 38 6.597 12.040 6.252 285 HA VAL 38 HA VAL 38 4.579 11.120 4.237 286 HB VAL 38 HB VAL 38 4.377 10.852 7.248 287 HG11 VAL 38 1HG1 VAL 38 2.369 10.872 5.426 288 HG12 VAL 38 2HG1 VAL 38 2.330 9.892 6.891 289 HG13 VAL 38 3HG1 VAL 38 2.821 9.170 5.360 290 HG21 VAL 38 1HG2 VAL 38 5.982 9.251 6.870 291 HG22 VAL 38 2HG2 VAL 38 5.594 9.120 5.155 292 HG23 VAL 38 3HG2 VAL 38 4.581 8.312 6.352 293 H LEU 39 H LEU 39 2.906 12.503 3.855 294 HA LEU 39 HA LEU 39 2.998 15.207 4.760 295 HB2 LEU 39 2HB LEU 39 0.633 13.670 3.639 296 HB3 LEU 39 1HB LEU 39 0.784 15.426 3.712 297 HG LEU 39 HG LEU 39 2.632 13.566 2.187 298 HD11 LEU 39 1HD1 LEU 39 0.103 14.365 1.470 299 HD12 LEU 39 2HD1 LEU 39 1.384 13.953 0.329 300 HD13 LEU 39 3HD1 LEU 39 1.097 15.639 0.763 301 HD21 LEU 39 1HD2 LEU 39 4.005 15.367 2.683 302 HD22 LEU 39 2HD2 LEU 39 2.653 16.492 2.820 303 HD23 LEU 39 3HD2 LEU 39 3.217 15.980 1.229 304 H VAL 40 H VAL 40 1.418 12.344 6.031 305 HA VAL 40 HA VAL 40 -0.470 13.558 7.765 306 HB VAL 40 HB VAL 40 1.156 11.103 8.434 307 HG11 VAL 40 1HG1 VAL 40 -1.757 11.401 8.983 308 HG12 VAL 40 2HG1 VAL 40 -0.645 12.350 9.970 309 HG13 VAL 40 3HG1 VAL 40 -0.511 10.592 9.933 310 HG21 VAL 40 1HG2 VAL 40 0.188 11.095 6.071 311 HG22 VAL 40 2HG2 VAL 40 -1.405 11.183 6.820 312 HG23 VAL 40 3HG2 VAL 40 -0.367 9.790 7.118 313 H LYS 41 H LYS 41 -0.261 14.537 9.775 314 HA LYS 41 HA LYS 41 2.204 15.718 10.516 315 HB2 LYS 41 2HB LYS 41 -0.224 15.108 12.214 316 HB3 LYS 41 1HB LYS 41 1.096 16.165 12.709 317 HG2 LYS 41 2HG LYS 41 0.668 17.570 10.685 318 HG3 LYS 41 1HG LYS 41 -0.730 16.557 10.320 319 HD2 LYS 41 2HD LYS 41 -1.676 17.124 12.560 320 HD3 LYS 41 1HD LYS 41 -0.322 18.225 12.819 321 HE2 LYS 41 2HE LYS 41 -1.940 18.500 10.312 322 HE3 LYS 41 1HE LYS 41 -2.601 19.127 11.822 323 HZ1 LYS 41 1HZ LYS 41 -0.385 20.088 10.241 324 HZ2 LYS 41 2HZ LYS 41 -0.075 20.021 11.910 325 HZ3 LYS 41 3HZ LYS 41 -1.390 20.923 11.322 326 H LYS 42 H LYS 42 0.732 12.650 11.482 327 HA LYS 42 HA LYS 42 3.275 11.994 12.912 328 HB2 LYS 42 2HB LYS 42 0.524 10.927 13.559 329 HB3 LYS 42 1HB LYS 42 2.003 10.636 14.467 330 HG2 LYS 42 2HG LYS 42 1.404 13.492 14.073 331 HG3 LYS 42 1HG LYS 42 0.186 12.636 15.015 332 HD2 LYS 42 2HD LYS 42 1.913 13.511 16.506 333 HD3 LYS 42 1HD LYS 42 1.986 11.749 16.485 334 HE2 LYS 42 2HE LYS 42 3.904 11.737 15.088 335 HE3 LYS 42 1HE LYS 42 3.683 13.427 14.635 336 HZ1 LYS 42 1HZ LYS 42 4.919 12.293 16.988 337 HZ2 LYS 42 2HZ LYS 42 3.875 13.596 17.301 338 HZ3 LYS 42 3HZ LYS 42 5.185 13.789 16.236 339 H GLU 43 H GLU 43 4.237 10.068 12.325 340 HA GLU 43 HA GLU 43 3.357 8.793 9.884 341 HB2 GLU 43 2HB GLU 43 5.461 7.964 11.890 342 HB3 GLU 43 1HB GLU 43 5.252 7.248 10.293 343 HG2 GLU 43 2HG GLU 43 5.622 9.486 9.272 344 HG3 GLU 43 1HG GLU 43 5.912 10.150 10.881 345 H ARG 44 H ARG 44 2.175 6.924 9.625 346 HA ARG 44 HA ARG 44 0.579 5.930 11.784 347 HB2 ARG 44 2HB ARG 44 1.258 4.633 9.125 348 HB3 ARG 44 1HB ARG 44 -0.031 4.108 10.209 349 HG2 ARG 44 2HG ARG 44 0.160 6.870 8.972 350 HG3 ARG 44 1HG ARG 44 -0.867 5.570 8.369 351 HD2 ARG 44 2HD ARG 44 -1.753 5.504 10.844 352 HD3 ARG 44 1HD ARG 44 -1.108 7.144 10.912 353 HE ARG 44 HE ARG 44 -3.507 6.347 9.530 354 HH11 ARG 44 1HH1 ARG 44 -4.533 7.928 8.280 355 HH12 ARG 44 2HH1 ARG 44 -3.657 9.347 7.814 356 HH21 ARG 44 1HH2 ARG 44 -0.733 8.390 9.415 357 HH22 ARG 44 2HH2 ARG 44 -1.506 9.609 8.458 358 H ALA 45 H ALA 45 0.837 4.106 13.093 359 HA ALA 45 HA ALA 45 3.394 2.592 12.776 360 HB1 ALA 45 1HB ALA 45 3.822 2.708 15.139 361 HB2 ALA 45 2HB ALA 45 2.269 3.488 15.439 362 HB3 ALA 45 3HB ALA 45 3.540 4.356 14.579 363 H GLY 46 H GLY 46 0.210 2.641 14.427 364 HA2 GLY 46 2HA GLY 46 0.302 -0.347 14.444 365 HA3 GLY 46 1HA GLY 46 -0.737 0.635 15.472 366 H LEU 47 H LEU 47 -1.493 -1.536 13.592 367 HA LEU 47 HA LEU 47 -3.547 0.010 12.121 368 HB2 LEU 47 2HB LEU 47 -1.738 -2.046 10.824 369 HB3 LEU 47 1HB LEU 47 -3.187 -1.370 10.081 370 HG LEU 47 HG LEU 47 -2.015 0.936 10.695 371 HD11 LEU 47 1HD1 LEU 47 -0.082 -0.729 11.643 372 HD12 LEU 47 2HD1 LEU 47 0.241 0.899 11.050 373 HD13 LEU 47 3HD1 LEU 47 0.486 -0.489 9.991 374 HD21 LEU 47 1HD2 LEU 47 -2.316 0.819 8.440 375 HD22 LEU 47 2HD2 LEU 47 -1.846 -0.876 8.365 376 HD23 LEU 47 3HD2 LEU 47 -0.610 0.379 8.406 377 H ALA 48 H ALA 48 -5.511 -1.018 12.110 378 HA ALA 48 HA ALA 48 -5.666 -3.928 12.533 379 HB1 ALA 48 1HB ALA 48 -5.621 -3.288 14.835 380 HB2 ALA 48 2HB ALA 48 -7.323 -3.544 14.452 381 HB3 ALA 48 3HB ALA 48 -6.678 -1.906 14.544 382 H PHE 49 H PHE 49 -7.293 -4.635 11.214 383 HA PHE 49 HA PHE 49 -9.692 -2.946 10.865 384 HB2 PHE 49 2HB PHE 49 -9.542 -3.040 8.403 385 HB3 PHE 49 1HB PHE 49 -8.176 -2.167 9.100 386 HD1 PHE 49 1HD PHE 49 -5.952 -3.277 9.298 387 HD2 PHE 49 2HD PHE 49 -9.245 -5.109 7.237 388 HE1 PHE 49 1HE PHE 49 -4.383 -4.837 8.182 389 HE2 PHE 49 2HE PHE 49 -7.679 -6.672 6.123 390 HZ PHE 49 HZ PHE 49 -5.244 -6.533 6.592 391 H GLU 50 H GLU 50 -11.513 -4.112 10.138 392 HA GLU 50 HA GLU 50 -11.292 -7.039 10.479 393 HB2 GLU 50 2HB GLU 50 -13.919 -5.902 9.785 394 HB3 GLU 50 1HB GLU 50 -13.469 -6.939 11.139 395 HG2 GLU 50 2HG GLU 50 -12.315 -4.865 12.127 396 HG3 GLU 50 1HG GLU 50 -13.208 -3.938 10.922 397 HA PRO 51 HA PRO 51 -11.140 -7.007 5.923 398 HB2 PRO 51 2HB PRO 51 -10.395 -9.598 5.574 399 HB3 PRO 51 1HB PRO 51 -9.262 -8.320 6.047 400 HG2 PRO 51 2HG PRO 51 -10.534 -10.430 7.698 401 HG3 PRO 51 1HG PRO 51 -8.917 -9.720 7.816 402 HD2 PRO 51 2HD PRO 51 -11.058 -9.046 9.453 403 HD3 PRO 51 1HD PRO 51 -9.631 -8.024 9.184 404 H PHE 52 H PHE 52 -13.387 -6.810 5.496 405 HA PHE 52 HA PHE 52 -14.672 -9.254 4.548 406 HB2 PHE 52 2HB PHE 52 -16.082 -7.663 6.714 407 HB3 PHE 52 1HB PHE 52 -16.634 -9.159 5.956 408 HD1 PHE 52 1HD PHE 52 -15.385 -11.299 6.356 409 HD2 PHE 52 2HD PHE 52 -14.486 -7.681 8.484 410 HE1 PHE 52 1HE PHE 52 -14.121 -12.605 8.045 411 HE2 PHE 52 2HE PHE 52 -13.229 -8.982 10.173 412 HZ PHE 52 HZ PHE 52 -13.040 -11.446 9.953 413 H VAL 53 H VAL 53 -17.055 -8.490 3.757 414 HA VAL 53 HA VAL 53 -16.522 -6.150 2.081 415 HB VAL 53 HB VAL 53 -19.150 -7.635 2.394 416 HG11 VAL 53 1HG1 VAL 53 -19.160 -6.868 -0.133 417 HG12 VAL 53 2HG1 VAL 53 -17.994 -5.670 0.434 418 HG13 VAL 53 3HG1 VAL 53 -19.612 -5.732 1.137 419 HG21 VAL 53 1HG2 VAL 53 -16.811 -8.847 1.639 420 HG22 VAL 53 2HG2 VAL 53 -17.412 -8.266 0.088 421 HG23 VAL 53 3HG2 VAL 53 -18.406 -9.336 1.073 422 H GLY 54 H GLY 54 -16.996 -4.084 2.694 423 HA2 GLY 54 2HA GLY 54 -18.188 -2.322 3.735 424 HA3 GLY 54 1HA GLY 54 -19.357 -3.510 4.324 425 H GLY 55 H GLY 55 -16.050 -4.255 4.879 426 HA2 GLY 55 2HA GLY 55 -16.412 -4.217 7.754 427 HA3 GLY 55 1HA GLY 55 -14.899 -4.547 6.909 428 H ARG 56 H ARG 56 -14.471 -3.059 9.029 429 HA ARG 56 HA ARG 56 -14.373 -0.232 8.034 430 HB2 ARG 56 2HB ARG 56 -14.497 -1.281 10.879 431 HB3 ARG 56 1HB ARG 56 -14.272 0.415 10.445 432 HG2 ARG 56 2HG ARG 56 -16.425 0.334 9.180 433 HG3 ARG 56 1HG ARG 56 -16.663 -1.317 9.755 434 HD2 ARG 56 2HD ARG 56 -16.402 1.158 11.490 435 HD3 ARG 56 1HD ARG 56 -17.883 0.245 11.195 436 HE ARG 56 HE ARG 56 -16.037 -1.607 12.216 437 HH11 ARG 56 1HH1 ARG 56 -15.990 -2.092 14.423 438 HH12 ARG 56 2HH1 ARG 56 -16.625 -0.950 15.561 439 HH21 ARG 56 1HH2 ARG 56 -17.521 1.365 13.140 440 HH22 ARG 56 2HH2 ARG 56 -17.492 1.007 14.834 441 H TYR 57 H TYR 57 -12.360 0.701 7.922 442 HA TYR 57 HA TYR 57 -10.071 -0.917 8.972 443 HB2 TYR 57 2HB TYR 57 -10.409 -0.616 6.400 444 HB3 TYR 57 1HB TYR 57 -9.839 1.027 6.685 445 HD1 TYR 57 1HD TYR 57 -7.632 1.246 8.101 446 HD2 TYR 57 2HD TYR 57 -8.856 -2.327 6.057 447 HE1 TYR 57 1HE TYR 57 -5.291 0.429 8.125 448 HE2 TYR 57 2HE TYR 57 -6.514 -3.149 6.086 449 HH TYR 57 HH TYR 57 -4.378 -2.542 7.801 450 H TYR 58 H TYR 58 -8.808 0.109 10.442 451 HA TYR 58 HA TYR 58 -8.730 3.072 10.440 452 HB2 TYR 58 2HB TYR 58 -9.087 3.071 12.924 453 HB3 TYR 58 1HB TYR 58 -10.508 2.567 12.008 454 HD1 TYR 58 1HD TYR 58 -8.243 1.674 14.617 455 HD2 TYR 58 2HD TYR 58 -10.771 0.024 11.567 456 HE1 TYR 58 1HE TYR 58 -8.264 -0.502 15.811 457 HE2 TYR 58 2HE TYR 58 -10.795 -2.152 12.758 458 HH TYR 58 HH TYR 58 -9.877 -2.526 15.913 459 H GLU 59 H GLU 59 -6.891 3.913 11.645 460 HA GLU 59 HA GLU 59 -4.813 1.872 12.298 461 HB2 GLU 59 2HB GLU 59 -4.370 4.423 10.715 462 HB3 GLU 59 1HB GLU 59 -3.125 3.258 11.168 463 HG2 GLU 59 2HG GLU 59 -4.292 1.513 9.864 464 HG3 GLU 59 1HG GLU 59 -5.516 2.691 9.390 465 H TRP 60 H TRP 60 -3.165 2.711 13.812 466 HA TRP 60 HA TRP 60 -4.287 4.909 15.495 467 HB2 TRP 60 2HB TRP 60 -2.283 2.720 16.114 468 HB3 TRP 60 1HB TRP 60 -2.647 4.049 17.213 469 HD1 TRP 60 HD TRP 60 -5.300 4.258 17.961 470 HE1 TRP 60 1HE TRP 60 -6.974 2.369 18.482 471 HE3 TRP 60 3HE TRP 60 -2.982 0.353 15.619 472 HZ2 TRP 60 2HZ TRP 60 -7.287 -0.428 17.977 473 HZ3 TRP 60 3HZ TRP 60 -3.989 -1.910 15.659 474 HH2 TRP 60 HH TRP 60 -6.136 -2.306 16.834 475 H ASP 61 H ASP 61 -3.195 6.812 15.610 476 HA ASP 61 HA ASP 61 -0.668 7.046 14.083 477 HB2 ASP 61 2HB ASP 61 -2.466 9.115 15.368 478 HB3 ASP 61 1HB ASP 61 -1.004 9.499 14.466 479 H ILE 62 H ILE 62 1.198 8.149 15.100 480 HA ILE 62 HA ILE 62 1.976 7.036 17.546 481 HB ILE 62 HB ILE 62 2.869 9.659 16.348 482 HG12 ILE 62 2HG1 ILE 62 4.091 6.905 16.174 483 HG13 ILE 62 1HG1 ILE 62 3.109 7.630 14.911 484 HG21 ILE 62 1HG2 ILE 62 3.515 9.488 18.701 485 HG22 ILE 62 2HG2 ILE 62 4.927 9.258 17.669 486 HG23 ILE 62 3HG2 ILE 62 4.147 7.866 18.419 487 HD11 ILE 62 1HD1 ILE 62 4.779 9.623 15.081 488 HD12 ILE 62 2HD1 ILE 62 5.290 8.168 14.228 489 HD13 ILE 62 3HD1 ILE 62 5.831 8.456 15.882 490 H ASP 63 H ASP 63 0.407 10.173 16.959 491 HA ASP 63 HA ASP 63 -0.219 10.268 19.886 492 HB2 ASP 63 2HB ASP 63 0.520 12.565 18.051 493 HB3 ASP 63 1HB ASP 63 -0.105 12.765 19.688 494 H GLY 64 H GLY 64 -1.351 10.434 16.645 495 HA2 GLY 64 2HA GLY 64 -3.856 11.802 17.323 496 HA3 GLY 64 1HA GLY 64 -3.443 11.125 15.749 497 H THR 65 H THR 65 -5.919 10.798 17.311 498 HA THR 65 HA THR 65 -6.047 8.188 18.490 499 HB THR 65 HB THR 65 -8.298 8.608 18.737 500 HG1 THR 65 1HG THR 65 -8.051 9.419 16.096 501 HG21 THR 65 1HG2 THR 65 -8.547 10.840 19.302 502 HG22 THR 65 2HG2 THR 65 -7.713 11.406 17.854 503 HG23 THR 65 3HG2 THR 65 -6.790 10.730 19.197 504 H GLU 66 H GLU 66 -8.430 7.358 16.907 505 HA GLU 66 HA GLU 66 -6.943 5.902 14.812 506 HB2 GLU 66 2HB GLU 66 -9.729 5.556 15.946 507 HB3 GLU 66 1HB GLU 66 -9.030 4.532 14.697 508 HG2 GLU 66 2HG GLU 66 -7.181 3.940 16.228 509 HG3 GLU 66 1HG GLU 66 -7.920 4.929 17.487 510 H ILE 67 H ILE 67 -7.210 6.306 12.668 511 HA ILE 67 HA ILE 67 -9.511 8.028 11.831 512 HB ILE 67 HB ILE 67 -6.693 8.094 10.710 513 HG12 ILE 67 2HG1 ILE 67 -8.206 10.117 12.393 514 HG13 ILE 67 1HG1 ILE 67 -6.854 9.129 12.951 515 HG21 ILE 67 1HG2 ILE 67 -8.475 8.556 9.050 516 HG22 ILE 67 2HG2 ILE 67 -7.533 10.004 9.403 517 HG23 ILE 67 3HG2 ILE 67 -9.133 9.798 10.116 518 HD11 ILE 67 1HD1 ILE 67 -5.508 10.801 12.246 519 HD12 ILE 67 2HD1 ILE 67 -6.824 11.581 11.365 520 HD13 ILE 67 3HD1 ILE 67 -5.902 10.283 10.605 521 H VAL 68 H VAL 68 -10.575 7.325 9.964 522 HA VAL 68 HA VAL 68 -10.176 4.596 9.145 523 HB VAL 68 HB VAL 68 -11.668 6.792 7.675 524 HG11 VAL 68 1HG1 VAL 68 -12.079 3.789 7.671 525 HG12 VAL 68 2HG1 VAL 68 -11.184 4.658 6.425 526 HG13 VAL 68 3HG1 VAL 68 -12.903 4.973 6.659 527 HG21 VAL 68 1HG2 VAL 68 -13.215 6.727 9.313 528 HG22 VAL 68 2HG2 VAL 68 -12.138 5.690 10.249 529 HG23 VAL 68 3HG2 VAL 68 -13.332 4.973 9.167 530 H TRP 69 H TRP 69 -8.775 3.802 7.638 531 HA TRP 69 HA TRP 69 -7.238 5.779 6.020 532 HB2 TRP 69 2HB TRP 69 -5.626 4.492 7.051 533 HB3 TRP 69 1HB TRP 69 -6.663 3.067 7.129 534 HD1 TRP 69 HD TRP 69 -4.074 4.759 4.997 535 HE1 TRP 69 1HE TRP 69 -3.570 3.306 2.928 536 HE3 TRP 69 3HE TRP 69 -7.837 1.328 5.387 537 HZ2 TRP 69 2HZ TRP 69 -4.621 0.993 1.614 538 HZ3 TRP 69 3HZ TRP 69 -8.060 -0.489 3.717 539 HH2 TRP 69 HH TRP 69 -6.459 -0.663 1.831 540 H GLY 70 H GLY 70 -9.802 3.620 5.715 541 HA2 GLY 70 2HA GLY 70 -10.282 4.003 3.017 542 HA3 GLY 70 1HA GLY 70 -9.216 2.601 3.061 543 H ARG 71 H ARG 71 -10.690 0.976 2.537 544 HA ARG 71 HA ARG 71 -12.512 0.150 4.656 545 HB2 ARG 71 2HB ARG 71 -13.659 1.896 2.921 546 HB3 ARG 71 1HB ARG 71 -13.941 0.382 2.062 547 HG2 ARG 71 2HG ARG 71 -14.980 -0.585 4.072 548 HG3 ARG 71 1HG ARG 71 -14.685 0.915 4.950 549 HD2 ARG 71 2HD ARG 71 -16.973 0.960 4.173 550 HD3 ARG 71 1HD ARG 71 -16.054 2.113 3.206 551 HE ARG 71 HE ARG 71 -16.109 -0.486 1.943 552 HH11 ARG 71 1HH1 ARG 71 -17.401 -0.684 0.098 553 HH12 ARG 71 2HH1 ARG 71 -18.619 0.504 -0.222 554 HH21 ARG 71 1HH2 ARG 71 -17.910 2.377 2.609 555 HH22 ARG 71 2HH2 ARG 71 -18.908 2.238 1.200 556 H ILE 72 H ILE 72 -14.040 -1.624 2.982 557 HA ILE 72 HA ILE 72 -11.931 -3.259 1.657 558 HB ILE 72 HB ILE 72 -13.923 -4.229 3.723 559 HG12 ILE 72 2HG1 ILE 72 -11.127 -5.021 3.971 560 HG13 ILE 72 1HG1 ILE 72 -11.308 -3.270 3.965 561 HG21 ILE 72 1HG2 ILE 72 -12.803 -6.465 3.253 562 HG22 ILE 72 2HG2 ILE 72 -12.124 -5.726 1.804 563 HG23 ILE 72 3HG2 ILE 72 -13.873 -5.880 1.978 564 HD11 ILE 72 1HD1 ILE 72 -11.496 -4.446 6.245 565 HD12 ILE 72 2HD1 ILE 72 -13.055 -5.035 5.671 566 HD13 ILE 72 3HD1 ILE 72 -12.774 -3.302 5.830 567 H LEU 73 H LEU 73 -12.904 -4.920 0.194 568 HA LEU 73 HA LEU 73 -15.605 -4.083 -0.782 569 HB2 LEU 73 2HB LEU 73 -13.692 -3.400 -2.283 570 HB3 LEU 73 1HB LEU 73 -13.318 -5.111 -2.486 571 HG LEU 73 HG LEU 73 -15.878 -5.279 -3.121 572 HD11 LEU 73 1HD1 LEU 73 -16.666 -3.253 -4.276 573 HD12 LEU 73 2HD1 LEU 73 -15.200 -2.399 -3.794 574 HD13 LEU 73 3HD1 LEU 73 -16.364 -2.912 -2.573 575 HD21 LEU 73 1HD2 LEU 73 -15.135 -4.536 -5.528 576 HD22 LEU 73 2HD2 LEU 73 -14.343 -5.917 -4.771 577 HD23 LEU 73 3HD2 LEU 73 -13.550 -4.343 -4.780 578 H GLU 74 H GLU 74 -13.246 -6.753 -0.795 579 HA GLU 74 HA GLU 74 -15.170 -8.689 0.080 580 HB2 GLU 74 2HB GLU 74 -16.006 -8.306 -2.250 581 HB3 GLU 74 1HB GLU 74 -14.441 -8.850 -2.847 582 HG2 GLU 74 2HG GLU 74 -14.770 -11.013 -1.657 583 HG3 GLU 74 1HG GLU 74 -16.377 -10.470 -1.172 584 H TRP 75 H TRP 75 -14.081 -10.522 0.766 585 HA TRP 75 HA TRP 75 -11.162 -10.590 0.177 586 HB2 TRP 75 2HB TRP 75 -12.273 -10.515 2.595 587 HB3 TRP 75 1HB TRP 75 -12.421 -12.251 2.326 588 HD1 TRP 75 HD TRP 75 -10.249 -13.695 2.359 589 HE1 TRP 75 1HE TRP 75 -7.794 -13.188 2.970 590 HE3 TRP 75 3HE TRP 75 -10.410 -8.593 2.499 591 HZ2 TRP 75 2HZ TRP 75 -6.123 -10.916 3.455 592 HZ3 TRP 75 3HZ TRP 75 -8.376 -7.284 3.039 593 HH2 TRP 75 HH TRP 75 -6.235 -8.438 3.515 594 H ASP 76 H ASP 76 -10.626 -12.063 -1.365 595 HA ASP 76 HA ASP 76 -12.314 -14.508 -1.611 596 HB2 ASP 76 2HB ASP 76 -11.495 -12.642 -3.538 597 HB3 ASP 76 1HB ASP 76 -10.519 -14.083 -3.833 598 HA PRO 77 HA PRO 77 -8.902 -16.743 0.374 599 HB2 PRO 77 2HB PRO 77 -9.870 -18.715 -1.693 600 HB3 PRO 77 1HB PRO 77 -9.392 -19.013 -0.010 601 HG2 PRO 77 2HG PRO 77 -11.950 -18.820 -0.698 602 HG3 PRO 77 1HG PRO 77 -11.353 -18.183 0.845 603 HD2 PRO 77 2HD PRO 77 -12.310 -16.715 -1.528 604 HD3 PRO 77 1HD PRO 77 -12.141 -16.147 0.149 605 HA PRO 78 HA PRO 78 -5.123 -16.227 -1.830 606 HB2 PRO 78 2HB PRO 78 -5.176 -19.211 -2.151 607 HB3 PRO 78 1HB PRO 78 -3.826 -18.159 -1.685 608 HG2 PRO 78 2HG PRO 78 -5.390 -19.556 0.088 609 HG3 PRO 78 1HG PRO 78 -4.453 -18.109 0.489 610 HD2 PRO 78 2HD PRO 78 -7.312 -18.385 0.486 611 HD3 PRO 78 1HD PRO 78 -6.372 -16.916 0.816 612 H HIS 79 H HIS 79 -6.125 -15.209 -3.659 613 HA HIS 79 HA HIS 79 -5.663 -16.271 -6.177 614 HB2 HIS 79 2HB HIS 79 -8.113 -17.358 -4.956 615 HB3 HIS 79 1HB HIS 79 -8.357 -16.669 -6.561 616 HD1 HIS 79 1HD HIS 79 -7.479 -19.761 -5.038 617 HD2 HIS 79 2HD HIS 79 -6.087 -17.707 -8.392 618 HE1 HIS 79 1HE HIS 79 -6.285 -21.468 -6.481 619 HE2 HIS 79 2HE HIS 79 -5.433 -20.229 -8.524 620 H ARG 80 H ARG 80 -8.260 -14.502 -4.397 621 HA ARG 80 HA ARG 80 -7.764 -12.249 -6.271 622 HB2 ARG 80 2HB ARG 80 -9.892 -13.886 -6.706 623 HB3 ARG 80 1HB ARG 80 -10.610 -12.695 -5.624 624 HG2 ARG 80 2HG ARG 80 -9.048 -11.999 -8.123 625 HG3 ARG 80 1HG ARG 80 -10.809 -12.063 -8.034 626 HD2 ARG 80 2HD ARG 80 -10.613 -10.402 -6.089 627 HD3 ARG 80 1HD ARG 80 -8.937 -10.182 -6.592 628 HE ARG 80 HE ARG 80 -9.720 -8.929 -8.428 629 HH11 ARG 80 1HH1 ARG 80 -11.350 -8.089 -9.756 630 HH12 ARG 80 2HH1 ARG 80 -12.971 -8.672 -9.588 631 HH21 ARG 80 1HH2 ARG 80 -12.189 -10.901 -7.050 632 HH22 ARG 80 2HH2 ARG 80 -13.446 -10.264 -8.057 633 H LEU 81 H LEU 81 -7.707 -10.327 -5.249 634 HA LEU 81 HA LEU 81 -8.954 -10.125 -2.537 635 HB2 LEU 81 2HB LEU 81 -6.470 -10.374 -2.376 636 HB3 LEU 81 1HB LEU 81 -6.293 -8.930 -3.372 637 HG LEU 81 HG LEU 81 -7.655 -7.671 -1.664 638 HD11 LEU 81 1HD1 LEU 81 -8.814 -8.956 -0.211 639 HD12 LEU 81 2HD1 LEU 81 -7.281 -9.194 0.628 640 HD13 LEU 81 3HD1 LEU 81 -7.829 -10.376 -0.560 641 HD21 LEU 81 1HD2 LEU 81 -4.940 -8.473 -1.590 642 HD22 LEU 81 2HD2 LEU 81 -5.524 -8.550 0.071 643 HD23 LEU 81 3HD2 LEU 81 -5.655 -7.046 -0.840 644 H ALA 82 H ALA 82 -10.344 -8.419 -2.420 645 HA ALA 82 HA ALA 82 -9.876 -6.091 -4.235 646 HB1 ALA 82 1HB ALA 82 -11.775 -7.809 -4.898 647 HB2 ALA 82 2HB ALA 82 -12.073 -6.074 -5.009 648 HB3 ALA 82 3HB ALA 82 -12.674 -6.986 -3.624 649 H MET 83 H MET 83 -10.182 -4.109 -3.206 650 HA MET 83 HA MET 83 -11.549 -4.132 -0.569 651 HB2 MET 83 2HB MET 83 -8.801 -2.941 -1.004 652 HB3 MET 83 1HB MET 83 -9.711 -2.955 0.506 653 HG2 MET 83 2HG MET 83 -9.706 -5.479 0.385 654 HG3 MET 83 1HG MET 83 -8.602 -5.344 -0.983 655 HE1 MET 83 1HE MET 83 -9.550 -4.320 2.332 656 HE2 MET 83 2HE MET 83 -8.278 -3.194 2.794 657 HE3 MET 83 3HE MET 83 -8.217 -4.861 3.360 658 H THR 84 H THR 84 -12.644 -2.224 -0.124 659 HA THR 84 HA THR 84 -12.510 -0.123 -2.243 660 HB THR 84 HB THR 84 -14.523 -0.446 0.009 661 HG1 THR 84 1HG THR 84 -15.828 -1.372 -1.556 662 HG21 THR 84 1HG2 THR 84 -15.608 0.906 -2.205 663 HG22 THR 84 2HG2 THR 84 -14.004 1.598 -1.969 664 HG23 THR 84 3HG2 THR 84 -15.169 1.605 -0.646 665 H TRP 85 H TRP 85 -11.673 1.917 -1.684 666 HA TRP 85 HA TRP 85 -10.736 2.142 1.139 667 HB2 TRP 85 2HB TRP 85 -8.921 3.413 0.398 668 HB3 TRP 85 1HB TRP 85 -9.117 2.222 -0.884 669 HD1 TRP 85 HD TRP 85 -11.329 3.370 -2.639 670 HE1 TRP 85 1HE TRP 85 -11.046 5.597 -3.904 671 HE3 TRP 85 3HE TRP 85 -7.605 5.487 0.135 672 HZ2 TRP 85 2HZ TRP 85 -9.442 7.964 -3.761 673 HZ3 TRP 85 3HZ TRP 85 -6.713 7.722 -0.454 674 HH2 TRP 85 HH TRP 85 -7.625 8.962 -2.395 675 H ARG 86 H ARG 86 -11.864 3.456 2.421 676 HA ARG 86 HA ARG 86 -13.286 5.782 1.179 677 HB2 ARG 86 2HB ARG 86 -14.762 4.062 2.237 678 HB3 ARG 86 1HB ARG 86 -13.926 4.329 3.767 679 HG2 ARG 86 2HG ARG 86 -14.628 6.665 3.785 680 HG3 ARG 86 1HG ARG 86 -15.390 6.476 2.205 681 HD2 ARG 86 2HD ARG 86 -17.132 6.297 3.860 682 HD3 ARG 86 1HD ARG 86 -16.843 4.675 3.231 683 HE ARG 86 HE ARG 86 -15.172 4.879 5.452 684 HH11 ARG 86 1HH1 ARG 86 -15.843 4.210 7.505 685 HH12 ARG 86 2HH1 ARG 86 -17.535 4.155 7.873 686 HH21 ARG 86 1HH2 ARG 86 -18.524 5.257 4.738 687 HH22 ARG 86 2HH2 ARG 86 -19.052 4.748 6.307 688 H ILE 87 H ILE 87 -11.958 7.526 1.505 689 HA ILE 87 HA ILE 87 -11.121 8.101 4.295 690 HB ILE 87 HB ILE 87 -9.222 6.970 3.045 691 HG12 ILE 87 2HG1 ILE 87 -8.597 9.848 3.739 692 HG13 ILE 87 1HG1 ILE 87 -9.022 8.667 4.977 693 HG21 ILE 87 1HG2 ILE 87 -9.806 8.112 0.856 694 HG22 ILE 87 2HG2 ILE 87 -8.101 8.186 1.297 695 HG23 ILE 87 3HG2 ILE 87 -9.133 9.595 1.534 696 HD11 ILE 87 1HD1 ILE 87 -6.953 7.781 4.926 697 HD12 ILE 87 2HD1 ILE 87 -6.476 9.094 3.852 698 HD13 ILE 87 3HD1 ILE 87 -7.037 7.565 3.179 699 H ASP 88 H ASP 88 -10.491 10.425 4.541 700 HA ASP 88 HA ASP 88 -12.156 12.092 2.734 701 HB2 ASP 88 2HB ASP 88 -12.425 12.253 5.224 702 HB3 ASP 88 1HB ASP 88 -10.776 12.871 5.319 703 H GLY 89 H GLY 89 -11.297 13.904 1.633 704 HA2 GLY 89 2HA GLY 89 -8.643 13.668 0.629 705 HA3 GLY 89 1HA GLY 89 -9.656 15.100 0.458 706 H HIS 90 H HIS 90 -9.961 15.484 3.349 707 HA HIS 90 HA HIS 90 -7.390 16.837 3.817 708 HB2 HIS 90 2HB HIS 90 -10.076 16.912 5.182 709 HB3 HIS 90 1HB HIS 90 -8.667 17.720 5.855 710 HD1 HIS 90 1HD HIS 90 -7.379 18.802 3.277 711 HD2 HIS 90 2HD HIS 90 -11.460 19.057 4.095 712 HE1 HIS 90 1HE HIS 90 -8.274 20.714 1.873 713 HE2 HIS 90 2HE HIS 90 -10.758 20.876 2.362 714 H TRP 91 H TRP 91 -7.786 13.827 4.050 715 HA TRP 91 HA TRP 91 -7.100 12.109 5.490 716 HB2 TRP 91 2HB TRP 91 -5.500 14.487 6.405 717 HB3 TRP 91 1HB TRP 91 -5.401 12.968 7.294 718 HD1 TRP 91 HD TRP 91 -4.208 14.664 4.185 719 HE1 TRP 91 1HE TRP 91 -2.766 13.037 2.797 720 HE3 TRP 91 3HE TRP 91 -5.180 10.301 6.652 721 HZ2 TRP 91 2HZ TRP 91 -2.117 10.251 2.743 722 HZ3 TRP 91 3HZ TRP 91 -4.138 8.179 5.913 723 HH2 TRP 91 HH TRP 91 -2.607 8.149 3.963 724 H GLN 92 H GLN 92 -9.474 13.864 6.153 725 HA GLN 92 HA GLN 92 -9.542 13.810 9.097 726 HB2 GLN 92 2HB GLN 92 -11.669 14.507 7.044 727 HB3 GLN 92 1HB GLN 92 -11.821 14.737 8.787 728 HG2 GLN 92 2HG GLN 92 -9.997 16.317 8.805 729 HG3 GLN 92 1HG GLN 92 -9.614 15.970 7.128 730 HE21 GLN 92 1HE2 GLN 92 -10.244 18.632 7.992 731 HE22 GLN 92 2HE2 GLN 92 -11.725 19.084 7.297 732 H SER 93 H SER 93 -12.529 12.992 7.683 733 HA SER 93 HA SER 93 -12.132 10.093 7.775 734 HB2 SER 93 2HB SER 93 -13.500 9.627 9.665 735 HB3 SER 93 1HB SER 93 -12.396 10.892 10.195 736 HG SER 93 HG SER 93 -14.341 12.214 9.201 737 H VAL 94 H VAL 94 -14.051 8.948 7.024 738 HA VAL 94 HA VAL 94 -16.162 10.711 5.859 739 HB VAL 94 HB VAL 94 -15.857 8.570 4.073 740 HG11 VAL 94 1HG1 VAL 94 -16.465 10.922 3.562 741 HG12 VAL 94 2HG1 VAL 94 -15.168 10.339 2.519 742 HG13 VAL 94 3HG1 VAL 94 -14.798 11.405 3.875 743 HG21 VAL 94 1HG2 VAL 94 -13.505 8.615 3.465 744 HG22 VAL 94 2HG2 VAL 94 -13.627 8.186 5.171 745 HG23 VAL 94 3HG2 VAL 94 -13.166 9.823 4.703 746 HA PRO 95 HA PRO 95 -18.020 7.417 8.556 747 HB2 PRO 95 2HB PRO 95 -20.285 9.323 8.199 748 HB3 PRO 95 1HB PRO 95 -19.683 8.547 9.676 749 HG2 PRO 95 2HG PRO 95 -19.206 11.117 9.147 750 HG3 PRO 95 1HG PRO 95 -18.021 10.093 9.976 751 HD2 PRO 95 2HD PRO 95 -17.992 11.110 7.172 752 HD3 PRO 95 1HD PRO 95 -16.632 10.725 8.250 753 H ASP 96 H ASP 96 -18.899 8.716 5.439 754 HA ASP 96 HA ASP 96 -20.321 6.177 4.858 755 HB2 ASP 96 2HB ASP 96 -22.024 7.918 5.481 756 HB3 ASP 96 1HB ASP 96 -21.457 8.875 4.115 757 H ASP 97 H ASP 97 -20.169 5.565 2.651 758 HA ASP 97 HA ASP 97 -18.005 6.930 1.191 759 HB2 ASP 97 2HB ASP 97 -18.253 5.024 -0.406 760 HB3 ASP 97 1HB ASP 97 -17.974 4.491 1.252 761 H ASP 98 H ASP 98 -18.771 8.805 0.254 762 HA ASP 98 HA ASP 98 -21.374 8.789 -1.130 763 HB2 ASP 98 2HB ASP 98 -20.508 10.746 0.262 764 HB3 ASP 98 1HB ASP 98 -19.361 11.032 -1.042 765 H ARG 99 H ARG 99 -17.989 9.512 -1.926 766 HA ARG 99 HA ARG 99 -18.541 8.600 -4.714 767 HB2 ARG 99 2HB ARG 99 -16.784 10.890 -3.789 768 HB3 ARG 99 1HB ARG 99 -16.849 10.288 -5.445 769 HG2 ARG 99 2HG ARG 99 -19.298 10.765 -5.480 770 HG3 ARG 99 1HG ARG 99 -19.154 11.469 -3.868 771 HD2 ARG 99 2HD ARG 99 -17.429 13.054 -4.803 772 HD3 ARG 99 1HD ARG 99 -17.815 12.437 -6.409 773 HE ARG 99 HE ARG 99 -19.772 13.742 -6.356 774 HH11 ARG 99 1HH1 ARG 99 -21.291 15.078 -5.347 775 HH12 ARG 99 2HH1 ARG 99 -21.250 15.266 -3.625 776 HH21 ARG 99 1HH2 ARG 99 -18.531 13.158 -3.192 777 HH22 ARG 99 2HH2 ARG 99 -19.689 14.180 -2.405 778 H ALA 100 H ALA 100 -17.487 7.112 -2.375 779 HA ALA 100 HA ALA 100 -14.633 6.876 -2.565 780 HB1 ALA 100 1HB ALA 100 -16.203 5.993 -0.719 781 HB2 ALA 100 2HB ALA 100 -14.853 4.961 -1.189 782 HB3 ALA 100 3HB ALA 100 -16.475 4.617 -1.787 783 H SER 101 H SER 101 -13.383 5.278 -3.655 784 HA SER 101 HA SER 101 -14.741 4.104 -6.046 785 HB2 SER 101 2HB SER 101 -11.835 4.867 -5.649 786 HB3 SER 101 1HB SER 101 -12.513 4.167 -7.116 787 HG SER 101 HG SER 101 -12.968 6.150 -7.625 788 H GLU 102 H GLU 102 -13.812 1.995 -6.784 789 HA GLU 102 HA GLU 102 -13.027 0.339 -4.422 790 HB2 GLU 102 2HB GLU 102 -14.338 -0.499 -7.026 791 HB3 GLU 102 1HB GLU 102 -13.983 -1.559 -5.662 792 HG2 GLU 102 2HG GLU 102 -15.449 -0.165 -4.221 793 HG3 GLU 102 1HG GLU 102 -15.842 0.836 -5.618 794 H ILE 103 H ILE 103 -11.358 -1.187 -4.652 795 HA ILE 103 HA ILE 103 -9.561 -0.736 -7.005 796 HB ILE 103 HB ILE 103 -8.812 -1.561 -4.184 797 HG12 ILE 103 2HG1 ILE 103 -8.354 1.089 -5.588 798 HG13 ILE 103 1HG1 ILE 103 -9.636 0.808 -4.408 799 HG21 ILE 103 1HG2 ILE 103 -7.210 -2.428 -5.720 800 HG22 ILE 103 2HG2 ILE 103 -6.504 -0.944 -5.083 801 HG23 ILE 103 3HG2 ILE 103 -7.234 -0.955 -6.688 802 HD11 ILE 103 1HD1 ILE 103 -7.830 1.734 -3.158 803 HD12 ILE 103 2HD1 ILE 103 -6.648 0.706 -3.966 804 HD13 ILE 103 3HD1 ILE 103 -7.790 0.002 -2.821 805 H GLU 104 H GLU 104 -8.847 -2.581 -8.097 806 HA GLU 104 HA GLU 104 -9.872 -5.189 -7.034 807 HB2 GLU 104 2HB GLU 104 -10.807 -4.456 -9.239 808 HB3 GLU 104 1HB GLU 104 -9.171 -4.484 -9.898 809 HG2 GLU 104 2HG GLU 104 -8.990 -6.890 -9.249 810 HG3 GLU 104 1HG GLU 104 -10.671 -6.841 -8.718 811 H VAL 105 H VAL 105 -8.327 -6.565 -6.341 812 HA VAL 105 HA VAL 105 -5.618 -6.397 -7.573 813 HB VAL 105 HB VAL 105 -6.165 -6.879 -4.632 814 HG11 VAL 105 1HG1 VAL 105 -3.697 -6.457 -4.480 815 HG12 VAL 105 2HG1 VAL 105 -3.636 -6.421 -6.241 816 HG13 VAL 105 3HG1 VAL 105 -4.100 -7.902 -5.405 817 HG21 VAL 105 1HG2 VAL 105 -4.854 -4.527 -4.680 818 HG22 VAL 105 2HG2 VAL 105 -6.615 -4.624 -4.709 819 HG23 VAL 105 3HG2 VAL 105 -5.720 -4.392 -6.210 820 H ASP 106 H ASP 106 -4.931 -8.377 -8.283 821 HA ASP 106 HA ASP 106 -6.345 -10.783 -7.200 822 HB2 ASP 106 2HB ASP 106 -6.855 -10.289 -9.593 823 HB3 ASP 106 1HB ASP 106 -5.133 -10.424 -9.955 824 H PHE 107 H PHE 107 -5.048 -12.322 -6.288 825 HA PHE 107 HA PHE 107 -2.101 -12.045 -6.724 826 HB2 PHE 107 2HB PHE 107 -3.721 -12.391 -4.271 827 HB3 PHE 107 1HB PHE 107 -2.244 -13.354 -4.363 828 HD1 PHE 107 1HD PHE 107 -0.060 -12.238 -4.775 829 HD2 PHE 107 2HD PHE 107 -3.637 -10.016 -3.978 830 HE1 PHE 107 1HE PHE 107 1.309 -10.243 -4.244 831 HE2 PHE 107 2HE PHE 107 -2.277 -8.011 -3.450 832 HZ PHE 107 HZ PHE 107 0.206 -8.130 -3.583 833 H VAL 108 H VAL 108 -1.253 -13.728 -7.783 834 HA VAL 108 HA VAL 108 -2.386 -16.434 -7.305 835 HB VAL 108 HB VAL 108 -2.323 -14.892 -9.790 836 HG11 VAL 108 1HG1 VAL 108 -1.726 -16.894 -11.202 837 HG12 VAL 108 2HG1 VAL 108 -1.097 -17.664 -9.749 838 HG13 VAL 108 3HG1 VAL 108 -0.360 -16.178 -10.350 839 HG21 VAL 108 1HG2 VAL 108 -3.549 -17.593 -9.219 840 HG22 VAL 108 2HG2 VAL 108 -4.100 -16.371 -10.366 841 HG23 VAL 108 3HG2 VAL 108 -4.253 -16.086 -8.632 842 HA PRO 109 HA PRO 109 1.910 -17.389 -6.572 843 HB2 PRO 109 2HB PRO 109 1.895 -20.050 -7.401 844 HB3 PRO 109 1HB PRO 109 1.454 -19.476 -5.785 845 HG2 PRO 109 2HG PRO 109 -0.277 -20.275 -8.044 846 HG3 PRO 109 1HG PRO 109 -0.537 -20.443 -6.300 847 HD2 PRO 109 2HD PRO 109 -1.802 -18.553 -7.798 848 HD3 PRO 109 1HD PRO 109 -1.398 -18.305 -6.084 849 H ASN 110 H ASN 110 3.660 -16.948 -7.832 850 HA ASN 110 HA ASN 110 3.532 -17.688 -10.721 851 HB2 ASN 110 2HB ASN 110 3.437 -15.207 -10.150 852 HB3 ASN 110 1HB ASN 110 5.092 -15.380 -9.571 853 HD21 ASN 110 1HD2 ASN 110 6.639 -14.935 -11.139 854 HD22 ASN 110 2HD2 ASN 110 6.416 -15.123 -12.812 855 H GLY 111 H GLY 111 4.953 -19.294 -11.147 856 HA2 GLY 111 2HA GLY 111 6.909 -20.583 -11.105 857 HA3 GLY 111 1HA GLY 111 7.739 -19.103 -10.623 858 H SER 112 H SER 112 8.914 -19.566 -8.840 859 HA SER 112 HA SER 112 8.105 -21.603 -6.927 860 HB2 SER 112 2HB SER 112 10.128 -20.918 -5.702 861 HB3 SER 112 1HB SER 112 10.485 -21.136 -7.412 862 HG SER 112 HG SER 112 11.285 -19.184 -7.121 863 H GLY 113 H GLY 113 9.117 -19.943 -4.631 864 HA2 GLY 113 2HA GLY 113 6.667 -19.195 -3.472 865 HA3 GLY 113 1HA GLY 113 8.233 -18.576 -2.946 866 H GLY 114 H GLY 114 8.002 -17.747 -6.139 867 HA2 GLY 114 2HA GLY 114 7.464 -14.971 -5.451 868 HA3 GLY 114 1HA GLY 114 7.837 -15.576 -7.062 869 H THR 115 H THR 115 5.568 -13.872 -5.686 870 HA THR 115 HA THR 115 3.311 -15.303 -7.032 871 HB THR 115 HB THR 115 3.069 -13.274 -4.796 872 HG1 THR 115 1HG THR 115 2.466 -15.565 -3.837 873 HG21 THR 115 1HG2 THR 115 0.825 -14.286 -4.580 874 HG22 THR 115 2HG2 THR 115 1.181 -15.348 -5.934 875 HG23 THR 115 3HG2 THR 115 1.073 -13.609 -6.190 876 H ARG 116 H ARG 116 2.161 -14.127 -8.544 877 HA ARG 116 HA ARG 116 3.168 -11.359 -9.088 878 HB2 ARG 116 2HB ARG 116 3.569 -13.036 -10.893 879 HB3 ARG 116 1HB ARG 116 1.829 -13.309 -10.993 880 HG2 ARG 116 2HG ARG 116 1.493 -10.919 -11.539 881 HG3 ARG 116 1HG ARG 116 3.236 -10.665 -11.469 882 HD2 ARG 116 2HD ARG 116 2.657 -10.974 -13.788 883 HD3 ARG 116 1HD ARG 116 3.473 -12.445 -13.254 884 HE ARG 116 HE ARG 116 0.609 -12.666 -12.920 885 HH11 ARG 116 1HH1 ARG 116 -0.473 -14.032 -14.358 886 HH12 ARG 116 2HH1 ARG 116 0.306 -14.513 -15.830 887 HH21 ARG 116 1HH2 ARG 116 3.208 -12.729 -15.185 888 HH22 ARG 116 2HH2 ARG 116 2.391 -13.775 -16.296 889 H VAL 117 H VAL 117 1.698 -9.724 -8.920 890 HA VAL 117 HA VAL 117 -1.183 -10.487 -8.817 891 HB VAL 117 HB VAL 117 -0.825 -9.975 -6.593 892 HG11 VAL 117 1HG1 VAL 117 1.403 -9.393 -6.384 893 HG12 VAL 117 2HG1 VAL 117 0.659 -7.816 -6.119 894 HG13 VAL 117 3HG1 VAL 117 1.326 -8.221 -7.701 895 HG21 VAL 117 1HG2 VAL 117 -2.452 -8.350 -7.796 896 HG22 VAL 117 2HG2 VAL 117 -1.173 -7.153 -7.597 897 HG23 VAL 117 3HG2 VAL 117 -1.899 -7.911 -6.179 898 H GLU 118 H GLU 118 -2.627 -9.190 -9.851 899 HA GLU 118 HA GLU 118 -1.487 -6.964 -11.481 900 HB2 GLU 118 2HB GLU 118 -2.566 -8.781 -12.765 901 HB3 GLU 118 1HB GLU 118 -4.044 -8.569 -11.828 902 HG2 GLU 118 2HG GLU 118 -4.203 -6.224 -12.662 903 HG3 GLU 118 1HG GLU 118 -2.780 -6.508 -13.660 904 H LEU 119 H LEU 119 -1.920 -4.980 -10.650 905 HA LEU 119 HA LEU 119 -4.423 -4.642 -9.059 906 HB2 LEU 119 2HB LEU 119 -2.224 -4.301 -7.854 907 HB3 LEU 119 1HB LEU 119 -1.925 -2.934 -8.925 908 HG LEU 119 HG LEU 119 -4.570 -2.960 -7.566 909 HD11 LEU 119 1HD1 LEU 119 -3.012 -3.744 -5.783 910 HD12 LEU 119 2HD1 LEU 119 -3.654 -2.133 -5.456 911 HD13 LEU 119 3HD1 LEU 119 -2.011 -2.320 -6.070 912 HD21 LEU 119 1HD2 LEU 119 -3.901 -1.098 -9.002 913 HD22 LEU 119 2HD2 LEU 119 -2.419 -0.878 -8.072 914 HD23 LEU 119 3HD2 LEU 119 -3.984 -0.542 -7.331 915 H ALA 120 H ALA 120 -5.930 -3.323 -9.938 916 HA ALA 120 HA ALA 120 -5.024 -1.263 -11.899 917 HB1 ALA 120 1HB ALA 120 -5.932 -3.031 -13.250 918 HB2 ALA 120 2HB ALA 120 -7.155 -1.763 -13.179 919 HB3 ALA 120 3HB ALA 120 -7.326 -3.209 -12.184 920 H HIS 121 H HIS 121 -6.055 0.705 -11.696 921 HA HIS 121 HA HIS 121 -8.236 0.883 -9.652 922 HB2 HIS 121 2HB HIS 121 -7.014 2.402 -8.521 923 HB3 HIS 121 1HB HIS 121 -5.676 2.116 -9.631 924 HD1 HIS 121 1HD HIS 121 -9.004 3.981 -10.050 925 HD2 HIS 121 2HD HIS 121 -4.913 4.577 -10.607 926 HE1 HIS 121 1HE HIS 121 -8.743 6.292 -11.055 927 HE2 HIS 121 2HE HIS 121 -6.260 6.670 -11.382 928 H VAL 122 H VAL 122 -10.066 1.972 -10.306 929 HA VAL 122 HA VAL 122 -9.894 3.588 -12.800 930 HB VAL 122 HB VAL 122 -11.966 2.514 -13.641 931 HG11 VAL 122 1HG1 VAL 122 -10.842 0.734 -14.611 932 HG12 VAL 122 2HG1 VAL 122 -10.086 0.250 -13.093 933 HG13 VAL 122 3HG1 VAL 122 -9.473 1.648 -13.976 934 HG21 VAL 122 1HG2 VAL 122 -12.381 0.195 -12.455 935 HG22 VAL 122 2HG2 VAL 122 -13.098 1.661 -11.784 936 HG23 VAL 122 3HG2 VAL 122 -11.628 0.991 -11.072 937 H LYS 123 H LYS 123 -11.372 5.277 -12.898 938 HA LYS 123 HA LYS 123 -12.799 6.934 -12.070 939 HB2 LYS 123 2HB LYS 123 -14.070 4.567 -10.668 940 HB3 LYS 123 1HB LYS 123 -14.829 6.130 -10.973 941 HG2 LYS 123 2HG LYS 123 -14.535 5.779 -13.412 942 HG3 LYS 123 1HG LYS 123 -13.845 4.190 -13.084 943 HD2 LYS 123 2HD LYS 123 -15.973 3.594 -11.883 944 HD3 LYS 123 1HD LYS 123 -16.654 5.121 -12.446 945 HE2 LYS 123 2HE LYS 123 -16.388 4.464 -14.758 946 HE3 LYS 123 1HE LYS 123 -15.489 3.020 -14.292 947 HZ1 LYS 123 1HZ LYS 123 -17.358 1.958 -13.607 948 HZ2 LYS 123 2HZ LYS 123 -18.057 2.948 -14.798 949 HZ3 LYS 123 3HZ LYS 123 -18.159 3.385 -13.160 950 H LEU 124 H LEU 124 -10.365 6.220 -10.438 951 HA LEU 124 HA LEU 124 -11.067 6.385 -7.646 952 HB2 LEU 124 2HB LEU 124 -8.834 5.650 -8.458 953 HB3 LEU 124 1HB LEU 124 -8.516 7.295 -9.011 954 HG LEU 124 HG LEU 124 -8.894 8.079 -6.648 955 HD11 LEU 124 1HD1 LEU 124 -10.134 6.438 -5.554 956 HD12 LEU 124 2HD1 LEU 124 -8.508 6.056 -4.990 957 HD13 LEU 124 3HD1 LEU 124 -9.231 5.116 -6.293 958 HD21 LEU 124 1HD2 LEU 124 -6.646 7.974 -6.551 959 HD22 LEU 124 2HD2 LEU 124 -6.661 6.731 -7.803 960 HD23 LEU 124 3HD2 LEU 124 -6.736 6.270 -6.101 961 H HIS 125 H HIS 125 -10.375 8.787 -10.141 962 HA HIS 125 HA HIS 125 -10.299 11.081 -8.462 963 HB2 HIS 125 2HB HIS 125 -9.562 11.220 -10.770 964 HB3 HIS 125 1HB HIS 125 -11.183 10.818 -11.337 965 HD1 HIS 125 1HD HIS 125 -11.001 13.043 -8.394 966 HD2 HIS 125 2HD HIS 125 -11.287 13.488 -12.532 967 HE1 HIS 125 1HE HIS 125 -11.692 15.443 -8.808 968 HE2 HIS 125 2HE HIS 125 -11.861 15.730 -11.325 969 H ARG 126 H ARG 126 -12.993 9.146 -9.544 970 HA ARG 126 HA ARG 126 -15.120 10.925 -9.498 971 HB2 ARG 126 2HB ARG 126 -16.523 9.093 -8.965 972 HB3 ARG 126 1HB ARG 126 -15.149 8.355 -9.781 973 HG2 ARG 126 2HG ARG 126 -14.124 7.989 -7.486 974 HG3 ARG 126 1HG ARG 126 -15.677 8.474 -6.806 975 HD2 ARG 126 2HD ARG 126 -15.230 6.168 -8.723 976 HD3 ARG 126 1HD ARG 126 -15.562 6.028 -6.996 977 HE ARG 126 HE ARG 126 -17.590 7.516 -8.514 978 HH11 ARG 126 1HH1 ARG 126 -19.637 6.557 -8.527 979 HH12 ARG 126 2HH1 ARG 126 -19.816 4.922 -7.985 980 HH21 ARG 126 1HH2 ARG 126 -16.449 4.511 -7.266 981 HH22 ARG 126 2HH2 ARG 126 -18.011 3.764 -7.270 982 H HIS 127 H HIS 127 -13.084 9.904 -6.863 983 HA HIS 127 HA HIS 127 -14.710 10.595 -4.651 984 HB2 HIS 127 2HB HIS 127 -12.260 9.574 -4.845 985 HB3 HIS 127 1HB HIS 127 -11.792 11.258 -4.619 986 HD1 HIS 127 1HD HIS 127 -14.452 11.744 -2.745 987 HD2 HIS 127 2HD HIS 127 -11.383 8.975 -2.171 988 HE1 HIS 127 1HE HIS 127 -14.454 11.171 -0.275 989 HE2 HIS 127 2HE HIS 127 -12.591 9.488 0.086 990 H GLY 128 H GLY 128 -12.573 12.582 -6.661 991 HA2 GLY 128 2HA GLY 128 -12.209 14.923 -6.635 992 HA3 GLY 128 1HA GLY 128 -13.962 14.915 -6.808 993 H ASP 129 H ASP 129 -12.630 13.627 -3.870 994 HA ASP 129 HA ASP 129 -13.692 16.015 -2.429 995 HB2 ASP 129 2HB ASP 129 -13.144 13.190 -1.478 996 HB3 ASP 129 1HB ASP 129 -13.728 14.496 -0.446 997 H GLY 130 H GLY 130 -10.863 15.237 -3.653 998 HA2 GLY 130 2HA GLY 130 -8.799 16.335 -3.049 999 HA3 GLY 130 1HA GLY 130 -9.372 16.434 -1.382 1000 H ALA 131 H ALA 131 -10.025 13.414 -2.734 1001 HA ALA 131 HA ALA 131 -8.388 11.978 -0.915 1002 HB1 ALA 131 1HB ALA 131 -9.457 10.180 -1.780 1003 HB2 ALA 131 2HB ALA 131 -8.912 10.549 -3.417 1004 HB3 ALA 131 3HB ALA 131 -10.351 11.335 -2.770 1005 H TRP 132 H TRP 132 -7.705 13.295 -4.087 1006 HA TRP 132 HA TRP 132 -5.441 11.781 -4.808 1007 HB2 TRP 132 2HB TRP 132 -6.505 13.515 -6.243 1008 HB3 TRP 132 1HB TRP 132 -5.845 14.762 -5.189 1009 HD1 TRP 132 HD TRP 132 -3.727 15.775 -6.093 1010 HE1 TRP 132 1HE TRP 132 -1.741 14.975 -7.527 1011 HE3 TRP 132 3HE TRP 132 -5.080 10.904 -6.856 1012 HZ2 TRP 132 2HZ TRP 132 -0.847 12.593 -8.825 1013 HZ3 TRP 132 3HZ TRP 132 -3.639 9.397 -8.184 1014 HH2 TRP 132 HH TRP 132 -1.526 10.232 -9.167 1015 H ASN 133 H ASN 133 -5.724 14.489 -2.541 1016 HA ASN 133 HA ASN 133 -2.946 14.888 -2.061 1017 HB2 ASN 133 2HB ASN 133 -4.883 16.324 -1.230 1018 HB3 ASN 133 1HB ASN 133 -5.118 15.117 0.035 1019 HD21 ASN 133 1HD2 ASN 133 -4.489 17.467 1.128 1020 HD22 ASN 133 2HD2 ASN 133 -2.852 17.580 1.559 1021 H ILE 134 H ILE 134 -5.265 12.615 -0.619 1022 HA ILE 134 HA ILE 134 -3.557 11.543 1.390 1023 HB ILE 134 HB ILE 134 -5.886 10.433 -0.154 1024 HG12 ILE 134 2HG1 ILE 134 -7.044 10.654 1.934 1025 HG13 ILE 134 1HG1 ILE 134 -5.538 10.907 2.813 1026 HG21 ILE 134 1HG2 ILE 134 -4.602 8.468 0.218 1027 HG22 ILE 134 2HG2 ILE 134 -5.775 8.514 1.532 1028 HG23 ILE 134 3HG2 ILE 134 -4.108 9.006 1.823 1029 HD11 ILE 134 1HD1 ILE 134 -6.540 12.778 0.652 1030 HD12 ILE 134 2HD1 ILE 134 -5.202 13.057 1.767 1031 HD13 ILE 134 3HD1 ILE 134 -6.857 13.017 2.368 1032 H HIS 135 H HIS 135 -3.973 10.690 -2.026 1033 HA HIS 135 HA HIS 135 -2.264 8.411 -2.049 1034 HB2 HIS 135 2HB HIS 135 -3.804 9.162 -3.913 1035 HB3 HIS 135 1HB HIS 135 -2.616 10.406 -4.303 1036 HD1 HIS 135 1HD HIS 135 -0.027 8.747 -3.868 1037 HD2 HIS 135 2HD HIS 135 -3.333 7.393 -6.022 1038 HE1 HIS 135 1HE HIS 135 0.823 6.940 -5.430 1039 HE2 HIS 135 2HE HIS 135 -1.180 6.109 -6.744 1040 H LYS 136 H LYS 136 -1.582 11.876 -2.327 1041 HA LYS 136 HA LYS 136 1.120 11.732 -3.138 1042 HB2 LYS 136 2HB LYS 136 -0.213 13.715 -1.292 1043 HB3 LYS 136 1HB LYS 136 1.364 13.947 -2.031 1044 HG2 LYS 136 2HG LYS 136 0.298 13.697 -4.267 1045 HG3 LYS 136 1HG LYS 136 -1.269 13.615 -3.471 1046 HD2 LYS 136 2HD LYS 136 -0.819 15.849 -2.448 1047 HD3 LYS 136 1HD LYS 136 0.675 15.937 -3.381 1048 HE2 LYS 136 2HE LYS 136 -1.300 15.243 -5.249 1049 HE3 LYS 136 1HE LYS 136 -2.047 16.477 -4.234 1050 HZ1 LYS 136 1HZ LYS 136 0.681 16.807 -5.321 1051 HZ2 LYS 136 2HZ LYS 136 -0.370 17.999 -4.719 1052 HZ3 LYS 136 3HZ LYS 136 -0.689 17.258 -6.214 1053 H ALA 137 H ALA 137 -0.258 11.595 0.148 1054 HA ALA 137 HA ALA 137 2.301 11.431 1.465 1055 HB1 ALA 137 1HB ALA 137 1.051 11.441 3.349 1056 HB2 ALA 137 2HB ALA 137 0.145 10.018 2.838 1057 HB3 ALA 137 3HB ALA 137 -0.349 11.621 2.291 1058 H LEU 138 H LEU 138 -0.004 8.987 0.331 1059 HA LEU 138 HA LEU 138 1.495 6.719 1.252 1060 HB2 LEU 138 2HB LEU 138 -0.429 6.908 -1.083 1061 HB3 LEU 138 1HB LEU 138 0.060 5.435 -0.261 1062 HG LEU 138 HG LEU 138 -1.478 7.743 0.957 1063 HD11 LEU 138 1HD1 LEU 138 -3.348 6.570 0.482 1064 HD12 LEU 138 2HD1 LEU 138 -2.643 5.079 1.105 1065 HD13 LEU 138 3HD1 LEU 138 -2.353 5.561 -0.567 1066 HD21 LEU 138 1HD2 LEU 138 -0.224 6.948 2.746 1067 HD22 LEU 138 2HD2 LEU 138 -0.137 5.315 2.086 1068 HD23 LEU 138 3HD2 LEU 138 -1.631 5.888 2.828 1069 H ASP 139 H ASP 139 1.690 8.815 -1.522 1070 HA ASP 139 HA ASP 139 3.358 7.049 -3.115 1071 HB2 ASP 139 2HB ASP 139 1.973 8.891 -4.083 1072 HB3 ASP 139 1HB ASP 139 3.031 10.061 -3.292 1073 H GLY 140 H GLY 140 5.284 6.470 -2.216 1074 HA2 GLY 140 2HA GLY 140 6.887 8.510 -0.780 1075 HA3 GLY 140 1HA GLY 140 7.188 6.773 -0.756 1076 HA PRO 141 HA PRO 141 10.387 8.714 -3.533 1077 HB2 PRO 141 2HB PRO 141 11.703 6.166 -2.726 1078 HB3 PRO 141 1HB PRO 141 12.359 7.814 -2.762 1079 HG2 PRO 141 2HG PRO 141 11.711 6.601 -0.471 1080 HG3 PRO 141 1HG PRO 141 11.508 8.346 -0.706 1081 HD2 PRO 141 2HD PRO 141 9.431 6.204 -0.637 1082 HD3 PRO 141 1HD PRO 141 9.312 7.910 -0.155 1083 H SER 142 H SER 142 10.896 8.095 -5.677 1084 HA SER 142 HA SER 142 10.576 6.960 -7.706 1085 HB2 SER 142 2HB SER 142 10.308 4.420 -6.106 1086 HB3 SER 142 1HB SER 142 11.025 4.646 -7.699 1087 HG SER 142 HG SER 142 12.457 6.171 -6.300 1088 HA PRO 143 HA PRO 143 5.993 6.948 -6.542 1089 HB2 PRO 143 2HB PRO 143 5.985 8.646 -8.983 1090 HB3 PRO 143 1HB PRO 143 5.167 8.894 -7.430 1091 HG2 PRO 143 2HG PRO 143 7.321 10.308 -8.142 1092 HG3 PRO 143 1HG PRO 143 6.998 9.855 -6.460 1093 HD2 PRO 143 2HD PRO 143 9.011 8.735 -8.357 1094 HD3 PRO 143 1HD PRO 143 9.083 8.886 -6.588 1095 H GLY 144 H GLY 144 4.420 5.680 -7.566 1096 HA2 GLY 144 2HA GLY 144 4.247 5.028 -10.296 1097 HA3 GLY 144 1HA GLY 144 5.295 3.810 -9.568 1098 H GLU 145 H GLU 145 3.239 2.555 -10.409 1099 HA GLU 145 HA GLU 145 0.747 2.668 -9.121 1100 HB2 GLU 145 2HB GLU 145 0.489 0.306 -9.702 1101 HB3 GLU 145 1HB GLU 145 1.293 1.153 -11.026 1102 HG2 GLU 145 2HG GLU 145 3.492 0.402 -10.123 1103 HG3 GLU 145 1HG GLU 145 2.637 -0.525 -8.889 1104 H THR 146 H THR 146 -0.091 1.263 -7.360 1105 HA THR 146 HA THR 146 1.381 1.525 -4.952 1106 HB THR 146 HB THR 146 -0.852 -0.397 -5.627 1107 HG1 THR 146 1HG THR 146 -1.269 1.825 -4.059 1108 HG21 THR 146 1HG2 THR 146 -0.024 -1.274 -3.647 1109 HG22 THR 146 2HG2 THR 146 -1.162 -0.076 -3.029 1110 HG23 THR 146 3HG2 THR 146 0.562 0.291 -3.081 1111 H LEU 147 H LEU 147 1.157 -1.152 -7.238 1112 HA LEU 147 HA LEU 147 2.454 -3.123 -5.661 1113 HB2 LEU 147 2HB LEU 147 2.590 -2.786 -8.669 1114 HB3 LEU 147 1HB LEU 147 2.839 -4.274 -7.758 1115 HG LEU 147 HG LEU 147 0.268 -2.676 -7.778 1116 HD11 LEU 147 1HD1 LEU 147 1.313 -4.875 -9.462 1117 HD12 LEU 147 2HD1 LEU 147 0.076 -3.670 -9.820 1118 HD13 LEU 147 3HD1 LEU 147 -0.330 -5.093 -8.862 1119 HD21 LEU 147 1HD2 LEU 147 -0.355 -5.151 -6.858 1120 HD22 LEU 147 2HD2 LEU 147 0.070 -3.811 -5.797 1121 HD23 LEU 147 3HD2 LEU 147 1.290 -5.004 -6.243 1122 H ALA 148 H ALA 148 3.732 -0.421 -7.512 1123 HA ALA 148 HA ALA 148 6.437 -1.293 -7.720 1124 HB1 ALA 148 1HB ALA 148 6.982 0.998 -8.184 1125 HB2 ALA 148 2HB ALA 148 5.543 1.571 -7.340 1126 HB3 ALA 148 3HB ALA 148 5.383 0.710 -8.871 1127 H ARG 149 H ARG 149 5.045 0.958 -5.293 1128 HA ARG 149 HA ARG 149 7.405 0.933 -3.657 1129 HB2 ARG 149 2HB ARG 149 6.036 2.049 -1.987 1130 HB3 ARG 149 1HB ARG 149 5.653 2.712 -3.573 1131 HG2 ARG 149 2HG ARG 149 3.726 1.105 -3.697 1132 HG3 ARG 149 1HG ARG 149 4.056 0.655 -2.024 1133 HD2 ARG 149 2HD ARG 149 3.798 3.062 -1.384 1134 HD3 ARG 149 1HD ARG 149 3.326 3.414 -3.046 1135 HE ARG 149 HE ARG 149 1.736 1.312 -1.759 1136 HH11 ARG 149 1HH1 ARG 149 -0.449 1.821 -1.483 1137 HH12 ARG 149 2HH1 ARG 149 -0.977 3.457 -1.692 1138 HH21 ARG 149 1HH2 ARG 149 2.186 4.660 -2.446 1139 HH22 ARG 149 2HH2 ARG 149 0.514 5.064 -2.238 1140 H PHE 150 H PHE 150 4.397 -0.939 -3.587 1141 HA PHE 150 HA PHE 150 4.886 -2.321 -1.133 1142 HB2 PHE 150 2HB PHE 150 2.688 -2.332 -2.212 1143 HB3 PHE 150 1HB PHE 150 3.356 -3.177 -3.604 1144 HD1 PHE 150 1HD PHE 150 3.669 -5.525 -3.608 1145 HD2 PHE 150 2HD PHE 150 2.661 -3.496 0.041 1146 HE1 PHE 150 1HE PHE 150 3.271 -7.709 -2.508 1147 HE2 PHE 150 2HE PHE 150 2.263 -5.683 1.143 1148 HZ PHE 150 HZ PHE 150 2.573 -7.789 -0.134 1149 H ALA 151 H ALA 151 5.761 -3.114 -4.500 1150 HA ALA 151 HA ALA 151 6.912 -5.672 -3.856 1151 HB1 ALA 151 1HB ALA 151 8.054 -5.405 -6.089 1152 HB2 ALA 151 2HB ALA 151 7.369 -3.783 -6.181 1153 HB3 ALA 151 3HB ALA 151 6.304 -5.189 -6.146 1154 H ASN 152 H ASN 152 8.297 -2.406 -4.131 1155 HA ASN 152 HA ASN 152 11.022 -3.195 -3.820 1156 HB2 ASN 152 2HB ASN 152 9.645 -0.609 -3.089 1157 HB3 ASN 152 1HB ASN 152 11.393 -0.829 -3.127 1158 HD21 ASN 152 1HD2 ASN 152 10.114 1.052 -4.864 1159 HD22 ASN 152 2HD2 ASN 152 10.260 0.494 -6.460 1160 H VAL 153 H VAL 153 8.687 -2.028 -1.374 1161 HA VAL 153 HA VAL 153 10.519 -2.424 0.816 1162 HB VAL 153 HB VAL 153 8.631 -1.973 2.241 1163 HG11 VAL 153 1HG1 VAL 153 8.584 0.179 1.585 1164 HG12 VAL 153 2HG1 VAL 153 7.654 -0.230 0.144 1165 HG13 VAL 153 3HG1 VAL 153 9.416 -0.323 0.114 1166 HG21 VAL 153 1HG2 VAL 153 6.905 -3.369 1.460 1167 HG22 VAL 153 2HG2 VAL 153 7.052 -2.768 -0.191 1168 HG23 VAL 153 3HG2 VAL 153 6.332 -1.751 1.055 1169 H ILE 154 H ILE 154 8.301 -4.508 -0.893 1170 HA ILE 154 HA ILE 154 8.332 -6.569 1.186 1171 HB ILE 154 HB ILE 154 7.216 -6.396 -1.604 1172 HG12 ILE 154 2HG1 ILE 154 6.211 -5.366 0.623 1173 HG13 ILE 154 1HG1 ILE 154 5.165 -6.146 -0.559 1174 HG21 ILE 154 1HG2 ILE 154 6.127 -8.645 -0.897 1175 HG22 ILE 154 2HG2 ILE 154 7.496 -8.767 0.211 1176 HG23 ILE 154 3HG2 ILE 154 7.774 -8.657 -1.527 1177 HD11 ILE 154 1HD1 ILE 154 6.416 -7.708 1.699 1178 HD12 ILE 154 2HD1 ILE 154 5.018 -8.138 0.714 1179 HD13 ILE 154 3HD1 ILE 154 4.890 -6.849 1.910 Start of MODEL 2 1 H1 MET 1 1HT MET 1 5.045 14.053 -4.806 2 H2 MET 1 2HT MET 1 3.894 12.841 -5.115 3 H3 MET 1 3HT MET 1 3.393 14.385 -4.616 4 HA MET 1 HA MET 1 3.064 14.772 -6.780 5 HB2 MET 1 2HB MET 1 6.047 14.738 -7.144 6 HB3 MET 1 1HB MET 1 4.867 15.916 -7.723 7 HG2 MET 1 2HG MET 1 5.689 17.142 -5.969 8 HG3 MET 1 1HG MET 1 4.503 16.202 -5.065 9 HE1 MET 1 1HE MET 1 6.652 17.678 -3.885 10 HE2 MET 1 2HE MET 1 8.122 17.365 -4.804 11 HE3 MET 1 3HE MET 1 7.985 16.778 -3.149 12 HA PRO 2 HA PRO 2 4.104 10.584 -8.430 13 HB2 PRO 2 2HB PRO 2 1.541 9.564 -8.334 14 HB3 PRO 2 1HB PRO 2 2.732 9.388 -7.035 15 HG2 PRO 2 2HG PRO 2 0.306 10.946 -7.073 16 HG3 PRO 2 1HG PRO 2 1.393 10.607 -5.721 17 HD2 PRO 2 2HD PRO 2 1.201 13.028 -7.359 18 HD3 PRO 2 1HD PRO 2 2.074 12.784 -5.828 19 H GLU 3 H GLU 3 3.203 9.558 -10.485 20 HA GLU 3 HA GLU 3 2.870 11.362 -12.577 21 HB2 GLU 3 2HB GLU 3 1.538 8.650 -12.348 22 HB3 GLU 3 1HB GLU 3 1.830 9.527 -13.848 23 HG2 GLU 3 2HG GLU 3 4.277 9.463 -13.364 24 HG3 GLU 3 1HG GLU 3 3.941 8.485 -11.934 25 H GLU 4 H GLU 4 0.936 12.211 -13.647 26 HA GLU 4 HA GLU 4 -0.999 13.311 -11.960 27 HB2 GLU 4 2HB GLU 4 -1.374 12.486 -14.858 28 HB3 GLU 4 1HB GLU 4 -2.405 13.615 -13.976 29 HG2 GLU 4 2HG GLU 4 -0.430 15.075 -13.585 30 HG3 GLU 4 1HG GLU 4 0.553 13.969 -14.544 31 H ILE 5 H ILE 5 -3.085 12.671 -11.313 32 HA ILE 5 HA ILE 5 -3.547 10.092 -10.469 33 HB ILE 5 HB ILE 5 -4.922 12.106 -9.926 34 HG12 ILE 5 2HG1 ILE 5 -6.738 9.926 -10.959 35 HG13 ILE 5 1HG1 ILE 5 -5.682 9.659 -9.570 36 HG21 ILE 5 1HG2 ILE 5 -6.649 11.597 -12.292 37 HG22 ILE 5 2HG2 ILE 5 -5.138 12.465 -12.576 38 HG23 ILE 5 3HG2 ILE 5 -6.321 13.104 -11.436 39 HD11 ILE 5 1HD1 ILE 5 -7.839 11.773 -9.840 40 HD12 ILE 5 2HD1 ILE 5 -6.680 11.724 -8.513 41 HD13 ILE 5 3HD1 ILE 5 -7.830 10.403 -8.731 42 HA PRO 6 HA PRO 6 -4.117 8.340 -14.663 43 HB2 PRO 6 2HB PRO 6 -2.966 5.959 -14.238 44 HB3 PRO 6 1HB PRO 6 -1.992 7.438 -14.367 45 HG2 PRO 6 2HG PRO 6 -2.756 5.879 -11.959 46 HG3 PRO 6 1HG PRO 6 -1.261 6.761 -12.311 47 HD2 PRO 6 2HD PRO 6 -3.413 7.703 -10.739 48 HD3 PRO 6 1HD PRO 6 -2.063 8.670 -11.362 49 H ASP 7 H ASP 7 -5.310 6.463 -15.519 50 HA ASP 7 HA ASP 7 -7.605 5.743 -13.829 51 HB2 ASP 7 2HB ASP 7 -7.831 6.301 -16.271 52 HB3 ASP 7 1HB ASP 7 -6.939 4.826 -16.643 53 H VAL 8 H VAL 8 -7.405 3.120 -15.660 54 HA VAL 8 HA VAL 8 -6.892 1.257 -13.648 55 HB VAL 8 HB VAL 8 -6.201 0.955 -16.587 56 HG11 VAL 8 1HG1 VAL 8 -5.665 -1.174 -16.099 57 HG12 VAL 8 2HG1 VAL 8 -7.211 -1.406 -15.283 58 HG13 VAL 8 3HG1 VAL 8 -5.824 -0.787 -14.385 59 HG21 VAL 8 1HG2 VAL 8 -8.445 0.327 -16.956 60 HG22 VAL 8 2HG2 VAL 8 -8.584 1.716 -15.879 61 HG23 VAL 8 3HG2 VAL 8 -8.752 0.082 -15.237 62 H ARG 9 H ARG 9 -5.048 0.379 -12.728 63 HA ARG 9 HA ARG 9 -2.512 1.736 -13.383 64 HB2 ARG 9 2HB ARG 9 -3.299 -0.091 -11.104 65 HB3 ARG 9 1HB ARG 9 -1.682 0.584 -11.307 66 HG2 ARG 9 2HG ARG 9 -2.719 2.877 -11.351 67 HG3 ARG 9 1HG ARG 9 -4.263 2.130 -10.940 68 HD2 ARG 9 2HD ARG 9 -3.186 1.158 -8.898 69 HD3 ARG 9 1HD ARG 9 -1.725 2.064 -9.284 70 HE ARG 9 HE ARG 9 -3.845 3.925 -9.245 71 HH11 ARG 9 1HH1 ARG 9 -4.235 5.152 -7.387 72 HH12 ARG 9 2HH1 ARG 9 -3.659 4.585 -5.855 73 HH21 ARG 9 1HH2 ARG 9 -2.236 1.703 -7.157 74 HH22 ARG 9 2HH2 ARG 9 -2.528 2.633 -5.725 75 H LYS 10 H LYS 10 -0.743 -0.338 -12.506 76 HA LYS 10 HA LYS 10 -0.995 -2.236 -14.798 77 HB2 LYS 10 2HB LYS 10 1.438 -0.941 -13.556 78 HB3 LYS 10 1HB LYS 10 1.516 -2.245 -14.734 79 HG2 LYS 10 2HG LYS 10 0.201 -0.855 -16.320 80 HG3 LYS 10 1HG LYS 10 0.240 0.466 -15.150 81 HD2 LYS 10 2HD LYS 10 2.736 0.392 -15.214 82 HD3 LYS 10 1HD LYS 10 2.636 -0.831 -16.481 83 HE2 LYS 10 2HE LYS 10 0.940 1.186 -17.379 84 HE3 LYS 10 1HE LYS 10 2.299 2.063 -16.675 85 HZ1 LYS 10 1HZ LYS 10 3.759 0.506 -17.976 86 HZ2 LYS 10 2HZ LYS 10 2.875 1.627 -18.897 87 HZ3 LYS 10 3HZ LYS 10 2.367 0.008 -18.807 88 H SER 11 H SER 11 0.934 -3.990 -14.294 89 HA SER 11 HA SER 11 0.308 -5.121 -11.592 90 HB2 SER 11 2HB SER 11 0.330 -7.336 -12.568 91 HB3 SER 11 1HB SER 11 -0.762 -6.341 -13.520 92 HG SER 11 HG SER 11 1.967 -6.842 -14.119 93 H VAL 12 H VAL 12 2.053 -6.252 -10.569 94 HA VAL 12 HA VAL 12 4.691 -6.105 -11.921 95 HB VAL 12 HB VAL 12 4.005 -4.859 -9.269 96 HG11 VAL 12 1HG1 VAL 12 6.662 -5.803 -10.347 97 HG12 VAL 12 2HG1 VAL 12 5.962 -6.105 -8.757 98 HG13 VAL 12 3HG1 VAL 12 6.555 -4.495 -9.168 99 HG21 VAL 12 1HG2 VAL 12 5.447 -3.892 -11.753 100 HG22 VAL 12 2HG2 VAL 12 5.197 -2.934 -10.291 101 HG23 VAL 12 3HG2 VAL 12 3.814 -3.438 -11.264 102 H VAL 13 H VAL 13 6.252 -7.578 -11.028 103 HA VAL 13 HA VAL 13 4.960 -9.836 -9.575 104 HB VAL 13 HB VAL 13 7.613 -9.756 -11.049 105 HG11 VAL 13 1HG1 VAL 13 5.941 -12.071 -10.019 106 HG12 VAL 13 2HG1 VAL 13 7.438 -11.492 -9.288 107 HG13 VAL 13 3HG1 VAL 13 7.463 -12.208 -10.900 108 HG21 VAL 13 1HG2 VAL 13 5.162 -9.552 -12.219 109 HG22 VAL 13 2HG2 VAL 13 5.316 -11.304 -12.107 110 HG23 VAL 13 3HG2 VAL 13 6.534 -10.365 -12.971 111 H VAL 14 H VAL 14 5.572 -10.299 -7.506 112 HA VAL 14 HA VAL 14 7.991 -8.904 -6.428 113 HB VAL 14 HB VAL 14 5.565 -9.618 -4.807 114 HG11 VAL 14 1HG1 VAL 14 7.803 -7.626 -4.384 115 HG12 VAL 14 2HG1 VAL 14 7.703 -9.216 -3.627 116 HG13 VAL 14 3HG1 VAL 14 6.503 -7.981 -3.247 117 HG21 VAL 14 1HG2 VAL 14 4.580 -8.071 -6.242 118 HG22 VAL 14 2HG2 VAL 14 6.102 -7.231 -6.539 119 HG23 VAL 14 3HG2 VAL 14 5.248 -6.997 -5.013 120 H ALA 15 H ALA 15 9.224 -10.094 -4.912 121 HA ALA 15 HA ALA 15 8.956 -13.014 -5.204 122 HB1 ALA 15 1HB ALA 15 11.085 -12.871 -3.670 123 HB2 ALA 15 2HB ALA 15 11.053 -11.162 -4.104 124 HB3 ALA 15 3HB ALA 15 11.205 -12.388 -5.362 125 H ALA 16 H ALA 16 7.144 -13.535 -3.942 126 HA ALA 16 HA ALA 16 7.615 -13.799 -1.094 127 HB1 ALA 16 1HB ALA 16 6.150 -12.235 -0.216 128 HB2 ALA 16 2HB ALA 16 5.159 -12.191 -1.675 129 HB3 ALA 16 3HB ALA 16 6.706 -11.346 -1.634 130 H SER 17 H SER 17 6.166 -15.344 -0.204 131 HA SER 17 HA SER 17 4.882 -17.097 -2.080 132 HB2 SER 17 2HB SER 17 4.457 -16.888 0.917 133 HB3 SER 17 1HB SER 17 4.010 -18.257 -0.097 134 HG SER 17 HG SER 17 6.533 -17.710 -0.606 135 H VAL 18 H VAL 18 2.636 -17.377 -2.501 136 HA VAL 18 HA VAL 18 1.066 -15.014 -2.630 137 HB VAL 18 HB VAL 18 -0.488 -17.513 -2.473 138 HG11 VAL 18 1HG1 VAL 18 -0.069 -15.803 -4.908 139 HG12 VAL 18 2HG1 VAL 18 -0.996 -15.168 -3.550 140 HG13 VAL 18 3HG1 VAL 18 -1.529 -16.635 -4.372 141 HG21 VAL 18 1HG2 VAL 18 1.421 -18.650 -3.280 142 HG22 VAL 18 2HG2 VAL 18 1.940 -17.271 -4.250 143 HG23 VAL 18 3HG2 VAL 18 0.542 -18.222 -4.746 144 H GLU 19 H GLU 19 1.119 -17.649 -0.253 145 HA GLU 19 HA GLU 19 -1.100 -16.789 1.312 146 HB2 GLU 19 2HB GLU 19 1.454 -18.185 2.175 147 HB3 GLU 19 1HB GLU 19 0.004 -18.037 3.168 148 HG2 GLU 19 2HG GLU 19 -1.295 -19.224 1.412 149 HG3 GLU 19 1HG GLU 19 0.189 -19.428 0.480 150 H HIS 20 H HIS 20 2.296 -15.812 1.285 151 HA HIS 20 HA HIS 20 2.279 -14.196 3.623 152 HB2 HIS 20 2HB HIS 20 4.301 -14.925 2.298 153 HB3 HIS 20 1HB HIS 20 3.865 -13.721 1.085 154 HD1 HIS 20 1HD HIS 20 4.328 -13.774 4.875 155 HD2 HIS 20 2HD HIS 20 5.101 -11.314 1.597 156 HE1 HIS 20 1HE HIS 20 5.518 -11.734 5.775 157 HE2 HIS 20 2HE HIS 20 5.996 -10.231 3.790 158 H CYS 21 H CYS 21 1.431 -13.480 0.247 159 HA CYS 21 HA CYS 21 1.163 -10.691 0.405 160 HB2 CYS 21 2HB CYS 21 -0.381 -12.762 -1.166 161 HB3 CYS 21 1HB CYS 21 -0.639 -11.034 -1.377 162 HG CYS 21 HG CYS 21 1.868 -12.593 -2.263 163 H PHE 22 H PHE 22 -1.454 -13.098 0.915 164 HA PHE 22 HA PHE 22 -3.322 -11.094 1.818 165 HB2 PHE 22 2HB PHE 22 -3.432 -14.033 2.501 166 HB3 PHE 22 1HB PHE 22 -4.780 -12.913 2.293 167 HD1 PHE 22 1HD PHE 22 -2.318 -15.014 0.624 168 HD2 PHE 22 2HD PHE 22 -5.382 -12.070 0.023 169 HE1 PHE 22 1HE PHE 22 -2.367 -15.566 -1.787 170 HE2 PHE 22 2HE PHE 22 -5.434 -12.621 -2.395 171 HZ PHE 22 HZ PHE 22 -3.922 -14.370 -3.297 172 H GLU 23 H GLU 23 -1.073 -13.253 3.488 173 HA GLU 23 HA GLU 23 -2.034 -12.629 6.136 174 HB2 GLU 23 2HB GLU 23 0.615 -13.730 5.160 175 HB3 GLU 23 1HB GLU 23 0.177 -13.591 6.863 176 HG2 GLU 23 2HG GLU 23 -1.409 -15.142 4.795 177 HG3 GLU 23 1HG GLU 23 -0.289 -15.863 5.950 178 H VAL 24 H VAL 24 0.433 -11.217 4.031 179 HA VAL 24 HA VAL 24 1.715 -9.567 5.942 180 HB VAL 24 HB VAL 24 1.323 -9.444 2.974 181 HG11 VAL 24 1HG1 VAL 24 2.872 -7.377 3.116 182 HG12 VAL 24 2HG1 VAL 24 2.292 -7.229 4.775 183 HG13 VAL 24 3HG1 VAL 24 1.155 -7.134 3.430 184 HG21 VAL 24 1HG2 VAL 24 3.745 -9.467 4.805 185 HG22 VAL 24 2HG2 VAL 24 3.791 -9.553 3.045 186 HG23 VAL 24 3HG2 VAL 24 3.078 -10.872 3.974 187 H PHE 25 H PHE 25 -1.144 -8.876 3.903 188 HA PHE 25 HA PHE 25 -1.489 -6.185 4.798 189 HB2 PHE 25 2HB PHE 25 -3.834 -7.952 4.157 190 HB3 PHE 25 1HB PHE 25 -3.589 -6.253 3.765 191 HD1 PHE 25 1HD PHE 25 -0.848 -6.306 2.616 192 HD2 PHE 25 2HD PHE 25 -4.156 -8.992 2.098 193 HE1 PHE 25 1HE PHE 25 0.039 -6.964 0.394 194 HE2 PHE 25 2HE PHE 25 -3.272 -9.652 -0.128 195 HZ PHE 25 HZ PHE 25 -1.174 -8.637 -0.978 196 H THR 26 H THR 26 -2.793 -9.254 6.040 197 HA THR 26 HA THR 26 -4.061 -7.780 8.272 198 HB THR 26 HB THR 26 -5.269 -9.810 8.693 199 HG1 THR 26 1HG THR 26 -4.646 -11.623 7.178 200 HG21 THR 26 1HG2 THR 26 -4.913 -9.380 5.717 201 HG22 THR 26 2HG2 THR 26 -6.061 -8.542 6.762 202 HG23 THR 26 3HG2 THR 26 -6.247 -10.268 6.453 203 H SER 27 H SER 27 -1.070 -9.232 7.716 204 HA SER 27 HA SER 27 -0.784 -10.426 10.379 205 HB2 SER 27 2HB SER 27 0.531 -11.454 8.678 206 HB3 SER 27 1HB SER 27 1.156 -9.901 8.133 207 HG SER 27 HG SER 27 2.668 -10.112 9.561 208 H ARG 28 H ARG 28 1.067 -7.808 8.781 209 HA ARG 28 HA ARG 28 0.698 -6.021 11.053 210 HB2 ARG 28 2HB ARG 28 3.269 -5.962 11.440 211 HB3 ARG 28 1HB ARG 28 2.346 -7.271 12.178 212 HG2 ARG 28 2HG ARG 28 3.182 -8.865 10.743 213 HG3 ARG 28 1HG ARG 28 3.368 -7.721 9.413 214 HD2 ARG 28 2HD ARG 28 5.577 -8.355 10.200 215 HD3 ARG 28 1HD ARG 28 5.281 -6.676 10.654 216 HE ARG 28 HE ARG 28 4.540 -8.596 12.731 217 HH11 ARG 28 1HH1 ARG 28 5.783 -8.488 14.618 218 HH12 ARG 28 2HH1 ARG 28 7.272 -7.605 14.607 219 HH21 ARG 28 1HH2 ARG 28 7.000 -6.664 11.281 220 HH22 ARG 28 2HH2 ARG 28 7.961 -6.572 12.719 221 HA PRO 29 HA PRO 29 1.495 -4.075 6.906 222 HB2 PRO 29 2HB PRO 29 -0.144 -1.963 8.168 223 HB3 PRO 29 1HB PRO 29 -0.339 -2.748 6.593 224 HG2 PRO 29 2HG PRO 29 -1.965 -3.233 8.684 225 HG3 PRO 29 1HG PRO 29 -1.596 -4.440 7.443 226 HD2 PRO 29 2HD PRO 29 -0.618 -4.269 10.250 227 HD3 PRO 29 1HD PRO 29 -0.856 -5.698 9.221 228 H ALA 30 H ALA 30 1.946 -3.009 10.199 229 HA ALA 30 HA ALA 30 3.271 -0.521 9.669 230 HB1 ALA 30 1HB ALA 30 3.613 -2.439 11.995 231 HB2 ALA 30 2HB ALA 30 2.447 -1.119 11.910 232 HB3 ALA 30 3HB ALA 30 4.174 -0.767 11.962 233 H ASP 31 H ASP 31 4.197 -3.717 9.043 234 HA ASP 31 HA ASP 31 6.972 -3.739 9.522 235 HB2 ASP 31 2HB ASP 31 5.550 -5.649 8.644 236 HB3 ASP 31 1HB ASP 31 5.647 -4.890 7.056 237 H TRP 32 H TRP 32 5.142 -2.101 6.989 238 HA TRP 32 HA TRP 32 7.627 -0.678 6.231 239 HB2 TRP 32 2HB TRP 32 6.839 -1.062 3.751 240 HB3 TRP 32 1HB TRP 32 7.787 -2.304 4.567 241 HD1 TRP 32 HD TRP 32 6.717 -4.614 4.837 242 HE1 TRP 32 1HE TRP 32 4.394 -5.617 4.365 243 HE3 TRP 32 3HE TRP 32 4.153 -0.362 3.719 244 HZ2 TRP 32 2HZ TRP 32 1.790 -4.727 3.612 245 HZ3 TRP 32 3HZ TRP 32 1.749 -0.460 3.124 246 HH2 TRP 32 HH TRP 32 0.562 -2.634 3.067 247 H TRP 33 H TRP 33 4.499 -0.447 7.145 248 HA TRP 33 HA TRP 33 3.289 1.338 5.312 249 HB2 TRP 33 2HB TRP 33 2.493 0.296 7.684 250 HB3 TRP 33 1HB TRP 33 2.865 1.944 8.187 251 HD1 TRP 33 HD TRP 33 1.376 3.895 7.276 252 HE1 TRP 33 1HE TRP 33 -0.875 3.946 6.021 253 HE3 TRP 33 3HE TRP 33 1.021 -1.010 5.888 254 HZ2 TRP 33 2HZ TRP 33 -2.598 2.149 4.615 255 HZ3 TRP 33 3HZ TRP 33 -0.934 -1.810 4.592 256 HH2 TRP 33 HH TRP 33 -2.742 -0.239 3.955 257 HA PRO 34 HA PRO 34 5.548 4.867 7.728 258 HB2 PRO 34 2HB PRO 34 7.935 3.686 8.889 259 HB3 PRO 34 1HB PRO 34 6.621 4.555 9.694 260 HG2 PRO 34 2HG PRO 34 7.100 1.894 10.001 261 HG3 PRO 34 1HG PRO 34 5.516 2.653 10.224 262 HD2 PRO 34 2HD PRO 34 6.541 1.076 7.895 263 HD3 PRO 34 1HD PRO 34 4.908 1.124 8.597 264 HA PRO 35 HA PRO 35 8.513 4.654 4.252 265 HB2 PRO 35 2HB PRO 35 8.006 7.119 3.218 266 HB3 PRO 35 1HB PRO 35 6.968 5.714 2.913 267 HG2 PRO 35 2HG PRO 35 6.511 8.048 4.643 268 HG3 PRO 35 1HG PRO 35 5.350 6.990 3.836 269 HD2 PRO 35 2HD PRO 35 6.103 6.904 6.577 270 HD3 PRO 35 1HD PRO 35 5.098 5.731 5.705 271 H SER 36 H SER 36 10.305 6.278 3.517 272 HA SER 36 HA SER 36 12.018 6.860 5.681 273 HB2 SER 36 2HB SER 36 11.986 8.246 2.985 274 HB3 SER 36 1HB SER 36 13.356 8.135 4.087 275 HG SER 36 HG SER 36 12.252 5.708 3.557 276 H HIS 37 H HIS 37 9.545 8.860 4.154 277 HA HIS 37 HA HIS 37 10.194 11.047 6.094 278 HB2 HIS 37 2HB HIS 37 8.581 11.228 3.531 279 HB3 HIS 37 1HB HIS 37 9.089 12.572 4.554 280 HD1 HIS 37 1HD HIS 37 11.833 12.744 4.847 281 HD2 HIS 37 2HD HIS 37 10.405 10.651 1.533 282 HE1 HIS 37 1HE HIS 37 13.760 12.595 3.206 283 HE2 HIS 37 2HE HIS 37 12.900 11.324 1.187 284 H VAL 38 H VAL 38 7.937 12.379 6.421 285 HA VAL 38 HA VAL 38 6.028 10.316 7.426 286 HB VAL 38 HB VAL 38 5.202 12.084 8.920 287 HG11 VAL 38 1HG1 VAL 38 6.999 12.004 10.393 288 HG12 VAL 38 2HG1 VAL 38 8.187 12.289 9.121 289 HG13 VAL 38 3HG1 VAL 38 7.430 10.705 9.282 290 HG21 VAL 38 1HG2 VAL 38 6.816 13.742 7.081 291 HG22 VAL 38 2HG2 VAL 38 6.990 14.154 8.786 292 HG23 VAL 38 3HG2 VAL 38 5.395 14.176 8.032 293 H LEU 39 H LEU 39 4.277 10.007 6.162 294 HA LEU 39 HA LEU 39 3.518 11.870 4.070 295 HB2 LEU 39 2HB LEU 39 1.904 9.557 5.181 296 HB3 LEU 39 1HB LEU 39 1.752 10.294 3.585 297 HG LEU 39 HG LEU 39 4.122 8.738 4.647 298 HD11 LEU 39 1HD1 LEU 39 3.193 7.795 2.144 299 HD12 LEU 39 2HD1 LEU 39 1.763 8.038 3.147 300 HD13 LEU 39 3HD1 LEU 39 3.066 6.990 3.708 301 HD21 LEU 39 1HD2 LEU 39 4.821 9.110 2.135 302 HD22 LEU 39 2HD2 LEU 39 5.160 10.362 3.330 303 HD23 LEU 39 3HD2 LEU 39 3.773 10.522 2.254 304 H VAL 40 H VAL 40 2.433 11.175 7.330 305 HA VAL 40 HA VAL 40 0.331 13.288 7.074 306 HB VAL 40 HB VAL 40 0.212 11.774 9.535 307 HG11 VAL 40 1HG1 VAL 40 -2.072 11.373 8.764 308 HG12 VAL 40 2HG1 VAL 40 -1.630 11.842 7.122 309 HG13 VAL 40 3HG1 VAL 40 -1.630 13.044 8.412 310 HG21 VAL 40 1HG2 VAL 40 -0.374 9.575 8.446 311 HG22 VAL 40 2HG2 VAL 40 1.337 9.985 8.324 312 HG23 VAL 40 3HG2 VAL 40 0.277 10.206 6.932 313 H LYS 41 H LYS 41 0.021 14.259 9.514 314 HA LYS 41 HA LYS 41 2.296 15.873 10.011 315 HB2 LYS 41 2HB LYS 41 0.064 15.081 11.895 316 HB3 LYS 41 1HB LYS 41 1.212 16.382 12.200 317 HG2 LYS 41 2HG LYS 41 0.475 17.472 10.076 318 HG3 LYS 41 1HG LYS 41 -0.749 16.216 9.893 319 HD2 LYS 41 2HD LYS 41 -1.685 16.863 12.119 320 HD3 LYS 41 1HD LYS 41 -0.524 18.189 12.184 321 HE2 LYS 41 2HE LYS 41 -2.790 18.873 11.333 322 HE3 LYS 41 1HE LYS 41 -1.477 19.203 10.201 323 HZ1 LYS 41 1HZ LYS 41 -2.060 17.393 8.882 324 HZ2 LYS 41 2HZ LYS 41 -3.558 18.079 9.301 325 HZ3 LYS 41 3HZ LYS 41 -3.009 16.679 10.092 326 H LYS 42 H LYS 42 1.370 12.722 11.233 327 HA LYS 42 HA LYS 42 4.007 12.554 12.628 328 HB2 LYS 42 2HB LYS 42 1.441 11.178 13.442 329 HB3 LYS 42 1HB LYS 42 2.978 11.099 14.295 330 HG2 LYS 42 2HG LYS 42 1.684 13.761 13.767 331 HG3 LYS 42 1HG LYS 42 1.149 12.775 15.126 332 HD2 LYS 42 2HD LYS 42 3.186 12.947 16.233 333 HD3 LYS 42 1HD LYS 42 4.089 13.245 14.751 334 HE2 LYS 42 2HE LYS 42 2.996 15.465 14.559 335 HE3 LYS 42 1HE LYS 42 2.182 15.171 16.096 336 HZ1 LYS 42 1HZ LYS 42 4.113 15.360 17.268 337 HZ2 LYS 42 2HZ LYS 42 4.448 16.441 16.001 338 HZ3 LYS 42 3HZ LYS 42 5.094 14.871 15.973 339 H GLU 43 H GLU 43 5.007 10.430 12.523 340 HA GLU 43 HA GLU 43 4.457 9.072 10.006 341 HB2 GLU 43 2HB GLU 43 6.757 9.347 11.000 342 HB3 GLU 43 1HB GLU 43 6.292 8.202 12.259 343 HG2 GLU 43 2HG GLU 43 5.793 6.515 10.501 344 HG3 GLU 43 1HG GLU 43 6.359 7.653 9.278 345 H ARG 44 H ARG 44 3.064 7.385 9.751 346 HA ARG 44 HA ARG 44 1.440 6.441 11.900 347 HB2 ARG 44 2HB ARG 44 1.951 5.312 9.143 348 HB3 ARG 44 1HB ARG 44 0.767 4.636 10.264 349 HG2 ARG 44 2HG ARG 44 -0.187 7.017 10.432 350 HG3 ARG 44 1HG ARG 44 0.794 7.386 9.015 351 HD2 ARG 44 2HD ARG 44 -0.357 5.778 7.681 352 HD3 ARG 44 1HD ARG 44 -1.127 5.059 9.094 353 HE ARG 44 HE ARG 44 -2.625 6.927 9.202 354 HH11 ARG 44 1HH1 ARG 44 -3.714 8.570 8.105 355 HH12 ARG 44 2HH1 ARG 44 -3.037 9.222 6.651 356 HH21 ARG 44 1HH2 ARG 44 -0.242 7.176 6.706 357 HH22 ARG 44 2HH2 ARG 44 -1.078 8.434 5.861 358 H ALA 45 H ALA 45 1.502 4.559 13.105 359 HA ALA 45 HA ALA 45 3.959 2.886 12.804 360 HB1 ALA 45 1HB ALA 45 2.818 3.994 15.378 361 HB2 ALA 45 2HB ALA 45 4.354 4.438 14.634 362 HB3 ALA 45 3HB ALA 45 4.125 2.814 15.282 363 H GLY 46 H GLY 46 0.587 3.069 13.989 364 HA2 GLY 46 2HA GLY 46 0.542 0.083 13.745 365 HA3 GLY 46 1HA GLY 46 -0.139 0.856 15.171 366 H LEU 47 H LEU 47 -1.443 -0.804 13.101 367 HA LEU 47 HA LEU 47 -3.778 0.901 12.716 368 HB2 LEU 47 2HB LEU 47 -3.901 0.518 10.261 369 HB3 LEU 47 1HB LEU 47 -2.531 1.529 10.713 370 HG LEU 47 HG LEU 47 -2.345 -1.463 10.258 371 HD11 LEU 47 1HD1 LEU 47 -2.672 0.614 8.352 372 HD12 LEU 47 2HD1 LEU 47 -2.234 -1.064 8.043 373 HD13 LEU 47 3HD1 LEU 47 -0.974 0.145 8.296 374 HD21 LEU 47 1HD2 LEU 47 0.142 -0.479 9.872 375 HD22 LEU 47 2HD2 LEU 47 -0.428 -1.010 11.453 376 HD23 LEU 47 3HD2 LEU 47 -0.449 0.704 11.036 377 H ALA 48 H ALA 48 -5.669 -0.348 12.307 378 HA ALA 48 HA ALA 48 -5.309 -3.282 12.014 379 HB1 ALA 48 1HB ALA 48 -7.130 -3.498 13.860 380 HB2 ALA 48 2HB ALA 48 -6.626 -1.877 14.333 381 HB3 ALA 48 3HB ALA 48 -5.467 -3.206 14.365 382 H PHE 49 H PHE 49 -7.039 -4.240 10.899 383 HA PHE 49 HA PHE 49 -9.461 -2.608 10.418 384 HB2 PHE 49 2HB PHE 49 -9.265 -2.831 7.978 385 HB3 PHE 49 1HB PHE 49 -7.879 -1.960 8.639 386 HD1 PHE 49 1HD PHE 49 -5.695 -3.098 8.922 387 HD2 PHE 49 2HD PHE 49 -9.004 -4.989 6.945 388 HE1 PHE 49 1HE PHE 49 -4.150 -4.757 7.928 389 HE2 PHE 49 2HE PHE 49 -7.458 -6.653 5.949 390 HZ PHE 49 HZ PHE 49 -5.030 -6.534 6.437 391 H GLU 50 H GLU 50 -11.263 -3.851 9.759 392 HA GLU 50 HA GLU 50 -10.995 -6.740 10.316 393 HB2 GLU 50 2HB GLU 50 -13.638 -5.622 9.589 394 HB3 GLU 50 1HB GLU 50 -13.191 -6.665 10.939 395 HG2 GLU 50 2HG GLU 50 -11.976 -4.582 11.883 396 HG3 GLU 50 1HG GLU 50 -12.940 -3.669 10.722 397 HA PRO 51 HA PRO 51 -10.988 -7.184 5.794 398 HB2 PRO 51 2HB PRO 51 -10.369 -9.823 5.686 399 HB3 PRO 51 1HB PRO 51 -9.167 -8.568 6.043 400 HG2 PRO 51 2HG PRO 51 -10.547 -10.445 7.882 401 HG3 PRO 51 1HG PRO 51 -8.887 -9.832 7.926 402 HD2 PRO 51 2HD PRO 51 -10.961 -8.872 9.506 403 HD3 PRO 51 1HD PRO 51 -9.477 -7.971 9.130 404 H PHE 52 H PHE 52 -13.248 -6.912 5.435 405 HA PHE 52 HA PHE 52 -14.674 -9.368 4.749 406 HB2 PHE 52 2HB PHE 52 -15.895 -7.518 6.824 407 HB3 PHE 52 1HB PHE 52 -16.601 -9.003 6.186 408 HD1 PHE 52 1HD PHE 52 -15.491 -11.216 6.669 409 HD2 PHE 52 2HD PHE 52 -14.286 -7.561 8.571 410 HE1 PHE 52 1HE PHE 52 -14.307 -12.516 8.417 411 HE2 PHE 52 2HE PHE 52 -13.104 -8.857 10.318 412 HZ PHE 52 HZ PHE 52 -13.110 -11.337 10.243 413 H VAL 53 H VAL 53 -17.007 -8.588 3.894 414 HA VAL 53 HA VAL 53 -16.413 -6.369 2.076 415 HB VAL 53 HB VAL 53 -19.075 -7.771 2.483 416 HG11 VAL 53 1HG1 VAL 53 -19.733 -6.239 0.963 417 HG12 VAL 53 2HG1 VAL 53 -18.688 -7.059 -0.197 418 HG13 VAL 53 3HG1 VAL 53 -18.079 -5.677 0.715 419 HG21 VAL 53 1HG2 VAL 53 -18.412 -9.508 1.125 420 HG22 VAL 53 2HG2 VAL 53 -16.844 -9.135 1.838 421 HG23 VAL 53 3HG2 VAL 53 -17.257 -8.514 0.240 422 H GLY 54 H GLY 54 -16.809 -4.260 2.593 423 HA2 GLY 54 2HA GLY 54 -17.961 -2.411 3.536 424 HA3 GLY 54 1HA GLY 54 -19.134 -3.539 4.228 425 H GLY 55 H GLY 55 -15.804 -4.273 4.715 426 HA2 GLY 55 2HA GLY 55 -16.072 -4.111 7.594 427 HA3 GLY 55 1HA GLY 55 -14.584 -4.467 6.714 428 H ARG 56 H ARG 56 -14.079 -2.884 8.749 429 HA ARG 56 HA ARG 56 -14.043 -0.105 7.626 430 HB2 ARG 56 2HB ARG 56 -14.095 -1.014 10.519 431 HB3 ARG 56 1HB ARG 56 -13.899 0.661 9.998 432 HG2 ARG 56 2HG ARG 56 -16.079 0.493 8.786 433 HG3 ARG 56 1HG ARG 56 -16.285 -1.128 9.450 434 HD2 ARG 56 2HD ARG 56 -16.016 1.437 11.047 435 HD3 ARG 56 1HD ARG 56 -17.489 0.489 10.840 436 HE ARG 56 HE ARG 56 -15.414 -1.170 11.931 437 HH11 ARG 56 1HH1 ARG 56 -15.534 -1.679 14.130 438 HH12 ARG 56 2HH1 ARG 56 -16.519 -0.712 15.177 439 HH21 ARG 56 1HH2 ARG 56 -17.569 1.422 12.653 440 HH22 ARG 56 2HH2 ARG 56 -17.671 1.044 14.340 441 H TYR 57 H TYR 57 -12.051 0.862 7.442 442 HA TYR 57 HA TYR 57 -9.714 -0.663 8.524 443 HB2 TYR 57 2HB TYR 57 -10.095 -0.459 5.935 444 HB3 TYR 57 1HB TYR 57 -9.513 1.191 6.165 445 HD1 TYR 57 1HD TYR 57 -8.563 -2.226 5.726 446 HD2 TYR 57 2HD TYR 57 -7.284 1.480 7.483 447 HE1 TYR 57 1HE TYR 57 -6.229 -3.066 5.790 448 HE2 TYR 57 2HE TYR 57 -4.949 0.643 7.545 449 HH TYR 57 HH TYR 57 -3.708 -1.463 5.890 450 H TYR 58 H TYR 58 -8.438 0.472 9.923 451 HA TYR 58 HA TYR 58 -8.543 3.445 9.823 452 HB2 TYR 58 2HB TYR 58 -8.461 3.065 12.491 453 HB3 TYR 58 1HB TYR 58 -9.968 3.296 11.608 454 HD1 TYR 58 1HD TYR 58 -11.162 1.191 10.711 455 HD2 TYR 58 2HD TYR 58 -8.058 1.067 13.678 456 HE1 TYR 58 1HE TYR 58 -11.905 -1.074 11.392 457 HE2 TYR 58 2HE TYR 58 -8.804 -1.196 14.361 458 HH TYR 58 HH TYR 58 -10.340 -2.782 14.100 459 H GLU 59 H GLU 59 -6.702 4.464 10.854 460 HA GLU 59 HA GLU 59 -4.414 2.614 11.371 461 HB2 GLU 59 2HB GLU 59 -4.313 5.232 9.840 462 HB3 GLU 59 1HB GLU 59 -2.934 4.192 10.199 463 HG2 GLU 59 2HG GLU 59 -4.033 2.350 8.937 464 HG3 GLU 59 1HG GLU 59 -5.345 3.446 8.519 465 H TRP 60 H TRP 60 -2.971 3.324 13.021 466 HA TRP 60 HA TRP 60 -4.036 5.585 14.661 467 HB2 TRP 60 2HB TRP 60 -2.166 3.343 15.472 468 HB3 TRP 60 1HB TRP 60 -2.815 4.590 16.537 469 HD1 TRP 60 HD TRP 60 -5.748 4.700 16.066 470 HE1 TRP 60 1HE TRP 60 -7.314 2.678 16.406 471 HE3 TRP 60 3HE TRP 60 -2.367 0.891 15.672 472 HZ2 TRP 60 2HZ TRP 60 -7.151 -0.178 16.502 473 HZ3 TRP 60 3HZ TRP 60 -3.099 -1.466 15.895 474 HH2 TRP 60 HH TRP 60 -5.482 -2.004 16.309 475 H ASP 61 H ASP 61 -2.793 7.361 14.983 476 HA ASP 61 HA ASP 61 -0.096 7.396 13.720 477 HB2 ASP 61 2HB ASP 61 -1.959 9.602 14.620 478 HB3 ASP 61 1HB ASP 61 -0.347 9.888 13.971 479 H ILE 62 H ILE 62 1.655 8.529 14.918 480 HA ILE 62 HA ILE 62 2.076 7.516 17.514 481 HB ILE 62 HB ILE 62 3.249 10.016 16.289 482 HG12 ILE 62 2HG1 ILE 62 4.403 7.233 16.376 483 HG13 ILE 62 1HG1 ILE 62 3.489 7.844 15.005 484 HG21 ILE 62 1HG2 ILE 62 5.060 8.658 17.979 485 HG22 ILE 62 2HG2 ILE 62 3.549 8.812 18.875 486 HG23 ILE 62 3HG2 ILE 62 4.344 10.249 18.232 487 HD11 ILE 62 1HD1 ILE 62 5.106 9.817 14.967 488 HD12 ILE 62 2HD1 ILE 62 5.786 8.260 14.489 489 HD13 ILE 62 3HD1 ILE 62 6.097 8.899 16.103 490 H ASP 63 H ASP 63 0.935 10.750 16.552 491 HA ASP 63 HA ASP 63 0.004 11.137 19.374 492 HB2 ASP 63 2HB ASP 63 0.981 13.188 17.366 493 HB3 ASP 63 1HB ASP 63 0.248 13.590 18.919 494 H GLY 64 H GLY 64 -0.836 11.058 16.026 495 HA2 GLY 64 2HA GLY 64 -3.324 12.554 16.342 496 HA3 GLY 64 1HA GLY 64 -2.848 11.639 14.911 497 H THR 65 H THR 65 -5.419 11.621 16.371 498 HA THR 65 HA THR 65 -5.669 9.200 17.889 499 HB THR 65 HB THR 65 -7.966 9.648 17.903 500 HG1 THR 65 1HG THR 65 -9.019 10.218 16.164 501 HG21 THR 65 1HG2 THR 65 -6.928 12.372 17.135 502 HG22 THR 65 2HG2 THR 65 -6.465 11.600 18.652 503 HG23 THR 65 3HG2 THR 65 -8.159 11.967 18.332 504 H GLU 66 H GLU 66 -8.047 8.285 16.382 505 HA GLU 66 HA GLU 66 -6.610 6.535 14.460 506 HB2 GLU 66 2HB GLU 66 -8.029 5.548 16.281 507 HB3 GLU 66 1HB GLU 66 -9.434 6.320 15.548 508 HG2 GLU 66 2HG GLU 66 -8.951 5.094 13.430 509 HG3 GLU 66 1HG GLU 66 -7.634 4.256 14.253 510 H ILE 67 H ILE 67 -6.903 6.808 12.285 511 HA ILE 67 HA ILE 67 -9.231 8.461 11.378 512 HB ILE 67 HB ILE 67 -6.456 8.379 10.155 513 HG12 ILE 67 2HG1 ILE 67 -7.873 10.552 11.733 514 HG13 ILE 67 1HG1 ILE 67 -6.500 9.599 12.299 515 HG21 ILE 67 1HG2 ILE 67 -8.286 8.740 8.524 516 HG22 ILE 67 2HG2 ILE 67 -7.318 10.197 8.729 517 HG23 ILE 67 3HG2 ILE 67 -8.894 10.069 9.509 518 HD11 ILE 67 1HD1 ILE 67 -6.574 11.654 10.095 519 HD12 ILE 67 2HD1 ILE 67 -5.293 10.444 10.168 520 HD13 ILE 67 3HD1 ILE 67 -5.505 11.587 11.496 521 H VAL 68 H VAL 68 -10.162 7.834 9.347 522 HA VAL 68 HA VAL 68 -9.876 4.970 8.776 523 HB VAL 68 HB VAL 68 -11.546 7.068 7.354 524 HG11 VAL 68 1HG1 VAL 68 -11.683 4.039 7.428 525 HG12 VAL 68 2HG1 VAL 68 -11.215 5.025 6.043 526 HG13 VAL 68 3HG1 VAL 68 -12.870 5.084 6.648 527 HG21 VAL 68 1HG2 VAL 68 -13.339 5.730 8.805 528 HG22 VAL 68 2HG2 VAL 68 -12.475 7.113 9.477 529 HG23 VAL 68 3HG2 VAL 68 -11.946 5.474 9.855 530 H TRP 69 H TRP 69 -8.548 4.161 7.223 531 HA TRP 69 HA TRP 69 -7.201 6.095 5.406 532 HB2 TRP 69 2HB TRP 69 -5.524 4.881 6.435 533 HB3 TRP 69 1HB TRP 69 -6.506 3.424 6.555 534 HD1 TRP 69 HD TRP 69 -4.065 5.209 4.313 535 HE1 TRP 69 1HE TRP 69 -3.539 3.729 2.268 536 HE3 TRP 69 3HE TRP 69 -7.619 1.590 4.903 537 HZ2 TRP 69 2HZ TRP 69 -4.497 1.326 1.047 538 HZ3 TRP 69 3HZ TRP 69 -7.788 -0.283 3.290 539 HH2 TRP 69 HH TRP 69 -6.234 -0.421 1.364 540 H GLY 70 H GLY 70 -9.792 4.014 5.351 541 HA2 GLY 70 2HA GLY 70 -10.450 4.229 2.689 542 HA3 GLY 70 1HA GLY 70 -9.367 2.838 2.716 543 H ARG 71 H ARG 71 -10.844 1.176 2.385 544 HA ARG 71 HA ARG 71 -12.513 0.462 4.667 545 HB2 ARG 71 2HB ARG 71 -13.792 2.074 2.904 546 HB3 ARG 71 1HB ARG 71 -14.092 0.511 2.149 547 HG2 ARG 71 2HG ARG 71 -14.997 -0.355 4.267 548 HG3 ARG 71 1HG ARG 71 -14.689 1.199 5.039 549 HD2 ARG 71 2HD ARG 71 -17.021 1.131 4.385 550 HD3 ARG 71 1HD ARG 71 -16.188 2.268 3.326 551 HE ARG 71 HE ARG 71 -16.048 -0.084 1.912 552 HH11 ARG 71 1HH1 ARG 71 -17.659 -0.798 0.496 553 HH12 ARG 71 2HH1 ARG 71 -19.293 -0.274 0.732 554 HH21 ARG 71 1HH2 ARG 71 -18.556 1.649 3.522 555 HH22 ARG 71 2HH2 ARG 71 -19.802 1.111 2.444 556 H ILE 72 H ILE 72 -14.076 -1.477 3.288 557 HA ILE 72 HA ILE 72 -11.984 -3.202 2.029 558 HB ILE 72 HB ILE 72 -14.174 -4.218 3.850 559 HG12 ILE 72 2HG1 ILE 72 -12.702 -2.742 5.150 560 HG13 ILE 72 1HG1 ILE 72 -12.468 -4.418 5.612 561 HG21 ILE 72 1HG2 ILE 72 -11.626 -5.394 2.727 562 HG22 ILE 72 2HG2 ILE 72 -13.279 -5.898 2.374 563 HG23 ILE 72 3HG2 ILE 72 -12.594 -6.173 3.976 564 HD11 ILE 72 1HD1 ILE 72 -10.571 -2.531 4.418 565 HD12 ILE 72 2HD1 ILE 72 -10.613 -4.077 3.575 566 HD13 ILE 72 3HD1 ILE 72 -10.263 -4.024 5.298 567 H LEU 73 H LEU 73 -12.898 -4.855 0.569 568 HA LEU 73 HA LEU 73 -15.616 -4.113 -0.447 569 HB2 LEU 73 2HB LEU 73 -13.755 -3.424 -1.980 570 HB3 LEU 73 1HB LEU 73 -13.261 -5.112 -2.080 571 HG LEU 73 HG LEU 73 -15.770 -5.510 -2.777 572 HD11 LEU 73 1HD1 LEU 73 -16.689 -3.592 -4.035 573 HD12 LEU 73 2HD1 LEU 73 -15.337 -2.597 -3.497 574 HD13 LEU 73 3HD1 LEU 73 -16.509 -3.201 -2.326 575 HD21 LEU 73 1HD2 LEU 73 -14.932 -4.556 -5.179 576 HD22 LEU 73 2HD2 LEU 73 -14.364 -6.076 -4.488 577 HD23 LEU 73 3HD2 LEU 73 -13.398 -4.611 -4.311 578 H GLU 74 H GLU 74 -13.196 -6.739 -0.476 579 HA GLU 74 HA GLU 74 -15.005 -8.696 0.565 580 HB2 GLU 74 2HB GLU 74 -16.043 -8.380 -1.695 581 HB3 GLU 74 1HB GLU 74 -14.522 -8.901 -2.412 582 HG2 GLU 74 2HG GLU 74 -14.698 -11.045 -1.159 583 HG3 GLU 74 1HG GLU 74 -16.270 -10.529 -0.549 584 H TRP 75 H TRP 75 -13.855 -10.548 1.124 585 HA TRP 75 HA TRP 75 -10.993 -10.587 0.287 586 HB2 TRP 75 2HB TRP 75 -10.588 -10.784 2.494 587 HB3 TRP 75 1HB TRP 75 -12.314 -10.900 2.837 588 HD1 TRP 75 HD TRP 75 -9.243 -13.050 2.111 589 HE1 TRP 75 1HE TRP 75 -9.762 -15.487 2.774 590 HE3 TRP 75 3HE TRP 75 -14.222 -12.635 3.172 591 HZ2 TRP 75 2HZ TRP 75 -11.994 -17.054 3.640 592 HZ3 TRP 75 3HZ TRP 75 -15.519 -14.614 3.912 593 HH2 TRP 75 HH TRP 75 -14.412 -16.820 4.147 594 H ASP 76 H ASP 76 -10.580 -12.112 -1.241 595 HA ASP 76 HA ASP 76 -12.290 -14.551 -1.280 596 HB2 ASP 76 2HB ASP 76 -11.616 -12.791 -3.323 597 HB3 ASP 76 1HB ASP 76 -10.556 -14.178 -3.591 598 HA PRO 77 HA PRO 77 -8.913 -16.878 0.598 599 HB2 PRO 77 2HB PRO 77 -9.827 -18.774 -1.559 600 HB3 PRO 77 1HB PRO 77 -9.383 -19.131 0.122 601 HG2 PRO 77 2HG PRO 77 -11.930 -18.913 -0.627 602 HG3 PRO 77 1HG PRO 77 -11.370 -18.362 0.960 603 HD2 PRO 77 2HD PRO 77 -12.297 -16.767 -1.334 604 HD3 PRO 77 1HD PRO 77 -12.122 -16.283 0.368 605 HA PRO 78 HA PRO 78 -5.106 -16.235 -1.510 606 HB2 PRO 78 2HB PRO 78 -5.073 -19.219 -1.854 607 HB3 PRO 78 1HB PRO 78 -3.764 -18.135 -1.344 608 HG2 PRO 78 2HG PRO 78 -5.322 -19.590 0.378 609 HG3 PRO 78 1HG PRO 78 -4.459 -18.108 0.812 610 HD2 PRO 78 2HD PRO 78 -7.310 -18.507 0.697 611 HD3 PRO 78 1HD PRO 78 -6.440 -17.016 1.109 612 H HIS 79 H HIS 79 -6.087 -15.235 -3.363 613 HA HIS 79 HA HIS 79 -5.537 -16.279 -5.872 614 HB2 HIS 79 2HB HIS 79 -7.992 -17.423 -4.714 615 HB3 HIS 79 1HB HIS 79 -8.213 -16.730 -6.321 616 HD1 HIS 79 1HD HIS 79 -7.347 -19.820 -4.817 617 HD2 HIS 79 2HD HIS 79 -5.837 -17.701 -8.078 618 HE1 HIS 79 1HE HIS 79 -6.071 -21.492 -6.232 619 HE2 HIS 79 2HE HIS 79 -5.148 -20.212 -8.218 620 H ARG 80 H ARG 80 -8.146 -14.531 -4.099 621 HA ARG 80 HA ARG 80 -7.691 -12.297 -6.007 622 HB2 ARG 80 2HB ARG 80 -9.844 -13.948 -6.351 623 HB3 ARG 80 1HB ARG 80 -10.526 -12.698 -5.313 624 HG2 ARG 80 2HG ARG 80 -8.972 -12.111 -7.846 625 HG3 ARG 80 1HG ARG 80 -10.732 -12.196 -7.769 626 HD2 ARG 80 2HD ARG 80 -8.926 -10.264 -6.303 627 HD3 ARG 80 1HD ARG 80 -10.122 -9.879 -7.538 628 HE ARG 80 HE ARG 80 -10.680 -10.420 -4.715 629 HH11 ARG 80 1HH1 ARG 80 -12.845 -10.185 -4.112 630 HH12 ARG 80 2HH1 ARG 80 -14.064 -10.073 -5.338 631 HH21 ARG 80 1HH2 ARG 80 -11.820 -10.346 -7.967 632 HH22 ARG 80 2HH2 ARG 80 -13.484 -10.164 -7.520 633 H LEU 81 H LEU 81 -7.606 -10.372 -5.019 634 HA LEU 81 HA LEU 81 -8.759 -10.133 -2.267 635 HB2 LEU 81 2HB LEU 81 -6.251 -10.303 -2.257 636 HB3 LEU 81 1HB LEU 81 -6.192 -8.856 -3.262 637 HG LEU 81 HG LEU 81 -7.560 -7.690 -1.454 638 HD11 LEU 81 1HD1 LEU 81 -8.354 -8.943 0.236 639 HD12 LEU 81 2HD1 LEU 81 -6.696 -9.266 0.742 640 HD13 LEU 81 3HD1 LEU 81 -7.504 -10.361 -0.378 641 HD21 LEU 81 1HD2 LEU 81 -5.266 -8.158 0.122 642 HD22 LEU 81 2HD2 LEU 81 -5.505 -6.860 -1.049 643 HD23 LEU 81 3HD2 LEU 81 -4.751 -8.374 -1.551 644 H ALA 82 H ALA 82 -10.125 -8.397 -2.052 645 HA ALA 82 HA ALA 82 -9.838 -6.132 -3.969 646 HB1 ALA 82 1HB ALA 82 -11.960 -6.315 -4.809 647 HB2 ALA 82 2HB ALA 82 -12.615 -6.938 -3.295 648 HB3 ALA 82 3HB ALA 82 -11.746 -8.014 -4.390 649 H MET 83 H MET 83 -10.379 -4.117 -3.048 650 HA MET 83 HA MET 83 -11.584 -4.128 -0.337 651 HB2 MET 83 2HB MET 83 -8.939 -2.786 -0.958 652 HB3 MET 83 1HB MET 83 -9.785 -2.757 0.590 653 HG2 MET 83 2HG MET 83 -9.626 -5.271 0.635 654 HG3 MET 83 1HG MET 83 -8.599 -5.173 -0.796 655 HE1 MET 83 1HE MET 83 -6.873 -2.271 0.054 656 HE2 MET 83 2HE MET 83 -6.783 -3.645 -1.045 657 HE3 MET 83 3HE MET 83 -5.511 -3.396 0.148 658 H THR 84 H THR 84 -12.743 -2.227 0.109 659 HA THR 84 HA THR 84 -12.884 -0.274 -2.144 660 HB THR 84 HB THR 84 -14.714 -0.578 0.262 661 HG1 THR 84 1HG THR 84 -15.629 -1.216 -2.237 662 HG21 THR 84 1HG2 THR 84 -14.702 1.668 -0.775 663 HG22 THR 84 2HG2 THR 84 -16.236 0.839 -1.044 664 HG23 THR 84 3HG2 THR 84 -15.046 0.934 -2.342 665 H TRP 85 H TRP 85 -12.093 1.812 -1.818 666 HA TRP 85 HA TRP 85 -10.882 2.321 0.851 667 HB2 TRP 85 2HB TRP 85 -10.410 3.461 -1.898 668 HB3 TRP 85 1HB TRP 85 -9.792 4.266 -0.458 669 HD1 TRP 85 HD TRP 85 -9.852 0.550 -0.115 670 HE1 TRP 85 1HE TRP 85 -7.469 -0.395 -0.350 671 HE3 TRP 85 3HE TRP 85 -7.427 4.695 -1.854 672 HZ2 TRP 85 2HZ TRP 85 -4.875 0.486 -1.167 673 HZ3 TRP 85 3HZ TRP 85 -5.000 4.613 -2.352 674 HH2 TRP 85 HH TRP 85 -3.723 2.515 -2.011 675 H ARG 86 H ARG 86 -12.020 3.556 2.234 676 HA ARG 86 HA ARG 86 -13.765 5.710 1.098 677 HB2 ARG 86 2HB ARG 86 -15.001 3.924 2.317 678 HB3 ARG 86 1HB ARG 86 -14.041 4.269 3.755 679 HG2 ARG 86 2HG ARG 86 -14.893 6.569 3.796 680 HG3 ARG 86 1HG ARG 86 -15.818 6.267 2.325 681 HD2 ARG 86 2HD ARG 86 -17.333 6.020 4.184 682 HD3 ARG 86 1HD ARG 86 -17.001 4.405 3.560 683 HE ARG 86 HE ARG 86 -15.103 4.704 5.533 684 HH11 ARG 86 1HH1 ARG 86 -15.467 4.174 7.701 685 HH12 ARG 86 2HH1 ARG 86 -17.082 4.196 8.325 686 HH21 ARG 86 1HH2 ARG 86 -18.514 5.152 5.315 687 HH22 ARG 86 2HH2 ARG 86 -18.808 4.749 6.974 688 H ILE 87 H ILE 87 -12.429 7.504 1.215 689 HA ILE 87 HA ILE 87 -11.523 8.287 3.927 690 HB ILE 87 HB ILE 87 -9.620 7.125 2.739 691 HG12 ILE 87 2HG1 ILE 87 -9.041 10.067 3.123 692 HG13 ILE 87 1HG1 ILE 87 -9.446 9.030 4.490 693 HG21 ILE 87 1HG2 ILE 87 -8.683 8.013 0.785 694 HG22 ILE 87 2HG2 ILE 87 -9.430 9.592 1.028 695 HG23 ILE 87 3HG2 ILE 87 -10.409 8.226 0.494 696 HD11 ILE 87 1HD1 ILE 87 -7.457 7.739 2.834 697 HD12 ILE 87 2HD1 ILE 87 -7.360 8.193 4.535 698 HD13 ILE 87 3HD1 ILE 87 -6.913 9.352 3.287 699 H ASP 88 H ASP 88 -11.183 10.607 4.115 700 HA ASP 88 HA ASP 88 -12.792 12.112 2.136 701 HB2 ASP 88 2HB ASP 88 -13.182 12.361 4.610 702 HB3 ASP 88 1HB ASP 88 -11.580 13.088 4.738 703 H GLY 89 H GLY 89 -11.980 13.918 1.006 704 HA2 GLY 89 2HA GLY 89 -9.270 13.782 0.133 705 HA3 GLY 89 1HA GLY 89 -10.357 15.134 -0.166 706 H HIS 90 H HIS 90 -10.765 15.508 2.793 707 HA HIS 90 HA HIS 90 -8.400 17.202 3.205 708 HB2 HIS 90 2HB HIS 90 -10.951 16.837 4.775 709 HB3 HIS 90 1HB HIS 90 -9.688 17.980 5.205 710 HD1 HIS 90 1HD HIS 90 -8.950 19.107 2.462 711 HD2 HIS 90 2HD HIS 90 -12.886 18.495 3.691 712 HE1 HIS 90 1HE HIS 90 -10.390 20.642 1.048 713 HE2 HIS 90 2HE HIS 90 -12.788 20.275 1.786 714 H TRP 91 H TRP 91 -8.559 14.099 3.516 715 HA TRP 91 HA TRP 91 -7.573 12.502 4.919 716 HB2 TRP 91 2HB TRP 91 -6.067 15.016 5.375 717 HB3 TRP 91 1HB TRP 91 -5.877 13.774 6.612 718 HD1 TRP 91 HD TRP 91 -4.487 14.789 3.404 719 HE1 TRP 91 1HE TRP 91 -3.150 12.872 2.315 720 HE3 TRP 91 3HE TRP 91 -6.059 10.872 6.278 721 HZ2 TRP 91 2HZ TRP 91 -2.797 10.049 2.622 722 HZ3 TRP 91 3HZ TRP 91 -5.207 8.583 5.860 723 HH2 TRP 91 HH TRP 91 -3.579 8.167 4.037 724 H GLN 92 H GLN 92 -10.025 14.087 5.806 725 HA GLN 92 HA GLN 92 -9.737 14.025 8.742 726 HB2 GLN 92 2HB GLN 92 -12.102 14.692 6.971 727 HB3 GLN 92 1HB GLN 92 -12.095 14.816 8.731 728 HG2 GLN 92 2HG GLN 92 -10.214 16.297 6.870 729 HG3 GLN 92 1HG GLN 92 -11.620 16.996 7.664 730 HE21 GLN 92 1HE2 GLN 92 -8.410 17.101 7.971 731 HE22 GLN 92 2HE2 GLN 92 -8.240 17.132 9.659 732 H SER 93 H SER 93 -12.832 13.095 7.670 733 HA SER 93 HA SER 93 -12.269 10.210 7.730 734 HB2 SER 93 2HB SER 93 -13.405 9.700 9.725 735 HB3 SER 93 1HB SER 93 -12.487 11.138 10.154 736 HG SER 93 HG SER 93 -14.289 12.337 10.066 737 H VAL 94 H VAL 94 -14.153 8.963 7.063 738 HA VAL 94 HA VAL 94 -16.399 10.616 5.986 739 HB VAL 94 HB VAL 94 -16.130 8.479 4.220 740 HG11 VAL 94 1HG1 VAL 94 -15.324 10.287 2.661 741 HG12 VAL 94 2HG1 VAL 94 -15.208 11.361 4.055 742 HG13 VAL 94 3HG1 VAL 94 -16.776 10.716 3.565 743 HG21 VAL 94 1HG2 VAL 94 -13.414 9.713 4.778 744 HG22 VAL 94 2HG2 VAL 94 -13.792 8.550 3.508 745 HG23 VAL 94 3HG2 VAL 94 -13.873 8.064 5.201 746 HA PRO 95 HA PRO 95 -18.048 7.314 8.800 747 HB2 PRO 95 2HB PRO 95 -20.412 9.097 8.429 748 HB3 PRO 95 1HB PRO 95 -19.751 8.392 9.916 749 HG2 PRO 95 2HG PRO 95 -19.409 10.967 9.310 750 HG3 PRO 95 1HG PRO 95 -18.163 10.025 10.147 751 HD2 PRO 95 2HD PRO 95 -18.223 10.966 7.318 752 HD3 PRO 95 1HD PRO 95 -16.831 10.675 8.383 753 H ASP 96 H ASP 96 -19.013 8.483 5.663 754 HA ASP 96 HA ASP 96 -20.293 5.864 5.138 755 HB2 ASP 96 2HB ASP 96 -22.096 7.503 5.783 756 HB3 ASP 96 1HB ASP 96 -21.626 8.469 4.386 757 H ASP 97 H ASP 97 -20.133 5.252 2.928 758 HA ASP 97 HA ASP 97 -18.071 6.724 1.441 759 HB2 ASP 97 2HB ASP 97 -18.320 4.823 -0.187 760 HB3 ASP 97 1HB ASP 97 -17.919 4.306 1.451 761 H ASP 98 H ASP 98 -18.927 8.587 0.542 762 HA ASP 98 HA ASP 98 -21.567 8.547 -0.735 763 HB2 ASP 98 2HB ASP 98 -20.568 10.541 0.510 764 HB3 ASP 98 1HB ASP 98 -19.509 10.744 -0.882 765 H ARG 99 H ARG 99 -18.232 9.177 -1.794 766 HA ARG 99 HA ARG 99 -18.984 8.116 -4.483 767 HB2 ARG 99 2HB ARG 99 -17.187 10.474 -3.850 768 HB3 ARG 99 1HB ARG 99 -17.412 9.786 -5.458 769 HG2 ARG 99 2HG ARG 99 -19.858 10.244 -5.270 770 HG3 ARG 99 1HG ARG 99 -19.561 11.032 -3.719 771 HD2 ARG 99 2HD ARG 99 -17.956 12.576 -4.903 772 HD3 ARG 99 1HD ARG 99 -18.498 11.875 -6.428 773 HE ARG 99 HE ARG 99 -20.663 12.897 -4.733 774 HH11 ARG 99 1HH1 ARG 99 -21.809 14.633 -5.616 775 HH12 ARG 99 2HH1 ARG 99 -21.170 15.465 -6.994 776 HH21 ARG 99 1HH2 ARG 99 -18.333 13.483 -7.206 777 HH22 ARG 99 2HH2 ARG 99 -19.202 14.815 -7.893 778 H ALA 100 H ALA 100 -17.715 6.754 -2.174 779 HA ALA 100 HA ALA 100 -14.879 6.594 -2.569 780 HB1 ALA 100 1HB ALA 100 -16.261 5.723 -0.584 781 HB2 ALA 100 2HB ALA 100 -14.936 4.701 -1.138 782 HB3 ALA 100 3HB ALA 100 -16.595 4.313 -1.588 783 H SER 101 H SER 101 -13.645 5.093 -3.754 784 HA SER 101 HA SER 101 -15.118 3.782 -5.996 785 HB2 SER 101 2HB SER 101 -12.207 4.603 -5.780 786 HB3 SER 101 1HB SER 101 -12.947 3.842 -7.186 787 HG SER 101 HG SER 101 -13.377 5.833 -7.723 788 H GLU 102 H GLU 102 -14.162 1.677 -6.740 789 HA GLU 102 HA GLU 102 -13.243 0.095 -4.375 790 HB2 GLU 102 2HB GLU 102 -14.620 -0.846 -6.909 791 HB3 GLU 102 1HB GLU 102 -14.207 -1.851 -5.519 792 HG2 GLU 102 2HG GLU 102 -15.655 -0.418 -4.088 793 HG3 GLU 102 1HG GLU 102 -16.118 0.502 -5.518 794 H ILE 103 H ILE 103 -11.536 -1.373 -4.634 795 HA ILE 103 HA ILE 103 -9.850 -0.933 -7.069 796 HB ILE 103 HB ILE 103 -8.967 -1.638 -4.255 797 HG12 ILE 103 2HG1 ILE 103 -8.664 0.979 -5.758 798 HG13 ILE 103 1HG1 ILE 103 -9.895 0.687 -4.528 799 HG21 ILE 103 1HG2 ILE 103 -7.679 -1.700 -6.848 800 HG22 ILE 103 2HG2 ILE 103 -7.063 -2.244 -5.287 801 HG23 ILE 103 3HG2 ILE 103 -6.868 -0.559 -5.775 802 HD11 ILE 103 1HD1 ILE 103 -8.180 0.242 -2.854 803 HD12 ILE 103 2HD1 ILE 103 -7.865 1.808 -3.605 804 HD13 ILE 103 3HD1 ILE 103 -6.913 0.400 -4.071 805 H GLU 104 H GLU 104 -9.064 -2.781 -8.112 806 HA GLU 104 HA GLU 104 -9.989 -5.391 -6.966 807 HB2 GLU 104 2HB GLU 104 -10.969 -4.739 -9.181 808 HB3 GLU 104 1HB GLU 104 -9.340 -4.746 -9.856 809 HG2 GLU 104 2HG GLU 104 -9.093 -7.127 -9.148 810 HG3 GLU 104 1HG GLU 104 -10.767 -7.106 -8.591 811 H VAL 105 H VAL 105 -8.384 -6.663 -6.221 812 HA VAL 105 HA VAL 105 -5.692 -6.451 -7.494 813 HB VAL 105 HB VAL 105 -6.207 -6.891 -4.540 814 HG11 VAL 105 1HG1 VAL 105 -3.731 -6.291 -4.468 815 HG12 VAL 105 2HG1 VAL 105 -3.730 -6.465 -6.223 816 HG13 VAL 105 3HG1 VAL 105 -4.116 -7.849 -5.200 817 HG21 VAL 105 1HG2 VAL 105 -5.010 -4.501 -4.596 818 HG22 VAL 105 2HG2 VAL 105 -6.763 -4.653 -4.702 819 HG23 VAL 105 3HG2 VAL 105 -5.809 -4.415 -6.165 820 H ASP 106 H ASP 106 -4.975 -8.433 -8.186 821 HA ASP 106 HA ASP 106 -6.314 -10.845 -7.025 822 HB2 ASP 106 2HB ASP 106 -5.232 -10.383 -9.816 823 HB3 ASP 106 1HB ASP 106 -5.831 -11.933 -9.225 824 H PHE 107 H PHE 107 -4.984 -12.338 -6.096 825 HA PHE 107 HA PHE 107 -2.048 -12.059 -6.598 826 HB2 PHE 107 2HB PHE 107 -3.607 -12.285 -4.089 827 HB3 PHE 107 1HB PHE 107 -2.129 -13.248 -4.167 828 HD1 PHE 107 1HD PHE 107 0.057 -12.129 -4.670 829 HD2 PHE 107 2HD PHE 107 -3.540 -9.907 -3.914 830 HE1 PHE 107 1HE PHE 107 1.403 -10.087 -4.266 831 HE2 PHE 107 2HE PHE 107 -2.195 -7.865 -3.510 832 HZ PHE 107 HZ PHE 107 0.286 -7.960 -3.688 833 H VAL 108 H VAL 108 -1.279 -13.780 -7.661 834 HA VAL 108 HA VAL 108 -2.355 -16.478 -6.985 835 HB VAL 108 HB VAL 108 -2.919 -16.962 -9.149 836 HG11 VAL 108 1HG1 VAL 108 -4.020 -14.767 -8.638 837 HG12 VAL 108 2HG1 VAL 108 -3.774 -15.045 -10.361 838 HG13 VAL 108 3HG1 VAL 108 -2.699 -13.959 -9.481 839 HG21 VAL 108 1HG2 VAL 108 -0.539 -15.254 -9.938 840 HG22 VAL 108 2HG2 VAL 108 -1.623 -15.993 -11.113 841 HG23 VAL 108 3HG2 VAL 108 -0.677 -17.011 -10.030 842 HA PRO 109 HA PRO 109 1.891 -17.603 -6.568 843 HB2 PRO 109 2HB PRO 109 1.882 -20.105 -7.806 844 HB3 PRO 109 1HB PRO 109 1.436 -19.793 -6.120 845 HG2 PRO 109 2HG PRO 109 -0.286 -20.234 -8.481 846 HG3 PRO 109 1HG PRO 109 -0.558 -20.660 -6.783 847 HD2 PRO 109 2HD PRO 109 -1.806 -18.556 -7.995 848 HD3 PRO 109 1HD PRO 109 -1.426 -18.581 -6.258 849 H ASN 110 H ASN 110 3.629 -16.933 -7.747 850 HA ASN 110 HA ASN 110 3.536 -17.269 -10.713 851 HB2 ASN 110 2HB ASN 110 3.395 -14.889 -9.806 852 HB3 ASN 110 1HB ASN 110 5.048 -15.117 -9.241 853 HD21 ASN 110 1HD2 ASN 110 6.592 -14.418 -10.715 854 HD22 ASN 110 2HD2 ASN 110 6.388 -14.384 -12.400 855 H GLY 111 H GLY 111 4.999 -18.789 -11.331 856 HA2 GLY 111 2HA GLY 111 6.962 -20.078 -11.365 857 HA3 GLY 111 1HA GLY 111 7.770 -18.643 -10.731 858 H SER 112 H SER 112 8.970 -19.423 -9.031 859 HA SER 112 HA SER 112 7.466 -20.893 -6.905 860 HB2 SER 112 2HB SER 112 10.338 -21.336 -7.737 861 HB3 SER 112 1HB SER 112 9.525 -22.147 -6.404 862 HG SER 112 HG SER 112 8.109 -23.066 -7.892 863 H GLY 113 H GLY 113 7.745 -20.087 -4.848 864 HA2 GLY 113 2HA GLY 113 8.513 -18.686 -3.131 865 HA3 GLY 113 1HA GLY 113 10.034 -18.565 -4.014 866 H GLY 114 H GLY 114 7.289 -17.684 -5.877 867 HA2 GLY 114 2HA GLY 114 7.535 -14.832 -5.115 868 HA3 GLY 114 1HA GLY 114 7.925 -15.263 -6.778 869 H THR 115 H THR 115 5.765 -13.522 -5.969 870 HA THR 115 HA THR 115 3.486 -15.094 -7.074 871 HB THR 115 HB THR 115 3.275 -14.775 -4.581 872 HG1 THR 115 1HG THR 115 1.146 -13.688 -4.845 873 HG21 THR 115 1HG2 THR 115 3.438 -12.736 -3.612 874 HG22 THR 115 2HG2 THR 115 2.542 -11.947 -4.909 875 HG23 THR 115 3HG2 THR 115 4.264 -12.271 -5.098 876 H ARG 116 H ARG 116 2.191 -13.942 -8.517 877 HA ARG 116 HA ARG 116 3.153 -11.185 -9.190 878 HB2 ARG 116 2HB ARG 116 3.561 -12.917 -10.952 879 HB3 ARG 116 1HB ARG 116 1.822 -13.203 -11.025 880 HG2 ARG 116 2HG ARG 116 1.469 -10.821 -11.615 881 HG3 ARG 116 1HG ARG 116 3.214 -10.568 -11.588 882 HD2 ARG 116 2HD ARG 116 3.450 -12.328 -13.350 883 HD3 ARG 116 1HD ARG 116 1.691 -12.430 -13.433 884 HE ARG 116 HE ARG 116 2.191 -9.743 -13.827 885 HH11 ARG 116 1HH1 ARG 116 2.561 -8.844 -15.868 886 HH12 ARG 116 2HH1 ARG 116 3.184 -9.843 -17.139 887 HH21 ARG 116 1HH2 ARG 116 3.332 -12.701 -15.182 888 HH22 ARG 116 2HH2 ARG 116 3.620 -12.026 -16.751 889 H VAL 117 H VAL 117 1.656 -9.594 -8.954 890 HA VAL 117 HA VAL 117 -1.212 -10.410 -8.832 891 HB VAL 117 HB VAL 117 -0.784 -9.931 -6.594 892 HG11 VAL 117 1HG1 VAL 117 0.583 -7.784 -6.041 893 HG12 VAL 117 2HG1 VAL 117 1.136 -7.898 -7.712 894 HG13 VAL 117 3HG1 VAL 117 1.454 -9.217 -6.585 895 HG21 VAL 117 1HG2 VAL 117 -1.325 -7.110 -7.484 896 HG22 VAL 117 2HG2 VAL 117 -2.039 -8.003 -6.147 897 HG23 VAL 117 3HG2 VAL 117 -2.520 -8.364 -7.801 898 H GLU 118 H GLU 118 -2.688 -9.117 -9.821 899 HA GLU 118 HA GLU 118 -1.609 -6.863 -11.455 900 HB2 GLU 118 2HB GLU 118 -2.693 -8.673 -12.734 901 HB3 GLU 118 1HB GLU 118 -4.146 -8.511 -11.751 902 HG2 GLU 118 2HG GLU 118 -4.389 -6.161 -12.553 903 HG3 GLU 118 1HG GLU 118 -2.992 -6.399 -13.598 904 H LEU 119 H LEU 119 -2.070 -4.874 -10.627 905 HA LEU 119 HA LEU 119 -4.548 -4.589 -8.985 906 HB2 LEU 119 2HB LEU 119 -2.356 -4.270 -7.777 907 HB3 LEU 119 1HB LEU 119 -2.047 -2.886 -8.822 908 HG LEU 119 HG LEU 119 -4.694 -2.918 -7.473 909 HD11 LEU 119 1HD1 LEU 119 -3.779 -2.150 -5.341 910 HD12 LEU 119 2HD1 LEU 119 -2.135 -2.340 -5.950 911 HD13 LEU 119 3HD1 LEU 119 -3.153 -3.759 -5.701 912 HD21 LEU 119 1HD2 LEU 119 -4.450 -0.609 -7.591 913 HD22 LEU 119 2HD2 LEU 119 -3.450 -1.099 -8.957 914 HD23 LEU 119 3HD2 LEU 119 -2.697 -0.683 -7.419 915 H ALA 120 H ALA 120 -6.081 -3.360 -9.924 916 HA ALA 120 HA ALA 120 -5.206 -1.169 -11.754 917 HB1 ALA 120 1HB ALA 120 -7.390 -1.757 -13.033 918 HB2 ALA 120 2HB ALA 120 -7.268 -3.316 -12.218 919 HB3 ALA 120 3HB ALA 120 -5.975 -2.778 -13.290 920 H HIS 121 H HIS 121 -6.286 0.739 -11.452 921 HA HIS 121 HA HIS 121 -8.594 0.724 -9.544 922 HB2 HIS 121 2HB HIS 121 -7.540 2.259 -8.266 923 HB3 HIS 121 1HB HIS 121 -6.092 1.994 -9.236 924 HD1 HIS 121 1HD HIS 121 -9.362 3.918 -9.807 925 HD2 HIS 121 2HD HIS 121 -5.243 4.409 -10.248 926 HE1 HIS 121 1HE HIS 121 -9.018 6.214 -10.819 927 HE2 HIS 121 2HE HIS 121 -6.515 6.532 -11.066 928 H VAL 122 H VAL 122 -10.402 1.865 -10.220 929 HA VAL 122 HA VAL 122 -10.109 3.585 -12.632 930 HB VAL 122 HB VAL 122 -12.137 2.554 -13.617 931 HG11 VAL 122 1HG1 VAL 122 -10.314 0.246 -13.091 932 HG12 VAL 122 2HG1 VAL 122 -9.617 1.686 -13.835 933 HG13 VAL 122 3HG1 VAL 122 -10.953 0.845 -14.622 934 HG21 VAL 122 1HG2 VAL 122 -11.904 0.891 -11.119 935 HG22 VAL 122 2HG2 VAL 122 -12.643 0.207 -12.568 936 HG23 VAL 122 3HG2 VAL 122 -13.338 1.645 -11.818 937 H LYS 123 H LYS 123 -11.626 5.245 -12.769 938 HA LYS 123 HA LYS 123 -13.099 6.867 -11.966 939 HB2 LYS 123 2HB LYS 123 -14.356 4.471 -10.605 940 HB3 LYS 123 1HB LYS 123 -15.126 6.034 -10.863 941 HG2 LYS 123 2HG LYS 123 -14.831 5.751 -13.314 942 HG3 LYS 123 1HG LYS 123 -14.144 4.152 -13.025 943 HD2 LYS 123 2HD LYS 123 -16.263 3.522 -11.843 944 HD3 LYS 123 1HD LYS 123 -16.944 5.074 -12.330 945 HE2 LYS 123 2HE LYS 123 -16.424 4.451 -14.724 946 HE3 LYS 123 1HE LYS 123 -16.000 2.839 -14.144 947 HZ1 LYS 123 1HZ LYS 123 -18.460 3.557 -14.887 948 HZ2 LYS 123 2HZ LYS 123 -18.547 3.865 -13.219 949 HZ3 LYS 123 3HZ LYS 123 -18.137 2.314 -13.779 950 H LEU 124 H LEU 124 -10.677 6.182 -10.286 951 HA LEU 124 HA LEU 124 -11.480 6.397 -7.513 952 HB2 LEU 124 2HB LEU 124 -9.214 5.606 -8.219 953 HB3 LEU 124 1HB LEU 124 -8.856 7.238 -8.788 954 HG LEU 124 HG LEU 124 -9.405 8.039 -6.424 955 HD11 LEU 124 1HD1 LEU 124 -10.200 6.537 -4.953 956 HD12 LEU 124 2HD1 LEU 124 -8.696 5.627 -5.088 957 HD13 LEU 124 3HD1 LEU 124 -10.049 5.254 -6.152 958 HD21 LEU 124 1HD2 LEU 124 -7.068 6.134 -6.768 959 HD22 LEU 124 2HD2 LEU 124 -7.174 7.443 -5.590 960 HD23 LEU 124 3HD2 LEU 124 -7.098 7.812 -7.314 961 H HIS 125 H HIS 125 -10.661 8.676 -10.062 962 HA HIS 125 HA HIS 125 -10.598 11.055 -8.510 963 HB2 HIS 125 2HB HIS 125 -9.785 11.066 -10.786 964 HB3 HIS 125 1HB HIS 125 -11.374 10.607 -11.393 965 HD1 HIS 125 1HD HIS 125 -10.810 13.181 -8.693 966 HD2 HIS 125 2HD HIS 125 -11.973 13.036 -12.696 967 HE1 HIS 125 1HE HIS 125 -11.641 15.497 -9.281 968 HE2 HIS 125 2HE HIS 125 -12.341 15.427 -11.719 969 H ARG 126 H ARG 126 -13.254 9.037 -9.373 970 HA ARG 126 HA ARG 126 -15.392 10.773 -9.659 971 HB2 ARG 126 2HB ARG 126 -16.798 9.045 -8.772 972 HB3 ARG 126 1HB ARG 126 -15.465 8.236 -9.590 973 HG2 ARG 126 2HG ARG 126 -14.290 8.091 -7.365 974 HG3 ARG 126 1HG ARG 126 -15.764 8.697 -6.615 975 HD2 ARG 126 2HD ARG 126 -15.484 6.153 -8.236 976 HD3 ARG 126 1HD ARG 126 -15.775 6.268 -6.500 977 HE ARG 126 HE ARG 126 -17.809 7.613 -8.112 978 HH11 ARG 126 1HH1 ARG 126 -19.869 6.688 -8.017 979 HH12 ARG 126 2HH1 ARG 126 -20.061 5.098 -7.358 980 HH21 ARG 126 1HH2 ARG 126 -16.685 4.687 -6.678 981 HH22 ARG 126 2HH2 ARG 126 -18.258 3.964 -6.599 982 H HIS 127 H HIS 127 -13.518 10.139 -6.745 983 HA HIS 127 HA HIS 127 -15.314 11.287 -4.856 984 HB2 HIS 127 2HB HIS 127 -12.468 10.580 -4.948 985 HB3 HIS 127 1HB HIS 127 -12.798 11.974 -3.924 986 HD1 HIS 127 1HD HIS 127 -15.700 10.946 -3.038 987 HD2 HIS 127 2HD HIS 127 -12.143 8.777 -2.785 988 HE1 HIS 127 1HE HIS 127 -16.056 9.189 -1.246 989 HE2 HIS 127 2HE HIS 127 -13.899 7.864 -1.086 990 H GLY 128 H GLY 128 -12.778 12.762 -6.848 991 HA2 GLY 128 2HA GLY 128 -12.230 15.039 -7.142 992 HA3 GLY 128 1HA GLY 128 -13.966 15.170 -7.426 993 H ASP 129 H ASP 129 -13.093 14.086 -4.291 994 HA ASP 129 HA ASP 129 -13.903 16.726 -3.187 995 HB2 ASP 129 2HB ASP 129 -14.375 15.507 -1.118 996 HB3 ASP 129 1HB ASP 129 -15.174 14.707 -2.471 997 H GLY 130 H GLY 130 -11.118 15.577 -4.128 998 HA2 GLY 130 2HA GLY 130 -9.034 16.650 -3.430 999 HA3 GLY 130 1HA GLY 130 -9.654 16.687 -1.779 1000 H ALA 131 H ALA 131 -10.459 13.757 -3.192 1001 HA ALA 131 HA ALA 131 -8.865 12.189 -1.452 1002 HB1 ALA 131 1HB ALA 131 -10.369 11.630 -3.991 1003 HB2 ALA 131 2HB ALA 131 -10.656 11.007 -2.366 1004 HB3 ALA 131 3HB ALA 131 -9.314 10.383 -3.325 1005 H TRP 132 H TRP 132 -8.180 13.514 -4.636 1006 HA TRP 132 HA TRP 132 -5.943 11.957 -5.360 1007 HB2 TRP 132 2HB TRP 132 -6.815 13.565 -6.918 1008 HB3 TRP 132 1HB TRP 132 -6.549 14.890 -5.789 1009 HD1 TRP 132 HD TRP 132 -4.545 16.271 -6.401 1010 HE1 TRP 132 1HE TRP 132 -2.248 15.852 -7.491 1011 HE3 TRP 132 3HE TRP 132 -4.864 11.241 -7.231 1012 HZ2 TRP 132 2HZ TRP 132 -0.748 13.674 -8.571 1013 HZ3 TRP 132 3HZ TRP 132 -2.988 10.025 -8.286 1014 HH2 TRP 132 HH TRP 132 -0.936 11.231 -8.962 1015 H ASN 133 H ASN 133 -6.188 14.697 -3.128 1016 HA ASN 133 HA ASN 133 -3.395 15.014 -2.620 1017 HB2 ASN 133 2HB ASN 133 -5.822 15.517 -0.874 1018 HB3 ASN 133 1HB ASN 133 -4.188 16.020 -0.455 1019 HD21 ASN 133 1HD2 ASN 133 -6.264 17.950 -0.855 1020 HD22 ASN 133 2HD2 ASN 133 -5.909 18.839 -2.256 1021 H ILE 134 H ILE 134 -5.857 12.910 -1.157 1022 HA ILE 134 HA ILE 134 -4.258 11.868 0.950 1023 HB ILE 134 HB ILE 134 -6.611 10.838 -0.591 1024 HG12 ILE 134 2HG1 ILE 134 -7.712 11.055 1.545 1025 HG13 ILE 134 1HG1 ILE 134 -6.170 11.292 2.368 1026 HG21 ILE 134 1HG2 ILE 134 -6.585 8.889 1.068 1027 HG22 ILE 134 2HG2 ILE 134 -4.888 9.287 1.342 1028 HG23 ILE 134 3HG2 ILE 134 -5.434 8.799 -0.263 1029 HD11 ILE 134 1HD1 ILE 134 -7.562 13.397 1.850 1030 HD12 ILE 134 2HD1 ILE 134 -7.079 13.150 0.173 1031 HD13 ILE 134 3HD1 ILE 134 -5.855 13.432 1.411 1032 H HIS 135 H HIS 135 -4.644 10.793 -2.421 1033 HA HIS 135 HA HIS 135 -2.904 8.530 -2.236 1034 HB2 HIS 135 2HB HIS 135 -4.363 8.867 -4.177 1035 HB3 HIS 135 1HB HIS 135 -3.512 10.355 -4.585 1036 HD1 HIS 135 1HD HIS 135 -0.862 8.369 -3.505 1037 HD2 HIS 135 2HD HIS 135 -3.234 8.223 -6.930 1038 HE1 HIS 135 1HE HIS 135 0.482 7.126 -5.249 1039 HE2 HIS 135 2HE HIS 135 -0.959 7.012 -7.335 1040 H LYS 136 H LYS 136 -2.327 11.964 -2.917 1041 HA LYS 136 HA LYS 136 0.413 11.838 -3.579 1042 HB2 LYS 136 2HB LYS 136 -1.024 13.893 -3.668 1043 HB3 LYS 136 1HB LYS 136 -0.926 13.976 -1.917 1044 HG2 LYS 136 2HG LYS 136 1.533 14.105 -2.075 1045 HG3 LYS 136 1HG LYS 136 1.402 14.095 -3.830 1046 HD2 LYS 136 2HD LYS 136 -0.023 16.148 -3.684 1047 HD3 LYS 136 1HD LYS 136 0.285 16.190 -1.949 1048 HE2 LYS 136 2HE LYS 136 2.438 16.262 -4.082 1049 HE3 LYS 136 1HE LYS 136 1.829 17.676 -3.222 1050 HZ1 LYS 136 1HZ LYS 136 2.456 16.484 -1.127 1051 HZ2 LYS 136 2HZ LYS 136 3.761 16.974 -2.096 1052 HZ3 LYS 136 3HZ LYS 136 3.269 15.348 -2.089 1053 H ALA 137 H ALA 137 -1.175 11.901 -0.409 1054 HA ALA 137 HA ALA 137 1.274 11.993 1.112 1055 HB1 ALA 137 1HB ALA 137 -0.609 10.706 2.714 1056 HB2 ALA 137 2HB ALA 137 -1.582 11.725 1.652 1057 HB3 ALA 137 3HB ALA 137 -0.320 12.445 2.650 1058 H LEU 138 H LEU 138 -0.778 9.360 -0.088 1059 HA LEU 138 HA LEU 138 0.853 7.297 1.184 1060 HB2 LEU 138 2HB LEU 138 -1.200 7.032 -1.028 1061 HB3 LEU 138 1HB LEU 138 -0.584 5.737 -0.015 1062 HG LEU 138 HG LEU 138 -2.230 8.110 0.888 1063 HD11 LEU 138 1HD1 LEU 138 -3.149 5.427 1.563 1064 HD12 LEU 138 2HD1 LEU 138 -2.988 5.637 -0.180 1065 HD13 LEU 138 3HD1 LEU 138 -4.015 6.730 0.749 1066 HD21 LEU 138 1HD2 LEU 138 -0.649 6.022 2.346 1067 HD22 LEU 138 2HD2 LEU 138 -2.142 6.625 3.066 1068 HD23 LEU 138 3HD2 LEU 138 -0.821 7.738 2.707 1069 H ASP 139 H ASP 139 1.299 9.303 -1.432 1070 HA ASP 139 HA ASP 139 2.293 7.637 -3.482 1071 HB2 ASP 139 2HB ASP 139 1.984 10.155 -3.562 1072 HB3 ASP 139 1HB ASP 139 3.510 10.289 -2.692 1073 H GLY 140 H GLY 140 3.898 8.801 -0.543 1074 HA2 GLY 140 2HA GLY 140 5.970 8.204 0.398 1075 HA3 GLY 140 1HA GLY 140 5.596 6.599 -0.227 1076 HA PRO 141 HA PRO 141 9.404 8.572 -2.316 1077 HB2 PRO 141 2HB PRO 141 11.022 6.382 -1.699 1078 HB3 PRO 141 1HB PRO 141 10.986 7.915 -0.811 1079 HG2 PRO 141 2HG PRO 141 9.701 5.324 -0.167 1080 HG3 PRO 141 1HG PRO 141 10.378 6.554 0.912 1081 HD2 PRO 141 2HD PRO 141 7.700 6.248 0.563 1082 HD3 PRO 141 1HD PRO 141 8.439 7.827 0.906 1083 H SER 142 H SER 142 10.260 7.847 -4.339 1084 HA SER 142 HA SER 142 10.188 6.671 -6.369 1085 HB2 SER 142 2HB SER 142 11.069 4.881 -4.704 1086 HB3 SER 142 1HB SER 142 9.438 4.220 -4.779 1087 HG SER 142 HG SER 142 11.307 4.586 -6.877 1088 HA PRO 143 HA PRO 143 5.497 7.058 -5.987 1089 HB2 PRO 143 2HB PRO 143 6.006 8.703 -8.406 1090 HB3 PRO 143 1HB PRO 143 4.994 9.054 -6.995 1091 HG2 PRO 143 2HG PRO 143 7.350 10.261 -7.400 1092 HG3 PRO 143 1HG PRO 143 6.736 9.891 -5.781 1093 HD2 PRO 143 2HD PRO 143 8.906 8.543 -7.323 1094 HD3 PRO 143 1HD PRO 143 8.721 8.745 -5.567 1095 H GLY 144 H GLY 144 4.054 5.822 -7.197 1096 HA2 GLY 144 2HA GLY 144 4.066 5.179 -9.886 1097 HA3 GLY 144 1HA GLY 144 5.178 4.007 -9.176 1098 H GLU 145 H GLU 145 3.310 2.583 -10.077 1099 HA GLU 145 HA GLU 145 0.752 2.479 -8.899 1100 HB2 GLU 145 2HB GLU 145 2.503 0.158 -9.771 1101 HB3 GLU 145 1HB GLU 145 0.763 0.077 -9.499 1102 HG2 GLU 145 2HG GLU 145 0.858 0.429 -11.805 1103 HG3 GLU 145 1HG GLU 145 0.679 2.075 -11.199 1104 H THR 146 H THR 146 -0.060 1.245 -7.097 1105 HA THR 146 HA THR 146 1.453 1.409 -4.711 1106 HB THR 146 HB THR 146 -0.889 -0.377 -5.383 1107 HG1 THR 146 1HG THR 146 -1.882 1.445 -5.268 1108 HG21 THR 146 1HG2 THR 146 -1.142 -0.192 -2.787 1109 HG22 THR 146 2HG2 THR 146 0.585 0.164 -2.825 1110 HG23 THR 146 3HG2 THR 146 -0.014 -1.369 -3.460 1111 H LEU 147 H LEU 147 1.039 -1.280 -6.981 1112 HA LEU 147 HA LEU 147 2.281 -3.297 -5.428 1113 HB2 LEU 147 2HB LEU 147 2.428 -2.953 -8.435 1114 HB3 LEU 147 1HB LEU 147 2.636 -4.453 -7.529 1115 HG LEU 147 HG LEU 147 0.107 -2.791 -7.611 1116 HD11 LEU 147 1HD1 LEU 147 1.143 -5.045 -9.201 1117 HD12 LEU 147 2HD1 LEU 147 -0.140 -3.897 -9.580 1118 HD13 LEU 147 3HD1 LEU 147 -0.480 -5.295 -8.564 1119 HD21 LEU 147 1HD2 LEU 147 -0.642 -5.138 -6.551 1120 HD22 LEU 147 2HD2 LEU 147 -0.059 -3.812 -5.546 1121 HD23 LEU 147 3HD2 LEU 147 1.030 -5.125 -5.992 1122 H ALA 148 H ALA 148 3.650 -0.722 -7.419 1123 HA ALA 148 HA ALA 148 6.342 -1.684 -7.465 1124 HB1 ALA 148 1HB ALA 148 5.945 1.248 -7.288 1125 HB2 ALA 148 2HB ALA 148 5.073 0.439 -8.590 1126 HB3 ALA 148 3HB ALA 148 6.828 0.304 -8.486 1127 H ARG 149 H ARG 149 4.783 0.683 -5.285 1128 HA ARG 149 HA ARG 149 7.046 0.939 -3.544 1129 HB2 ARG 149 2HB ARG 149 4.099 1.396 -3.049 1130 HB3 ARG 149 1HB ARG 149 5.381 1.891 -1.952 1131 HG2 ARG 149 2HG ARG 149 6.359 3.312 -3.693 1132 HG3 ARG 149 1HG ARG 149 5.120 2.788 -4.833 1133 HD2 ARG 149 2HD ARG 149 4.449 4.932 -3.938 1134 HD3 ARG 149 1HD ARG 149 3.384 3.705 -3.260 1135 HE ARG 149 HE ARG 149 5.462 5.203 -1.784 1136 HH11 ARG 149 1HH1 ARG 149 5.303 5.007 0.460 1137 HH12 ARG 149 2HH1 ARG 149 4.236 3.825 1.140 1138 HH21 ARG 149 1HH2 ARG 149 3.151 2.638 -1.927 1139 HH22 ARG 149 2HH2 ARG 149 3.021 2.487 -0.208 1140 H PHE 150 H PHE 150 4.164 -1.124 -3.473 1141 HA PHE 150 HA PHE 150 4.695 -2.354 -0.940 1142 HB2 PHE 150 2HB PHE 150 2.500 -2.497 -2.026 1143 HB3 PHE 150 1HB PHE 150 3.203 -3.407 -3.361 1144 HD1 PHE 150 1HD PHE 150 3.680 -5.737 -3.180 1145 HD2 PHE 150 2HD PHE 150 2.429 -3.510 0.272 1146 HE1 PHE 150 1HE PHE 150 3.362 -7.854 -1.933 1147 HE2 PHE 150 2HE PHE 150 2.109 -5.630 1.521 1148 HZ PHE 150 HZ PHE 150 2.581 -7.801 0.416 1149 H ALA 151 H ALA 151 5.589 -3.268 -4.267 1150 HA ALA 151 HA ALA 151 6.854 -5.739 -3.514 1151 HB1 ALA 151 1HB ALA 151 6.106 -5.048 -5.848 1152 HB2 ALA 151 2HB ALA 151 7.699 -5.796 -5.751 1153 HB3 ALA 151 3HB ALA 151 7.555 -4.047 -5.919 1154 H ASN 152 H ASN 152 8.106 -2.438 -3.965 1155 HA ASN 152 HA ASN 152 10.863 -3.087 -3.677 1156 HB2 ASN 152 2HB ASN 152 9.382 -0.557 -2.951 1157 HB3 ASN 152 1HB ASN 152 11.137 -0.694 -3.038 1158 HD21 ASN 152 1HD2 ASN 152 9.703 1.093 -4.760 1159 HD22 ASN 152 2HD2 ASN 152 9.835 0.520 -6.353 1160 H VAL 153 H VAL 153 8.528 -1.977 -1.209 1161 HA VAL 153 HA VAL 153 10.411 -2.249 0.953 1162 HB VAL 153 HB VAL 153 8.445 -1.958 2.402 1163 HG11 VAL 153 1HG1 VAL 153 9.510 -0.030 1.134 1164 HG12 VAL 153 2HG1 VAL 153 7.846 0.240 1.651 1165 HG13 VAL 153 3HG1 VAL 153 8.191 -0.176 -0.028 1166 HG21 VAL 153 1HG2 VAL 153 7.009 -2.543 -0.171 1167 HG22 VAL 153 2HG2 VAL 153 6.237 -1.558 1.070 1168 HG23 VAL 153 3HG2 VAL 153 6.719 -3.214 1.432 1169 H ILE 154 H ILE 154 8.170 -4.452 -0.612 1170 HA ILE 154 HA ILE 154 8.402 -6.458 1.509 1171 HB ILE 154 HB ILE 154 7.085 -6.371 -1.192 1172 HG12 ILE 154 2HG1 ILE 154 6.218 -5.409 1.140 1173 HG13 ILE 154 1HG1 ILE 154 5.121 -6.175 -0.002 1174 HG21 ILE 154 1HG2 ILE 154 6.162 -8.663 -0.459 1175 HG22 ILE 154 2HG2 ILE 154 7.565 -8.726 0.612 1176 HG23 ILE 154 3HG2 ILE 154 7.792 -8.608 -1.133 1177 HD11 ILE 154 1HD1 ILE 154 5.097 -8.211 1.206 1178 HD12 ILE 154 2HD1 ILE 154 5.020 -6.968 2.455 1179 HD13 ILE 154 3HD1 ILE 154 6.547 -7.781 2.114 Start of MODEL 3 1 H1 MET 1 1HT MET 1 4.063 13.197 -4.569 2 H2 MET 1 2HT MET 1 2.604 12.326 -4.541 3 H3 MET 1 3HT MET 1 2.670 13.901 -3.905 4 HA MET 1 HA MET 1 1.617 14.052 -6.011 5 HB2 MET 1 2HB MET 1 3.394 15.754 -5.381 6 HB3 MET 1 1HB MET 1 4.511 14.850 -6.404 7 HG2 MET 1 2HG MET 1 2.290 15.137 -8.029 8 HG3 MET 1 1HG MET 1 2.347 16.675 -7.169 9 HE1 MET 1 1HE MET 1 3.729 16.913 -10.786 10 HE2 MET 1 2HE MET 1 3.291 18.203 -9.668 11 HE3 MET 1 3HE MET 1 2.289 16.757 -9.770 12 HA PRO 2 HA PRO 2 3.340 10.500 -8.353 13 HB2 PRO 2 2HB PRO 2 1.001 9.061 -8.457 14 HB3 PRO 2 1HB PRO 2 2.187 8.921 -7.148 15 HG2 PRO 2 2HG PRO 2 -0.470 10.076 -7.099 16 HG3 PRO 2 1HG PRO 2 0.605 9.673 -5.753 17 HD2 PRO 2 2HD PRO 2 0.099 12.281 -6.956 18 HD3 PRO 2 1HD PRO 2 1.011 11.896 -5.477 19 H GLU 3 H GLU 3 2.584 9.662 -10.547 20 HA GLU 3 HA GLU 3 1.992 11.670 -12.367 21 HB2 GLU 3 2HB GLU 3 0.980 8.822 -12.554 22 HB3 GLU 3 1HB GLU 3 1.239 9.924 -13.903 23 HG2 GLU 3 2HG GLU 3 3.662 10.033 -13.286 24 HG3 GLU 3 1HG GLU 3 3.364 8.815 -12.044 25 H GLU 4 H GLU 4 -0.031 12.402 -13.346 26 HA GLU 4 HA GLU 4 -2.111 13.007 -11.582 27 HB2 GLU 4 2HB GLU 4 -2.355 12.527 -14.570 28 HB3 GLU 4 1HB GLU 4 -3.524 13.396 -13.575 29 HG2 GLU 4 2HG GLU 4 -1.752 15.027 -12.957 30 HG3 GLU 4 1HG GLU 4 -0.631 14.185 -14.029 31 H ILE 5 H ILE 5 -4.208 12.027 -11.224 32 HA ILE 5 HA ILE 5 -4.255 9.347 -10.624 33 HB ILE 5 HB ILE 5 -6.777 10.412 -11.803 34 HG12 ILE 5 2HG1 ILE 5 -5.215 11.683 -9.569 35 HG13 ILE 5 1HG1 ILE 5 -6.102 12.455 -10.876 36 HG21 ILE 5 1HG2 ILE 5 -6.354 8.254 -10.380 37 HG22 ILE 5 2HG2 ILE 5 -7.765 9.251 -10.027 38 HG23 ILE 5 3HG2 ILE 5 -6.323 9.374 -9.018 39 HD11 ILE 5 1HD1 ILE 5 -7.145 11.257 -8.335 40 HD12 ILE 5 2HD1 ILE 5 -8.178 11.260 -9.762 41 HD13 ILE 5 3HD1 ILE 5 -7.576 12.782 -9.107 42 HA PRO 6 HA PRO 6 -4.212 7.831 -14.941 43 HB2 PRO 6 2HB PRO 6 -2.882 5.530 -14.498 44 HB3 PRO 6 1HB PRO 6 -2.047 7.096 -14.508 45 HG2 PRO 6 2HG PRO 6 -2.834 5.391 -12.218 46 HG3 PRO 6 1HG PRO 6 -1.419 6.432 -12.417 47 HD2 PRO 6 2HD PRO 6 -3.759 7.077 -10.989 48 HD3 PRO 6 1HD PRO 6 -2.494 8.216 -11.490 49 H ASP 7 H ASP 7 -5.403 6.102 -16.007 50 HA ASP 7 HA ASP 7 -7.698 5.160 -14.542 51 HB2 ASP 7 2HB ASP 7 -7.624 5.565 -17.029 52 HB3 ASP 7 1HB ASP 7 -6.649 4.103 -17.183 53 H VAL 8 H VAL 8 -7.205 2.439 -16.123 54 HA VAL 8 HA VAL 8 -6.751 0.802 -13.882 55 HB VAL 8 HB VAL 8 -6.322 -0.995 -15.478 56 HG11 VAL 8 1HG1 VAL 8 -8.228 -0.086 -17.232 57 HG12 VAL 8 2HG1 VAL 8 -8.489 0.966 -15.842 58 HG13 VAL 8 3HG1 VAL 8 -8.577 -0.784 -15.651 59 HG21 VAL 8 1HG2 VAL 8 -5.876 1.307 -17.391 60 HG22 VAL 8 2HG2 VAL 8 -6.179 -0.341 -17.941 61 HG23 VAL 8 3HG2 VAL 8 -4.749 0.017 -16.973 62 H ARG 9 H ARG 9 -4.893 -0.033 -12.915 63 HA ARG 9 HA ARG 9 -2.378 1.323 -13.634 64 HB2 ARG 9 2HB ARG 9 -3.007 -0.513 -11.327 65 HB3 ARG 9 1HB ARG 9 -1.511 0.385 -11.535 66 HG2 ARG 9 2HG ARG 9 -4.232 1.702 -11.417 67 HG3 ARG 9 1HG ARG 9 -3.224 1.451 -10.001 68 HD2 ARG 9 2HD ARG 9 -2.611 3.151 -12.416 69 HD3 ARG 9 1HD ARG 9 -2.756 3.664 -10.739 70 HE ARG 9 HE ARG 9 -0.673 1.931 -10.570 71 HH11 ARG 9 1HH1 ARG 9 1.485 2.434 -11.022 72 HH12 ARG 9 2HH1 ARG 9 1.849 3.699 -12.147 73 HH21 ARG 9 1HH2 ARG 9 -1.473 4.437 -12.802 74 HH22 ARG 9 2HH2 ARG 9 0.177 4.831 -13.155 75 H LYS 10 H LYS 10 -0.669 -0.807 -12.594 76 HA LYS 10 HA LYS 10 -0.901 -2.757 -14.846 77 HB2 LYS 10 2HB LYS 10 1.530 -1.370 -13.707 78 HB3 LYS 10 1HB LYS 10 1.620 -2.748 -14.794 79 HG2 LYS 10 2HG LYS 10 0.280 -1.490 -16.463 80 HG3 LYS 10 1HG LYS 10 0.295 -0.093 -15.386 81 HD2 LYS 10 2HD LYS 10 2.791 -0.118 -15.453 82 HD3 LYS 10 1HD LYS 10 2.715 -1.431 -16.630 83 HE2 LYS 10 2HE LYS 10 2.813 0.345 -18.094 84 HE3 LYS 10 1HE LYS 10 1.067 0.286 -17.857 85 HZ1 LYS 10 1HZ LYS 10 2.837 1.918 -16.137 86 HZ2 LYS 10 2HZ LYS 10 1.151 2.026 -16.314 87 HZ3 LYS 10 3HZ LYS 10 2.174 2.522 -17.577 88 H SER 11 H SER 11 0.976 -4.519 -14.314 89 HA SER 11 HA SER 11 0.424 -5.498 -11.536 90 HB2 SER 11 2HB SER 11 0.384 -7.754 -12.392 91 HB3 SER 11 1HB SER 11 -0.698 -6.795 -13.393 92 HG SER 11 HG SER 11 0.509 -7.683 -14.905 93 H VAL 12 H VAL 12 2.191 -6.571 -10.494 94 HA VAL 12 HA VAL 12 4.794 -6.508 -11.923 95 HB VAL 12 HB VAL 12 4.172 -5.136 -9.319 96 HG11 VAL 12 1HG1 VAL 12 6.132 -6.262 -8.714 97 HG12 VAL 12 2HG1 VAL 12 6.771 -4.772 -9.407 98 HG13 VAL 12 3HG1 VAL 12 6.757 -6.254 -10.363 99 HG21 VAL 12 1HG2 VAL 12 5.376 -3.277 -10.467 100 HG22 VAL 12 2HG2 VAL 12 3.940 -3.795 -11.351 101 HG23 VAL 12 3HG2 VAL 12 5.540 -4.306 -11.891 102 H VAL 13 H VAL 13 6.348 -7.981 -11.066 103 HA VAL 13 HA VAL 13 5.112 -10.118 -9.398 104 HB VAL 13 HB VAL 13 7.678 -10.208 -11.017 105 HG11 VAL 13 1HG1 VAL 13 6.503 -11.956 -9.064 106 HG12 VAL 13 2HG1 VAL 13 7.992 -12.180 -9.980 107 HG13 VAL 13 3HG1 VAL 13 6.458 -12.752 -10.637 108 HG21 VAL 13 1HG2 VAL 13 5.254 -11.705 -11.868 109 HG22 VAL 13 2HG2 VAL 13 6.490 -10.919 -12.848 110 HG23 VAL 13 3HG2 VAL 13 5.209 -9.959 -12.111 111 H VAL 14 H VAL 14 5.806 -10.392 -7.327 112 HA VAL 14 HA VAL 14 8.357 -9.053 -6.524 113 HB VAL 14 HB VAL 14 5.978 -9.370 -4.718 114 HG11 VAL 14 1HG1 VAL 14 7.101 -7.682 -3.397 115 HG12 VAL 14 2HG1 VAL 14 8.310 -7.444 -4.658 116 HG13 VAL 14 3HG1 VAL 14 8.258 -8.962 -3.761 117 HG21 VAL 14 1HG2 VAL 14 6.675 -7.082 -6.575 118 HG22 VAL 14 2HG2 VAL 14 5.565 -6.920 -5.214 119 HG23 VAL 14 3HG2 VAL 14 5.177 -8.011 -6.545 120 H ALA 15 H ALA 15 9.548 -10.130 -4.866 121 HA ALA 15 HA ALA 15 9.189 -13.035 -4.893 122 HB1 ALA 15 1HB ALA 15 11.167 -11.613 -3.132 123 HB2 ALA 15 2HB ALA 15 11.422 -11.654 -4.878 124 HB3 ALA 15 3HB ALA 15 11.331 -13.160 -3.964 125 H ALA 16 H ALA 16 7.289 -13.438 -3.720 126 HA ALA 16 HA ALA 16 7.578 -13.496 -0.834 127 HB1 ALA 16 1HB ALA 16 6.832 -11.285 -0.718 128 HB2 ALA 16 2HB ALA 16 5.311 -12.172 -0.617 129 HB3 ALA 16 3HB ALA 16 5.812 -11.450 -2.147 130 H SER 17 H SER 17 6.117 -15.002 0.060 131 HA SER 17 HA SER 17 4.839 -16.795 -1.828 132 HB2 SER 17 2HB SER 17 4.267 -18.117 0.082 133 HB3 SER 17 1HB SER 17 5.850 -17.430 0.432 134 HG SER 17 HG SER 17 3.543 -16.016 1.166 135 H VAL 18 H VAL 18 2.501 -17.293 -1.812 136 HA VAL 18 HA VAL 18 0.878 -14.961 -2.040 137 HB VAL 18 HB VAL 18 -0.562 -17.466 -1.429 138 HG11 VAL 18 1HG1 VAL 18 -0.538 -15.998 -4.049 139 HG12 VAL 18 2HG1 VAL 18 -1.289 -15.243 -2.644 140 HG13 VAL 18 3HG1 VAL 18 -1.882 -16.797 -3.234 141 HG21 VAL 18 1HG2 VAL 18 1.249 -18.638 -2.383 142 HG22 VAL 18 2HG2 VAL 18 1.617 -17.334 -3.513 143 HG23 VAL 18 3HG2 VAL 18 0.195 -18.344 -3.765 144 H GLU 19 H GLU 19 1.242 -17.335 0.575 145 HA GLU 19 HA GLU 19 -0.780 -16.307 2.299 146 HB2 GLU 19 2HB GLU 19 1.851 -17.654 2.976 147 HB3 GLU 19 1HB GLU 19 0.535 -17.391 4.121 148 HG2 GLU 19 2HG GLU 19 -0.975 -18.715 2.657 149 HG3 GLU 19 1HG GLU 19 0.380 -19.026 1.571 150 H HIS 20 H HIS 20 2.569 -15.366 1.753 151 HA HIS 20 HA HIS 20 2.882 -13.572 3.930 152 HB2 HIS 20 2HB HIS 20 4.652 -14.456 2.312 153 HB3 HIS 20 1HB HIS 20 4.083 -13.234 1.174 154 HD1 HIS 20 1HD HIS 20 4.974 -13.218 4.889 155 HD2 HIS 20 2HD HIS 20 5.636 -10.980 1.432 156 HE1 HIS 20 1HE HIS 20 6.432 -11.266 5.567 157 HE2 HIS 20 2HE HIS 20 6.841 -9.896 3.472 158 H CYS 21 H CYS 21 1.550 -13.103 0.667 159 HA CYS 21 HA CYS 21 1.295 -10.290 0.705 160 HB2 CYS 21 2HB CYS 21 -0.437 -12.403 -0.607 161 HB3 CYS 21 1HB CYS 21 -0.555 -10.678 -0.947 162 HG CYS 21 HG CYS 21 1.117 -11.681 -2.684 163 H PHE 22 H PHE 22 -1.212 -12.707 1.593 164 HA PHE 22 HA PHE 22 -2.984 -10.613 2.562 165 HB2 PHE 22 2HB PHE 22 -3.266 -13.502 3.329 166 HB3 PHE 22 1HB PHE 22 -4.524 -12.323 2.952 167 HD1 PHE 22 1HD PHE 22 -4.651 -11.432 0.528 168 HD2 PHE 22 2HD PHE 22 -2.415 -14.909 1.669 169 HE1 PHE 22 1HE PHE 22 -4.605 -12.180 -1.836 170 HE2 PHE 22 2HE PHE 22 -2.366 -15.661 -0.687 171 HZ PHE 22 HZ PHE 22 -3.459 -14.297 -2.442 172 H GLU 23 H GLU 23 -0.707 -12.857 4.079 173 HA GLU 23 HA GLU 23 -1.541 -12.309 6.774 174 HB2 GLU 23 2HB GLU 23 1.053 -13.371 5.641 175 HB3 GLU 23 1HB GLU 23 0.726 -13.257 7.370 176 HG2 GLU 23 2HG GLU 23 -1.007 -14.771 5.394 177 HG3 GLU 23 1HG GLU 23 0.202 -15.516 6.440 178 H VAL 24 H VAL 24 1.019 -10.851 4.742 179 HA VAL 24 HA VAL 24 2.096 -9.231 6.816 180 HB VAL 24 HB VAL 24 3.029 -7.835 5.004 181 HG11 VAL 24 1HG1 VAL 24 3.301 -10.728 5.281 182 HG12 VAL 24 2HG1 VAL 24 4.551 -9.496 5.108 183 HG13 VAL 24 3HG1 VAL 24 3.762 -10.160 3.677 184 HG21 VAL 24 1HG2 VAL 24 2.393 -9.167 2.694 185 HG22 VAL 24 2HG2 VAL 24 1.664 -7.646 3.216 186 HG23 VAL 24 3HG2 VAL 24 0.870 -9.175 3.573 187 H PHE 25 H PHE 25 -0.529 -8.533 4.470 188 HA PHE 25 HA PHE 25 -0.907 -5.809 5.199 189 HB2 PHE 25 2HB PHE 25 -3.227 -7.678 4.715 190 HB3 PHE 25 1HB PHE 25 -3.104 -5.971 4.315 191 HD1 PHE 25 1HD PHE 25 -0.251 -6.139 3.088 192 HD2 PHE 25 2HD PHE 25 -3.819 -8.474 2.584 193 HE1 PHE 25 1HE PHE 25 0.475 -6.745 0.797 194 HE2 PHE 25 2HE PHE 25 -3.095 -9.081 0.284 195 HZ PHE 25 HZ PHE 25 -0.947 -8.215 -0.607 196 H THR 26 H THR 26 -2.195 -8.780 6.644 197 HA THR 26 HA THR 26 -3.406 -7.175 8.819 198 HB THR 26 HB THR 26 -4.664 -9.147 9.334 199 HG1 THR 26 1HG THR 26 -2.599 -10.433 8.741 200 HG21 THR 26 1HG2 THR 26 -5.747 -9.623 7.195 201 HG22 THR 26 2HG2 THR 26 -4.347 -8.987 6.326 202 HG23 THR 26 3HG2 THR 26 -5.350 -7.907 7.299 203 H SER 27 H SER 27 -0.450 -8.704 8.277 204 HA SER 27 HA SER 27 -0.170 -9.368 11.182 205 HB2 SER 27 2HB SER 27 0.240 -11.226 9.551 206 HB3 SER 27 1HB SER 27 1.601 -10.299 8.928 207 HG SER 27 HG SER 27 2.717 -10.879 10.605 208 H ARG 28 H ARG 28 1.760 -7.983 8.477 209 HA ARG 28 HA ARG 28 3.169 -6.338 10.554 210 HB2 ARG 28 2HB ARG 28 5.187 -6.495 9.145 211 HB3 ARG 28 1HB ARG 28 4.637 -8.094 9.644 212 HG2 ARG 28 2HG ARG 28 4.380 -8.716 7.498 213 HG3 ARG 28 1HG ARG 28 3.302 -7.352 7.206 214 HD2 ARG 28 2HD ARG 28 5.415 -7.429 5.770 215 HD3 ARG 28 1HD ARG 28 5.118 -5.912 6.623 216 HE ARG 28 HE ARG 28 7.093 -6.303 7.841 217 HH11 ARG 28 1HH1 ARG 28 8.848 -7.562 8.511 218 HH12 ARG 28 2HH1 ARG 28 8.876 -9.253 8.139 219 HH21 ARG 28 1HH2 ARG 28 5.828 -9.210 6.485 220 HH22 ARG 28 2HH2 ARG 28 7.165 -10.186 6.993 221 HA PRO 29 HA PRO 29 1.342 -3.844 6.887 222 HB2 PRO 29 2HB PRO 29 -0.564 -2.502 8.383 223 HB3 PRO 29 1HB PRO 29 -0.890 -3.921 7.374 224 HG2 PRO 29 2HG PRO 29 -0.527 -3.729 10.312 225 HG3 PRO 29 1HG PRO 29 -1.586 -4.790 9.369 226 HD2 PRO 29 2HD PRO 29 0.744 -5.655 10.500 227 HD3 PRO 29 1HD PRO 29 0.079 -6.353 9.006 228 H ALA 30 H ALA 30 1.762 -3.001 10.310 229 HA ALA 30 HA ALA 30 2.391 -0.224 9.836 230 HB1 ALA 30 1HB ALA 30 3.424 -0.538 12.227 231 HB2 ALA 30 2HB ALA 30 2.646 -2.119 12.147 232 HB3 ALA 30 3HB ALA 30 1.677 -0.651 12.013 233 H ASP 31 H ASP 31 4.278 -3.160 9.766 234 HA ASP 31 HA ASP 31 6.852 -2.031 10.242 235 HB2 ASP 31 2HB ASP 31 6.013 -4.442 8.620 236 HB3 ASP 31 1HB ASP 31 7.692 -4.041 8.982 237 H TRP 32 H TRP 32 4.882 -2.114 7.302 238 HA TRP 32 HA TRP 32 7.132 -0.728 5.887 239 HB2 TRP 32 2HB TRP 32 6.822 -2.098 4.140 240 HB3 TRP 32 1HB TRP 32 5.713 -3.030 5.143 241 HD1 TRP 32 HD TRP 32 5.681 -0.022 2.733 242 HE1 TRP 32 1HE TRP 32 3.366 0.100 1.618 243 HE3 TRP 32 3HE TRP 32 3.322 -3.793 5.215 244 HZ2 TRP 32 2HZ TRP 32 0.851 -1.232 1.757 245 HZ3 TRP 32 3HZ TRP 32 0.960 -4.353 4.701 246 HH2 TRP 32 HH TRP 32 -0.280 -3.074 2.975 247 H TRP 33 H TRP 33 3.915 -0.327 7.044 248 HA TRP 33 HA TRP 33 2.781 1.421 5.168 249 HB2 TRP 33 2HB TRP 33 2.153 0.678 7.757 250 HB3 TRP 33 1HB TRP 33 2.465 2.407 7.912 251 HD1 TRP 33 HD TRP 33 0.736 4.050 6.933 252 HE1 TRP 33 1HE TRP 33 -1.529 3.775 5.734 253 HE3 TRP 33 3HE TRP 33 0.813 -0.979 6.034 254 HZ2 TRP 33 2HZ TRP 33 -3.101 1.699 4.550 255 HZ3 TRP 33 3HZ TRP 33 -1.078 -2.076 4.872 256 HH2 TRP 33 HH TRP 33 -3.033 -0.745 4.129 257 HA PRO 34 HA PRO 34 5.366 5.000 7.025 258 HB2 PRO 34 2HB PRO 34 7.546 3.984 8.589 259 HB3 PRO 34 1HB PRO 34 6.143 4.907 9.147 260 HG2 PRO 34 2HG PRO 34 6.670 2.263 9.753 261 HG3 PRO 34 1HG PRO 34 5.096 3.062 9.900 262 HD2 PRO 34 2HD PRO 34 6.086 1.227 7.759 263 HD3 PRO 34 1HD PRO 34 4.442 1.430 8.403 264 HA PRO 35 HA PRO 35 8.463 3.960 3.838 265 HB2 PRO 35 2HB PRO 35 8.535 6.398 2.629 266 HB3 PRO 35 1HB PRO 35 7.245 5.216 2.340 267 HG2 PRO 35 2HG PRO 35 7.218 7.677 3.977 268 HG3 PRO 35 1HG PRO 35 5.916 6.916 3.053 269 HD2 PRO 35 2HD PRO 35 6.249 6.733 5.827 270 HD3 PRO 35 1HD PRO 35 5.240 5.658 4.837 271 H SER 36 H SER 36 10.461 5.520 2.998 272 HA SER 36 HA SER 36 12.286 5.661 5.166 273 HB2 SER 36 2HB SER 36 13.784 6.786 3.628 274 HB3 SER 36 1HB SER 36 12.900 5.557 2.729 275 HG SER 36 HG SER 36 11.648 7.112 1.831 276 H HIS 37 H HIS 37 9.951 7.961 3.991 277 HA HIS 37 HA HIS 37 10.941 9.942 6.009 278 HB2 HIS 37 2HB HIS 37 9.393 10.526 3.465 279 HB3 HIS 37 1HB HIS 37 10.051 11.713 4.591 280 HD1 HIS 37 1HD HIS 37 12.795 11.498 4.908 281 HD2 HIS 37 2HD HIS 37 11.151 9.893 1.427 282 HE1 HIS 37 1HE HIS 37 14.707 11.239 3.266 283 HE2 HIS 37 2HE HIS 37 13.717 10.263 1.143 284 H VAL 38 H VAL 38 8.930 11.481 6.572 285 HA VAL 38 HA VAL 38 6.722 9.613 7.303 286 HB VAL 38 HB VAL 38 7.354 12.363 8.413 287 HG11 VAL 38 1HG1 VAL 38 5.790 11.761 10.172 288 HG12 VAL 38 2HG1 VAL 38 5.591 10.146 9.495 289 HG13 VAL 38 3HG1 VAL 38 4.985 11.551 8.617 290 HG21 VAL 38 1HG2 VAL 38 8.072 10.905 10.424 291 HG22 VAL 38 2HG2 VAL 38 9.178 10.987 9.052 292 HG23 VAL 38 3HG2 VAL 38 8.144 9.575 9.268 293 H LEU 39 H LEU 39 4.912 9.753 6.104 294 HA LEU 39 HA LEU 39 4.363 12.287 4.631 295 HB2 LEU 39 2HB LEU 39 3.152 9.537 4.210 296 HB3 LEU 39 1HB LEU 39 2.977 10.940 3.154 297 HG LEU 39 HG LEU 39 5.564 9.484 3.777 298 HD11 LEU 39 1HD1 LEU 39 4.032 8.331 2.184 299 HD12 LEU 39 2HD1 LEU 39 5.522 8.872 1.415 300 HD13 LEU 39 3HD1 LEU 39 4.030 9.780 1.178 301 HD21 LEU 39 1HD2 LEU 39 6.286 11.672 3.466 302 HD22 LEU 39 2HD2 LEU 39 4.930 12.079 2.415 303 HD23 LEU 39 3HD2 LEU 39 6.262 11.102 1.798 304 H VAL 40 H VAL 40 3.637 10.957 7.483 305 HA VAL 40 HA VAL 40 0.799 11.903 7.465 306 HB VAL 40 HB VAL 40 2.094 9.964 9.391 307 HG11 VAL 40 1HG1 VAL 40 0.244 10.396 10.606 308 HG12 VAL 40 2HG1 VAL 40 -0.690 9.647 9.312 309 HG13 VAL 40 3HG1 VAL 40 -0.434 11.391 9.317 310 HG21 VAL 40 1HG2 VAL 40 1.767 8.344 7.861 311 HG22 VAL 40 2HG2 VAL 40 1.227 9.558 6.701 312 HG23 VAL 40 3HG2 VAL 40 0.060 8.775 7.767 313 H LYS 41 H LYS 41 0.145 13.104 9.431 314 HA LYS 41 HA LYS 41 1.993 15.099 10.207 315 HB2 LYS 41 2HB LYS 41 -0.491 15.232 10.515 316 HB3 LYS 41 1HB LYS 41 -0.339 14.095 11.852 317 HG2 LYS 41 2HG LYS 41 1.205 15.666 12.995 318 HG3 LYS 41 1HG LYS 41 0.980 16.817 11.677 319 HD2 LYS 41 2HD LYS 41 -1.482 16.795 12.153 320 HD3 LYS 41 1HD LYS 41 -1.157 15.785 13.562 321 HE2 LYS 41 2HE LYS 41 -0.870 17.709 14.710 322 HE3 LYS 41 1HE LYS 41 0.651 17.880 13.835 323 HZ1 LYS 41 1HZ LYS 41 -0.171 19.641 12.807 324 HZ2 LYS 41 2HZ LYS 41 -1.629 19.486 13.665 325 HZ3 LYS 41 3HZ LYS 41 -1.437 18.713 12.165 326 H LYS 42 H LYS 42 1.186 11.996 11.734 327 HA LYS 42 HA LYS 42 3.679 12.271 13.346 328 HB2 LYS 42 2HB LYS 42 1.563 12.615 14.723 329 HB3 LYS 42 1HB LYS 42 1.145 10.947 14.343 330 HG2 LYS 42 2HG LYS 42 2.264 10.846 16.439 331 HG3 LYS 42 1HG LYS 42 3.451 10.309 15.251 332 HD2 LYS 42 2HD LYS 42 3.652 13.149 15.425 333 HD3 LYS 42 1HD LYS 42 3.627 12.518 17.070 334 HE2 LYS 42 2HE LYS 42 5.417 11.421 14.888 335 HE3 LYS 42 1HE LYS 42 5.931 12.640 16.054 336 HZ1 LYS 42 1HZ LYS 42 6.550 10.464 16.824 337 HZ2 LYS 42 2HZ LYS 42 4.951 9.907 16.678 338 HZ3 LYS 42 3HZ LYS 42 5.340 11.086 17.838 339 H GLU 43 H GLU 43 4.927 10.389 13.375 340 HA GLU 43 HA GLU 43 4.713 8.530 11.300 341 HB2 GLU 43 2HB GLU 43 5.923 8.104 14.037 342 HB3 GLU 43 1HB GLU 43 6.231 7.090 12.630 343 HG2 GLU 43 2HG GLU 43 7.092 9.081 11.415 344 HG3 GLU 43 1HG GLU 43 6.852 10.048 12.871 345 H ARG 44 H ARG 44 3.571 6.649 10.983 346 HA ARG 44 HA ARG 44 1.487 6.011 12.979 347 HB2 ARG 44 2HB ARG 44 1.978 5.082 10.145 348 HB3 ARG 44 1HB ARG 44 0.709 4.407 11.168 349 HG2 ARG 44 2HG ARG 44 -0.085 6.802 11.532 350 HG3 ARG 44 1HG ARG 44 1.003 7.261 10.221 351 HD2 ARG 44 2HD ARG 44 -0.153 5.856 8.660 352 HD3 ARG 44 1HD ARG 44 -1.097 5.102 9.947 353 HE ARG 44 HE ARG 44 -1.858 7.661 10.250 354 HH11 ARG 44 1HH1 ARG 44 -3.399 8.780 9.033 355 HH12 ARG 44 2HH1 ARG 44 -3.694 8.314 7.392 356 HH21 ARG 44 1HH2 ARG 44 -1.367 5.745 7.418 357 HH22 ARG 44 2HH2 ARG 44 -2.545 6.598 6.479 358 H ALA 45 H ALA 45 1.340 4.050 14.045 359 HA ALA 45 HA ALA 45 3.584 2.125 13.609 360 HB1 ALA 45 1HB ALA 45 4.226 2.144 15.809 361 HB2 ALA 45 2HB ALA 45 2.610 2.550 16.387 362 HB3 ALA 45 3HB ALA 45 3.639 3.802 15.692 363 H GLY 46 H GLY 46 0.310 2.627 14.964 364 HA2 GLY 46 2HA GLY 46 -0.031 -0.330 15.016 365 HA3 GLY 46 1HA GLY 46 -1.120 0.837 15.759 366 H LEU 47 H LEU 47 -1.719 -1.358 13.864 367 HA LEU 47 HA LEU 47 -3.440 0.194 12.080 368 HB2 LEU 47 2HB LEU 47 -1.299 0.041 10.817 369 HB3 LEU 47 1HB LEU 47 -1.410 -1.712 10.888 370 HG LEU 47 HG LEU 47 -3.770 -0.188 9.853 371 HD11 LEU 47 1HD1 LEU 47 -2.460 -0.655 7.537 372 HD12 LEU 47 2HD1 LEU 47 -1.086 -0.296 8.582 373 HD13 LEU 47 3HD1 LEU 47 -2.380 0.886 8.388 374 HD21 LEU 47 1HD2 LEU 47 -3.067 -2.899 10.057 375 HD22 LEU 47 2HD2 LEU 47 -2.835 -2.513 8.356 376 HD23 LEU 47 3HD2 LEU 47 -4.397 -2.231 9.117 377 H ALA 48 H ALA 48 -5.320 -0.893 11.874 378 HA ALA 48 HA ALA 48 -5.375 -3.833 11.873 379 HB1 ALA 48 1HB ALA 48 -5.400 -3.276 14.290 380 HB2 ALA 48 2HB ALA 48 -6.927 -3.996 13.776 381 HB3 ALA 48 3HB ALA 48 -6.814 -2.254 14.028 382 H PHE 49 H PHE 49 -7.117 -4.544 10.637 383 HA PHE 49 HA PHE 49 -9.424 -2.732 10.302 384 HB2 PHE 49 2HB PHE 49 -9.292 -2.593 7.924 385 HB3 PHE 49 1HB PHE 49 -7.708 -2.134 8.544 386 HD1 PHE 49 1HD PHE 49 -9.558 -4.421 6.463 387 HD2 PHE 49 2HD PHE 49 -5.860 -3.898 8.585 388 HE1 PHE 49 1HE PHE 49 -8.517 -6.205 5.091 389 HE2 PHE 49 2HE PHE 49 -4.819 -5.683 7.213 390 HZ PHE 49 HZ PHE 49 -6.149 -6.835 5.463 391 H GLU 50 H GLU 50 -11.309 -3.802 9.590 392 HA GLU 50 HA GLU 50 -11.227 -6.727 9.968 393 HB2 GLU 50 2HB GLU 50 -13.802 -5.439 9.324 394 HB3 GLU 50 1HB GLU 50 -13.388 -6.522 10.654 395 HG2 GLU 50 2HG GLU 50 -12.102 -4.562 11.669 396 HG3 GLU 50 1HG GLU 50 -12.900 -3.545 10.469 397 HA PRO 51 HA PRO 51 -11.273 -6.854 5.411 398 HB2 PRO 51 2HB PRO 51 -10.655 -9.487 5.133 399 HB3 PRO 51 1HB PRO 51 -9.445 -8.242 5.491 400 HG2 PRO 51 2HG PRO 51 -10.698 -10.234 7.289 401 HG3 PRO 51 1HG PRO 51 -9.057 -9.572 7.301 402 HD2 PRO 51 2HD PRO 51 -11.107 -8.771 9.004 403 HD3 PRO 51 1HD PRO 51 -9.653 -7.817 8.648 404 H PHE 52 H PHE 52 -13.559 -6.572 5.181 405 HA PHE 52 HA PHE 52 -14.982 -8.999 4.387 406 HB2 PHE 52 2HB PHE 52 -16.165 -7.297 6.604 407 HB3 PHE 52 1HB PHE 52 -16.834 -8.785 5.929 408 HD1 PHE 52 1HD PHE 52 -15.562 -10.960 6.228 409 HD2 PHE 52 2HD PHE 52 -14.520 -7.351 8.310 410 HE1 PHE 52 1HE PHE 52 -14.226 -12.279 7.850 411 HE2 PHE 52 2HE PHE 52 -13.191 -8.668 9.930 412 HZ PHE 52 HZ PHE 52 -13.035 -11.131 9.700 413 H VAL 53 H VAL 53 -17.335 -8.214 3.640 414 HA VAL 53 HA VAL 53 -16.843 -5.883 1.940 415 HB VAL 53 HB VAL 53 -19.480 -7.327 2.346 416 HG11 VAL 53 1HG1 VAL 53 -18.312 -5.502 0.245 417 HG12 VAL 53 2HG1 VAL 53 -19.849 -5.361 1.100 418 HG13 VAL 53 3HG1 VAL 53 -19.640 -6.598 -0.140 419 HG21 VAL 53 1HG2 VAL 53 -17.122 -8.528 1.481 420 HG22 VAL 53 2HG2 VAL 53 -17.919 -8.066 -0.021 421 HG23 VAL 53 3HG2 VAL 53 -18.753 -9.099 1.138 422 H GLY 54 H GLY 54 -17.229 -3.817 2.604 423 HA2 GLY 54 2HA GLY 54 -18.408 -2.043 3.657 424 HA3 GLY 54 1HA GLY 54 -19.533 -3.229 4.329 425 H GLY 55 H GLY 55 -16.207 -3.976 4.689 426 HA2 GLY 55 2HA GLY 55 -16.383 -3.893 7.579 427 HA3 GLY 55 1HA GLY 55 -14.929 -4.246 6.642 428 H ARG 56 H ARG 56 -14.337 -2.716 8.697 429 HA ARG 56 HA ARG 56 -14.216 0.061 7.576 430 HB2 ARG 56 2HB ARG 56 -14.467 -0.767 10.481 431 HB3 ARG 56 1HB ARG 56 -14.224 0.886 9.916 432 HG2 ARG 56 2HG ARG 56 -16.329 0.708 8.591 433 HG3 ARG 56 1HG ARG 56 -16.591 -0.897 9.276 434 HD2 ARG 56 2HD ARG 56 -16.483 0.158 11.568 435 HD3 ARG 56 1HD ARG 56 -16.474 1.732 10.774 436 HE ARG 56 HE ARG 56 -18.766 1.422 10.214 437 HH11 ARG 56 1HH1 ARG 56 -20.723 0.315 10.458 438 HH12 ARG 56 2HH1 ARG 56 -20.716 -1.298 11.089 439 HH21 ARG 56 1HH2 ARG 56 -17.273 -1.420 11.473 440 HH22 ARG 56 2HH2 ARG 56 -18.764 -2.280 11.665 441 H TYR 57 H TYR 57 -12.218 1.075 7.694 442 HA TYR 57 HA TYR 57 -9.966 -0.597 8.749 443 HB2 TYR 57 2HB TYR 57 -10.263 -0.094 6.174 444 HB3 TYR 57 1HB TYR 57 -9.618 1.486 6.610 445 HD1 TYR 57 1HD TYR 57 -8.775 -1.793 5.625 446 HD2 TYR 57 2HD TYR 57 -7.454 1.413 8.163 447 HE1 TYR 57 1HE TYR 57 -6.480 -2.737 5.620 448 HE2 TYR 57 2HE TYR 57 -5.159 0.470 8.157 449 HH TYR 57 HH TYR 57 -4.342 -2.357 6.169 450 H TYR 58 H TYR 58 -8.783 0.379 10.358 451 HA TYR 58 HA TYR 58 -8.811 3.357 10.497 452 HB2 TYR 58 2HB TYR 58 -8.742 2.253 13.154 453 HB3 TYR 58 1HB TYR 58 -9.884 3.406 12.472 454 HD1 TYR 58 1HD TYR 58 -12.119 2.773 12.134 455 HD2 TYR 58 2HD TYR 58 -9.098 -0.247 12.533 456 HE1 TYR 58 1HE TYR 58 -13.874 1.021 12.156 457 HE2 TYR 58 2HE TYR 58 -10.847 -2.002 12.545 458 HH TYR 58 HH TYR 58 -13.386 -2.073 11.540 459 H GLU 59 H GLU 59 -6.918 4.248 11.421 460 HA GLU 59 HA GLU 59 -4.731 2.294 12.016 461 HB2 GLU 59 2HB GLU 59 -4.487 4.908 10.492 462 HB3 GLU 59 1HB GLU 59 -3.156 3.824 10.895 463 HG2 GLU 59 2HG GLU 59 -4.275 2.019 9.592 464 HG3 GLU 59 1HG GLU 59 -5.531 3.166 9.128 465 H TRP 60 H TRP 60 -3.376 2.907 13.758 466 HA TRP 60 HA TRP 60 -4.375 5.253 15.313 467 HB2 TRP 60 2HB TRP 60 -2.730 2.866 16.200 468 HB3 TRP 60 1HB TRP 60 -3.227 4.199 17.243 469 HD1 TRP 60 HD TRP 60 -6.019 4.623 17.233 470 HE1 TRP 60 1HE TRP 60 -7.864 2.829 17.409 471 HE3 TRP 60 3HE TRP 60 -3.378 0.498 15.789 472 HZ2 TRP 60 2HZ TRP 60 -8.175 0.016 16.997 473 HZ3 TRP 60 3HZ TRP 60 -4.471 -1.725 15.693 474 HH2 TRP 60 HH TRP 60 -6.863 -1.970 16.295 475 H ASP 61 H ASP 61 -3.066 6.981 15.598 476 HA ASP 61 HA ASP 61 -0.323 6.831 14.456 477 HB2 ASP 61 2HB ASP 61 -2.036 9.181 15.297 478 HB3 ASP 61 1HB ASP 61 -0.423 9.318 14.604 479 H ILE 62 H ILE 62 1.484 7.693 15.713 480 HA ILE 62 HA ILE 62 1.565 6.806 18.387 481 HB ILE 62 HB ILE 62 3.269 8.905 17.051 482 HG12 ILE 62 2HG1 ILE 62 3.791 5.975 17.548 483 HG13 ILE 62 1HG1 ILE 62 3.227 6.624 16.016 484 HG21 ILE 62 1HG2 ILE 62 3.166 7.952 19.775 485 HG22 ILE 62 2HG2 ILE 62 4.185 9.212 19.081 486 HG23 ILE 62 3HG2 ILE 62 4.704 7.528 19.026 487 HD11 ILE 62 1HD1 ILE 62 5.287 8.227 16.231 488 HD12 ILE 62 2HD1 ILE 62 5.545 6.568 15.691 489 HD13 ILE 62 3HD1 ILE 62 5.882 7.014 17.364 490 H ASP 63 H ASP 63 0.867 10.037 17.102 491 HA ASP 63 HA ASP 63 0.040 10.838 19.867 492 HB2 ASP 63 2HB ASP 63 1.157 12.510 17.602 493 HB3 ASP 63 1HB ASP 63 0.439 13.199 19.058 494 H GLY 64 H GLY 64 -0.876 10.577 16.512 495 HA2 GLY 64 2HA GLY 64 -3.297 12.193 16.840 496 HA3 GLY 64 1HA GLY 64 -2.871 11.255 15.407 497 H THR 65 H THR 65 -5.430 11.336 16.882 498 HA THR 65 HA THR 65 -5.746 8.919 18.404 499 HB THR 65 HB THR 65 -7.265 10.961 18.424 500 HG1 THR 65 1HG THR 65 -7.766 8.793 19.247 501 HG21 THR 65 1HG2 THR 65 -8.839 9.744 16.243 502 HG22 THR 65 2HG2 THR 65 -7.362 10.565 15.747 503 HG23 THR 65 3HG2 THR 65 -8.598 11.442 16.647 504 H GLU 66 H GLU 66 -8.204 8.094 16.982 505 HA GLU 66 HA GLU 66 -6.892 6.349 14.958 506 HB2 GLU 66 2HB GLU 66 -8.163 5.297 16.838 507 HB3 GLU 66 1HB GLU 66 -9.619 6.103 16.263 508 HG2 GLU 66 2HG GLU 66 -9.337 4.955 14.063 509 HG3 GLU 66 1HG GLU 66 -7.964 4.075 14.737 510 H ILE 67 H ILE 67 -7.346 6.641 12.823 511 HA ILE 67 HA ILE 67 -9.811 8.147 12.093 512 HB ILE 67 HB ILE 67 -8.554 9.326 10.330 513 HG12 ILE 67 2HG1 ILE 67 -6.040 8.268 11.635 514 HG13 ILE 67 1HG1 ILE 67 -6.759 7.487 10.228 515 HG21 ILE 67 1HG2 ILE 67 -8.757 10.076 12.846 516 HG22 ILE 67 2HG2 ILE 67 -7.702 10.966 11.749 517 HG23 ILE 67 3HG2 ILE 67 -7.017 9.788 12.868 518 HD11 ILE 67 1HD1 ILE 67 -5.110 9.033 9.400 519 HD12 ILE 67 2HD1 ILE 67 -5.734 10.328 10.422 520 HD13 ILE 67 3HD1 ILE 67 -6.694 9.737 9.065 521 H VAL 68 H VAL 68 -10.363 7.789 9.708 522 HA VAL 68 HA VAL 68 -10.020 4.906 9.146 523 HB VAL 68 HB VAL 68 -11.708 6.979 7.714 524 HG11 VAL 68 1HG1 VAL 68 -11.072 4.185 7.213 525 HG12 VAL 68 2HG1 VAL 68 -11.966 5.322 6.204 526 HG13 VAL 68 3HG1 VAL 68 -12.804 4.412 7.461 527 HG21 VAL 68 1HG2 VAL 68 -12.985 6.889 9.580 528 HG22 VAL 68 2HG2 VAL 68 -12.038 5.560 10.247 529 HG23 VAL 68 3HG2 VAL 68 -13.355 5.226 9.124 530 H TRP 69 H TRP 69 -8.725 4.135 7.547 531 HA TRP 69 HA TRP 69 -7.312 6.131 5.838 532 HB2 TRP 69 2HB TRP 69 -5.639 4.915 6.886 533 HB3 TRP 69 1HB TRP 69 -6.607 3.444 6.954 534 HD1 TRP 69 HD TRP 69 -4.106 5.276 4.832 535 HE1 TRP 69 1HE TRP 69 -3.544 3.867 2.746 536 HE3 TRP 69 3HE TRP 69 -7.709 1.677 5.197 537 HZ2 TRP 69 2HZ TRP 69 -4.497 1.522 1.409 538 HZ3 TRP 69 3HZ TRP 69 -7.859 -0.132 3.509 539 HH2 TRP 69 HH TRP 69 -6.259 -0.216 1.616 540 H GLY 70 H GLY 70 -9.872 3.998 5.672 541 HA2 GLY 70 2HA GLY 70 -10.422 4.265 2.977 542 HA3 GLY 70 1HA GLY 70 -9.356 2.864 3.041 543 H ARG 71 H ARG 71 -10.839 1.225 2.614 544 HA ARG 71 HA ARG 71 -12.632 0.486 4.792 545 HB2 ARG 71 2HB ARG 71 -13.799 2.167 3.028 546 HB3 ARG 71 1HB ARG 71 -14.051 0.646 2.173 547 HG2 ARG 71 2HG ARG 71 -15.087 -0.317 4.204 548 HG3 ARG 71 1HG ARG 71 -14.865 1.220 5.035 549 HD2 ARG 71 2HD ARG 71 -16.249 2.325 3.275 550 HD3 ARG 71 1HD ARG 71 -16.544 0.741 2.557 551 HE ARG 71 HE ARG 71 -17.297 0.502 5.248 552 HH11 ARG 71 1HH1 ARG 71 -19.446 0.805 5.880 553 HH12 ARG 71 2HH1 ARG 71 -20.505 1.744 4.881 554 HH21 ARG 71 1HH2 ARG 71 -18.086 2.417 2.491 555 HH22 ARG 71 2HH2 ARG 71 -19.734 2.657 2.963 556 H ILE 72 H ILE 72 -14.148 -1.381 3.180 557 HA ILE 72 HA ILE 72 -12.019 -3.024 1.908 558 HB ILE 72 HB ILE 72 -14.000 -4.049 3.967 559 HG12 ILE 72 2HG1 ILE 72 -11.604 -4.631 4.999 560 HG13 ILE 72 1HG1 ILE 72 -11.121 -3.230 4.045 561 HG21 ILE 72 1HG2 ILE 72 -13.560 -5.727 2.262 562 HG22 ILE 72 2HG2 ILE 72 -12.653 -6.156 3.710 563 HG23 ILE 72 3HG2 ILE 72 -11.829 -5.409 2.343 564 HD11 ILE 72 1HD1 ILE 72 -13.372 -2.255 5.211 565 HD12 ILE 72 2HD1 ILE 72 -11.763 -2.081 5.911 566 HD13 ILE 72 3HD1 ILE 72 -12.829 -3.371 6.462 567 H LEU 73 H LEU 73 -12.965 -4.741 0.497 568 HA LEU 73 HA LEU 73 -15.716 -4.018 -0.438 569 HB2 LEU 73 2HB LEU 73 -13.867 -3.308 -2.003 570 HB3 LEU 73 1HB LEU 73 -13.435 -5.008 -2.170 571 HG LEU 73 HG LEU 73 -16.004 -5.283 -2.735 572 HD11 LEU 73 1HD1 LEU 73 -16.887 -3.321 -3.926 573 HD12 LEU 73 2HD1 LEU 73 -15.437 -2.408 -3.515 574 HD13 LEU 73 3HD1 LEU 73 -16.550 -2.916 -2.244 575 HD21 LEU 73 1HD2 LEU 73 -15.309 -4.525 -5.182 576 HD22 LEU 73 2HD2 LEU 73 -14.555 -5.930 -4.430 577 HD23 LEU 73 3HD2 LEU 73 -13.713 -4.380 -4.445 578 H GLU 74 H GLU 74 -13.261 -6.603 -0.556 579 HA GLU 74 HA GLU 74 -15.106 -8.584 0.444 580 HB2 GLU 74 2HB GLU 74 -15.957 -8.302 -1.892 581 HB3 GLU 74 1HB GLU 74 -14.371 -8.795 -2.479 582 HG2 GLU 74 2HG GLU 74 -14.606 -10.939 -1.232 583 HG3 GLU 74 1HG GLU 74 -16.235 -10.452 -0.758 584 H TRP 75 H TRP 75 -13.949 -10.351 1.184 585 HA TRP 75 HA TRP 75 -11.032 -10.356 0.559 586 HB2 TRP 75 2HB TRP 75 -12.035 -10.104 2.986 587 HB3 TRP 75 1HB TRP 75 -12.242 -11.851 2.864 588 HD1 TRP 75 HD TRP 75 -10.118 -13.354 2.976 589 HE1 TRP 75 1HE TRP 75 -7.631 -12.879 3.458 590 HE3 TRP 75 3HE TRP 75 -10.113 -8.259 2.643 591 HZ2 TRP 75 2HZ TRP 75 -5.872 -10.631 3.676 592 HZ3 TRP 75 3HZ TRP 75 -8.021 -6.977 2.992 593 HH2 TRP 75 HH TRP 75 -5.902 -8.157 3.508 594 H ASP 76 H ASP 76 -10.430 -11.965 -0.823 595 HA ASP 76 HA ASP 76 -12.085 -14.449 -0.866 596 HB2 ASP 76 2HB ASP 76 -11.033 -12.741 -2.961 597 HB3 ASP 76 1HB ASP 76 -10.526 -14.421 -3.175 598 HA PRO 77 HA PRO 77 -8.558 -16.436 1.194 599 HB2 PRO 77 2HB PRO 77 -9.559 -18.598 -0.655 600 HB3 PRO 77 1HB PRO 77 -9.022 -18.739 1.029 601 HG2 PRO 77 2HG PRO 77 -11.602 -18.652 0.418 602 HG3 PRO 77 1HG PRO 77 -10.969 -17.868 1.874 603 HD2 PRO 77 2HD PRO 77 -12.027 -16.639 -0.589 604 HD3 PRO 77 1HD PRO 77 -11.826 -15.921 1.026 605 HA PRO 78 HA PRO 78 -4.861 -16.077 -1.179 606 HB2 PRO 78 2HB PRO 78 -4.938 -19.076 -1.328 607 HB3 PRO 78 1HB PRO 78 -3.563 -18.006 -0.984 608 HG2 PRO 78 2HG PRO 78 -5.068 -19.285 0.933 609 HG3 PRO 78 1HG PRO 78 -4.088 -17.837 1.210 610 HD2 PRO 78 2HD PRO 78 -6.941 -18.046 1.373 611 HD3 PRO 78 1HD PRO 78 -5.965 -16.573 1.530 612 H HIS 79 H HIS 79 -5.944 -15.151 -3.002 613 HA HIS 79 HA HIS 79 -5.601 -16.366 -5.481 614 HB2 HIS 79 2HB HIS 79 -8.029 -17.293 -4.096 615 HB3 HIS 79 1HB HIS 79 -8.318 -16.692 -5.729 616 HD1 HIS 79 1HD HIS 79 -7.467 -19.714 -4.052 617 HD2 HIS 79 2HD HIS 79 -6.175 -17.920 -7.589 618 HE1 HIS 79 1HE HIS 79 -6.394 -21.546 -5.435 619 HE2 HIS 79 2HE HIS 79 -5.604 -20.465 -7.590 620 H ARG 80 H ARG 80 -8.223 -14.514 -3.807 621 HA ARG 80 HA ARG 80 -7.640 -12.323 -5.726 622 HB2 ARG 80 2HB ARG 80 -9.602 -13.538 -6.591 623 HB3 ARG 80 1HB ARG 80 -10.427 -13.284 -5.068 624 HG2 ARG 80 2HG ARG 80 -11.190 -11.581 -6.587 625 HG3 ARG 80 1HG ARG 80 -10.161 -10.800 -5.405 626 HD2 ARG 80 2HD ARG 80 -8.380 -10.569 -6.928 627 HD3 ARG 80 1HD ARG 80 -9.032 -11.798 -8.016 628 HE ARG 80 HE ARG 80 -9.705 -8.992 -8.052 629 HH11 ARG 80 1HH1 ARG 80 -11.383 -8.354 -9.431 630 HH12 ARG 80 2HH1 ARG 80 -12.476 -9.546 -10.050 631 HH21 ARG 80 1HH2 ARG 80 -10.936 -12.191 -8.423 632 HH22 ARG 80 2HH2 ARG 80 -12.223 -11.716 -9.481 633 H LEU 81 H LEU 81 -8.075 -10.247 -4.965 634 HA LEU 81 HA LEU 81 -9.007 -9.973 -2.159 635 HB2 LEU 81 2HB LEU 81 -6.507 -10.168 -2.112 636 HB3 LEU 81 1HB LEU 81 -6.415 -8.762 -3.170 637 HG LEU 81 HG LEU 81 -7.788 -7.510 -1.415 638 HD11 LEU 81 1HD1 LEU 81 -7.782 -10.134 -0.246 639 HD12 LEU 81 2HD1 LEU 81 -8.585 -8.677 0.333 640 HD13 LEU 81 3HD1 LEU 81 -6.931 -9.029 0.832 641 HD21 LEU 81 1HD2 LEU 81 -4.983 -8.213 -1.478 642 HD22 LEU 81 2HD2 LEU 81 -5.502 -7.940 0.186 643 HD23 LEU 81 3HD2 LEU 81 -5.732 -6.679 -1.026 644 H ALA 82 H ALA 82 -10.435 -8.311 -2.079 645 HA ALA 82 HA ALA 82 -10.097 -6.056 -4.009 646 HB1 ALA 82 1HB ALA 82 -12.298 -6.155 -4.730 647 HB2 ALA 82 2HB ALA 82 -12.856 -6.936 -3.250 648 HB3 ALA 82 3HB ALA 82 -11.997 -7.873 -4.471 649 H MET 83 H MET 83 -10.368 -4.048 -3.028 650 HA MET 83 HA MET 83 -11.645 -3.998 -0.346 651 HB2 MET 83 2HB MET 83 -8.912 -2.845 -0.950 652 HB3 MET 83 1HB MET 83 -9.774 -2.706 0.582 653 HG2 MET 83 2HG MET 83 -9.809 -5.217 0.711 654 HG3 MET 83 1HG MET 83 -8.775 -5.251 -0.718 655 HE1 MET 83 1HE MET 83 -5.553 -3.694 0.186 656 HE2 MET 83 2HE MET 83 -6.816 -2.475 0.042 657 HE3 MET 83 3HE MET 83 -6.842 -3.887 -1.011 658 H THR 84 H THR 84 -12.764 -2.101 0.070 659 HA THR 84 HA THR 84 -12.718 -0.060 -2.112 660 HB THR 84 HB THR 84 -14.670 -0.327 0.202 661 HG1 THR 84 1HG THR 84 -15.042 -2.090 -0.979 662 HG21 THR 84 1HG2 THR 84 -14.217 1.663 -1.812 663 HG22 THR 84 2HG2 THR 84 -15.450 1.639 -0.551 664 HG23 THR 84 3HG2 THR 84 -15.774 0.893 -2.115 665 H TRP 85 H TRP 85 -11.912 2.017 -1.622 666 HA TRP 85 HA TRP 85 -10.915 2.324 1.171 667 HB2 TRP 85 2HB TRP 85 -9.126 3.587 0.365 668 HB3 TRP 85 1HB TRP 85 -9.340 2.375 -0.894 669 HD1 TRP 85 HD TRP 85 -11.572 3.459 -2.638 670 HE1 TRP 85 1HE TRP 85 -11.344 5.676 -3.936 671 HE3 TRP 85 3HE TRP 85 -7.877 5.685 0.082 672 HZ2 TRP 85 2HZ TRP 85 -9.786 8.079 -3.832 673 HZ3 TRP 85 3HZ TRP 85 -7.035 7.930 -0.539 674 HH2 TRP 85 HH TRP 85 -7.980 9.128 -2.490 675 H ARG 86 H ARG 86 -12.041 3.650 2.437 676 HA ARG 86 HA ARG 86 -13.543 5.903 1.158 677 HB2 ARG 86 2HB ARG 86 -14.991 4.230 2.259 678 HB3 ARG 86 1HB ARG 86 -14.093 4.442 3.761 679 HG2 ARG 86 2HG ARG 86 -14.754 6.808 3.837 680 HG3 ARG 86 1HG ARG 86 -15.636 6.620 2.321 681 HD2 ARG 86 2HD ARG 86 -17.211 6.450 4.173 682 HD3 ARG 86 1HD ARG 86 -17.046 4.865 3.415 683 HE ARG 86 HE ARG 86 -15.956 4.080 5.379 684 HH11 ARG 86 1HH1 ARG 86 -15.394 4.328 7.552 685 HH12 ARG 86 2HH1 ARG 86 -15.406 5.909 8.262 686 HH21 ARG 86 1HH2 ARG 86 -16.410 7.498 5.349 687 HH22 ARG 86 2HH2 ARG 86 -15.982 7.702 7.014 688 H ILE 87 H ILE 87 -12.327 7.724 1.434 689 HA ILE 87 HA ILE 87 -11.497 8.429 4.182 690 HB ILE 87 HB ILE 87 -9.556 7.260 3.056 691 HG12 ILE 87 2HG1 ILE 87 -8.968 10.189 3.531 692 HG13 ILE 87 1HG1 ILE 87 -9.430 9.119 4.855 693 HG21 ILE 87 1HG2 ILE 87 -10.141 8.257 0.781 694 HG22 ILE 87 2HG2 ILE 87 -8.436 8.325 1.227 695 HG23 ILE 87 3HG2 ILE 87 -9.442 9.768 1.364 696 HD11 ILE 87 1HD1 ILE 87 -6.851 9.453 3.752 697 HD12 ILE 87 2HD1 ILE 87 -7.392 7.855 3.241 698 HD13 ILE 87 3HD1 ILE 87 -7.352 8.265 4.955 699 H ASP 88 H ASP 88 -10.999 10.764 4.356 700 HA ASP 88 HA ASP 88 -12.592 12.304 2.385 701 HB2 ASP 88 2HB ASP 88 -12.966 12.569 4.862 702 HB3 ASP 88 1HB ASP 88 -11.346 13.257 4.981 703 H GLY 89 H GLY 89 -11.727 14.088 1.253 704 HA2 GLY 89 2HA GLY 89 -9.044 13.869 0.342 705 HA3 GLY 89 1HA GLY 89 -10.070 15.281 0.101 706 H HIS 90 H HIS 90 -10.392 15.536 3.101 707 HA HIS 90 HA HIS 90 -7.973 17.156 3.505 708 HB2 HIS 90 2HB HIS 90 -10.442 16.763 5.203 709 HB3 HIS 90 1HB HIS 90 -9.162 17.914 5.548 710 HD1 HIS 90 1HD HIS 90 -8.624 19.097 2.800 711 HD2 HIS 90 2HD HIS 90 -12.468 18.377 4.240 712 HE1 HIS 90 1HE HIS 90 -10.175 20.620 1.494 713 HE2 HIS 90 2HE HIS 90 -12.521 20.187 2.362 714 H TRP 91 H TRP 91 -8.193 14.048 3.676 715 HA TRP 91 HA TRP 91 -7.134 12.380 4.932 716 HB2 TRP 91 2HB TRP 91 -5.632 14.839 5.451 717 HB3 TRP 91 1HB TRP 91 -5.548 13.700 6.793 718 HD1 TRP 91 HD TRP 91 -3.732 14.483 3.822 719 HE1 TRP 91 1HE TRP 91 -2.433 12.454 2.904 720 HE3 TRP 91 3HE TRP 91 -6.040 10.725 6.392 721 HZ2 TRP 91 2HZ TRP 91 -2.385 9.605 3.220 722 HZ3 TRP 91 3HZ TRP 91 -5.351 8.369 6.064 723 HH2 TRP 91 HH TRP 91 -3.529 7.804 4.483 724 H GLN 92 H GLN 92 -9.628 13.834 5.898 725 HA GLN 92 HA GLN 92 -9.377 13.306 8.817 726 HB2 GLN 92 2HB GLN 92 -11.579 14.687 7.258 727 HB3 GLN 92 1HB GLN 92 -11.521 14.509 9.013 728 HG2 GLN 92 2HG GLN 92 -9.481 15.973 7.310 729 HG3 GLN 92 1HG GLN 92 -10.693 16.720 8.346 730 HE21 GLN 92 1HE2 GLN 92 -7.499 16.235 8.371 731 HE22 GLN 92 2HE2 GLN 92 -7.230 15.912 10.016 732 H SER 93 H SER 93 -12.565 13.170 7.750 733 HA SER 93 HA SER 93 -12.561 10.326 7.042 734 HB2 SER 93 2HB SER 93 -13.680 9.501 8.958 735 HB3 SER 93 1HB SER 93 -12.405 10.522 9.612 736 HG SER 93 HG SER 93 -14.628 10.826 10.448 737 H VAL 94 H VAL 94 -14.795 9.599 6.502 738 HA VAL 94 HA VAL 94 -16.595 11.910 5.885 739 HB VAL 94 HB VAL 94 -17.252 9.990 4.013 740 HG11 VAL 94 1HG1 VAL 94 -15.424 12.385 3.979 741 HG12 VAL 94 2HG1 VAL 94 -17.049 12.226 3.315 742 HG13 VAL 94 3HG1 VAL 94 -15.688 11.444 2.512 743 HG21 VAL 94 1HG2 VAL 94 -15.289 8.987 3.155 744 HG22 VAL 94 2HG2 VAL 94 -15.138 8.781 4.899 745 HG23 VAL 94 3HG2 VAL 94 -14.233 10.055 4.083 746 HA PRO 95 HA PRO 95 -19.705 9.757 8.166 747 HB2 PRO 95 2HB PRO 95 -21.949 10.361 6.658 748 HB3 PRO 95 1HB PRO 95 -21.205 11.453 7.840 749 HG2 PRO 95 2HG PRO 95 -20.977 11.426 4.881 750 HG3 PRO 95 1HG PRO 95 -21.026 12.797 6.002 751 HD2 PRO 95 2HD PRO 95 -18.712 11.927 4.850 752 HD3 PRO 95 1HD PRO 95 -18.758 12.681 6.460 753 H ASP 96 H ASP 96 -19.663 9.241 4.665 754 HA ASP 96 HA ASP 96 -19.930 6.368 5.022 755 HB2 ASP 96 2HB ASP 96 -22.041 6.100 3.807 756 HB3 ASP 96 1HB ASP 96 -22.303 7.089 5.244 757 H ASP 97 H ASP 97 -20.024 5.301 2.753 758 HA ASP 97 HA ASP 97 -18.084 6.705 1.067 759 HB2 ASP 97 2HB ASP 97 -18.230 4.632 -0.337 760 HB3 ASP 97 1HB ASP 97 -17.832 4.303 1.349 761 H ASP 98 H ASP 98 -19.028 8.413 -0.016 762 HA ASP 98 HA ASP 98 -21.614 7.969 -1.392 763 HB2 ASP 98 2HB ASP 98 -21.134 10.065 -0.021 764 HB3 ASP 98 1HB ASP 98 -20.004 10.516 -1.295 765 H ARG 99 H ARG 99 -18.382 9.256 -2.131 766 HA ARG 99 HA ARG 99 -18.753 8.316 -4.941 767 HB2 ARG 99 2HB ARG 99 -17.122 10.654 -3.904 768 HB3 ARG 99 1HB ARG 99 -17.194 10.131 -5.588 769 HG2 ARG 99 2HG ARG 99 -19.662 10.498 -5.557 770 HG3 ARG 99 1HG ARG 99 -19.517 11.131 -3.916 771 HD2 ARG 99 2HD ARG 99 -17.881 12.833 -4.803 772 HD3 ARG 99 1HD ARG 99 -18.272 12.275 -6.429 773 HE ARG 99 HE ARG 99 -19.956 13.957 -4.753 774 HH11 ARG 99 1HH1 ARG 99 -21.939 14.562 -5.652 775 HH12 ARG 99 2HH1 ARG 99 -22.542 13.714 -7.037 776 HH21 ARG 99 1HH2 ARG 99 -19.827 11.565 -7.231 777 HH22 ARG 99 2HH2 ARG 99 -21.346 12.017 -7.931 778 H ALA 100 H ALA 100 -17.582 7.001 -2.433 779 HA ALA 100 HA ALA 100 -14.734 6.869 -2.760 780 HB1 ALA 100 1HB ALA 100 -14.792 5.072 -1.228 781 HB2 ALA 100 2HB ALA 100 -16.411 4.585 -1.727 782 HB3 ALA 100 3HB ALA 100 -16.186 6.053 -0.778 783 H SER 101 H SER 101 -13.471 5.281 -3.839 784 HA SER 101 HA SER 101 -14.899 3.934 -6.087 785 HB2 SER 101 2HB SER 101 -13.118 5.595 -6.653 786 HB3 SER 101 1HB SER 101 -11.950 4.577 -5.814 787 HG SER 101 HG SER 101 -11.838 3.855 -7.847 788 H GLU 102 H GLU 102 -13.956 1.797 -6.758 789 HA GLU 102 HA GLU 102 -13.155 0.238 -4.334 790 HB2 GLU 102 2HB GLU 102 -14.470 -0.724 -6.893 791 HB3 GLU 102 1HB GLU 102 -14.118 -1.711 -5.473 792 HG2 GLU 102 2HG GLU 102 -15.582 -0.216 -4.115 793 HG3 GLU 102 1HG GLU 102 -15.991 0.669 -5.583 794 H ILE 103 H ILE 103 -11.471 -1.284 -4.530 795 HA ILE 103 HA ILE 103 -9.701 -0.877 -6.911 796 HB ILE 103 HB ILE 103 -8.913 -1.614 -4.077 797 HG12 ILE 103 2HG1 ILE 103 -8.545 1.012 -5.552 798 HG13 ILE 103 1HG1 ILE 103 -9.789 0.726 -4.333 799 HG21 ILE 103 1HG2 ILE 103 -6.986 -2.233 -5.056 800 HG22 ILE 103 2HG2 ILE 103 -6.760 -0.551 -5.540 801 HG23 ILE 103 3HG2 ILE 103 -7.556 -1.683 -6.632 802 HD11 ILE 103 1HD1 ILE 103 -6.788 0.704 -3.965 803 HD12 ILE 103 2HD1 ILE 103 -7.890 0.015 -2.771 804 HD13 ILE 103 3HD1 ILE 103 -7.972 1.734 -3.159 805 H GLU 104 H GLU 104 -8.920 -2.730 -7.937 806 HA GLU 104 HA GLU 104 -9.915 -5.332 -6.834 807 HB2 GLU 104 2HB GLU 104 -10.822 -4.689 -9.068 808 HB3 GLU 104 1HB GLU 104 -9.174 -4.663 -9.697 809 HG2 GLU 104 2HG GLU 104 -8.917 -7.054 -8.997 810 HG3 GLU 104 1HG GLU 104 -10.614 -7.059 -8.515 811 H VAL 105 H VAL 105 -8.352 -6.621 -6.039 812 HA VAL 105 HA VAL 105 -5.632 -6.478 -7.249 813 HB VAL 105 HB VAL 105 -6.211 -6.778 -4.288 814 HG11 VAL 105 1HG1 VAL 105 -4.137 -7.847 -4.943 815 HG12 VAL 105 2HG1 VAL 105 -3.740 -6.328 -4.141 816 HG13 VAL 105 3HG1 VAL 105 -3.666 -6.441 -5.898 817 HG21 VAL 105 1HG2 VAL 105 -4.953 -4.440 -4.395 818 HG22 VAL 105 2HG2 VAL 105 -6.701 -4.533 -4.605 819 HG23 VAL 105 3HG2 VAL 105 -5.651 -4.396 -6.014 820 H ASP 106 H ASP 106 -4.796 -8.500 -7.705 821 HA ASP 106 HA ASP 106 -6.168 -10.837 -6.458 822 HB2 ASP 106 2HB ASP 106 -5.950 -12.030 -8.634 823 HB3 ASP 106 1HB ASP 106 -7.005 -10.621 -8.740 824 H PHE 107 H PHE 107 -4.814 -12.332 -5.612 825 HA PHE 107 HA PHE 107 -1.915 -12.117 -6.318 826 HB2 PHE 107 2HB PHE 107 -3.323 -12.429 -3.708 827 HB3 PHE 107 1HB PHE 107 -1.782 -13.262 -3.909 828 HD1 PHE 107 1HD PHE 107 -3.461 -9.999 -3.701 829 HD2 PHE 107 2HD PHE 107 0.288 -12.009 -4.298 830 HE1 PHE 107 1HE PHE 107 -2.257 -7.866 -3.320 831 HE2 PHE 107 2HE PHE 107 1.492 -9.876 -3.916 832 HZ PHE 107 HZ PHE 107 0.224 -7.807 -3.427 833 H VAL 108 H VAL 108 -1.111 -13.901 -7.270 834 HA VAL 108 HA VAL 108 -2.324 -16.541 -6.606 835 HB VAL 108 HB VAL 108 -2.689 -17.113 -8.817 836 HG11 VAL 108 1HG1 VAL 108 -3.906 -14.923 -8.182 837 HG12 VAL 108 2HG1 VAL 108 -3.829 -15.342 -9.894 838 HG13 VAL 108 3HG1 VAL 108 -2.737 -14.124 -9.233 839 HG21 VAL 108 1HG2 VAL 108 -0.476 -16.946 -9.674 840 HG22 VAL 108 2HG2 VAL 108 -0.422 -15.202 -9.414 841 HG23 VAL 108 3HG2 VAL 108 -1.432 -15.871 -10.695 842 HA PRO 109 HA PRO 109 1.912 -17.688 -6.074 843 HB2 PRO 109 2HB PRO 109 1.824 -20.348 -6.785 844 HB3 PRO 109 1HB PRO 109 1.265 -19.716 -5.227 845 HG2 PRO 109 2HG PRO 109 -0.298 -20.503 -7.619 846 HG3 PRO 109 1HG PRO 109 -0.690 -20.681 -5.900 847 HD2 PRO 109 2HD PRO 109 -1.777 -18.729 -7.493 848 HD3 PRO 109 1HD PRO 109 -1.552 -18.544 -5.739 849 H ASN 110 H ASN 110 3.726 -17.503 -7.334 850 HA ASN 110 HA ASN 110 3.411 -17.898 -10.264 851 HB2 ASN 110 2HB ASN 110 4.255 -15.676 -9.191 852 HB3 ASN 110 1HB ASN 110 5.764 -16.558 -8.971 853 HD21 ASN 110 1HD2 ASN 110 6.340 -14.654 -10.628 854 HD22 ASN 110 2HD2 ASN 110 6.239 -15.083 -12.267 855 H GLY 111 H GLY 111 4.897 -19.226 -11.396 856 HA2 GLY 111 2HA GLY 111 5.783 -21.582 -10.217 857 HA3 GLY 111 1HA GLY 111 6.554 -20.892 -11.648 858 H SER 112 H SER 112 7.464 -18.471 -10.361 859 HA SER 112 HA SER 112 9.903 -19.499 -9.149 860 HB2 SER 112 2HB SER 112 8.892 -16.664 -9.435 861 HB3 SER 112 1HB SER 112 10.520 -17.116 -8.944 862 HG SER 112 HG SER 112 10.881 -17.099 -11.018 863 H GLY 113 H GLY 113 10.648 -18.696 -6.973 864 HA2 GLY 113 2HA GLY 113 8.655 -19.240 -4.959 865 HA3 GLY 113 1HA GLY 113 10.292 -18.661 -4.648 866 H GLY 114 H GLY 114 7.927 -17.031 -6.696 867 HA2 GLY 114 2HA GLY 114 7.641 -14.910 -4.631 868 HA3 GLY 114 1HA GLY 114 8.098 -14.478 -6.279 869 H THR 115 H THR 115 5.737 -13.463 -5.123 870 HA THR 115 HA THR 115 3.601 -15.035 -6.507 871 HB THR 115 HB THR 115 3.294 -14.639 -4.054 872 HG1 THR 115 1HG THR 115 1.186 -13.561 -4.386 873 HG21 THR 115 1HG2 THR 115 4.302 -12.131 -4.636 874 HG22 THR 115 2HG2 THR 115 3.518 -12.592 -3.125 875 HG23 THR 115 3HG2 THR 115 2.582 -11.821 -4.406 876 H ARG 116 H ARG 116 2.328 -14.004 -8.039 877 HA ARG 116 HA ARG 116 3.240 -11.269 -8.842 878 HB2 ARG 116 2HB ARG 116 3.644 -13.079 -10.515 879 HB3 ARG 116 1HB ARG 116 1.910 -13.405 -10.540 880 HG2 ARG 116 2HG ARG 116 1.498 -11.065 -11.258 881 HG3 ARG 116 1HG ARG 116 3.239 -10.785 -11.291 882 HD2 ARG 116 2HD ARG 116 3.466 -12.636 -12.951 883 HD3 ARG 116 1HD ARG 116 1.709 -12.789 -12.974 884 HE ARG 116 HE ARG 116 3.266 -10.658 -14.241 885 HH11 ARG 116 1HH1 ARG 116 2.048 -9.181 -15.444 886 HH12 ARG 116 2HH1 ARG 116 0.327 -9.143 -15.257 887 HH21 ARG 116 1HH2 ARG 116 0.260 -11.691 -12.907 888 HH22 ARG 116 2HH2 ARG 116 -0.686 -10.564 -13.821 889 H VAL 117 H VAL 117 1.742 -9.670 -8.676 890 HA VAL 117 HA VAL 117 -1.122 -10.488 -8.490 891 HB VAL 117 HB VAL 117 -0.654 -9.884 -6.282 892 HG11 VAL 117 1HG1 VAL 117 1.366 -8.177 -7.587 893 HG12 VAL 117 2HG1 VAL 117 1.429 -9.010 -6.033 894 HG13 VAL 117 3HG1 VAL 117 0.612 -7.453 -6.166 895 HG21 VAL 117 1HG2 VAL 117 -1.287 -7.132 -7.317 896 HG22 VAL 117 2HG2 VAL 117 -1.971 -7.980 -5.931 897 HG23 VAL 117 3HG2 VAL 117 -2.446 -8.436 -7.565 898 H GLU 118 H GLU 118 -2.601 -9.270 -9.551 899 HA GLU 118 HA GLU 118 -1.551 -7.083 -11.290 900 HB2 GLU 118 2HB GLU 118 -2.601 -8.967 -12.492 901 HB3 GLU 118 1HB GLU 118 -4.062 -8.784 -11.522 902 HG2 GLU 118 2HG GLU 118 -4.341 -6.478 -12.425 903 HG3 GLU 118 1HG GLU 118 -2.931 -6.731 -13.449 904 H LEU 119 H LEU 119 -2.043 -5.073 -10.549 905 HA LEU 119 HA LEU 119 -4.529 -4.749 -8.927 906 HB2 LEU 119 2HB LEU 119 -2.352 -4.340 -7.724 907 HB3 LEU 119 1HB LEU 119 -2.047 -3.014 -8.844 908 HG LEU 119 HG LEU 119 -4.707 -2.976 -7.533 909 HD11 LEU 119 1HD1 LEU 119 -2.179 -2.334 -5.982 910 HD12 LEU 119 2HD1 LEU 119 -3.205 -3.741 -5.692 911 HD13 LEU 119 3HD1 LEU 119 -3.837 -2.117 -5.417 912 HD21 LEU 119 1HD2 LEU 119 -3.963 -1.161 -8.999 913 HD22 LEU 119 2HD2 LEU 119 -2.513 -0.935 -8.023 914 HD23 LEU 119 3HD2 LEU 119 -4.098 -0.561 -7.347 915 H ALA 120 H ALA 120 -6.065 -3.473 -9.832 916 HA ALA 120 HA ALA 120 -5.196 -1.422 -11.817 917 HB1 ALA 120 1HB ALA 120 -6.356 -2.392 -13.480 918 HB2 ALA 120 2HB ALA 120 -7.804 -2.468 -12.476 919 HB3 ALA 120 3HB ALA 120 -6.626 -3.780 -12.425 920 H HIS 121 H HIS 121 -6.231 0.535 -11.589 921 HA HIS 121 HA HIS 121 -8.487 0.665 -9.622 922 HB2 HIS 121 2HB HIS 121 -7.346 2.202 -8.431 923 HB3 HIS 121 1HB HIS 121 -5.946 1.905 -9.459 924 HD1 HIS 121 1HD HIS 121 -9.230 3.808 -10.028 925 HD2 HIS 121 2HD HIS 121 -5.113 4.331 -10.452 926 HE1 HIS 121 1HE HIS 121 -8.900 6.099 -11.059 927 HE2 HIS 121 2HE HIS 121 -6.399 6.434 -11.303 928 H VAL 122 H VAL 122 -10.296 1.792 -10.317 929 HA VAL 122 HA VAL 122 -10.033 3.404 -12.806 930 HB VAL 122 HB VAL 122 -12.087 2.343 -13.709 931 HG11 VAL 122 1HG1 VAL 122 -10.328 0.011 -13.171 932 HG12 VAL 122 2HG1 VAL 122 -9.542 1.430 -13.863 933 HG13 VAL 122 3HG1 VAL 122 -10.887 0.667 -14.709 934 HG21 VAL 122 1HG2 VAL 122 -11.821 0.797 -11.143 935 HG22 VAL 122 2HG2 VAL 122 -12.555 0.027 -12.550 936 HG23 VAL 122 3HG2 VAL 122 -13.266 1.493 -11.876 937 H LYS 123 H LYS 123 -11.514 5.085 -12.984 938 HA LYS 123 HA LYS 123 -12.979 6.744 -12.247 939 HB2 LYS 123 2HB LYS 123 -14.264 4.413 -10.802 940 HB3 LYS 123 1HB LYS 123 -15.023 5.967 -11.148 941 HG2 LYS 123 2HG LYS 123 -14.695 5.569 -13.574 942 HG3 LYS 123 1HG LYS 123 -14.002 3.989 -13.206 943 HD2 LYS 123 2HD LYS 123 -16.137 3.398 -12.029 944 HD3 LYS 123 1HD LYS 123 -16.820 4.919 -12.607 945 HE2 LYS 123 2HE LYS 123 -16.508 4.244 -14.918 946 HE3 LYS 123 1HE LYS 123 -15.654 2.784 -14.416 947 HZ1 LYS 123 1HZ LYS 123 -18.463 3.276 -14.578 948 HZ2 LYS 123 2HZ LYS 123 -18.013 2.700 -13.044 949 HZ3 LYS 123 3HZ LYS 123 -17.633 1.804 -14.438 950 H LEU 124 H LEU 124 -10.571 6.207 -10.566 951 HA LEU 124 HA LEU 124 -11.333 6.425 -7.789 952 HB2 LEU 124 2HB LEU 124 -9.064 5.734 -8.499 953 HB3 LEU 124 1HB LEU 124 -8.783 7.352 -9.150 954 HG LEU 124 HG LEU 124 -9.211 8.273 -6.851 955 HD11 LEU 124 1HD1 LEU 124 -8.779 6.281 -5.100 956 HD12 LEU 124 2HD1 LEU 124 -9.627 5.362 -6.342 957 HD13 LEU 124 3HD1 LEU 124 -10.403 6.756 -5.593 958 HD21 LEU 124 1HD2 LEU 124 -6.937 6.903 -7.874 959 HD22 LEU 124 2HD2 LEU 124 -7.043 6.522 -6.154 960 HD23 LEU 124 3HD2 LEU 124 -6.967 8.203 -6.681 961 H HIS 125 H HIS 125 -10.734 8.757 -10.366 962 HA HIS 125 HA HIS 125 -10.725 11.119 -8.785 963 HB2 HIS 125 2HB HIS 125 -10.030 11.218 -11.097 964 HB3 HIS 125 1HB HIS 125 -11.621 10.684 -11.636 965 HD1 HIS 125 1HD HIS 125 -11.502 13.081 -8.809 966 HD2 HIS 125 2HD HIS 125 -11.982 13.254 -12.948 967 HE1 HIS 125 1HE HIS 125 -12.381 15.397 -9.329 968 HE2 HIS 125 2HE HIS 125 -12.665 15.520 -11.848 969 H ARG 126 H ARG 126 -13.376 9.061 -9.775 970 HA ARG 126 HA ARG 126 -15.549 10.785 -9.742 971 HB2 ARG 126 2HB ARG 126 -16.896 8.926 -9.139 972 HB3 ARG 126 1HB ARG 126 -15.525 8.222 -9.991 973 HG2 ARG 126 2HG ARG 126 -14.422 7.912 -7.722 974 HG3 ARG 126 1HG ARG 126 -15.973 8.351 -7.008 975 HD2 ARG 126 2HD ARG 126 -15.486 6.040 -8.907 976 HD3 ARG 126 1HD ARG 126 -15.797 5.912 -7.175 977 HE ARG 126 HE ARG 126 -17.926 7.364 -8.446 978 HH11 ARG 126 1HH1 ARG 126 -19.886 6.282 -8.752 979 HH12 ARG 126 2HH1 ARG 126 -19.924 4.551 -8.686 980 HH21 ARG 126 1HH2 ARG 126 -16.526 4.237 -8.066 981 HH22 ARG 126 2HH2 ARG 126 -18.021 3.393 -8.299 982 H HIS 127 H HIS 127 -13.454 9.882 -7.110 983 HA HIS 127 HA HIS 127 -15.080 10.592 -4.897 984 HB2 HIS 127 2HB HIS 127 -12.613 9.611 -5.078 985 HB3 HIS 127 1HB HIS 127 -12.177 11.310 -4.898 986 HD1 HIS 127 1HD HIS 127 -14.838 11.802 -3.037 987 HD2 HIS 127 2HD HIS 127 -11.733 9.091 -2.385 988 HE1 HIS 127 1HE HIS 127 -14.839 11.292 -0.553 989 HE2 HIS 127 2HE HIS 127 -12.952 9.645 -0.147 990 H GLY 128 H GLY 128 -13.012 12.565 -6.987 991 HA2 GLY 128 2HA GLY 128 -12.703 14.914 -7.036 992 HA3 GLY 128 1HA GLY 128 -14.459 14.865 -7.164 993 H ASP 129 H ASP 129 -13.026 13.680 -4.231 994 HA ASP 129 HA ASP 129 -14.099 16.085 -2.825 995 HB2 ASP 129 2HB ASP 129 -13.497 13.287 -1.825 996 HB3 ASP 129 1HB ASP 129 -14.059 14.610 -0.804 997 H GLY 130 H GLY 130 -11.277 15.325 -4.086 998 HA2 GLY 130 2HA GLY 130 -9.205 16.430 -3.559 999 HA3 GLY 130 1HA GLY 130 -9.767 16.637 -1.898 1000 H ALA 131 H ALA 131 -10.384 13.543 -3.123 1001 HA ALA 131 HA ALA 131 -8.849 12.171 -1.194 1002 HB1 ALA 131 1HB ALA 131 -10.648 11.479 -3.201 1003 HB2 ALA 131 2HB ALA 131 -9.853 10.358 -2.096 1004 HB3 ALA 131 3HB ALA 131 -9.155 10.674 -3.686 1005 H TRP 132 H TRP 132 -7.948 13.333 -4.399 1006 HA TRP 132 HA TRP 132 -5.620 11.809 -4.831 1007 HB2 TRP 132 2HB TRP 132 -6.647 13.501 -6.415 1008 HB3 TRP 132 1HB TRP 132 -5.876 14.760 -5.451 1009 HD1 TRP 132 HD TRP 132 -3.642 15.484 -6.382 1010 HE1 TRP 132 1HE TRP 132 -1.740 14.378 -7.726 1011 HE3 TRP 132 3HE TRP 132 -5.504 10.744 -6.824 1012 HZ2 TRP 132 2HZ TRP 132 -1.094 11.824 -8.839 1013 HZ3 TRP 132 3HZ TRP 132 -4.223 8.999 -8.024 1014 HH2 TRP 132 HH TRP 132 -2.024 9.532 -9.032 1015 H ASN 133 H ASN 133 -6.088 14.666 -2.783 1016 HA ASN 133 HA ASN 133 -3.378 15.177 -2.146 1017 HB2 ASN 133 2HB ASN 133 -5.872 15.425 -0.437 1018 HB3 ASN 133 1HB ASN 133 -4.302 16.092 -0.001 1019 HD21 ASN 133 1HD2 ASN 133 -6.557 17.804 -0.410 1020 HD22 ASN 133 2HD2 ASN 133 -6.284 18.729 -1.806 1021 H ILE 134 H ILE 134 -5.693 12.892 -0.723 1022 HA ILE 134 HA ILE 134 -3.994 11.905 1.353 1023 HB ILE 134 HB ILE 134 -6.353 10.792 -0.133 1024 HG12 ILE 134 2HG1 ILE 134 -7.452 11.053 1.990 1025 HG13 ILE 134 1HG1 ILE 134 -5.916 11.320 2.815 1026 HG21 ILE 134 1HG2 ILE 134 -6.245 8.890 1.571 1027 HG22 ILE 134 2HG2 ILE 134 -4.568 9.361 1.838 1028 HG23 ILE 134 3HG2 ILE 134 -5.086 8.809 0.247 1029 HD11 ILE 134 1HD1 ILE 134 -5.613 13.446 1.774 1030 HD12 ILE 134 2HD1 ILE 134 -7.293 13.414 2.303 1031 HD13 ILE 134 3HD1 ILE 134 -6.898 13.137 0.608 1032 H HIS 135 H HIS 135 -4.451 10.896 -2.022 1033 HA HIS 135 HA HIS 135 -2.778 8.603 -1.969 1034 HB2 HIS 135 2HB HIS 135 -4.273 9.354 -3.878 1035 HB3 HIS 135 1HB HIS 135 -3.030 10.537 -4.287 1036 HD1 HIS 135 1HD HIS 135 -0.463 9.133 -4.176 1037 HD2 HIS 135 2HD HIS 135 -3.891 7.157 -5.493 1038 HE1 HIS 135 1HE HIS 135 0.331 7.157 -5.550 1039 HE2 HIS 135 2HE HIS 135 -1.747 5.947 -6.356 1040 H LYS 136 H LYS 136 -2.005 12.040 -2.449 1041 HA LYS 136 HA LYS 136 0.737 11.756 -3.104 1042 HB2 LYS 136 2HB LYS 136 -0.628 13.920 -1.492 1043 HB3 LYS 136 1HB LYS 136 0.987 14.049 -2.174 1044 HG2 LYS 136 2HG LYS 136 0.013 13.659 -4.430 1045 HG3 LYS 136 1HG LYS 136 -1.589 13.678 -3.706 1046 HD2 LYS 136 2HD LYS 136 -1.126 15.971 -2.835 1047 HD3 LYS 136 1HD LYS 136 0.417 15.949 -3.691 1048 HE2 LYS 136 2HE LYS 136 -1.347 15.199 -5.667 1049 HE3 LYS 136 1HE LYS 136 -2.302 16.357 -4.739 1050 HZ1 LYS 136 1HZ LYS 136 -1.199 17.797 -6.066 1051 HZ2 LYS 136 2HZ LYS 136 0.135 16.768 -6.287 1052 HZ3 LYS 136 3HZ LYS 136 -0.021 17.665 -4.853 1053 H ALA 137 H ALA 137 -0.904 11.812 0.030 1054 HA ALA 137 HA ALA 137 1.491 11.765 1.623 1055 HB1 ALA 137 1HB ALA 137 -0.277 12.311 2.978 1056 HB2 ALA 137 2HB ALA 137 -0.315 10.567 3.237 1057 HB3 ALA 137 3HB ALA 137 -1.409 11.309 2.070 1058 H LEU 138 H LEU 138 -0.407 9.288 0.012 1059 HA LEU 138 HA LEU 138 1.075 7.120 1.335 1060 HB2 LEU 138 2HB LEU 138 -0.934 7.014 -0.930 1061 HB3 LEU 138 1HB LEU 138 -0.352 5.647 0.006 1062 HG LEU 138 HG LEU 138 -1.949 7.992 1.064 1063 HD11 LEU 138 1HD1 LEU 138 -2.680 5.055 0.978 1064 HD12 LEU 138 2HD1 LEU 138 -3.134 6.183 -0.299 1065 HD13 LEU 138 3HD1 LEU 138 -3.736 6.420 1.343 1066 HD21 LEU 138 1HD2 LEU 138 -1.958 6.277 3.088 1067 HD22 LEU 138 2HD2 LEU 138 -0.629 7.418 2.883 1068 HD23 LEU 138 3HD2 LEU 138 -0.447 5.747 2.350 1069 H ASP 139 H ASP 139 1.626 9.243 -1.177 1070 HA ASP 139 HA ASP 139 2.914 7.359 -3.007 1071 HB2 ASP 139 2HB ASP 139 1.843 9.484 -3.787 1072 HB3 ASP 139 1HB ASP 139 3.096 10.384 -2.932 1073 H GLY 140 H GLY 140 4.785 6.439 -2.356 1074 HA2 GLY 140 2HA GLY 140 6.639 7.949 -0.612 1075 HA3 GLY 140 1HA GLY 140 6.752 6.230 -0.986 1076 HA PRO 141 HA PRO 141 9.954 8.690 -3.444 1077 HB2 PRO 141 2HB PRO 141 11.416 6.164 -2.850 1078 HB3 PRO 141 1HB PRO 141 11.979 7.842 -2.752 1079 HG2 PRO 141 2HG PRO 141 11.409 6.409 -0.568 1080 HG3 PRO 141 1HG PRO 141 11.114 8.153 -0.657 1081 HD2 PRO 141 2HD PRO 141 9.153 5.907 -0.756 1082 HD3 PRO 141 1HD PRO 141 8.946 7.563 -0.144 1083 H SER 142 H SER 142 10.436 8.294 -5.643 1084 HA SER 142 HA SER 142 10.169 7.293 -7.753 1085 HB2 SER 142 2HB SER 142 11.561 5.519 -6.436 1086 HB3 SER 142 1HB SER 142 10.047 4.622 -6.363 1087 HG SER 142 HG SER 142 9.965 4.721 -8.633 1088 HA PRO 143 HA PRO 143 5.610 7.000 -6.525 1089 HB2 PRO 143 2HB PRO 143 5.532 8.771 -8.921 1090 HB3 PRO 143 1HB PRO 143 4.676 8.924 -7.375 1091 HG2 PRO 143 2HG PRO 143 6.767 10.469 -7.990 1092 HG3 PRO 143 1HG PRO 143 6.450 9.924 -6.334 1093 HD2 PRO 143 2HD PRO 143 8.545 9.003 -8.247 1094 HD3 PRO 143 1HD PRO 143 8.578 9.053 -6.471 1095 H GLY 144 H GLY 144 4.101 5.668 -7.545 1096 HA2 GLY 144 2HA GLY 144 3.897 5.084 -10.290 1097 HA3 GLY 144 1HA GLY 144 5.026 3.905 -9.619 1098 H GLU 145 H GLU 145 3.081 2.505 -10.401 1099 HA GLU 145 HA GLU 145 0.582 2.450 -9.133 1100 HB2 GLU 145 2HB GLU 145 1.009 -0.190 -9.362 1101 HB3 GLU 145 1HB GLU 145 0.693 0.827 -10.767 1102 HG2 GLU 145 2HG GLU 145 3.520 0.559 -9.822 1103 HG3 GLU 145 1HG GLU 145 2.803 -0.792 -10.698 1104 H THR 146 H THR 146 -0.175 1.126 -7.303 1105 HA THR 146 HA THR 146 1.317 1.509 -4.924 1106 HB THR 146 HB THR 146 -0.868 -0.491 -5.525 1107 HG1 THR 146 1HG THR 146 -2.194 1.085 -5.021 1108 HG21 THR 146 1HG2 THR 146 -1.136 -0.201 -2.930 1109 HG22 THR 146 2HG2 THR 146 0.565 0.261 -3.001 1110 HG23 THR 146 3HG2 THR 146 0.061 -1.334 -3.563 1111 H LEU 147 H LEU 147 1.134 -1.251 -7.120 1112 HA LEU 147 HA LEU 147 2.524 -3.133 -5.523 1113 HB2 LEU 147 2HB LEU 147 2.626 -2.849 -8.536 1114 HB3 LEU 147 1HB LEU 147 2.951 -4.308 -7.600 1115 HG LEU 147 HG LEU 147 0.306 -2.835 -7.734 1116 HD11 LEU 147 1HD1 LEU 147 -0.487 -4.680 -9.004 1117 HD12 LEU 147 2HD1 LEU 147 0.932 -5.654 -8.621 1118 HD13 LEU 147 3HD1 LEU 147 1.076 -4.278 -9.715 1119 HD21 LEU 147 1HD2 LEU 147 -0.353 -5.077 -6.509 1120 HD22 LEU 147 2HD2 LEU 147 0.311 -3.733 -5.580 1121 HD23 LEU 147 3HD2 LEU 147 1.347 -5.085 -6.036 1122 H ALA 148 H ALA 148 3.694 -0.470 -7.516 1123 HA ALA 148 HA ALA 148 6.437 -1.237 -7.641 1124 HB1 ALA 148 1HB ALA 148 6.849 1.249 -7.912 1125 HB2 ALA 148 2HB ALA 148 5.125 1.494 -7.629 1126 HB3 ALA 148 3HB ALA 148 5.667 0.574 -9.033 1127 H ARG 149 H ARG 149 4.848 1.014 -5.353 1128 HA ARG 149 HA ARG 149 7.146 1.272 -3.660 1129 HB2 ARG 149 2HB ARG 149 4.207 1.678 -3.084 1130 HB3 ARG 149 1HB ARG 149 5.509 2.168 -2.007 1131 HG2 ARG 149 2HG ARG 149 6.450 3.568 -3.852 1132 HG3 ARG 149 1HG ARG 149 5.044 3.155 -4.833 1133 HD2 ARG 149 2HD ARG 149 4.998 4.598 -2.166 1134 HD3 ARG 149 1HD ARG 149 4.680 5.316 -3.744 1135 HE ARG 149 HE ARG 149 2.819 3.676 -2.199 1136 HH11 ARG 149 1HH1 ARG 149 0.779 3.401 -3.134 1137 HH12 ARG 149 2HH1 ARG 149 0.544 3.804 -4.802 1138 HH21 ARG 149 1HH2 ARG 149 3.827 4.807 -5.297 1139 HH22 ARG 149 2HH2 ARG 149 2.269 4.601 -6.026 1140 H PHE 150 H PHE 150 4.324 -0.875 -3.571 1141 HA PHE 150 HA PHE 150 4.918 -2.109 -1.058 1142 HB2 PHE 150 2HB PHE 150 2.729 -2.316 -2.165 1143 HB3 PHE 150 1HB PHE 150 3.474 -3.233 -3.472 1144 HD1 PHE 150 1HD PHE 150 2.571 -3.283 0.119 1145 HD2 PHE 150 2HD PHE 150 4.122 -5.532 -3.196 1146 HE1 PHE 150 1HE PHE 150 2.306 -5.381 1.416 1147 HE2 PHE 150 2HE PHE 150 3.858 -7.629 -1.898 1148 HZ PHE 150 HZ PHE 150 2.952 -7.552 0.404 1149 H ALA 151 H ALA 151 5.831 -2.982 -4.393 1150 HA ALA 151 HA ALA 151 7.168 -5.415 -3.673 1151 HB1 ALA 151 1HB ALA 151 6.452 -4.797 -5.995 1152 HB2 ALA 151 2HB ALA 151 8.127 -5.338 -5.899 1153 HB3 ALA 151 3HB ALA 151 7.762 -3.618 -6.038 1154 H ASN 152 H ASN 152 8.324 -2.069 -3.989 1155 HA ASN 152 HA ASN 152 11.098 -2.630 -3.713 1156 HB2 ASN 152 2HB ASN 152 9.527 -0.202 -2.841 1157 HB3 ASN 152 1HB ASN 152 11.284 -0.272 -2.939 1158 HD21 ASN 152 1HD2 ASN 152 9.765 1.558 -4.548 1159 HD22 ASN 152 2HD2 ASN 152 9.917 1.089 -6.172 1160 H VAL 153 H VAL 153 8.694 -1.797 -1.209 1161 HA VAL 153 HA VAL 153 10.563 -2.088 0.964 1162 HB VAL 153 HB VAL 153 8.539 -2.053 2.387 1163 HG11 VAL 153 1HG1 VAL 153 8.688 -0.096 0.086 1164 HG12 VAL 153 2HG1 VAL 153 9.355 0.093 1.707 1165 HG13 VAL 153 3HG1 VAL 153 7.609 0.136 1.462 1166 HG21 VAL 153 1HG2 VAL 153 6.324 -1.853 1.277 1167 HG22 VAL 153 2HG2 VAL 153 7.076 -3.415 0.959 1168 HG23 VAL 153 3HG2 VAL 153 7.095 -2.160 -0.277 1169 H ILE 154 H ILE 154 8.277 -4.278 -0.610 1170 HA ILE 154 HA ILE 154 8.829 -6.429 1.302 1171 HB ILE 154 HB ILE 154 7.142 -6.138 -1.163 1172 HG12 ILE 154 2HG1 ILE 154 6.701 -5.601 1.490 1173 HG13 ILE 154 1HG1 ILE 154 5.435 -5.941 0.318 1174 HG21 ILE 154 1HG2 ILE 154 6.405 -8.521 -0.708 1175 HG22 ILE 154 2HG2 ILE 154 7.840 -8.680 0.310 1176 HG23 ILE 154 3HG2 ILE 154 8.012 -8.347 -1.412 1177 HD11 ILE 154 1HD1 ILE 154 5.325 -7.317 2.443 1178 HD12 ILE 154 2HD1 ILE 154 6.819 -8.098 1.932 1179 HD13 ILE 154 3HD1 ILE 154 5.360 -8.261 0.955 Start of MODEL 4 1 H1 MET 1 1HT MET 1 4.001 13.900 -4.509 2 H2 MET 1 2HT MET 1 2.979 12.609 -4.925 3 H3 MET 1 3HT MET 1 2.318 14.084 -4.402 4 HA MET 1 HA MET 1 2.076 14.528 -6.567 5 HB2 MET 1 2HB MET 1 3.978 15.982 -5.789 6 HB3 MET 1 1HB MET 1 5.094 14.788 -6.451 7 HG2 MET 1 2HG MET 1 4.396 15.187 -8.669 8 HG3 MET 1 1HG MET 1 2.904 15.971 -8.152 9 HE1 MET 1 1HE MET 1 5.762 17.663 -10.148 10 HE2 MET 1 2HE MET 1 4.292 18.623 -10.001 11 HE3 MET 1 3HE MET 1 4.178 16.879 -10.219 12 HA PRO 2 HA PRO 2 3.561 10.515 -8.305 13 HB2 PRO 2 2HB PRO 2 1.119 9.261 -8.395 14 HB3 PRO 2 1HB PRO 2 2.214 9.180 -7.006 15 HG2 PRO 2 2HG PRO 2 -0.333 10.543 -7.258 16 HG3 PRO 2 1HG PRO 2 0.621 10.203 -5.808 17 HD2 PRO 2 2HD PRO 2 0.415 12.695 -7.301 18 HD3 PRO 2 1HD PRO 2 1.213 12.401 -5.740 19 H GLU 3 H GLU 3 2.843 9.501 -10.448 20 HA GLU 3 HA GLU 3 2.494 11.349 -12.495 21 HB2 GLU 3 2HB GLU 3 1.261 8.582 -12.448 22 HB3 GLU 3 1HB GLU 3 1.679 9.511 -13.884 23 HG2 GLU 3 2HG GLU 3 4.071 9.486 -13.139 24 HG3 GLU 3 1HG GLU 3 3.605 8.424 -11.808 25 H GLU 4 H GLU 4 0.561 12.172 -13.596 26 HA GLU 4 HA GLU 4 -1.512 13.044 -11.944 27 HB2 GLU 4 2HB GLU 4 -1.703 12.398 -14.893 28 HB3 GLU 4 1HB GLU 4 -2.857 13.380 -13.986 29 HG2 GLU 4 2HG GLU 4 0.100 13.996 -14.270 30 HG3 GLU 4 1HG GLU 4 -1.189 14.775 -15.179 31 H ILE 5 H ILE 5 -3.741 12.294 -11.697 32 HA ILE 5 HA ILE 5 -4.071 9.701 -10.836 33 HB ILE 5 HB ILE 5 -6.028 11.609 -12.111 34 HG12 ILE 5 2HG1 ILE 5 -5.839 10.444 -9.319 35 HG13 ILE 5 1HG1 ILE 5 -5.116 11.981 -9.797 36 HG21 ILE 5 1HG2 ILE 5 -6.465 8.750 -11.263 37 HG22 ILE 5 2HG2 ILE 5 -7.037 9.568 -12.716 38 HG23 ILE 5 3HG2 ILE 5 -7.772 9.928 -11.155 39 HD11 ILE 5 1HD1 ILE 5 -7.156 12.717 -8.972 40 HD12 ILE 5 2HD1 ILE 5 -8.005 11.257 -9.484 41 HD13 ILE 5 3HD1 ILE 5 -7.566 12.484 -10.672 42 HA PRO 6 HA PRO 6 -3.788 7.785 -14.985 43 HB2 PRO 6 2HB PRO 6 -2.616 5.479 -14.250 44 HB3 PRO 6 1HB PRO 6 -1.703 6.999 -14.311 45 HG2 PRO 6 2HG PRO 6 -2.752 5.517 -11.969 46 HG3 PRO 6 1HG PRO 6 -1.279 6.486 -12.130 47 HD2 PRO 6 2HD PRO 6 -3.711 7.340 -10.970 48 HD3 PRO 6 1HD PRO 6 -2.341 8.374 -11.422 49 H ASP 7 H ASP 7 -5.023 6.083 -15.996 50 HA ASP 7 HA ASP 7 -7.417 5.295 -14.584 51 HB2 ASP 7 2HB ASP 7 -6.230 4.356 -17.216 52 HB3 ASP 7 1HB ASP 7 -7.837 3.924 -16.638 53 H VAL 8 H VAL 8 -6.931 2.512 -16.074 54 HA VAL 8 HA VAL 8 -6.562 0.939 -13.767 55 HB VAL 8 HB VAL 8 -6.211 -0.917 -15.272 56 HG11 VAL 8 1HG1 VAL 8 -8.451 0.316 -15.268 57 HG12 VAL 8 2HG1 VAL 8 -8.133 -0.705 -16.671 58 HG13 VAL 8 3HG1 VAL 8 -7.939 1.043 -16.791 59 HG21 VAL 8 1HG2 VAL 8 -5.196 1.254 -17.054 60 HG22 VAL 8 2HG2 VAL 8 -5.986 -0.125 -17.820 61 HG23 VAL 8 3HG2 VAL 8 -4.567 -0.375 -16.802 62 H ARG 9 H ARG 9 -4.726 0.094 -12.755 63 HA ARG 9 HA ARG 9 -2.187 1.428 -13.439 64 HB2 ARG 9 2HB ARG 9 -3.036 -0.300 -11.107 65 HB3 ARG 9 1HB ARG 9 -1.386 0.276 -11.316 66 HG2 ARG 9 2HG ARG 9 -2.283 2.617 -11.417 67 HG3 ARG 9 1HG ARG 9 -3.877 1.973 -11.024 68 HD2 ARG 9 2HD ARG 9 -2.925 0.981 -8.945 69 HD3 ARG 9 1HD ARG 9 -1.380 1.743 -9.319 70 HE ARG 9 HE ARG 9 -3.042 3.892 -9.342 71 HH11 ARG 9 1HH1 ARG 9 -3.717 5.050 -7.524 72 HH12 ARG 9 2HH1 ARG 9 -3.793 4.257 -5.986 73 HH21 ARG 9 1HH2 ARG 9 -2.703 1.201 -7.211 74 HH22 ARG 9 2HH2 ARG 9 -3.219 2.078 -5.809 75 H LYS 10 H LYS 10 -0.434 -0.649 -12.463 76 HA LYS 10 HA LYS 10 -0.676 -2.604 -14.706 77 HB2 LYS 10 2HB LYS 10 1.752 -1.265 -13.503 78 HB3 LYS 10 1HB LYS 10 1.839 -2.613 -14.629 79 HG2 LYS 10 2HG LYS 10 0.534 -1.292 -16.276 80 HG3 LYS 10 1HG LYS 10 0.552 0.074 -15.159 81 HD2 LYS 10 2HD LYS 10 3.048 0.021 -15.196 82 HD3 LYS 10 1HD LYS 10 2.972 -1.256 -16.411 83 HE2 LYS 10 2HE LYS 10 1.438 1.270 -16.898 84 HE3 LYS 10 1HE LYS 10 3.186 1.286 -17.138 85 HZ1 LYS 10 1HZ LYS 10 1.118 -0.166 -18.606 86 HZ2 LYS 10 2HZ LYS 10 2.619 -0.937 -18.405 87 HZ3 LYS 10 3HZ LYS 10 2.534 0.575 -19.175 88 H SER 11 H SER 11 1.142 -4.399 -14.195 89 HA SER 11 HA SER 11 0.554 -5.427 -11.442 90 HB2 SER 11 2HB SER 11 0.546 -7.663 -12.348 91 HB3 SER 11 1HB SER 11 -0.503 -6.691 -13.371 92 HG SER 11 HG SER 11 2.224 -7.311 -13.858 93 H VAL 12 H VAL 12 2.307 -6.475 -10.369 94 HA VAL 12 HA VAL 12 4.945 -6.355 -11.734 95 HB VAL 12 HB VAL 12 4.243 -5.086 -9.098 96 HG11 VAL 12 1HG1 VAL 12 6.788 -4.691 -9.002 97 HG12 VAL 12 2HG1 VAL 12 6.910 -6.009 -10.168 98 HG13 VAL 12 3HG1 VAL 12 6.214 -6.303 -8.575 99 HG21 VAL 12 1HG2 VAL 12 5.648 -4.139 -11.609 100 HG22 VAL 12 2HG2 VAL 12 5.439 -3.166 -10.152 101 HG23 VAL 12 3HG2 VAL 12 4.029 -3.673 -11.085 102 H VAL 13 H VAL 13 6.490 -7.833 -10.896 103 HA VAL 13 HA VAL 13 5.245 -10.066 -9.372 104 HB VAL 13 HB VAL 13 7.867 -9.984 -10.898 105 HG11 VAL 13 1HG1 VAL 13 7.434 -12.538 -10.775 106 HG12 VAL 13 2HG1 VAL 13 6.316 -12.143 -9.470 107 HG13 VAL 13 3HG1 VAL 13 8.025 -11.735 -9.320 108 HG21 VAL 13 1HG2 VAL 13 5.458 -11.512 -11.805 109 HG22 VAL 13 2HG2 VAL 13 6.758 -10.800 -12.761 110 HG23 VAL 13 3HG2 VAL 13 5.491 -9.772 -12.092 111 H VAL 14 H VAL 14 5.938 -10.549 -7.319 112 HA VAL 14 HA VAL 14 8.355 -9.101 -6.313 113 HB VAL 14 HB VAL 14 7.225 -8.744 -4.192 114 HG11 VAL 14 1HG1 VAL 14 6.677 -7.383 -6.459 115 HG12 VAL 14 2HG1 VAL 14 5.961 -6.968 -4.901 116 HG13 VAL 14 3HG1 VAL 14 5.052 -7.941 -6.056 117 HG21 VAL 14 1HG2 VAL 14 5.761 -10.438 -3.708 118 HG22 VAL 14 2HG2 VAL 14 5.307 -10.663 -5.396 119 HG23 VAL 14 3HG2 VAL 14 4.590 -9.353 -4.458 120 H ALA 15 H ALA 15 9.482 -10.221 -4.563 121 HA ALA 15 HA ALA 15 9.248 -13.154 -4.846 122 HB1 ALA 15 1HB ALA 15 11.369 -11.277 -4.240 123 HB2 ALA 15 2HB ALA 15 11.489 -12.975 -4.701 124 HB3 ALA 15 3HB ALA 15 11.288 -12.535 -3.006 125 H ALA 16 H ALA 16 7.402 -13.654 -3.620 126 HA ALA 16 HA ALA 16 7.805 -13.893 -0.766 127 HB1 ALA 16 1HB ALA 16 5.664 -11.962 -1.716 128 HB2 ALA 16 2HB ALA 16 7.145 -11.505 -0.874 129 HB3 ALA 16 3HB ALA 16 5.926 -12.476 -0.051 130 H SER 17 H SER 17 6.281 -15.372 0.125 131 HA SER 17 HA SER 17 5.006 -17.132 -1.755 132 HB2 SER 17 2HB SER 17 4.547 -16.882 1.232 133 HB3 SER 17 1HB SER 17 4.084 -18.253 0.229 134 HG SER 17 HG SER 17 6.741 -17.286 0.374 135 H VAL 18 H VAL 18 2.753 -17.424 -2.168 136 HA VAL 18 HA VAL 18 1.197 -15.058 -2.389 137 HB VAL 18 HB VAL 18 -0.213 -17.678 -2.175 138 HG11 VAL 18 1HG1 VAL 18 -0.886 -15.238 -3.175 139 HG12 VAL 18 2HG1 VAL 18 -1.605 -16.749 -3.725 140 HG13 VAL 18 3HG1 VAL 18 -0.277 -16.026 -4.628 141 HG21 VAL 18 1HG2 VAL 18 1.663 -18.603 -3.216 142 HG22 VAL 18 2HG2 VAL 18 2.062 -17.101 -4.053 143 HG23 VAL 18 3HG2 VAL 18 0.704 -18.084 -4.602 144 H GLU 19 H GLU 19 1.141 -17.673 0.011 145 HA GLU 19 HA GLU 19 -1.085 -16.815 1.528 146 HB2 GLU 19 2HB GLU 19 0.176 -18.963 1.860 147 HB3 GLU 19 1HB GLU 19 1.469 -18.033 2.621 148 HG2 GLU 19 2HG GLU 19 -0.177 -17.176 4.284 149 HG3 GLU 19 1HG GLU 19 -1.407 -18.214 3.564 150 H HIS 20 H HIS 20 2.276 -15.727 1.546 151 HA HIS 20 HA HIS 20 2.131 -14.064 3.864 152 HB2 HIS 20 2HB HIS 20 4.284 -13.649 3.327 153 HB3 HIS 20 1HB HIS 20 4.057 -14.673 1.909 154 HD1 HIS 20 1HD HIS 20 2.828 -13.260 -0.193 155 HD2 HIS 20 2HD HIS 20 5.024 -11.085 2.611 156 HE1 HIS 20 1HE HIS 20 3.379 -11.033 -1.275 157 HE2 HIS 20 2HE HIS 20 4.697 -9.703 0.427 158 H CYS 21 H CYS 21 1.329 -13.478 0.462 159 HA CYS 21 HA CYS 21 0.941 -10.706 0.497 160 HB2 CYS 21 2HB CYS 21 -0.876 -12.695 -0.893 161 HB3 CYS 21 1HB CYS 21 -0.543 -11.037 -1.382 162 HG CYS 21 HG CYS 21 1.974 -12.774 -1.263 163 H PHE 22 H PHE 22 -1.624 -13.153 1.033 164 HA PHE 22 HA PHE 22 -3.518 -11.178 1.944 165 HB2 PHE 22 2HB PHE 22 -3.647 -14.119 2.593 166 HB3 PHE 22 1HB PHE 22 -4.982 -12.999 2.301 167 HD1 PHE 22 1HD PHE 22 -5.331 -12.056 -0.021 168 HD2 PHE 22 2HD PHE 22 -2.538 -15.213 0.802 169 HE1 PHE 22 1HE PHE 22 -5.233 -12.601 -2.438 170 HE2 PHE 22 2HE PHE 22 -2.445 -15.761 -1.609 171 HZ PHE 22 HZ PHE 22 -3.787 -14.454 -3.230 172 H GLU 23 H GLU 23 -1.287 -13.354 3.635 173 HA GLU 23 HA GLU 23 -2.334 -12.748 6.260 174 HB2 GLU 23 2HB GLU 23 0.342 -13.856 5.371 175 HB3 GLU 23 1HB GLU 23 -0.149 -13.713 7.058 176 HG2 GLU 23 2HG GLU 23 -1.642 -15.286 4.937 177 HG3 GLU 23 1HG GLU 23 -0.588 -15.983 6.167 178 H VAL 24 H VAL 24 0.205 -11.336 4.246 179 HA VAL 24 HA VAL 24 1.433 -9.712 6.201 180 HB VAL 24 HB VAL 24 1.106 -9.557 3.234 181 HG11 VAL 24 1HG1 VAL 24 1.946 -7.309 5.058 182 HG12 VAL 24 2HG1 VAL 24 0.834 -7.257 3.691 183 HG13 VAL 24 3HG1 VAL 24 2.567 -7.432 3.412 184 HG21 VAL 24 1HG2 VAL 24 3.598 -9.504 3.401 185 HG22 VAL 24 2HG2 VAL 24 2.900 -10.916 4.194 186 HG23 VAL 24 3HG2 VAL 24 3.455 -9.546 5.157 187 H PHE 25 H PHE 25 -1.413 -9.011 4.150 188 HA PHE 25 HA PHE 25 -1.775 -6.342 5.151 189 HB2 PHE 25 2HB PHE 25 -4.065 -8.079 4.259 190 HB3 PHE 25 1HB PHE 25 -3.836 -6.349 4.022 191 HD1 PHE 25 1HD PHE 25 -1.080 -6.197 2.992 192 HD2 PHE 25 2HD PHE 25 -4.209 -9.009 2.137 193 HE1 PHE 25 1HE PHE 25 -0.064 -6.648 0.775 194 HE2 PHE 25 2HE PHE 25 -3.194 -9.463 -0.084 195 HZ PHE 25 HZ PHE 25 -1.121 -8.281 -0.763 196 H THR 26 H THR 26 -3.293 -9.436 6.105 197 HA THR 26 HA THR 26 -4.599 -8.037 8.366 198 HB THR 26 HB THR 26 -5.996 -9.979 8.538 199 HG1 THR 26 1HG THR 26 -4.134 -11.152 6.755 200 HG21 THR 26 1HG2 THR 26 -5.396 -9.331 5.641 201 HG22 THR 26 2HG2 THR 26 -6.562 -8.510 6.681 202 HG23 THR 26 3HG2 THR 26 -6.835 -10.185 6.199 203 H SER 27 H SER 27 -1.679 -9.700 7.964 204 HA SER 27 HA SER 27 -1.828 -10.814 10.734 205 HB2 SER 27 2HB SER 27 -0.054 -12.267 10.188 206 HB3 SER 27 1HB SER 27 -1.070 -12.260 8.752 207 HG SER 27 HG SER 27 1.267 -10.701 9.204 208 H ARG 28 H ARG 28 0.774 -9.292 8.767 209 HA ARG 28 HA ARG 28 1.484 -7.730 11.226 210 HB2 ARG 28 2HB ARG 28 3.821 -8.030 10.717 211 HB3 ARG 28 1HB ARG 28 3.059 -9.623 10.710 212 HG2 ARG 28 2HG ARG 28 2.716 -8.774 8.101 213 HG3 ARG 28 1HG ARG 28 4.312 -8.151 8.506 214 HD2 ARG 28 2HD ARG 28 3.356 -11.003 8.556 215 HD3 ARG 28 1HD ARG 28 4.748 -10.328 7.707 216 HE ARG 28 HE ARG 28 5.317 -9.861 10.376 217 HH11 ARG 28 1HH1 ARG 28 6.445 -11.341 11.658 218 HH12 ARG 28 2HH1 ARG 28 6.421 -13.022 11.244 219 HH21 ARG 28 1HH2 ARG 28 4.404 -12.577 8.457 220 HH22 ARG 28 2HH2 ARG 28 5.265 -13.722 9.431 221 HA PRO 29 HA PRO 29 0.880 -4.961 7.447 222 HB2 PRO 29 2HB PRO 29 -0.850 -3.233 8.750 223 HB3 PRO 29 1HB PRO 29 -1.362 -4.577 7.715 224 HG2 PRO 29 2HG PRO 29 -1.265 -4.393 10.671 225 HG3 PRO 29 1HG PRO 29 -2.408 -5.251 9.625 226 HD2 PRO 29 2HD PRO 29 -0.406 -6.509 11.006 227 HD3 PRO 29 1HD PRO 29 -1.071 -7.128 9.479 228 H ALA 30 H ALA 30 1.529 -4.513 10.853 229 HA ALA 30 HA ALA 30 2.502 -1.798 10.688 230 HB1 ALA 30 1HB ALA 30 1.816 -3.286 12.768 231 HB2 ALA 30 2HB ALA 30 3.043 -2.030 12.932 232 HB3 ALA 30 3HB ALA 30 3.526 -3.717 12.746 233 H ASP 31 H ASP 31 3.884 -4.882 9.882 234 HA ASP 31 HA ASP 31 6.636 -4.373 10.241 235 HB2 ASP 31 2HB ASP 31 5.630 -6.538 9.442 236 HB3 ASP 31 1HB ASP 31 5.407 -5.793 7.859 237 H TRP 32 H TRP 32 4.399 -3.188 7.808 238 HA TRP 32 HA TRP 32 6.452 -1.227 6.976 239 HB2 TRP 32 2HB TRP 32 5.912 -1.623 4.561 240 HB3 TRP 32 1HB TRP 32 6.720 -2.993 5.320 241 HD1 TRP 32 HD TRP 32 5.363 -5.200 5.652 242 HE1 TRP 32 1HE TRP 32 3.109 -6.037 4.741 243 HE3 TRP 32 3HE TRP 32 3.476 -0.827 3.856 244 HZ2 TRP 32 2HZ TRP 32 0.808 -4.987 3.421 245 HZ3 TRP 32 3HZ TRP 32 1.248 -0.766 2.769 246 HH2 TRP 32 HH TRP 32 -0.090 -2.843 2.551 247 H TRP 33 H TRP 33 5.421 0.663 7.386 248 HA TRP 33 HA TRP 33 2.479 0.795 7.056 249 HB2 TRP 33 2HB TRP 33 2.521 2.662 8.472 250 HB3 TRP 33 1HB TRP 33 3.862 1.702 9.096 251 HD1 TRP 33 HD TRP 33 3.056 4.971 7.427 252 HE1 TRP 33 1HE TRP 33 5.218 6.339 7.115 253 HE3 TRP 33 3HE TRP 33 6.528 1.422 8.626 254 HZ2 TRP 33 2HZ TRP 33 8.047 5.977 7.342 255 HZ3 TRP 33 3HZ TRP 33 8.947 1.961 8.570 256 HH2 TRP 33 HH TRP 33 9.709 4.231 7.930 257 HA PRO 34 HA PRO 34 2.293 2.816 3.126 258 HB2 PRO 34 2HB PRO 34 1.094 5.105 4.642 259 HB3 PRO 34 1HB PRO 34 0.537 4.327 3.149 260 HG2 PRO 34 2HG PRO 34 -0.571 3.826 5.548 261 HG3 PRO 34 1HG PRO 34 -0.484 2.620 4.255 262 HD2 PRO 34 2HD PRO 34 0.957 2.681 6.816 263 HD3 PRO 34 1HD PRO 34 0.749 1.334 5.676 264 HA PRO 35 HA PRO 35 6.171 5.179 4.010 265 HB2 PRO 35 2HB PRO 35 6.472 4.828 1.078 266 HB3 PRO 35 1HB PRO 35 7.615 4.458 2.381 267 HG2 PRO 35 2HG PRO 35 6.308 2.541 1.049 268 HG3 PRO 35 1HG PRO 35 6.717 2.391 2.767 269 HD2 PRO 35 2HD PRO 35 4.069 2.970 1.503 270 HD3 PRO 35 1HD PRO 35 4.440 2.071 2.991 271 H SER 36 H SER 36 6.278 7.391 3.970 272 HA SER 36 HA SER 36 5.275 8.886 1.641 273 HB2 SER 36 2HB SER 36 3.673 10.207 2.869 274 HB3 SER 36 1HB SER 36 3.282 8.512 3.153 275 HG SER 36 HG SER 36 4.659 8.754 5.081 276 H HIS 37 H HIS 37 5.953 11.162 1.736 277 HA HIS 37 HA HIS 37 8.414 11.468 3.355 278 HB2 HIS 37 2HB HIS 37 8.465 12.004 0.924 279 HB3 HIS 37 1HB HIS 37 7.260 13.263 1.196 280 HD1 HIS 37 1HD HIS 37 10.670 12.316 2.655 281 HD2 HIS 37 2HD HIS 37 8.445 15.706 1.675 282 HE1 HIS 37 1HE HIS 37 12.146 14.314 3.156 283 HE2 HIS 37 2HE HIS 37 10.801 16.382 2.564 284 H VAL 38 H VAL 38 6.249 14.089 2.388 285 HA VAL 38 HA VAL 38 5.779 14.680 5.286 286 HB VAL 38 HB VAL 38 6.255 16.693 3.065 287 HG11 VAL 38 1HG1 VAL 38 6.544 17.827 5.635 288 HG12 VAL 38 2HG1 VAL 38 5.062 16.872 5.693 289 HG13 VAL 38 3HG1 VAL 38 5.251 18.134 4.475 290 HG21 VAL 38 1HG2 VAL 38 8.070 16.559 5.394 291 HG22 VAL 38 2HG2 VAL 38 8.447 16.796 3.688 292 HG23 VAL 38 3HG2 VAL 38 8.161 15.171 4.312 293 H LEU 39 H LEU 39 3.648 14.963 5.790 294 HA LEU 39 HA LEU 39 1.649 16.243 4.345 295 HB2 LEU 39 2HB LEU 39 2.301 13.655 3.166 296 HB3 LEU 39 1HB LEU 39 0.623 13.716 3.697 297 HG LEU 39 HG LEU 39 1.796 16.000 2.114 298 HD11 LEU 39 1HD1 LEU 39 0.448 13.560 0.930 299 HD12 LEU 39 2HD1 LEU 39 2.190 13.831 0.891 300 HD13 LEU 39 3HD1 LEU 39 1.106 14.943 0.056 301 HD21 LEU 39 1HD2 LEU 39 -0.544 16.344 1.520 302 HD22 LEU 39 2HD2 LEU 39 -0.415 16.207 3.273 303 HD23 LEU 39 3HD2 LEU 39 -1.001 14.842 2.323 304 H VAL 40 H VAL 40 2.502 13.539 6.408 305 HA VAL 40 HA VAL 40 -0.126 13.802 7.808 306 HB VAL 40 HB VAL 40 1.916 11.665 8.343 307 HG11 VAL 40 1HG1 VAL 40 0.066 10.455 9.214 308 HG12 VAL 40 2HG1 VAL 40 -1.098 11.532 8.442 309 HG13 VAL 40 3HG1 VAL 40 -0.135 12.105 9.805 310 HG21 VAL 40 1HG2 VAL 40 0.796 10.249 6.663 311 HG22 VAL 40 2HG2 VAL 40 1.486 11.681 5.897 312 HG23 VAL 40 3HG2 VAL 40 -0.247 11.597 6.212 313 H LYS 41 H LYS 41 -0.133 14.648 9.872 314 HA LYS 41 HA LYS 41 2.142 16.000 10.901 315 HB2 LYS 41 2HB LYS 41 -0.298 14.960 12.358 316 HB3 LYS 41 1HB LYS 41 0.858 16.104 13.033 317 HG2 LYS 41 2HG LYS 41 0.377 17.649 11.130 318 HG3 LYS 41 1HG LYS 41 -0.865 16.527 10.575 319 HD2 LYS 41 2HD LYS 41 -1.996 16.749 12.794 320 HD3 LYS 41 1HD LYS 41 -0.805 17.971 13.239 321 HE2 LYS 41 2HE LYS 41 -2.665 19.206 12.424 322 HE3 LYS 41 1HE LYS 41 -1.508 19.200 11.093 323 HZ1 LYS 41 1HZ LYS 41 -2.949 18.124 9.825 324 HZ2 LYS 41 2HZ LYS 41 -4.118 18.301 11.045 325 HZ3 LYS 41 3HZ LYS 41 -3.156 16.902 10.983 326 H LYS 42 H LYS 42 0.849 12.758 11.540 327 HA LYS 42 HA LYS 42 3.414 12.111 12.933 328 HB2 LYS 42 2HB LYS 42 0.765 10.786 13.496 329 HB3 LYS 42 1HB LYS 42 2.245 10.665 14.438 330 HG2 LYS 42 2HG LYS 42 0.787 13.284 14.040 331 HG3 LYS 42 1HG LYS 42 0.434 12.203 15.380 332 HD2 LYS 42 2HD LYS 42 2.293 12.810 16.506 333 HD3 LYS 42 1HD LYS 42 3.306 12.690 15.072 334 HE2 LYS 42 2HE LYS 42 3.323 14.997 15.757 335 HE3 LYS 42 1HE LYS 42 2.322 14.899 14.310 336 HZ1 LYS 42 1HZ LYS 42 1.603 15.780 16.880 337 HZ2 LYS 42 2HZ LYS 42 0.678 14.405 16.502 338 HZ3 LYS 42 3HZ LYS 42 0.661 15.754 15.470 339 H GLU 43 H GLU 43 4.228 9.974 12.539 340 HA GLU 43 HA GLU 43 3.458 8.917 9.905 341 HB2 GLU 43 2HB GLU 43 5.584 8.021 11.862 342 HB3 GLU 43 1HB GLU 43 5.391 7.406 10.223 343 HG2 GLU 43 2HG GLU 43 5.718 9.713 9.350 344 HG3 GLU 43 1HG GLU 43 5.996 10.275 10.998 345 H ARG 44 H ARG 44 2.308 7.022 9.584 346 HA ARG 44 HA ARG 44 0.726 5.957 11.709 347 HB2 ARG 44 2HB ARG 44 1.448 4.726 9.033 348 HB3 ARG 44 1HB ARG 44 0.177 4.135 10.102 349 HG2 ARG 44 2HG ARG 44 0.269 6.945 8.968 350 HG3 ARG 44 1HG ARG 44 -0.673 5.627 8.271 351 HD2 ARG 44 2HD ARG 44 -1.635 5.393 10.704 352 HD3 ARG 44 1HD ARG 44 -1.063 7.051 10.887 353 HE ARG 44 HE ARG 44 -3.390 6.251 9.401 354 HH11 ARG 44 1HH1 ARG 44 -4.427 7.844 8.179 355 HH12 ARG 44 2HH1 ARG 44 -3.581 9.302 7.782 356 HH21 ARG 44 1HH2 ARG 44 -0.671 8.370 9.420 357 HH22 ARG 44 2HH2 ARG 44 -1.453 9.598 8.484 358 H ALA 45 H ALA 45 0.991 4.130 12.994 359 HA ALA 45 HA ALA 45 3.573 2.653 12.706 360 HB1 ALA 45 1HB ALA 45 2.360 3.698 15.282 361 HB2 ALA 45 2HB ALA 45 3.832 4.292 14.513 362 HB3 ALA 45 3HB ALA 45 3.781 2.659 15.179 363 H GLY 46 H GLY 46 0.360 2.651 14.293 364 HA2 GLY 46 2HA GLY 46 0.470 -0.334 14.270 365 HA3 GLY 46 1HA GLY 46 -0.591 0.627 15.292 366 H LEU 47 H LEU 47 -1.308 -1.524 13.383 367 HA LEU 47 HA LEU 47 -3.305 0.041 11.831 368 HB2 LEU 47 2HB LEU 47 -1.511 -2.124 10.698 369 HB3 LEU 47 1HB LEU 47 -2.942 -1.505 9.880 370 HG LEU 47 HG LEU 47 -1.763 0.839 10.357 371 HD11 LEU 47 1HD1 LEU 47 0.707 -0.718 9.791 372 HD12 LEU 47 2HD1 LEU 47 0.131 -0.737 11.458 373 HD13 LEU 47 3HD1 LEU 47 0.510 0.796 10.674 374 HD21 LEU 47 1HD2 LEU 47 -0.842 0.730 8.100 375 HD22 LEU 47 2HD2 LEU 47 -2.358 -0.170 8.135 376 HD23 LEU 47 3HD2 LEU 47 -0.821 -1.032 8.159 377 H ALA 48 H ALA 48 -5.313 -0.881 11.928 378 HA ALA 48 HA ALA 48 -5.600 -3.774 12.404 379 HB1 ALA 48 1HB ALA 48 -7.235 -3.227 14.332 380 HB2 ALA 48 2HB ALA 48 -6.420 -1.665 14.404 381 HB3 ALA 48 3HB ALA 48 -5.510 -3.149 14.689 382 H PHE 49 H PHE 49 -7.284 -4.429 11.135 383 HA PHE 49 HA PHE 49 -9.599 -2.624 10.778 384 HB2 PHE 49 2HB PHE 49 -9.489 -2.814 8.314 385 HB3 PHE 49 1HB PHE 49 -8.079 -1.980 8.970 386 HD1 PHE 49 1HD PHE 49 -5.911 -3.205 9.217 387 HD2 PHE 49 2HD PHE 49 -9.292 -4.910 7.191 388 HE1 PHE 49 1HE PHE 49 -4.426 -4.878 8.148 389 HE2 PHE 49 2HE PHE 49 -7.811 -6.585 6.124 390 HZ PHE 49 HZ PHE 49 -5.373 -6.565 6.602 391 H GLU 50 H GLU 50 -11.495 -3.714 10.125 392 HA GLU 50 HA GLU 50 -11.437 -6.626 10.578 393 HB2 GLU 50 2HB GLU 50 -13.979 -5.335 9.797 394 HB3 GLU 50 1HB GLU 50 -13.633 -6.402 11.158 395 HG2 GLU 50 2HG GLU 50 -12.344 -4.415 12.167 396 HG3 GLU 50 1HG GLU 50 -13.158 -3.428 10.952 397 HA PRO 51 HA PRO 51 -11.263 -6.872 6.034 398 HB2 PRO 51 2HB PRO 51 -10.719 -9.529 5.842 399 HB3 PRO 51 1HB PRO 51 -9.491 -8.314 6.247 400 HG2 PRO 51 2HG PRO 51 -10.920 -10.222 8.011 401 HG3 PRO 51 1HG PRO 51 -9.255 -9.625 8.099 402 HD2 PRO 51 2HD PRO 51 -11.351 -8.703 9.676 403 HD3 PRO 51 1HD PRO 51 -9.850 -7.805 9.362 404 H PHE 52 H PHE 52 -13.482 -6.529 5.576 405 HA PHE 52 HA PHE 52 -14.960 -8.923 4.788 406 HB2 PHE 52 2HB PHE 52 -16.205 -7.074 6.850 407 HB3 PHE 52 1HB PHE 52 -16.924 -8.531 6.163 408 HD1 PHE 52 1HD PHE 52 -14.618 -7.186 8.627 409 HD2 PHE 52 2HD PHE 52 -15.928 -10.778 6.673 410 HE1 PHE 52 1HE PHE 52 -13.521 -8.541 10.386 411 HE2 PHE 52 2HE PHE 52 -14.831 -12.136 8.434 412 HZ PHE 52 HZ PHE 52 -13.625 -11.017 10.291 413 H VAL 53 H VAL 53 -17.244 -8.059 3.901 414 HA VAL 53 HA VAL 53 -16.561 -5.844 2.109 415 HB VAL 53 HB VAL 53 -19.255 -7.199 2.459 416 HG11 VAL 53 1HG1 VAL 53 -17.993 -5.403 0.404 417 HG12 VAL 53 2HG1 VAL 53 -19.608 -5.329 1.108 418 HG13 VAL 53 3HG1 VAL 53 -19.226 -6.562 -0.093 419 HG21 VAL 53 1HG2 VAL 53 -16.847 -8.416 1.684 420 HG22 VAL 53 2HG2 VAL 53 -17.685 -8.072 0.172 421 HG23 VAL 53 3HG2 VAL 53 -18.473 -9.042 1.417 422 H GLY 54 H GLY 54 -16.897 -3.732 2.660 423 HA2 GLY 54 2HA GLY 54 -18.012 -1.862 3.600 424 HA3 GLY 54 1HA GLY 54 -19.266 -2.955 4.197 425 H GLY 55 H GLY 55 -16.015 -3.861 4.853 426 HA2 GLY 55 2HA GLY 55 -16.435 -3.733 7.715 427 HA3 GLY 55 1HA GLY 55 -14.923 -4.157 6.912 428 H ARG 56 H ARG 56 -14.450 -2.642 9.000 429 HA ARG 56 HA ARG 56 -14.222 0.159 7.953 430 HB2 ARG 56 2HB ARG 56 -14.375 -0.828 10.819 431 HB3 ARG 56 1HB ARG 56 -14.102 0.850 10.345 432 HG2 ARG 56 2HG ARG 56 -16.266 0.810 9.100 433 HG3 ARG 56 1HG ARG 56 -16.547 -0.825 9.700 434 HD2 ARG 56 2HD ARG 56 -16.320 0.085 12.043 435 HD3 ARG 56 1HD ARG 56 -16.284 1.705 11.346 436 HE ARG 56 HE ARG 56 -18.646 0.050 11.664 437 HH11 ARG 56 1HH1 ARG 56 -20.576 0.911 10.863 438 HH12 ARG 56 2HH1 ARG 56 -20.521 2.242 9.755 439 HH21 ARG 56 1HH2 ARG 56 -17.059 2.433 9.744 440 HH22 ARG 56 2HH2 ARG 56 -18.530 3.103 9.122 441 H TYR 57 H TYR 57 -12.169 1.016 7.846 442 HA TYR 57 HA TYR 57 -9.955 -0.694 8.911 443 HB2 TYR 57 2HB TYR 57 -10.255 -0.411 6.342 444 HB3 TYR 57 1HB TYR 57 -9.651 1.224 6.607 445 HD1 TYR 57 1HD TYR 57 -7.453 1.407 8.056 446 HD2 TYR 57 2HD TYR 57 -8.729 -2.147 6.009 447 HE1 TYR 57 1HE TYR 57 -5.130 0.539 8.112 448 HE2 TYR 57 2HE TYR 57 -6.408 -3.017 6.068 449 HH TYR 57 HH TYR 57 -4.355 -2.678 7.453 450 H TYR 58 H TYR 58 -8.670 0.278 10.391 451 HA TYR 58 HA TYR 58 -8.401 3.222 10.351 452 HB2 TYR 58 2HB TYR 58 -8.914 3.380 12.761 453 HB3 TYR 58 1HB TYR 58 -10.300 2.787 11.847 454 HD1 TYR 58 1HD TYR 58 -10.503 0.205 11.602 455 HD2 TYR 58 2HD TYR 58 -8.139 2.152 14.605 456 HE1 TYR 58 1HE TYR 58 -10.558 -1.861 12.976 457 HE2 TYR 58 2HE TYR 58 -8.192 0.089 15.983 458 HH TYR 58 HH TYR 58 -10.316 -2.466 15.389 459 H GLU 59 H GLU 59 -6.562 3.962 11.627 460 HA GLU 59 HA GLU 59 -4.665 1.804 12.433 461 HB2 GLU 59 2HB GLU 59 -3.968 4.242 10.762 462 HB3 GLU 59 1HB GLU 59 -2.826 3.029 11.340 463 HG2 GLU 59 2HG GLU 59 -4.064 1.289 10.069 464 HG3 GLU 59 1HG GLU 59 -5.141 2.538 9.444 465 H TRP 60 H TRP 60 -2.916 2.704 13.891 466 HA TRP 60 HA TRP 60 -4.057 4.920 15.537 467 HB2 TRP 60 2HB TRP 60 -2.038 2.759 16.192 468 HB3 TRP 60 1HB TRP 60 -2.425 4.095 17.274 469 HD1 TRP 60 HD TRP 60 -5.024 4.261 18.097 470 HE1 TRP 60 1HE TRP 60 -6.712 2.374 18.579 471 HE3 TRP 60 3HE TRP 60 -2.807 0.419 15.560 472 HZ2 TRP 60 2HZ TRP 60 -7.073 -0.397 17.972 473 HZ3 TRP 60 3HZ TRP 60 -3.843 -1.829 15.531 474 HH2 TRP 60 HH TRP 60 -5.972 -2.241 16.730 475 H ASP 61 H ASP 61 -2.985 6.832 15.656 476 HA ASP 61 HA ASP 61 -0.477 7.117 14.114 477 HB2 ASP 61 2HB ASP 61 -2.285 9.143 15.457 478 HB3 ASP 61 1HB ASP 61 -0.832 9.561 14.556 479 H ILE 62 H ILE 62 1.370 8.293 15.130 480 HA ILE 62 HA ILE 62 2.248 7.128 17.522 481 HB ILE 62 HB ILE 62 3.001 9.841 16.429 482 HG12 ILE 62 2HG1 ILE 62 4.322 7.154 16.045 483 HG13 ILE 62 1HG1 ILE 62 3.264 7.907 14.862 484 HG21 ILE 62 1HG2 ILE 62 4.365 10.003 18.204 485 HG22 ILE 62 2HG2 ILE 62 5.142 8.498 17.715 486 HG23 ILE 62 3HG2 ILE 62 3.765 8.462 18.816 487 HD11 ILE 62 1HD1 ILE 62 5.442 8.530 14.169 488 HD12 ILE 62 2HD1 ILE 62 5.958 8.856 15.824 489 HD13 ILE 62 3HD1 ILE 62 4.830 9.947 15.021 490 H ASP 63 H ASP 63 0.628 10.266 17.079 491 HA ASP 63 HA ASP 63 -0.015 10.214 20.002 492 HB2 ASP 63 2HB ASP 63 0.725 12.599 18.283 493 HB3 ASP 63 1HB ASP 63 0.090 12.720 19.925 494 H GLY 64 H GLY 64 -1.136 10.459 16.782 495 HA2 GLY 64 2HA GLY 64 -3.637 11.827 17.467 496 HA3 GLY 64 1HA GLY 64 -3.221 11.165 15.887 497 H THR 65 H THR 65 -5.703 10.826 17.446 498 HA THR 65 HA THR 65 -5.835 8.205 18.586 499 HB THR 65 HB THR 65 -7.540 10.036 18.893 500 HG1 THR 65 1HG THR 65 -8.436 8.245 19.555 501 HG21 THR 65 1HG2 THR 65 -8.983 9.200 16.478 502 HG22 THR 65 2HG2 THR 65 -7.498 10.092 16.152 503 HG23 THR 65 3HG2 THR 65 -8.759 10.814 17.153 504 H GLU 66 H GLU 66 -8.190 7.358 16.966 505 HA GLU 66 HA GLU 66 -6.649 5.948 14.880 506 HB2 GLU 66 2HB GLU 66 -9.473 5.580 15.915 507 HB3 GLU 66 1HB GLU 66 -8.709 4.561 14.700 508 HG2 GLU 66 2HG GLU 66 -6.918 3.997 16.317 509 HG3 GLU 66 1HG GLU 66 -7.736 4.969 17.539 510 H ILE 67 H ILE 67 -6.876 6.372 12.730 511 HA ILE 67 HA ILE 67 -9.122 8.160 11.880 512 HB ILE 67 HB ILE 67 -6.297 8.125 10.774 513 HG12 ILE 67 2HG1 ILE 67 -7.739 10.200 12.458 514 HG13 ILE 67 1HG1 ILE 67 -6.433 9.155 13.020 515 HG21 ILE 67 1HG2 ILE 67 -7.061 10.075 9.476 516 HG22 ILE 67 2HG2 ILE 67 -8.672 9.919 10.177 517 HG23 ILE 67 3HG2 ILE 67 -8.049 8.662 9.107 518 HD11 ILE 67 1HD1 ILE 67 -6.299 11.596 11.406 519 HD12 ILE 67 2HD1 ILE 67 -5.391 10.258 10.704 520 HD13 ILE 67 3HD1 ILE 67 -5.035 10.802 12.345 521 H VAL 68 H VAL 68 -10.123 7.583 9.911 522 HA VAL 68 HA VAL 68 -9.854 4.818 9.110 523 HB VAL 68 HB VAL 68 -11.241 7.082 7.641 524 HG11 VAL 68 1HG1 VAL 68 -12.570 5.294 6.644 525 HG12 VAL 68 2HG1 VAL 68 -11.720 4.087 7.609 526 HG13 VAL 68 3HG1 VAL 68 -10.860 4.976 6.352 527 HG21 VAL 68 1HG2 VAL 68 -12.227 5.197 9.805 528 HG22 VAL 68 2HG2 VAL 68 -13.274 6.241 8.844 529 HG23 VAL 68 3HG2 VAL 68 -12.076 6.950 9.928 530 H TRP 69 H TRP 69 -8.442 3.988 7.646 531 HA TRP 69 HA TRP 69 -6.853 5.904 6.002 532 HB2 TRP 69 2HB TRP 69 -5.307 4.613 7.158 533 HB3 TRP 69 1HB TRP 69 -6.339 3.183 7.148 534 HD1 TRP 69 HD TRP 69 -3.636 4.927 5.208 535 HE1 TRP 69 1HE TRP 69 -2.994 3.509 3.152 536 HE3 TRP 69 3HE TRP 69 -7.397 1.471 5.306 537 HZ2 TRP 69 2HZ TRP 69 -3.947 1.212 1.739 538 HZ3 TRP 69 3HZ TRP 69 -7.504 -0.319 3.596 539 HH2 TRP 69 HH TRP 69 -5.787 -0.455 1.812 540 H GLY 70 H GLY 70 -9.457 3.822 5.752 541 HA2 GLY 70 2HA GLY 70 -9.984 4.097 3.066 542 HA3 GLY 70 1HA GLY 70 -8.891 2.713 3.116 543 H ARG 71 H ARG 71 -10.364 1.051 2.669 544 HA ARG 71 HA ARG 71 -12.093 0.258 4.870 545 HB2 ARG 71 2HB ARG 71 -13.327 1.965 3.175 546 HB3 ARG 71 1HB ARG 71 -13.627 0.449 2.332 547 HG2 ARG 71 2HG ARG 71 -14.575 -0.522 4.384 548 HG3 ARG 71 1HG ARG 71 -14.268 0.987 5.243 549 HD2 ARG 71 2HD ARG 71 -16.582 1.002 4.557 550 HD3 ARG 71 1HD ARG 71 -15.719 2.152 3.537 551 HE ARG 71 HE ARG 71 -15.629 -0.224 2.104 552 HH11 ARG 71 1HH1 ARG 71 -17.217 -0.782 0.595 553 HH12 ARG 71 2HH1 ARG 71 -18.804 -0.103 0.736 554 HH21 ARG 71 1HH2 ARG 71 -18.047 1.748 3.569 555 HH22 ARG 71 2HH2 ARG 71 -19.274 1.331 2.420 556 H ILE 72 H ILE 72 -13.677 -1.557 3.290 557 HA ILE 72 HA ILE 72 -11.610 -3.221 1.938 558 HB ILE 72 HB ILE 72 -13.562 -4.171 4.057 559 HG12 ILE 72 2HG1 ILE 72 -11.051 -4.958 4.808 560 HG13 ILE 72 1HG1 ILE 72 -10.701 -3.418 4.022 561 HG21 ILE 72 1HG2 ILE 72 -12.347 -6.367 3.695 562 HG22 ILE 72 2HG2 ILE 72 -11.644 -5.656 2.241 563 HG23 ILE 72 3HG2 ILE 72 -13.390 -5.873 2.361 564 HD11 ILE 72 1HD1 ILE 72 -11.178 -3.158 6.456 565 HD12 ILE 72 2HD1 ILE 72 -12.792 -3.813 6.180 566 HD13 ILE 72 3HD1 ILE 72 -12.326 -2.280 5.444 567 H LEU 73 H LEU 73 -12.631 -4.908 0.529 568 HA LEU 73 HA LEU 73 -15.368 -4.078 -0.358 569 HB2 LEU 73 2HB LEU 73 -13.518 -3.457 -1.954 570 HB3 LEU 73 1HB LEU 73 -13.152 -5.173 -2.113 571 HG LEU 73 HG LEU 73 -15.726 -5.367 -2.658 572 HD11 LEU 73 1HD1 LEU 73 -15.091 -2.483 -3.351 573 HD12 LEU 73 2HD1 LEU 73 -16.275 -3.031 -2.164 574 HD13 LEU 73 3HD1 LEU 73 -16.531 -3.355 -3.877 575 HD21 LEU 73 1HD2 LEU 73 -15.066 -4.638 -5.107 576 HD22 LEU 73 2HD2 LEU 73 -14.283 -6.033 -4.364 577 HD23 LEU 73 3HD2 LEU 73 -13.455 -4.475 -4.408 578 H GLU 74 H GLU 74 -13.040 -6.780 -0.505 579 HA GLU 74 HA GLU 74 -14.861 -8.684 0.607 580 HB2 GLU 74 2HB GLU 74 -15.987 -8.326 -1.606 581 HB3 GLU 74 1HB GLU 74 -14.517 -8.896 -2.388 582 HG2 GLU 74 2HG GLU 74 -14.709 -11.036 -1.130 583 HG3 GLU 74 1HG GLU 74 -16.235 -10.469 -0.452 584 H TRP 75 H TRP 75 -13.750 -10.580 1.097 585 HA TRP 75 HA TRP 75 -10.915 -10.668 0.189 586 HB2 TRP 75 2HB TRP 75 -10.763 -10.700 2.493 587 HB3 TRP 75 1HB TRP 75 -12.334 -11.479 2.689 588 HD1 TRP 75 HD TRP 75 -8.657 -12.225 2.164 589 HE1 TRP 75 1HE TRP 75 -8.269 -14.763 2.391 590 HE3 TRP 75 3HE TRP 75 -13.496 -13.842 2.346 591 HZ2 TRP 75 2HZ TRP 75 -9.810 -17.165 2.618 592 HZ3 TRP 75 3HZ TRP 75 -14.009 -16.255 2.564 593 HH2 TRP 75 HH TRP 75 -12.174 -17.918 2.702 594 H ASP 76 H ASP 76 -10.409 -12.224 -1.274 595 HA ASP 76 HA ASP 76 -12.231 -14.578 -1.487 596 HB2 ASP 76 2HB ASP 76 -11.449 -12.731 -3.443 597 HB3 ASP 76 1HB ASP 76 -10.517 -14.191 -3.786 598 HA PRO 77 HA PRO 77 -8.918 -17.074 0.275 599 HB2 PRO 77 2HB PRO 77 -9.853 -18.832 -1.988 600 HB3 PRO 77 1HB PRO 77 -9.427 -19.287 -0.326 601 HG2 PRO 77 2HG PRO 77 -11.965 -18.978 -1.079 602 HG3 PRO 77 1HG PRO 77 -11.407 -18.526 0.540 603 HD2 PRO 77 2HD PRO 77 -12.286 -16.789 -1.666 604 HD3 PRO 77 1HD PRO 77 -12.110 -16.402 0.060 605 HA PRO 78 HA PRO 78 -5.085 -16.389 -1.776 606 HB2 PRO 78 2HB PRO 78 -5.095 -19.353 -2.258 607 HB3 PRO 78 1HB PRO 78 -3.775 -18.315 -1.685 608 HG2 PRO 78 2HG PRO 78 -5.366 -19.825 -0.047 609 HG3 PRO 78 1HG PRO 78 -4.490 -18.375 0.462 610 HD2 PRO 78 2HD PRO 78 -7.346 -18.735 0.299 611 HD3 PRO 78 1HD PRO 78 -6.461 -17.279 0.797 612 H HIS 79 H HIS 79 -6.155 -15.300 -3.563 613 HA HIS 79 HA HIS 79 -5.556 -16.252 -6.123 614 HB2 HIS 79 2HB HIS 79 -8.061 -17.350 -5.024 615 HB3 HIS 79 1HB HIS 79 -8.236 -16.604 -6.613 616 HD1 HIS 79 1HD HIS 79 -7.455 -19.757 -5.164 617 HD2 HIS 79 2HD HIS 79 -5.908 -17.611 -8.390 618 HE1 HIS 79 1HE HIS 79 -6.226 -21.431 -6.616 619 HE2 HIS 79 2HE HIS 79 -5.280 -20.136 -8.582 620 H ARG 80 H ARG 80 -8.114 -14.488 -4.295 621 HA ARG 80 HA ARG 80 -7.568 -12.193 -6.104 622 HB2 ARG 80 2HB ARG 80 -9.700 -13.741 -6.661 623 HB3 ARG 80 1HB ARG 80 -10.433 -12.673 -5.470 624 HG2 ARG 80 2HG ARG 80 -8.873 -11.677 -7.871 625 HG3 ARG 80 1HG ARG 80 -10.624 -11.860 -7.852 626 HD2 ARG 80 2HD ARG 80 -10.083 -10.435 -5.515 627 HD3 ARG 80 1HD ARG 80 -8.982 -9.740 -6.702 628 HE ARG 80 HE ARG 80 -11.761 -9.231 -6.617 629 HH11 ARG 80 1HH1 ARG 80 -12.804 -8.366 -8.423 630 HH12 ARG 80 2HH1 ARG 80 -12.083 -8.538 -9.989 631 HH21 ARG 80 1HH2 ARG 80 -9.325 -10.281 -8.821 632 HH22 ARG 80 2HH2 ARG 80 -10.115 -9.623 -10.214 633 H LEU 81 H LEU 81 -7.413 -10.328 -5.000 634 HA LEU 81 HA LEU 81 -8.637 -10.188 -2.272 635 HB2 LEU 81 2HB LEU 81 -6.124 -10.348 -2.245 636 HB3 LEU 81 1HB LEU 81 -6.064 -8.855 -3.179 637 HG LEU 81 HG LEU 81 -7.562 -7.878 -1.280 638 HD11 LEU 81 1HD1 LEU 81 -6.222 -9.658 0.621 639 HD12 LEU 81 2HD1 LEU 81 -7.415 -10.492 -0.372 640 HD13 LEU 81 3HD1 LEU 81 -7.893 -9.098 0.594 641 HD21 LEU 81 1HD2 LEU 81 -4.658 -8.328 -1.456 642 HD22 LEU 81 2HD2 LEU 81 -5.220 -7.949 0.172 643 HD23 LEU 81 3HD2 LEU 81 -5.549 -6.834 -1.156 644 H ALA 82 H ALA 82 -10.063 -8.505 -2.064 645 HA ALA 82 HA ALA 82 -9.773 -6.189 -3.934 646 HB1 ALA 82 1HB ALA 82 -12.015 -6.244 -4.548 647 HB2 ALA 82 2HB ALA 82 -12.497 -7.126 -3.098 648 HB3 ALA 82 3HB ALA 82 -11.674 -7.969 -4.411 649 H MET 83 H MET 83 -10.118 -4.185 -2.960 650 HA MET 83 HA MET 83 -11.244 -4.160 -0.211 651 HB2 MET 83 2HB MET 83 -8.579 -2.921 -0.945 652 HB3 MET 83 1HB MET 83 -9.364 -2.836 0.633 653 HG2 MET 83 2HG MET 83 -9.304 -5.351 0.714 654 HG3 MET 83 1HG MET 83 -8.334 -5.319 -0.759 655 HE1 MET 83 1HE MET 83 -5.137 -3.644 0.043 656 HE2 MET 83 2HE MET 83 -6.463 -2.489 -0.054 657 HE3 MET 83 3HE MET 83 -6.452 -3.899 -1.111 658 H THR 84 H THR 84 -12.367 -2.261 0.252 659 HA THR 84 HA THR 84 -12.489 -0.268 -1.965 660 HB THR 84 HB THR 84 -14.308 -0.584 0.446 661 HG1 THR 84 1HG THR 84 -15.727 -1.327 -1.354 662 HG21 THR 84 1HG2 THR 84 -14.711 1.579 -0.238 663 HG22 THR 84 2HG2 THR 84 -15.786 0.727 -1.346 664 HG23 THR 84 3HG2 THR 84 -14.197 1.261 -1.895 665 H TRP 85 H TRP 85 -11.698 1.820 -1.597 666 HA TRP 85 HA TRP 85 -10.427 2.232 1.062 667 HB2 TRP 85 2HB TRP 85 -9.939 3.330 -1.686 668 HB3 TRP 85 1HB TRP 85 -9.388 4.237 -0.279 669 HD1 TRP 85 HD TRP 85 -9.409 0.465 -0.041 670 HE1 TRP 85 1HE TRP 85 -6.983 -0.402 -0.025 671 HE3 TRP 85 3HE TRP 85 -6.924 4.777 -1.183 672 HZ2 TRP 85 2HZ TRP 85 -4.336 0.600 -0.441 673 HZ3 TRP 85 3HZ TRP 85 -4.453 4.793 -1.365 674 HH2 TRP 85 HH TRP 85 -3.157 2.712 -0.996 675 H ARG 86 H ARG 86 -11.523 3.459 2.499 676 HA ARG 86 HA ARG 86 -13.257 5.658 1.431 677 HB2 ARG 86 2HB ARG 86 -14.486 3.855 2.650 678 HB3 ARG 86 1HB ARG 86 -13.507 4.195 4.078 679 HG2 ARG 86 2HG ARG 86 -14.356 6.484 4.158 680 HG3 ARG 86 1HG ARG 86 -15.269 6.223 2.672 681 HD2 ARG 86 2HD ARG 86 -16.811 5.951 4.502 682 HD3 ARG 86 1HD ARG 86 -16.478 4.342 3.861 683 HE ARG 86 HE ARG 86 -14.600 4.694 5.890 684 HH11 ARG 86 1HH1 ARG 86 -15.002 4.020 8.010 685 HH12 ARG 86 2HH1 ARG 86 -16.636 3.859 8.558 686 HH21 ARG 86 1HH2 ARG 86 -18.027 4.839 5.536 687 HH22 ARG 86 2HH2 ARG 86 -18.349 4.323 7.158 688 H ILE 87 H ILE 87 -11.745 7.338 1.488 689 HA ILE 87 HA ILE 87 -10.820 8.111 4.208 690 HB ILE 87 HB ILE 87 -8.971 6.936 2.939 691 HG12 ILE 87 2HG1 ILE 87 -8.328 9.858 3.359 692 HG13 ILE 87 1HG1 ILE 87 -8.711 8.804 4.720 693 HG21 ILE 87 1HG2 ILE 87 -9.867 8.245 0.772 694 HG22 ILE 87 2HG2 ILE 87 -8.186 7.732 0.925 695 HG23 ILE 87 3HG2 ILE 87 -8.637 9.398 1.290 696 HD11 ILE 87 1HD1 ILE 87 -6.789 7.558 2.921 697 HD12 ILE 87 2HD1 ILE 87 -6.672 7.845 4.657 698 HD13 ILE 87 3HD1 ILE 87 -6.204 9.110 3.520 699 H ASP 88 H ASP 88 -10.397 10.431 4.391 700 HA ASP 88 HA ASP 88 -12.047 11.979 2.473 701 HB2 ASP 88 2HB ASP 88 -12.397 12.197 4.955 702 HB3 ASP 88 1HB ASP 88 -10.784 12.904 5.068 703 H GLY 89 H GLY 89 -11.231 13.791 1.356 704 HA2 GLY 89 2HA GLY 89 -8.544 13.634 0.430 705 HA3 GLY 89 1HA GLY 89 -9.611 15.013 0.183 706 H HIS 90 H HIS 90 -9.972 15.376 3.122 707 HA HIS 90 HA HIS 90 -7.547 16.978 3.547 708 HB2 HIS 90 2HB HIS 90 -10.108 16.700 5.121 709 HB3 HIS 90 1HB HIS 90 -8.809 17.808 5.536 710 HD1 HIS 90 1HD HIS 90 -8.051 18.904 2.792 711 HD2 HIS 90 2HD HIS 90 -12.000 18.396 4.025 712 HE1 HIS 90 1HE HIS 90 -9.451 20.469 1.371 713 HE2 HIS 90 2HE HIS 90 -11.859 20.165 2.111 714 H TRP 91 H TRP 91 -7.751 13.895 3.822 715 HA TRP 91 HA TRP 91 -6.830 12.261 5.228 716 HB2 TRP 91 2HB TRP 91 -5.315 14.757 5.859 717 HB3 TRP 91 1HB TRP 91 -5.117 13.383 6.946 718 HD1 TRP 91 HD TRP 91 -3.937 14.727 3.713 719 HE1 TRP 91 1HE TRP 91 -2.535 12.963 2.460 720 HE3 TRP 91 3HE TRP 91 -5.040 10.587 6.491 721 HZ2 TRP 91 2HZ TRP 91 -1.962 10.163 2.614 722 HZ3 TRP 91 3HZ TRP 91 -4.055 8.387 5.917 723 HH2 TRP 91 HH TRP 91 -2.517 8.170 3.984 724 H GLN 92 H GLN 92 -9.276 13.871 6.077 725 HA GLN 92 HA GLN 92 -9.058 13.758 9.020 726 HB2 GLN 92 2HB GLN 92 -11.353 14.531 7.199 727 HB3 GLN 92 1HB GLN 92 -11.398 14.610 8.962 728 HG2 GLN 92 2HG GLN 92 -9.411 16.079 7.204 729 HG3 GLN 92 1HG GLN 92 -10.827 16.801 7.959 730 HE21 GLN 92 1HE2 GLN 92 -7.631 16.814 8.392 731 HE22 GLN 92 2HE2 GLN 92 -7.528 16.803 10.086 732 H SER 93 H SER 93 -12.153 12.940 7.870 733 HA SER 93 HA SER 93 -11.672 10.037 7.896 734 HB2 SER 93 2HB SER 93 -12.992 9.551 9.819 735 HB3 SER 93 1HB SER 93 -11.894 10.832 10.317 736 HG SER 93 HG SER 93 -13.762 12.228 9.520 737 H VAL 94 H VAL 94 -13.585 8.847 7.196 738 HA VAL 94 HA VAL 94 -15.761 10.559 6.078 739 HB VAL 94 HB VAL 94 -15.483 8.471 4.261 740 HG11 VAL 94 1HG1 VAL 94 -16.042 10.741 3.646 741 HG12 VAL 94 2HG1 VAL 94 -14.570 10.300 2.781 742 HG13 VAL 94 3HG1 VAL 94 -14.479 11.330 4.210 743 HG21 VAL 94 1HG2 VAL 94 -12.742 9.641 4.806 744 HG22 VAL 94 2HG2 VAL 94 -13.161 8.368 3.661 745 HG23 VAL 94 3HG2 VAL 94 -13.241 8.054 5.394 746 HA PRO 95 HA PRO 95 -17.506 7.203 8.773 747 HB2 PRO 95 2HB PRO 95 -19.838 9.028 8.413 748 HB3 PRO 95 1HB PRO 95 -19.212 8.274 9.891 749 HG2 PRO 95 2HG PRO 95 -18.825 10.860 9.360 750 HG3 PRO 95 1HG PRO 95 -17.609 9.881 10.196 751 HD2 PRO 95 2HD PRO 95 -17.600 10.899 7.394 752 HD3 PRO 95 1HD PRO 95 -16.232 10.554 8.476 753 H ASP 96 H ASP 96 -18.480 8.532 5.690 754 HA ASP 96 HA ASP 96 -19.734 5.927 5.029 755 HB2 ASP 96 2HB ASP 96 -21.545 7.526 5.735 756 HB3 ASP 96 1HB ASP 96 -21.065 8.564 4.395 757 H ASP 97 H ASP 97 -19.563 5.413 2.796 758 HA ASP 97 HA ASP 97 -17.539 7.016 1.366 759 HB2 ASP 97 2HB ASP 97 -17.618 5.115 -0.273 760 HB3 ASP 97 1HB ASP 97 -17.216 4.611 1.369 761 H ASP 98 H ASP 98 -18.503 8.812 0.454 762 HA ASP 98 HA ASP 98 -21.120 8.585 -0.862 763 HB2 ASP 98 2HB ASP 98 -20.317 10.623 0.449 764 HB3 ASP 98 1HB ASP 98 -19.251 10.949 -0.915 765 H ARG 99 H ARG 99 -17.825 9.503 -1.840 766 HA ARG 99 HA ARG 99 -18.456 8.490 -4.577 767 HB2 ARG 99 2HB ARG 99 -16.825 10.924 -3.797 768 HB3 ARG 99 1HB ARG 99 -16.935 10.280 -5.436 769 HG2 ARG 99 2HG ARG 99 -19.412 10.576 -5.341 770 HG3 ARG 99 1HG ARG 99 -19.231 11.324 -3.753 771 HD2 ARG 99 2HD ARG 99 -17.680 13.008 -4.814 772 HD3 ARG 99 1HD ARG 99 -18.113 12.330 -6.384 773 HE ARG 99 HE ARG 99 -20.235 13.374 -6.202 774 HH11 ARG 99 1HH1 ARG 99 -21.677 14.779 -5.174 775 HH12 ARG 99 2HH1 ARG 99 -21.384 15.252 -3.533 776 HH21 ARG 99 1HH2 ARG 99 -18.475 13.388 -3.237 777 HH22 ARG 99 2HH2 ARG 99 -19.571 14.464 -2.437 778 H ALA 100 H ALA 100 -17.096 7.267 -2.161 779 HA ALA 100 HA ALA 100 -14.268 7.182 -2.651 780 HB1 ALA 100 1HB ALA 100 -14.189 5.560 -0.991 781 HB2 ALA 100 2HB ALA 100 -15.710 4.823 -1.495 782 HB3 ALA 100 3HB ALA 100 -15.720 6.344 -0.602 783 H SER 101 H SER 101 -13.036 5.585 -3.754 784 HA SER 101 HA SER 101 -14.562 4.158 -5.883 785 HB2 SER 101 2HB SER 101 -11.638 4.951 -5.745 786 HB3 SER 101 1HB SER 101 -12.392 4.097 -7.089 787 HG SER 101 HG SER 101 -13.909 6.176 -6.574 788 H GLU 102 H GLU 102 -13.658 1.997 -6.520 789 HA GLU 102 HA GLU 102 -12.745 0.525 -4.085 790 HB2 GLU 102 2HB GLU 102 -14.193 -0.497 -6.546 791 HB3 GLU 102 1HB GLU 102 -13.742 -1.468 -5.144 792 HG2 GLU 102 2HG GLU 102 -15.132 0.006 -3.703 793 HG3 GLU 102 1HG GLU 102 -15.629 0.905 -5.137 794 H ILE 103 H ILE 103 -11.117 -1.074 -4.322 795 HA ILE 103 HA ILE 103 -9.399 -0.703 -6.745 796 HB ILE 103 HB ILE 103 -8.569 -1.515 -3.944 797 HG12 ILE 103 2HG1 ILE 103 -8.125 1.131 -5.355 798 HG13 ILE 103 1HG1 ILE 103 -9.408 0.861 -4.174 799 HG21 ILE 103 1HG2 ILE 103 -6.920 -2.360 -5.353 800 HG22 ILE 103 2HG2 ILE 103 -6.307 -0.736 -5.044 801 HG23 ILE 103 3HG2 ILE 103 -7.151 -1.089 -6.552 802 HD11 ILE 103 1HD1 ILE 103 -7.705 0.189 -2.499 803 HD12 ILE 103 2HD1 ILE 103 -7.448 1.839 -3.071 804 HD13 ILE 103 3HD1 ILE 103 -6.436 0.529 -3.676 805 H GLU 104 H GLU 104 -8.725 -2.563 -7.821 806 HA GLU 104 HA GLU 104 -9.755 -5.151 -6.720 807 HB2 GLU 104 2HB GLU 104 -10.719 -4.410 -8.917 808 HB3 GLU 104 1HB GLU 104 -9.094 -4.473 -9.601 809 HG2 GLU 104 2HG GLU 104 -8.948 -6.876 -8.946 810 HG3 GLU 104 1HG GLU 104 -10.616 -6.795 -8.379 811 H VAL 105 H VAL 105 -8.187 -6.501 -6.012 812 HA VAL 105 HA VAL 105 -5.485 -6.312 -7.269 813 HB VAL 105 HB VAL 105 -6.058 -6.887 -4.349 814 HG11 VAL 105 1HG1 VAL 105 -3.519 -6.296 -4.304 815 HG12 VAL 105 2HG1 VAL 105 -3.574 -6.638 -6.033 816 HG13 VAL 105 3HG1 VAL 105 -4.000 -7.895 -4.873 817 HG21 VAL 105 1HG2 VAL 105 -4.721 -4.551 -4.314 818 HG22 VAL 105 2HG2 VAL 105 -6.481 -4.625 -4.372 819 HG23 VAL 105 3HG2 VAL 105 -5.561 -4.363 -5.853 820 H ASP 106 H ASP 106 -4.738 -8.256 -8.005 821 HA ASP 106 HA ASP 106 -6.177 -10.711 -7.078 822 HB2 ASP 106 2HB ASP 106 -4.916 -10.114 -9.770 823 HB3 ASP 106 1HB ASP 106 -5.621 -11.665 -9.311 824 H PHE 107 H PHE 107 -4.910 -12.298 -6.197 825 HA PHE 107 HA PHE 107 -1.953 -12.052 -6.572 826 HB2 PHE 107 2HB PHE 107 -3.576 -12.354 -4.100 827 HB3 PHE 107 1HB PHE 107 -2.092 -13.305 -4.193 828 HD1 PHE 107 1HD PHE 107 0.094 -12.209 -4.473 829 HD2 PHE 107 2HD PHE 107 -3.508 -9.933 -3.954 830 HE1 PHE 107 1HE PHE 107 1.445 -10.203 -3.952 831 HE2 PHE 107 2HE PHE 107 -2.156 -7.918 -3.434 832 HZ PHE 107 HZ PHE 107 0.327 -8.058 -3.434 833 H VAL 108 H VAL 108 -1.204 -13.765 -7.666 834 HA VAL 108 HA VAL 108 -2.377 -16.445 -7.093 835 HB VAL 108 HB VAL 108 -2.763 -16.926 -9.320 836 HG11 VAL 108 1HG1 VAL 108 -3.737 -14.997 -10.445 837 HG12 VAL 108 2HG1 VAL 108 -2.818 -13.895 -9.419 838 HG13 VAL 108 3HG1 VAL 108 -4.092 -14.896 -8.720 839 HG21 VAL 108 1HG2 VAL 108 -1.503 -15.645 -11.162 840 HG22 VAL 108 2HG2 VAL 108 -0.544 -16.742 -10.170 841 HG23 VAL 108 3HG2 VAL 108 -0.491 -15.005 -9.869 842 HA PRO 109 HA PRO 109 1.839 -17.622 -6.523 843 HB2 PRO 109 2HB PRO 109 1.804 -20.167 -7.651 844 HB3 PRO 109 1HB PRO 109 1.303 -19.774 -5.998 845 HG2 PRO 109 2HG PRO 109 -0.343 -20.251 -8.411 846 HG3 PRO 109 1HG PRO 109 -0.678 -20.638 -6.714 847 HD2 PRO 109 2HD PRO 109 -1.850 -18.536 -7.997 848 HD3 PRO 109 1HD PRO 109 -1.502 -18.521 -6.252 849 H ASN 110 H ASN 110 3.583 -16.983 -7.678 850 HA ASN 110 HA ASN 110 3.603 -17.472 -10.622 851 HB2 ASN 110 2HB ASN 110 3.422 -15.046 -9.825 852 HB3 ASN 110 1HB ASN 110 5.065 -15.241 -9.219 853 HD21 ASN 110 1HD2 ASN 110 5.760 -13.608 -10.864 854 HD22 ASN 110 2HD2 ASN 110 5.955 -14.081 -12.483 855 H GLY 111 H GLY 111 5.232 -18.823 -11.256 856 HA2 GLY 111 2HA GLY 111 7.292 -19.960 -11.218 857 HA3 GLY 111 1HA GLY 111 7.897 -18.667 -10.178 858 H SER 112 H SER 112 8.417 -19.299 -8.135 859 HA SER 112 HA SER 112 6.764 -21.371 -6.816 860 HB2 SER 112 2HB SER 112 9.436 -21.831 -7.866 861 HB3 SER 112 1HB SER 112 9.375 -22.094 -6.125 862 HG SER 112 HG SER 112 7.455 -23.142 -7.928 863 H GLY 113 H GLY 113 9.653 -19.284 -6.458 864 HA2 GLY 113 2HA GLY 113 8.967 -18.959 -3.584 865 HA3 GLY 113 1HA GLY 113 10.504 -18.514 -4.322 866 H GLY 114 H GLY 114 7.836 -17.521 -6.209 867 HA2 GLY 114 2HA GLY 114 7.741 -14.874 -4.865 868 HA3 GLY 114 1HA GLY 114 8.197 -14.935 -6.564 869 H THR 115 H THR 115 5.892 -13.557 -5.581 870 HA THR 115 HA THR 115 3.730 -15.182 -6.857 871 HB THR 115 HB THR 115 3.310 -13.128 -4.673 872 HG1 THR 115 1HG THR 115 4.479 -15.376 -4.354 873 HG21 THR 115 1HG2 THR 115 1.573 -15.345 -5.788 874 HG22 THR 115 2HG2 THR 115 1.388 -13.628 -6.145 875 HG23 THR 115 3HG2 THR 115 1.116 -14.225 -4.509 876 H ARG 116 H ARG 116 2.460 -14.078 -8.357 877 HA ARG 116 HA ARG 116 3.366 -11.295 -8.994 878 HB2 ARG 116 2HB ARG 116 3.787 -12.998 -10.765 879 HB3 ARG 116 1HB ARG 116 2.057 -13.338 -10.818 880 HG2 ARG 116 2HG ARG 116 1.627 -10.966 -11.411 881 HG3 ARG 116 1HG ARG 116 3.367 -10.668 -11.413 882 HD2 ARG 116 2HD ARG 116 3.628 -12.419 -13.170 883 HD3 ARG 116 1HD ARG 116 1.874 -12.599 -13.215 884 HE ARG 116 HE ARG 116 3.409 -10.333 -14.299 885 HH11 ARG 116 1HH1 ARG 116 2.178 -8.880 -15.513 886 HH12 ARG 116 2HH1 ARG 116 0.449 -8.970 -15.455 887 HH21 ARG 116 1HH2 ARG 116 0.395 -11.643 -13.250 888 HH22 ARG 116 2HH2 ARG 116 -0.559 -10.535 -14.176 889 H VAL 117 H VAL 117 1.868 -9.706 -8.767 890 HA VAL 117 HA VAL 117 -0.999 -10.528 -8.622 891 HB VAL 117 HB VAL 117 -0.701 -9.994 -6.414 892 HG11 VAL 117 1HG1 VAL 117 0.941 -7.969 -5.889 893 HG12 VAL 117 2HG1 VAL 117 1.593 -8.394 -7.471 894 HG13 VAL 117 3HG1 VAL 117 1.563 -9.593 -6.177 895 HG21 VAL 117 1HG2 VAL 117 -0.836 -7.148 -7.433 896 HG22 VAL 117 2HG2 VAL 117 -1.570 -7.819 -5.979 897 HG23 VAL 117 3HG2 VAL 117 -2.208 -8.248 -7.563 898 H GLU 118 H GLU 118 -2.478 -9.242 -9.642 899 HA GLU 118 HA GLU 118 -1.386 -6.999 -11.286 900 HB2 GLU 118 2HB GLU 118 -2.459 -8.819 -12.562 901 HB3 GLU 118 1HB GLU 118 -3.924 -8.643 -11.597 902 HG2 GLU 118 2HG GLU 118 -4.150 -6.301 -12.417 903 HG3 GLU 118 1HG GLU 118 -2.735 -6.544 -13.438 904 H LEU 119 H LEU 119 -1.895 -4.991 -10.542 905 HA LEU 119 HA LEU 119 -4.367 -4.697 -8.892 906 HB2 LEU 119 2HB LEU 119 -2.166 -4.355 -7.689 907 HB3 LEU 119 1HB LEU 119 -1.882 -2.972 -8.745 908 HG LEU 119 HG LEU 119 -4.524 -3.026 -7.389 909 HD11 LEU 119 1HD1 LEU 119 -3.613 -2.236 -5.261 910 HD12 LEU 119 2HD1 LEU 119 -1.969 -2.419 -5.872 911 HD13 LEU 119 3HD1 LEU 119 -2.976 -3.842 -5.613 912 HD21 LEU 119 1HD2 LEU 119 -2.368 -0.936 -7.833 913 HD22 LEU 119 2HD2 LEU 119 -3.950 -0.614 -7.122 914 HD23 LEU 119 3HD2 LEU 119 -3.829 -1.144 -8.798 915 H ALA 120 H ALA 120 -5.895 -3.416 -9.793 916 HA ALA 120 HA ALA 120 -5.011 -1.292 -11.696 917 HB1 ALA 120 1HB ALA 120 -6.151 -2.226 -13.396 918 HB2 ALA 120 2HB ALA 120 -7.612 -2.311 -12.410 919 HB3 ALA 120 3HB ALA 120 -6.446 -3.634 -12.375 920 H HIS 121 H HIS 121 -6.014 0.665 -11.362 921 HA HIS 121 HA HIS 121 -8.319 0.711 -9.447 922 HB2 HIS 121 2HB HIS 121 -7.300 2.307 -8.197 923 HB3 HIS 121 1HB HIS 121 -5.816 1.807 -9.006 924 HD1 HIS 121 1HD HIS 121 -8.749 4.122 -9.880 925 HD2 HIS 121 2HD HIS 121 -4.592 3.973 -10.176 926 HE1 HIS 121 1HE HIS 121 -8.028 6.287 -10.982 927 HE2 HIS 121 2HE HIS 121 -5.500 6.213 -11.147 928 H VAL 122 H VAL 122 -10.109 1.820 -10.147 929 HA VAL 122 HA VAL 122 -9.796 3.598 -12.519 930 HB VAL 122 HB VAL 122 -11.830 2.594 -13.517 931 HG11 VAL 122 1HG1 VAL 122 -9.263 1.608 -13.560 932 HG12 VAL 122 2HG1 VAL 122 -10.569 1.044 -14.601 933 HG13 VAL 122 3HG1 VAL 122 -10.192 0.178 -13.111 934 HG21 VAL 122 1HG2 VAL 122 -13.115 1.603 -11.883 935 HG22 VAL 122 2HG2 VAL 122 -11.709 1.058 -10.964 936 HG23 VAL 122 3HG2 VAL 122 -12.220 0.175 -12.403 937 H LYS 123 H LYS 123 -11.439 5.197 -12.711 938 HA LYS 123 HA LYS 123 -12.949 6.787 -11.889 939 HB2 LYS 123 2HB LYS 123 -14.011 4.568 -10.133 940 HB3 LYS 123 1HB LYS 123 -14.889 5.953 -10.782 941 HG2 LYS 123 2HG LYS 123 -13.679 3.738 -12.462 942 HG3 LYS 123 1HG LYS 123 -15.381 3.842 -12.018 943 HD2 LYS 123 2HD LYS 123 -15.439 6.116 -13.120 944 HD3 LYS 123 1HD LYS 123 -13.813 5.792 -13.724 945 HE2 LYS 123 2HE LYS 123 -14.946 4.912 -15.502 946 HE3 LYS 123 1HE LYS 123 -15.039 3.494 -14.456 947 HZ1 LYS 123 1HZ LYS 123 -17.087 5.587 -14.223 948 HZ2 LYS 123 2HZ LYS 123 -17.205 3.922 -13.907 949 HZ3 LYS 123 3HZ LYS 123 -17.181 4.486 -15.509 950 H LEU 124 H LEU 124 -10.367 6.305 -10.412 951 HA LEU 124 HA LEU 124 -10.891 6.565 -7.588 952 HB2 LEU 124 2HB LEU 124 -8.677 5.914 -8.532 953 HB3 LEU 124 1HB LEU 124 -8.491 7.556 -9.154 954 HG LEU 124 HG LEU 124 -8.762 8.402 -6.801 955 HD11 LEU 124 1HD1 LEU 124 -9.630 6.915 -5.332 956 HD12 LEU 124 2HD1 LEU 124 -8.021 6.195 -5.287 957 HD13 LEU 124 3HD1 LEU 124 -9.246 5.543 -6.372 958 HD21 LEU 124 1HD2 LEU 124 -6.491 6.418 -6.999 959 HD22 LEU 124 2HD2 LEU 124 -6.486 8.009 -6.237 960 HD23 LEU 124 3HD2 LEU 124 -6.540 7.873 -7.996 961 H HIS 125 H HIS 125 -10.434 8.893 -10.214 962 HA HIS 125 HA HIS 125 -10.423 11.250 -8.621 963 HB2 HIS 125 2HB HIS 125 -9.756 11.326 -10.957 964 HB3 HIS 125 1HB HIS 125 -11.379 10.851 -11.458 965 HD1 HIS 125 1HD HIS 125 -11.240 13.145 -8.584 966 HD2 HIS 125 2HD HIS 125 -11.557 13.502 -12.728 967 HE1 HIS 125 1HE HIS 125 -12.015 15.509 -9.039 968 HE2 HIS 125 2HE HIS 125 -12.203 15.744 -11.560 969 H ARG 126 H ARG 126 -13.063 9.183 -9.632 970 HA ARG 126 HA ARG 126 -15.253 10.879 -9.550 971 HB2 ARG 126 2HB ARG 126 -16.565 9.000 -9.126 972 HB3 ARG 126 1HB ARG 126 -15.094 8.250 -9.739 973 HG2 ARG 126 2HG ARG 126 -14.314 8.093 -7.317 974 HG3 ARG 126 1HG ARG 126 -15.957 8.544 -6.856 975 HD2 ARG 126 2HD ARG 126 -15.172 6.137 -8.521 976 HD3 ARG 126 1HD ARG 126 -15.751 6.109 -6.855 977 HE ARG 126 HE ARG 126 -17.401 6.523 -9.250 978 HH11 ARG 126 1HH1 ARG 126 -19.624 6.601 -8.852 979 HH12 ARG 126 2HH1 ARG 126 -20.193 6.768 -7.224 980 HH21 ARG 126 1HH2 ARG 126 -17.016 6.842 -5.839 981 HH22 ARG 126 2HH2 ARG 126 -18.716 6.904 -5.518 982 H HIS 127 H HIS 127 -13.145 9.942 -6.934 983 HA HIS 127 HA HIS 127 -14.780 10.622 -4.717 984 HB2 HIS 127 2HB HIS 127 -12.319 9.631 -4.895 985 HB3 HIS 127 1HB HIS 127 -11.871 11.324 -4.699 986 HD1 HIS 127 1HD HIS 127 -14.620 11.712 -2.860 987 HD2 HIS 127 2HD HIS 127 -11.363 9.192 -2.184 988 HE1 HIS 127 1HE HIS 127 -14.607 11.202 -0.375 989 HE2 HIS 127 2HE HIS 127 -12.629 9.672 0.046 990 H GLY 128 H GLY 128 -12.697 12.617 -6.773 991 HA2 GLY 128 2HA GLY 128 -12.391 14.964 -6.803 992 HA3 GLY 128 1HA GLY 128 -14.151 14.928 -6.893 993 H ASP 129 H ASP 129 -12.711 13.652 -4.017 994 HA ASP 129 HA ASP 129 -13.712 16.040 -2.536 995 HB2 ASP 129 2HB ASP 129 -13.134 13.206 -1.628 996 HB3 ASP 129 1HB ASP 129 -13.640 14.508 -0.550 997 H GLY 130 H GLY 130 -10.926 15.279 -3.870 998 HA2 GLY 130 2HA GLY 130 -8.846 16.385 -3.352 999 HA3 GLY 130 1HA GLY 130 -9.362 16.505 -1.668 1000 H ALA 131 H ALA 131 -9.997 13.455 -3.006 1001 HA ALA 131 HA ALA 131 -8.337 12.047 -1.195 1002 HB1 ALA 131 1HB ALA 131 -10.315 11.286 -2.830 1003 HB2 ALA 131 2HB ALA 131 -9.134 10.135 -2.208 1004 HB3 ALA 131 3HB ALA 131 -8.950 10.795 -3.833 1005 H TRP 132 H TRP 132 -7.649 13.363 -4.382 1006 HA TRP 132 HA TRP 132 -5.329 11.896 -5.029 1007 HB2 TRP 132 2HB TRP 132 -6.441 13.621 -6.492 1008 HB3 TRP 132 1HB TRP 132 -5.707 14.868 -5.485 1009 HD1 TRP 132 HD TRP 132 -3.525 15.740 -6.419 1010 HE1 TRP 132 1HE TRP 132 -1.608 14.794 -7.861 1011 HE3 TRP 132 3HE TRP 132 -5.200 10.969 -7.099 1012 HZ2 TRP 132 2HZ TRP 132 -0.884 12.332 -9.132 1013 HZ3 TRP 132 3HZ TRP 132 -3.882 9.345 -8.415 1014 HH2 TRP 132 HH TRP 132 -1.730 10.017 -9.433 1015 H ASN 133 H ASN 133 -5.731 14.647 -2.828 1016 HA ASN 133 HA ASN 133 -2.989 15.150 -2.297 1017 HB2 ASN 133 2HB ASN 133 -5.412 15.353 -0.485 1018 HB3 ASN 133 1HB ASN 133 -3.826 16.008 -0.094 1019 HD21 ASN 133 1HD2 ASN 133 -6.097 17.727 -0.369 1020 HD22 ASN 133 2HD2 ASN 133 -5.877 18.692 -1.749 1021 H ILE 134 H ILE 134 -5.252 12.830 -0.840 1022 HA ILE 134 HA ILE 134 -3.485 11.791 1.141 1023 HB ILE 134 HB ILE 134 -5.852 10.663 -0.331 1024 HG12 ILE 134 2HG1 ILE 134 -6.940 10.853 1.788 1025 HG13 ILE 134 1HG1 ILE 134 -5.410 11.066 2.635 1026 HG21 ILE 134 1HG2 ILE 134 -4.539 8.705 -0.038 1027 HG22 ILE 134 2HG2 ILE 134 -5.646 8.723 1.334 1028 HG23 ILE 134 3HG2 ILE 134 -3.971 9.231 1.546 1029 HD11 ILE 134 1HD1 ILE 134 -5.105 13.255 1.751 1030 HD12 ILE 134 2HD1 ILE 134 -6.799 13.185 2.230 1031 HD13 ILE 134 3HD1 ILE 134 -6.356 13.018 0.533 1032 H HIS 135 H HIS 135 -3.990 10.950 -2.261 1033 HA HIS 135 HA HIS 135 -2.262 8.688 -2.350 1034 HB2 HIS 135 2HB HIS 135 -3.858 9.441 -4.168 1035 HB3 HIS 135 1HB HIS 135 -2.689 10.694 -4.581 1036 HD1 HIS 135 1HD HIS 135 -0.092 8.999 -4.170 1037 HD2 HIS 135 2HD HIS 135 -3.415 7.732 -6.349 1038 HE1 HIS 135 1HE HIS 135 0.737 7.221 -5.773 1039 HE2 HIS 135 2HE HIS 135 -1.277 6.443 -7.104 1040 H LYS 136 H LYS 136 -1.613 12.167 -2.623 1041 HA LYS 136 HA LYS 136 1.065 12.055 -3.497 1042 HB2 LYS 136 2HB LYS 136 -0.211 13.975 -1.544 1043 HB3 LYS 136 1HB LYS 136 1.347 14.229 -2.314 1044 HG2 LYS 136 2HG LYS 136 0.225 14.071 -4.529 1045 HG3 LYS 136 1HG LYS 136 -1.322 13.960 -3.700 1046 HD2 LYS 136 2HD LYS 136 -0.845 16.151 -2.602 1047 HD3 LYS 136 1HD LYS 136 0.631 16.273 -3.561 1048 HE2 LYS 136 2HE LYS 136 -0.562 17.136 -5.260 1049 HE3 LYS 136 1HE LYS 136 -1.491 15.640 -5.351 1050 HZ1 LYS 136 1HZ LYS 136 -2.537 18.022 -4.735 1051 HZ2 LYS 136 2HZ LYS 136 -2.222 17.410 -3.182 1052 HZ3 LYS 136 3HZ LYS 136 -3.208 16.540 -4.257 1053 H ALA 137 H ALA 137 -0.237 11.806 -0.192 1054 HA ALA 137 HA ALA 137 2.353 11.547 1.056 1055 HB1 ALA 137 1HB ALA 137 0.315 10.092 2.491 1056 HB2 ALA 137 2HB ALA 137 -0.349 11.621 1.913 1057 HB3 ALA 137 3HB ALA 137 1.094 11.613 2.927 1058 H LEU 138 H LEU 138 -0.040 9.235 -0.157 1059 HA LEU 138 HA LEU 138 1.408 6.864 0.580 1060 HB2 LEU 138 2HB LEU 138 -0.590 7.287 -1.660 1061 HB3 LEU 138 1HB LEU 138 -0.103 5.735 -0.998 1062 HG LEU 138 HG LEU 138 -1.487 7.951 0.538 1063 HD11 LEU 138 1HD1 LEU 138 -2.777 6.507 -1.216 1064 HD12 LEU 138 2HD1 LEU 138 -3.454 6.666 0.405 1065 HD13 LEU 138 3HD1 LEU 138 -2.578 5.203 -0.045 1066 HD21 LEU 138 1HD2 LEU 138 -0.186 5.376 1.267 1067 HD22 LEU 138 2HD2 LEU 138 -1.688 5.783 2.096 1068 HD23 LEU 138 3HD2 LEU 138 -0.303 6.871 2.192 1069 H ASP 139 H ASP 139 1.597 9.106 -2.087 1070 HA ASP 139 HA ASP 139 2.850 7.602 -4.079 1071 HB2 ASP 139 2HB ASP 139 2.216 10.056 -4.173 1072 HB3 ASP 139 1HB ASP 139 3.702 10.397 -3.286 1073 H GLY 140 H GLY 140 4.334 9.051 -1.189 1074 HA2 GLY 140 2HA GLY 140 6.490 8.762 -0.289 1075 HA3 GLY 140 1HA GLY 140 6.272 7.085 -0.790 1076 HA PRO 141 HA PRO 141 9.778 9.219 -3.184 1077 HB2 PRO 141 2HB PRO 141 11.647 7.275 -2.511 1078 HB3 PRO 141 1HB PRO 141 11.458 8.833 -1.685 1079 HG2 PRO 141 2HG PRO 141 10.499 6.142 -0.892 1080 HG3 PRO 141 1HG PRO 141 11.077 7.482 0.112 1081 HD2 PRO 141 2HD PRO 141 8.432 6.866 -0.133 1082 HD3 PRO 141 1HD PRO 141 9.008 8.523 0.153 1083 H SER 142 H SER 142 10.557 8.456 -5.216 1084 HA SER 142 HA SER 142 10.534 7.113 -7.143 1085 HB2 SER 142 2HB SER 142 11.650 5.549 -5.377 1086 HB3 SER 142 1HB SER 142 10.097 4.718 -5.367 1087 HG SER 142 HG SER 142 11.861 4.095 -6.959 1088 HA PRO 143 HA PRO 143 5.846 7.137 -6.562 1089 HB2 PRO 143 2HB PRO 143 6.182 8.499 -9.191 1090 HB3 PRO 143 1HB PRO 143 5.135 8.925 -7.826 1091 HG2 PRO 143 2HG PRO 143 7.358 10.294 -8.373 1092 HG3 PRO 143 1HG PRO 143 6.803 10.028 -6.713 1093 HD2 PRO 143 2HD PRO 143 9.074 8.747 -8.164 1094 HD3 PRO 143 1HD PRO 143 8.894 9.098 -6.431 1095 H GLY 144 H GLY 144 4.435 5.686 -7.562 1096 HA2 GLY 144 2HA GLY 144 4.543 4.690 -10.178 1097 HA3 GLY 144 1HA GLY 144 5.572 3.622 -9.223 1098 H GLU 145 H GLU 145 3.638 2.198 -10.103 1099 HA GLU 145 HA GLU 145 1.055 2.341 -8.956 1100 HB2 GLU 145 2HB GLU 145 2.663 -0.128 -9.682 1101 HB3 GLU 145 1HB GLU 145 0.920 -0.088 -9.417 1102 HG2 GLU 145 2HG GLU 145 1.042 0.125 -11.739 1103 HG3 GLU 145 1HG GLU 145 0.961 1.811 -11.230 1104 H THR 146 H THR 146 0.160 1.110 -7.139 1105 HA THR 146 HA THR 146 1.595 1.400 -4.717 1106 HB THR 146 HB THR 146 -0.704 -0.435 -5.402 1107 HG1 THR 146 1HG THR 146 -0.412 2.205 -4.628 1108 HG21 THR 146 1HG2 THR 146 0.692 0.160 -2.810 1109 HG22 THR 146 2HG2 THR 146 0.150 -1.394 -3.447 1110 HG23 THR 146 3HG2 THR 146 -1.026 -0.238 -2.821 1111 H LEU 147 H LEU 147 1.318 -1.364 -6.908 1112 HA LEU 147 HA LEU 147 2.525 -3.317 -5.255 1113 HB2 LEU 147 2HB LEU 147 2.827 -3.039 -8.257 1114 HB3 LEU 147 1HB LEU 147 3.000 -4.513 -7.305 1115 HG LEU 147 HG LEU 147 0.466 -2.889 -7.636 1116 HD11 LEU 147 1HD1 LEU 147 -0.314 -4.615 -9.006 1117 HD12 LEU 147 2HD1 LEU 147 0.850 -5.777 -8.373 1118 HD13 LEU 147 3HD1 LEU 147 1.381 -4.513 -9.481 1119 HD21 LEU 147 1HD2 LEU 147 -0.403 -5.072 -6.418 1120 HD22 LEU 147 2HD2 LEU 147 0.244 -3.730 -5.473 1121 HD23 LEU 147 3HD2 LEU 147 1.251 -5.138 -5.809 1122 H ALA 148 H ALA 148 3.914 -0.694 -7.137 1123 HA ALA 148 HA ALA 148 6.630 -1.568 -7.126 1124 HB1 ALA 148 1HB ALA 148 5.350 0.564 -8.199 1125 HB2 ALA 148 2HB ALA 148 7.100 0.501 -8.000 1126 HB3 ALA 148 3HB ALA 148 6.108 1.342 -6.809 1127 H ARG 149 H ARG 149 4.965 0.676 -4.889 1128 HA ARG 149 HA ARG 149 7.166 0.851 -3.057 1129 HB2 ARG 149 2HB ARG 149 4.209 1.325 -2.651 1130 HB3 ARG 149 1HB ARG 149 5.458 1.770 -1.495 1131 HG2 ARG 149 2HG ARG 149 6.535 3.170 -3.263 1132 HG3 ARG 149 1HG ARG 149 5.179 2.801 -4.329 1133 HD2 ARG 149 2HD ARG 149 5.019 4.216 -1.653 1134 HD3 ARG 149 1HD ARG 149 4.794 4.953 -3.239 1135 HE ARG 149 HE ARG 149 2.836 3.307 -1.814 1136 HH11 ARG 149 1HH1 ARG 149 0.831 3.117 -2.842 1137 HH12 ARG 149 2HH1 ARG 149 0.672 3.600 -4.497 1138 HH21 ARG 149 1HH2 ARG 149 3.991 4.554 -4.814 1139 HH22 ARG 149 2HH2 ARG 149 2.461 4.414 -5.614 1140 H PHE 150 H PHE 150 4.284 -1.211 -3.175 1141 HA PHE 150 HA PHE 150 4.669 -2.499 -0.649 1142 HB2 PHE 150 2HB PHE 150 2.557 -2.621 -1.902 1143 HB3 PHE 150 1HB PHE 150 3.359 -3.523 -3.182 1144 HD1 PHE 150 1HD PHE 150 2.430 -3.643 0.426 1145 HD2 PHE 150 2HD PHE 150 3.688 -5.857 -3.033 1146 HE1 PHE 150 1HE PHE 150 1.995 -5.770 1.627 1147 HE2 PHE 150 2HE PHE 150 3.254 -7.982 -1.834 1148 HZ PHE 150 HZ PHE 150 2.414 -7.937 0.494 1149 H ALA 151 H ALA 151 5.812 -3.340 -3.925 1150 HA ALA 151 HA ALA 151 7.035 -5.819 -3.130 1151 HB1 ALA 151 1HB ALA 151 6.534 -4.844 -5.521 1152 HB2 ALA 151 2HB ALA 151 7.939 -5.883 -5.285 1153 HB3 ALA 151 3HB ALA 151 8.138 -4.132 -5.360 1154 H ASN 152 H ASN 152 8.223 -2.477 -3.255 1155 HA ASN 152 HA ASN 152 10.964 -3.088 -2.714 1156 HB2 ASN 152 2HB ASN 152 9.357 -0.604 -2.113 1157 HB3 ASN 152 1HB ASN 152 11.112 -0.707 -1.993 1158 HD21 ASN 152 1HD2 ASN 152 9.870 1.093 -3.840 1159 HD22 ASN 152 2HD2 ASN 152 10.197 0.555 -5.416 1160 H VAL 153 H VAL 153 8.352 -2.085 -0.476 1161 HA VAL 153 HA VAL 153 10.013 -2.365 1.861 1162 HB VAL 153 HB VAL 153 8.050 -1.952 3.117 1163 HG11 VAL 153 1HG1 VAL 153 7.698 0.101 2.268 1164 HG12 VAL 153 2HG1 VAL 153 6.910 -0.562 0.837 1165 HG13 VAL 153 3HG1 VAL 153 8.666 -0.397 0.880 1166 HG21 VAL 153 1HG2 VAL 153 6.725 -3.345 0.848 1167 HG22 VAL 153 2HG2 VAL 153 5.789 -2.118 1.693 1168 HG23 VAL 153 3HG2 VAL 153 6.434 -3.500 2.578 1169 H ILE 154 H ILE 154 8.035 -4.563 -0.001 1170 HA ILE 154 HA ILE 154 8.098 -6.658 2.042 1171 HB ILE 154 HB ILE 154 7.109 -6.503 -0.797 1172 HG12 ILE 154 2HG1 ILE 154 5.964 -5.498 1.367 1173 HG13 ILE 154 1HG1 ILE 154 5.005 -6.318 0.141 1174 HG21 ILE 154 1HG2 ILE 154 6.058 -8.780 -0.144 1175 HG22 ILE 154 2HG2 ILE 154 7.368 -8.860 1.037 1176 HG23 ILE 154 3HG2 ILE 154 7.737 -8.745 -0.684 1177 HD11 ILE 154 1HD1 ILE 154 6.199 -7.873 2.425 1178 HD12 ILE 154 2HD1 ILE 154 4.806 -8.280 1.422 1179 HD13 ILE 154 3HD1 ILE 154 4.677 -7.005 2.634 Start of MODEL 5 1 H1 MET 1 1HT MET 1 3.411 13.981 -3.838 2 H2 MET 1 2HT MET 1 5.050 13.660 -4.151 3 H3 MET 1 3HT MET 1 3.878 12.465 -4.436 4 HA MET 1 HA MET 1 2.917 14.401 -5.977 5 HB2 MET 1 2HB MET 1 5.941 14.627 -6.098 6 HB3 MET 1 1HB MET 1 4.788 15.474 -7.130 7 HG2 MET 1 2HG MET 1 3.966 16.780 -5.320 8 HG3 MET 1 1HG MET 1 4.736 15.741 -4.121 9 HE1 MET 1 1HE MET 1 7.358 18.068 -3.175 10 HE2 MET 1 2HE MET 1 6.567 16.523 -2.876 11 HE3 MET 1 3HE MET 1 5.599 17.989 -3.007 12 HA PRO 2 HA PRO 2 4.108 10.394 -7.909 13 HB2 PRO 2 2HB PRO 2 1.590 9.294 -7.919 14 HB3 PRO 2 1HB PRO 2 2.737 9.117 -6.581 15 HG2 PRO 2 2HG PRO 2 0.270 10.635 -6.693 16 HG3 PRO 2 1HG PRO 2 1.263 10.209 -5.293 17 HD2 PRO 2 2HD PRO 2 1.146 12.739 -6.738 18 HD3 PRO 2 1HD PRO 2 1.987 12.369 -5.213 19 H GLU 3 H GLU 3 3.252 9.477 -10.041 20 HA GLU 3 HA GLU 3 2.937 11.391 -12.030 21 HB2 GLU 3 2HB GLU 3 1.606 8.670 -11.978 22 HB3 GLU 3 1HB GLU 3 1.926 9.630 -13.421 23 HG2 GLU 3 2HG GLU 3 4.364 9.540 -12.892 24 HG3 GLU 3 1HG GLU 3 4.000 8.485 -11.526 25 H GLU 4 H GLU 4 1.033 12.306 -13.080 26 HA GLU 4 HA GLU 4 -0.940 13.311 -11.379 27 HB2 GLU 4 2HB GLU 4 -1.243 12.664 -14.329 28 HB3 GLU 4 1HB GLU 4 -2.293 13.743 -13.410 29 HG2 GLU 4 2HG GLU 4 -0.323 15.166 -12.877 30 HG3 GLU 4 1HG GLU 4 0.682 14.113 -13.874 31 H ILE 5 H ILE 5 -3.054 12.653 -10.834 32 HA ILE 5 HA ILE 5 -3.562 10.037 -10.141 33 HB ILE 5 HB ILE 5 -4.966 12.000 -9.529 34 HG12 ILE 5 2HG1 ILE 5 -6.793 9.991 -10.826 35 HG13 ILE 5 1HG1 ILE 5 -5.754 9.502 -9.487 36 HG21 ILE 5 1HG2 ILE 5 -6.233 13.153 -11.040 37 HG22 ILE 5 2HG2 ILE 5 -6.584 11.713 -11.998 38 HG23 ILE 5 3HG2 ILE 5 -5.033 12.534 -12.175 39 HD11 ILE 5 1HD1 ILE 5 -7.194 12.037 -9.035 40 HD12 ILE 5 2HD1 ILE 5 -6.981 10.658 -7.958 41 HD13 ILE 5 3HD1 ILE 5 -8.240 10.627 -9.188 42 HA PRO 6 HA PRO 6 -4.034 8.517 -14.439 43 HB2 PRO 6 2HB PRO 6 -2.879 6.118 -14.120 44 HB3 PRO 6 1HB PRO 6 -1.911 7.605 -14.169 45 HG2 PRO 6 2HG PRO 6 -2.670 5.917 -11.852 46 HG3 PRO 6 1HG PRO 6 -1.194 6.853 -12.138 47 HD2 PRO 6 2HD PRO 6 -3.405 7.651 -10.555 48 HD3 PRO 6 1HD PRO 6 -2.049 8.671 -11.068 49 H ASP 7 H ASP 7 -5.235 6.682 -15.405 50 HA ASP 7 HA ASP 7 -7.561 5.925 -13.812 51 HB2 ASP 7 2HB ASP 7 -8.312 4.831 -15.874 52 HB3 ASP 7 1HB ASP 7 -7.726 6.452 -16.238 53 H VAL 8 H VAL 8 -7.292 3.266 -15.569 54 HA VAL 8 HA VAL 8 -6.814 1.462 -13.495 55 HB VAL 8 HB VAL 8 -6.291 -0.193 -15.253 56 HG11 VAL 8 1HG1 VAL 8 -8.331 0.352 -16.745 57 HG12 VAL 8 2HG1 VAL 8 -8.514 1.786 -15.735 58 HG13 VAL 8 3HG1 VAL 8 -8.613 0.181 -15.012 59 HG21 VAL 8 1HG2 VAL 8 -4.834 1.225 -16.637 60 HG22 VAL 8 2HG2 VAL 8 -6.210 2.245 -17.056 61 HG23 VAL 8 3HG2 VAL 8 -6.152 0.571 -17.609 62 H ARG 9 H ARG 9 -4.969 0.570 -12.564 63 HA ARG 9 HA ARG 9 -2.448 1.983 -13.157 64 HB2 ARG 9 2HB ARG 9 -3.234 0.074 -10.945 65 HB3 ARG 9 1HB ARG 9 -1.626 0.783 -11.103 66 HG2 ARG 9 2HG ARG 9 -2.682 3.054 -11.068 67 HG3 ARG 9 1HG ARG 9 -4.237 2.284 -10.754 68 HD2 ARG 9 2HD ARG 9 -3.223 1.220 -8.719 69 HD3 ARG 9 1HD ARG 9 -1.769 2.177 -8.999 70 HE ARG 9 HE ARG 9 -3.973 3.962 -8.956 71 HH11 ARG 9 1HH1 ARG 9 -4.417 5.120 -7.066 72 HH12 ARG 9 2HH1 ARG 9 -3.812 4.541 -5.550 73 HH21 ARG 9 1HH2 ARG 9 -2.259 1.764 -6.927 74 HH22 ARG 9 2HH2 ARG 9 -2.591 2.640 -5.471 75 H LYS 10 H LYS 10 -0.676 -0.129 -12.301 76 HA LYS 10 HA LYS 10 -0.883 -1.940 -14.667 77 HB2 LYS 10 2HB LYS 10 1.524 -0.656 -13.364 78 HB3 LYS 10 1HB LYS 10 1.631 -1.923 -14.581 79 HG2 LYS 10 2HG LYS 10 0.306 -0.509 -16.134 80 HG3 LYS 10 1HG LYS 10 0.311 0.778 -14.926 81 HD2 LYS 10 2HD LYS 10 2.800 0.772 -14.977 82 HD3 LYS 10 1HD LYS 10 2.749 -0.440 -16.257 83 HE2 LYS 10 2HE LYS 10 1.020 1.527 -17.176 84 HE3 LYS 10 1HE LYS 10 2.315 2.451 -16.417 85 HZ1 LYS 10 1HZ LYS 10 2.434 0.608 -18.694 86 HZ2 LYS 10 2HZ LYS 10 3.802 0.758 -17.698 87 HZ3 LYS 10 3HZ LYS 10 3.171 2.121 -18.492 88 H SER 11 H SER 11 1.004 -3.724 -14.237 89 HA SER 11 HA SER 11 0.401 -4.934 -11.561 90 HB2 SER 11 2HB SER 11 0.374 -7.114 -12.606 91 HB3 SER 11 1HB SER 11 -0.706 -6.071 -13.523 92 HG SER 11 HG SER 11 1.629 -7.279 -14.265 93 H VAL 12 H VAL 12 2.145 -6.110 -10.596 94 HA VAL 12 HA VAL 12 4.771 -5.965 -11.970 95 HB VAL 12 HB VAL 12 4.096 -4.722 -9.320 96 HG11 VAL 12 1HG1 VAL 12 6.000 -5.973 -8.719 97 HG12 VAL 12 2HG1 VAL 12 6.684 -4.429 -9.227 98 HG13 VAL 12 3HG1 VAL 12 6.718 -5.811 -10.322 99 HG21 VAL 12 1HG2 VAL 12 5.608 -3.800 -11.778 100 HG22 VAL 12 2HG2 VAL 12 5.381 -2.838 -10.318 101 HG23 VAL 12 3HG2 VAL 12 3.988 -3.287 -11.303 102 H VAL 13 H VAL 13 6.323 -7.478 -11.110 103 HA VAL 13 HA VAL 13 5.013 -9.723 -9.649 104 HB VAL 13 HB VAL 13 7.633 -9.692 -11.178 105 HG11 VAL 13 1HG1 VAL 13 7.253 -12.192 -11.109 106 HG12 VAL 13 2HG1 VAL 13 5.948 -11.895 -9.961 107 HG13 VAL 13 3HG1 VAL 13 7.606 -11.462 -9.543 108 HG21 VAL 13 1HG2 VAL 13 5.122 -9.450 -12.265 109 HG22 VAL 13 2HG2 VAL 13 5.327 -11.202 -12.233 110 HG23 VAL 13 3HG2 VAL 13 6.495 -10.192 -13.086 111 H VAL 14 H VAL 14 5.644 -10.191 -7.590 112 HA VAL 14 HA VAL 14 8.162 -8.936 -6.582 113 HB VAL 14 HB VAL 14 5.728 -9.387 -4.882 114 HG11 VAL 14 1HG1 VAL 14 8.120 -9.005 -3.976 115 HG12 VAL 14 2HG1 VAL 14 6.823 -8.007 -3.317 116 HG13 VAL 14 3HG1 VAL 14 7.912 -7.345 -4.536 117 HG21 VAL 14 1HG2 VAL 14 5.536 -6.788 -5.201 118 HG22 VAL 14 2HG2 VAL 14 4.840 -7.856 -6.420 119 HG23 VAL 14 3HG2 VAL 14 6.405 -7.094 -6.705 120 H ALA 15 H ALA 15 9.307 -10.181 -5.022 121 HA ALA 15 HA ALA 15 8.808 -13.074 -5.257 122 HB1 ALA 15 1HB ALA 15 10.978 -13.366 -4.291 123 HB2 ALA 15 2HB ALA 15 10.994 -11.717 -3.666 124 HB3 ALA 15 3HB ALA 15 11.117 -12.004 -5.402 125 H ALA 16 H ALA 16 6.975 -13.457 -3.975 126 HA ALA 16 HA ALA 16 7.462 -13.657 -1.113 127 HB1 ALA 16 1HB ALA 16 5.175 -12.311 -0.783 128 HB2 ALA 16 2HB ALA 16 5.737 -11.488 -2.238 129 HB3 ALA 16 3HB ALA 16 6.733 -11.485 -0.782 130 H SER 17 H SER 17 5.977 -15.136 -0.160 131 HA SER 17 HA SER 17 4.642 -16.910 -2.006 132 HB2 SER 17 2HB SER 17 4.399 -16.728 1.010 133 HB3 SER 17 1HB SER 17 3.868 -18.082 0.017 134 HG SER 17 HG SER 17 6.335 -17.622 -0.685 135 H VAL 18 H VAL 18 2.393 -17.200 -2.321 136 HA VAL 18 HA VAL 18 0.763 -14.900 -2.429 137 HB VAL 18 HB VAL 18 -0.830 -17.297 -1.976 138 HG11 VAL 18 1HG1 VAL 18 -1.280 -15.141 -3.363 139 HG12 VAL 18 2HG1 VAL 18 -1.810 -16.686 -4.025 140 HG13 VAL 18 3HG1 VAL 18 -0.330 -15.935 -4.617 141 HG21 VAL 18 1HG2 VAL 18 1.470 -17.460 -3.948 142 HG22 VAL 18 2HG2 VAL 18 0.072 -18.532 -3.970 143 HG23 VAL 18 3HG2 VAL 18 1.161 -18.539 -2.586 144 H GLU 19 H GLU 19 0.887 -17.435 0.071 145 HA GLU 19 HA GLU 19 -1.175 -16.394 1.731 146 HB2 GLU 19 2HB GLU 19 1.343 -17.908 2.490 147 HB3 GLU 19 1HB GLU 19 -0.029 -17.640 3.566 148 HG2 GLU 19 2HG GLU 19 -1.505 -18.804 1.940 149 HG3 GLU 19 1HG GLU 19 -0.098 -19.127 0.923 150 H HIS 20 H HIS 20 2.254 -15.601 1.462 151 HA HIS 20 HA HIS 20 2.468 -13.924 3.745 152 HB2 HIS 20 2HB HIS 20 4.351 -14.797 2.285 153 HB3 HIS 20 1HB HIS 20 3.909 -13.560 1.108 154 HD1 HIS 20 1HD HIS 20 4.604 -13.665 4.862 155 HD2 HIS 20 2HD HIS 20 5.325 -11.241 1.545 156 HE1 HIS 20 1HE HIS 20 5.971 -11.707 5.689 157 HE2 HIS 20 2HE HIS 20 6.417 -10.225 3.681 158 H CYS 21 H CYS 21 1.435 -13.264 0.410 159 HA CYS 21 HA CYS 21 1.309 -10.456 0.508 160 HB2 CYS 21 2HB CYS 21 -0.446 -12.464 -0.931 161 HB3 CYS 21 1HB CYS 21 -0.526 -10.727 -1.212 162 HG CYS 21 HG CYS 21 1.728 -10.769 -2.344 163 H PHE 22 H PHE 22 -1.453 -12.686 1.088 164 HA PHE 22 HA PHE 22 -3.112 -10.553 2.120 165 HB2 PHE 22 2HB PHE 22 -3.563 -13.445 2.796 166 HB3 PHE 22 1HB PHE 22 -4.749 -12.194 2.423 167 HD1 PHE 22 1HD PHE 22 -5.205 -11.530 0.093 168 HD2 PHE 22 2HD PHE 22 -2.322 -14.564 1.044 169 HE1 PHE 22 1HE PHE 22 -5.157 -12.234 -2.284 170 HE2 PHE 22 2HE PHE 22 -2.275 -15.270 -1.326 171 HZ PHE 22 HZ PHE 22 -3.692 -14.106 -2.992 172 H GLU 23 H GLU 23 -1.028 -12.984 3.586 173 HA GLU 23 HA GLU 23 -1.820 -12.545 6.304 174 HB2 GLU 23 2HB GLU 23 -0.527 -14.517 5.517 175 HB3 GLU 23 1HB GLU 23 0.854 -13.465 5.228 176 HG2 GLU 23 2HG GLU 23 0.844 -12.827 7.627 177 HG3 GLU 23 1HG GLU 23 -0.478 -13.962 7.896 178 H VAL 24 H VAL 24 0.637 -11.023 4.254 179 HA VAL 24 HA VAL 24 1.945 -9.537 6.295 180 HB VAL 24 HB VAL 24 1.691 -9.311 3.324 181 HG11 VAL 24 1HG1 VAL 24 2.663 -7.175 5.213 182 HG12 VAL 24 2HG1 VAL 24 1.611 -7.009 3.811 183 HG13 VAL 24 3HG1 VAL 24 3.331 -7.325 3.591 184 HG21 VAL 24 1HG2 VAL 24 3.339 -10.839 4.291 185 HG22 VAL 24 2HG2 VAL 24 3.991 -9.544 5.290 186 HG23 VAL 24 3HG2 VAL 24 4.174 -9.481 3.538 187 H PHE 25 H PHE 25 -0.798 -8.584 4.182 188 HA PHE 25 HA PHE 25 -0.977 -5.910 5.170 189 HB2 PHE 25 2HB PHE 25 -3.436 -7.458 4.411 190 HB3 PHE 25 1HB PHE 25 -3.040 -5.774 4.080 191 HD1 PHE 25 1HD PHE 25 -3.798 -8.397 2.316 192 HD2 PHE 25 2HD PHE 25 -0.284 -6.029 2.995 193 HE1 PHE 25 1HE PHE 25 -2.922 -9.058 0.086 194 HE2 PHE 25 2HE PHE 25 0.597 -6.689 0.771 195 HZ PHE 25 HZ PHE 25 -0.723 -8.204 -0.684 196 H THR 26 H THR 26 -2.674 -8.867 6.212 197 HA THR 26 HA THR 26 -3.930 -7.391 8.423 198 HB THR 26 HB THR 26 -5.173 -9.436 8.805 199 HG1 THR 26 1HG THR 26 -4.480 -11.090 7.012 200 HG21 THR 26 1HG2 THR 26 -4.821 -8.580 5.938 201 HG22 THR 26 2HG2 THR 26 -6.158 -8.242 7.037 202 HG23 THR 26 3HG2 THR 26 -5.957 -9.859 6.364 203 H SER 27 H SER 27 -1.141 -9.472 8.020 204 HA SER 27 HA SER 27 -1.103 -10.036 10.928 205 HB2 SER 27 2HB SER 27 0.983 -10.912 8.953 206 HB3 SER 27 1HB SER 27 0.568 -11.636 10.499 207 HG SER 27 HG SER 27 -1.000 -12.680 9.567 208 H ARG 28 H ARG 28 1.014 -8.414 8.520 209 HA ARG 28 HA ARG 28 2.290 -7.024 10.850 210 HB2 ARG 28 2HB ARG 28 4.420 -7.089 9.629 211 HB3 ARG 28 1HB ARG 28 3.810 -8.717 9.902 212 HG2 ARG 28 2HG ARG 28 3.725 -9.115 7.689 213 HG3 ARG 28 1HG ARG 28 2.747 -7.674 7.426 214 HD2 ARG 28 2HD ARG 28 5.017 -7.742 6.231 215 HD3 ARG 28 1HD ARG 28 4.672 -6.288 7.167 216 HE ARG 28 HE ARG 28 5.987 -7.866 8.988 217 HH11 ARG 28 1HH1 ARG 28 8.236 -7.937 9.204 218 HH12 ARG 28 2HH1 ARG 28 9.236 -7.547 7.844 219 HH21 ARG 28 1HH2 ARG 28 6.565 -6.921 5.723 220 HH22 ARG 28 2HH2 ARG 28 8.290 -6.971 5.874 221 HA PRO 29 HA PRO 29 0.663 -4.087 7.514 222 HB2 PRO 29 2HB PRO 29 -1.018 -2.695 9.204 223 HB3 PRO 29 1HB PRO 29 -1.526 -4.051 8.186 224 HG2 PRO 29 2HG PRO 29 -0.890 -3.996 11.087 225 HG3 PRO 29 1HG PRO 29 -2.128 -4.916 10.215 226 HD2 PRO 29 2HD PRO 29 0.213 -6.035 11.080 227 HD3 PRO 29 1HD PRO 29 -0.659 -6.608 9.640 228 H ALA 30 H ALA 30 1.618 -3.625 10.896 229 HA ALA 30 HA ALA 30 2.450 -0.850 10.457 230 HB1 ALA 30 1HB ALA 30 1.574 -1.573 12.643 231 HB2 ALA 30 2HB ALA 30 3.222 -0.964 12.793 232 HB3 ALA 30 3HB ALA 30 2.918 -2.701 12.807 233 H ASP 31 H ASP 31 4.038 -3.993 10.429 234 HA ASP 31 HA ASP 31 6.699 -3.167 10.860 235 HB2 ASP 31 2HB ASP 31 5.615 -5.286 8.990 236 HB3 ASP 31 1HB ASP 31 7.331 -5.078 9.333 237 H TRP 32 H TRP 32 4.640 -2.777 8.041 238 HA TRP 32 HA TRP 32 6.765 -1.061 6.859 239 HB2 TRP 32 2HB TRP 32 7.047 -2.544 5.185 240 HB3 TRP 32 1HB TRP 32 5.718 -3.540 5.775 241 HD1 TRP 32 HD TRP 32 6.464 -0.627 3.421 242 HE1 TRP 32 1HE TRP 32 4.487 -0.343 1.799 243 HE3 TRP 32 3HE TRP 32 3.198 -3.967 5.445 244 HZ2 TRP 32 2HZ TRP 32 1.864 -1.397 1.416 245 HZ3 TRP 32 3HZ TRP 32 0.959 -4.312 4.435 246 HH2 TRP 32 HH TRP 32 0.287 -3.029 2.421 247 H TRP 33 H TRP 33 5.835 0.924 7.006 248 HA TRP 33 HA TRP 33 3.043 1.462 7.041 249 HB2 TRP 33 2HB TRP 33 5.016 3.448 5.938 250 HB3 TRP 33 1HB TRP 33 3.636 3.732 6.997 251 HD1 TRP 33 HD TRP 33 4.095 3.830 9.508 252 HE1 TRP 33 1HE TRP 33 6.132 3.352 11.015 253 HE3 TRP 33 3HE TRP 33 7.273 1.783 6.073 254 HZ2 TRP 33 2HZ TRP 33 8.761 2.251 10.792 255 HZ3 TRP 33 3HZ TRP 33 9.537 1.032 6.747 256 HH2 TRP 33 HH TRP 33 10.285 1.263 9.100 257 HA PRO 34 HA PRO 34 1.830 0.922 2.831 258 HB2 PRO 34 2HB PRO 34 0.409 3.448 2.659 259 HB3 PRO 34 1HB PRO 34 -0.235 1.807 2.722 260 HG2 PRO 34 2HG PRO 34 -0.251 3.736 4.783 261 HG3 PRO 34 1HG PRO 34 -0.791 2.059 4.860 262 HD2 PRO 34 2HD PRO 34 1.528 3.215 6.105 263 HD3 PRO 34 1HD PRO 34 0.971 1.532 6.171 264 HA PRO 35 HA PRO 35 3.805 4.767 0.828 265 HB2 PRO 35 2HB PRO 35 4.536 6.898 2.298 266 HB3 PRO 35 1HB PRO 35 2.847 6.641 1.823 267 HG2 PRO 35 2HG PRO 35 4.166 6.172 4.442 268 HG3 PRO 35 1HG PRO 35 2.535 6.762 4.086 269 HD2 PRO 35 2HD PRO 35 3.184 4.130 4.790 270 HD3 PRO 35 1HD PRO 35 1.673 4.650 4.028 271 H SER 36 H SER 36 6.000 4.900 0.230 272 HA SER 36 HA SER 36 7.938 3.382 1.664 273 HB2 SER 36 2HB SER 36 8.441 5.610 -0.331 274 HB3 SER 36 1HB SER 36 9.584 4.352 0.128 275 HG SER 36 HG SER 36 7.016 3.790 -0.924 276 H HIS 37 H HIS 37 7.087 6.791 1.733 277 HA HIS 37 HA HIS 37 9.016 7.168 3.992 278 HB2 HIS 37 2HB HIS 37 8.066 9.217 1.961 279 HB3 HIS 37 1HB HIS 37 9.139 9.549 3.322 280 HD1 HIS 37 1HD HIS 37 9.050 7.957 -0.064 281 HD2 HIS 37 2HD HIS 37 11.790 8.486 3.037 282 HE1 HIS 37 1HE HIS 37 11.321 7.331 -0.998 283 HE2 HIS 37 2HE HIS 37 12.995 7.648 0.882 284 H VAL 38 H VAL 38 8.162 9.238 5.322 285 HA VAL 38 HA VAL 38 5.297 8.633 5.891 286 HB VAL 38 HB VAL 38 7.309 10.122 7.600 287 HG11 VAL 38 1HG1 VAL 38 4.764 10.457 7.918 288 HG12 VAL 38 2HG1 VAL 38 5.700 9.989 9.333 289 HG13 VAL 38 3HG1 VAL 38 4.747 8.783 8.471 290 HG21 VAL 38 1HG2 VAL 38 7.081 7.327 7.009 291 HG22 VAL 38 2HG2 VAL 38 6.571 7.584 8.677 292 HG23 VAL 38 3HG2 VAL 38 8.169 8.115 8.151 293 H LEU 39 H LEU 39 3.848 10.060 5.136 294 HA LEU 39 HA LEU 39 4.692 12.910 4.793 295 HB2 LEU 39 2HB LEU 39 2.471 11.434 3.343 296 HB3 LEU 39 1HB LEU 39 3.010 13.085 3.033 297 HG LEU 39 HG LEU 39 4.621 10.546 2.633 298 HD11 LEU 39 1HD1 LEU 39 3.195 12.477 0.849 299 HD12 LEU 39 2HD1 LEU 39 3.375 10.728 0.695 300 HD13 LEU 39 3HD1 LEU 39 4.716 11.795 0.278 301 HD21 LEU 39 1HD2 LEU 39 6.237 12.346 1.604 302 HD22 LEU 39 2HD2 LEU 39 6.251 12.066 3.345 303 HD23 LEU 39 3HD2 LEU 39 5.387 13.454 2.682 304 H VAL 40 H VAL 40 3.182 11.014 6.904 305 HA VAL 40 HA VAL 40 0.766 12.665 7.338 306 HB VAL 40 HB VAL 40 1.386 10.798 9.473 307 HG11 VAL 40 1HG1 VAL 40 -0.779 10.724 7.351 308 HG12 VAL 40 2HG1 VAL 40 -0.851 11.744 8.788 309 HG13 VAL 40 3HG1 VAL 40 -0.834 9.989 8.954 310 HG21 VAL 40 1HG2 VAL 40 2.677 9.542 7.868 311 HG22 VAL 40 2HG2 VAL 40 1.458 9.778 6.615 312 HG23 VAL 40 3HG2 VAL 40 1.112 8.740 8.000 313 H LYS 41 H LYS 41 0.444 13.714 9.472 314 HA LYS 41 HA LYS 41 2.618 15.355 10.245 315 HB2 LYS 41 2HB LYS 41 0.168 14.551 11.826 316 HB3 LYS 41 1HB LYS 41 1.253 15.868 12.267 317 HG2 LYS 41 2HG LYS 41 0.793 16.930 10.053 318 HG3 LYS 41 1HG LYS 41 -0.384 15.659 9.724 319 HD2 LYS 41 2HD LYS 41 -1.610 16.317 11.802 320 HD3 LYS 41 1HD LYS 41 -0.483 17.659 12.001 321 HE2 LYS 41 2HE LYS 41 -1.141 18.369 9.630 322 HE3 LYS 41 1HE LYS 41 -2.470 17.218 9.766 323 HZ1 LYS 41 1HZ LYS 41 -3.517 18.987 10.644 324 HZ2 LYS 41 2HZ LYS 41 -2.077 19.769 11.098 325 HZ3 LYS 41 3HZ LYS 41 -2.714 18.526 12.065 326 H LYS 42 H LYS 42 1.520 12.238 11.497 327 HA LYS 42 HA LYS 42 4.036 12.102 13.102 328 HB2 LYS 42 2HB LYS 42 1.354 10.935 13.867 329 HB3 LYS 42 1HB LYS 42 2.833 10.842 14.816 330 HG2 LYS 42 2HG LYS 42 1.707 13.509 13.985 331 HG3 LYS 42 1HG LYS 42 1.096 12.683 15.418 332 HD2 LYS 42 2HD LYS 42 2.980 13.107 16.614 333 HD3 LYS 42 1HD LYS 42 4.038 12.757 15.251 334 HE2 LYS 42 2HE LYS 42 4.245 15.110 15.825 335 HE3 LYS 42 1HE LYS 42 3.428 14.973 14.268 336 HZ1 LYS 42 1HZ LYS 42 1.461 15.650 15.131 337 HZ2 LYS 42 2HZ LYS 42 2.487 16.461 16.216 338 HZ3 LYS 42 3HZ LYS 42 1.762 14.992 16.665 339 H GLU 43 H GLU 43 5.108 10.101 13.040 340 HA GLU 43 HA GLU 43 4.726 8.472 10.735 341 HB2 GLU 43 2HB GLU 43 6.123 7.816 13.338 342 HB3 GLU 43 1HB GLU 43 6.292 6.898 11.845 343 HG2 GLU 43 2HG GLU 43 7.157 8.926 10.713 344 HG3 GLU 43 1HG GLU 43 7.033 9.814 12.232 345 H ARG 44 H ARG 44 3.439 6.674 10.401 346 HA ARG 44 HA ARG 44 1.401 6.078 12.389 347 HB2 ARG 44 2HB ARG 44 2.084 4.854 9.713 348 HB3 ARG 44 1HB ARG 44 0.790 4.233 10.737 349 HG2 ARG 44 2HG ARG 44 -0.142 6.595 10.792 350 HG3 ARG 44 1HG ARG 44 1.022 6.993 9.526 351 HD2 ARG 44 2HD ARG 44 0.061 5.397 8.023 352 HD3 ARG 44 1HD ARG 44 -0.930 4.697 9.304 353 HE ARG 44 HE ARG 44 -1.847 7.235 9.310 354 HH11 ARG 44 1HH1 ARG 44 -3.376 8.118 7.896 355 HH12 ARG 44 2HH1 ARG 44 -3.546 7.459 6.303 356 HH21 ARG 44 1HH2 ARG 44 -1.081 5.062 6.740 357 HH22 ARG 44 2HH2 ARG 44 -2.248 5.732 5.649 358 H ALA 45 H ALA 45 1.235 4.248 13.674 359 HA ALA 45 HA ALA 45 3.575 2.389 13.633 360 HB1 ALA 45 1HB ALA 45 4.216 3.080 15.664 361 HB2 ALA 45 2HB ALA 45 2.620 2.696 16.309 362 HB3 ALA 45 3HB ALA 45 2.941 4.297 15.644 363 H GLY 46 H GLY 46 0.251 2.873 14.919 364 HA2 GLY 46 2HA GLY 46 -0.005 -0.090 15.039 365 HA3 GLY 46 1HA GLY 46 -1.108 1.060 15.779 366 H LEU 47 H LEU 47 -1.632 -1.192 13.908 367 HA LEU 47 HA LEU 47 -3.326 0.328 12.008 368 HB2 LEU 47 2HB LEU 47 -1.218 -1.700 11.245 369 HB3 LEU 47 1HB LEU 47 -2.658 -1.492 10.259 370 HG LEU 47 HG LEU 47 -2.062 1.044 10.281 371 HD11 LEU 47 1HD1 LEU 47 -0.206 1.660 11.387 372 HD12 LEU 47 2HD1 LEU 47 0.748 0.628 10.331 373 HD13 LEU 47 3HD1 LEU 47 0.108 -0.014 11.840 374 HD21 LEU 47 1HD2 LEU 47 -0.855 0.799 8.267 375 HD22 LEU 47 2HD2 LEU 47 -1.773 -0.701 8.373 376 HD23 LEU 47 3HD2 LEU 47 -0.064 -0.678 8.814 377 H ALA 48 H ALA 48 -5.352 -0.605 11.953 378 HA ALA 48 HA ALA 48 -5.631 -3.502 12.401 379 HB1 ALA 48 1HB ALA 48 -6.739 -1.434 14.310 380 HB2 ALA 48 2HB ALA 48 -5.666 -2.780 14.692 381 HB3 ALA 48 3HB ALA 48 -7.341 -3.089 14.232 382 H PHE 49 H PHE 49 -7.212 -4.206 11.043 383 HA PHE 49 HA PHE 49 -9.563 -2.492 10.552 384 HB2 PHE 49 2HB PHE 49 -9.333 -2.649 8.104 385 HB3 PHE 49 1HB PHE 49 -7.966 -1.795 8.819 386 HD1 PHE 49 1HD PHE 49 -5.773 -2.937 9.084 387 HD2 PHE 49 2HD PHE 49 -9.064 -4.772 7.022 388 HE1 PHE 49 1HE PHE 49 -4.217 -4.571 8.057 389 HE2 PHE 49 2HE PHE 49 -7.512 -6.407 5.997 390 HZ PHE 49 HZ PHE 49 -5.082 -6.304 6.513 391 H GLU 50 H GLU 50 -11.381 -3.684 9.817 392 HA GLU 50 HA GLU 50 -11.158 -6.592 10.290 393 HB2 GLU 50 2HB GLU 50 -13.771 -5.406 9.547 394 HB3 GLU 50 1HB GLU 50 -13.372 -6.515 10.859 395 HG2 GLU 50 2HG GLU 50 -12.146 -4.501 11.924 396 HG3 GLU 50 1HG GLU 50 -13.060 -3.517 10.781 397 HA PRO 51 HA PRO 51 -11.052 -6.842 5.750 398 HB2 PRO 51 2HB PRO 51 -10.390 -9.474 5.556 399 HB3 PRO 51 1HB PRO 51 -9.211 -8.205 5.935 400 HG2 PRO 51 2HG PRO 51 -10.518 -10.170 7.728 401 HG3 PRO 51 1HG PRO 51 -8.884 -9.494 7.788 402 HD2 PRO 51 2HD PRO 51 -10.998 -8.667 9.395 403 HD3 PRO 51 1HD PRO 51 -9.544 -7.704 9.060 404 H PHE 52 H PHE 52 -13.318 -6.591 5.403 405 HA PHE 52 HA PHE 52 -14.698 -9.046 4.622 406 HB2 PHE 52 2HB PHE 52 -15.952 -7.292 6.759 407 HB3 PHE 52 1HB PHE 52 -16.627 -8.770 6.073 408 HD1 PHE 52 1HD PHE 52 -14.349 -7.360 8.513 409 HD2 PHE 52 2HD PHE 52 -15.458 -10.972 6.472 410 HE1 PHE 52 1HE PHE 52 -13.136 -8.690 10.212 411 HE2 PHE 52 2HE PHE 52 -14.243 -12.306 8.175 412 HZ PHE 52 HZ PHE 52 -13.079 -11.165 10.045 413 H VAL 53 H VAL 53 -17.065 -8.276 3.850 414 HA VAL 53 HA VAL 53 -16.553 -6.014 2.059 415 HB VAL 53 HB VAL 53 -19.175 -7.477 2.507 416 HG11 VAL 53 1HG1 VAL 53 -19.661 -5.609 1.198 417 HG12 VAL 53 2HG1 VAL 53 -19.280 -6.809 -0.037 418 HG13 VAL 53 3HG1 VAL 53 -18.074 -5.607 0.426 419 HG21 VAL 53 1HG2 VAL 53 -18.406 -9.264 1.351 420 HG22 VAL 53 2HG2 VAL 53 -16.788 -8.633 1.650 421 HG23 VAL 53 3HG2 VAL 53 -17.623 -8.240 0.149 422 H GLY 54 H GLY 54 -16.953 -3.926 2.649 423 HA2 GLY 54 2HA GLY 54 -18.098 -2.113 3.661 424 HA3 GLY 54 1HA GLY 54 -19.276 -3.264 4.305 425 H GLY 55 H GLY 55 -15.950 -4.016 4.794 426 HA2 GLY 55 2HA GLY 55 -16.246 -3.949 7.675 427 HA3 GLY 55 1HA GLY 55 -14.749 -4.281 6.798 428 H ARG 56 H ARG 56 -14.267 -2.764 8.889 429 HA ARG 56 HA ARG 56 -14.203 0.048 7.850 430 HB2 ARG 56 2HB ARG 56 -14.301 -0.934 10.719 431 HB3 ARG 56 1HB ARG 56 -14.113 0.753 10.237 432 HG2 ARG 56 2HG ARG 56 -16.275 0.599 8.997 433 HG3 ARG 56 1HG ARG 56 -16.475 -1.044 9.610 434 HD2 ARG 56 2HD ARG 56 -16.276 -0.099 11.946 435 HD3 ARG 56 1HD ARG 56 -16.339 1.512 11.231 436 HE ARG 56 HE ARG 56 -18.597 -0.291 11.566 437 HH11 ARG 56 1HH1 ARG 56 -20.582 0.469 10.799 438 HH12 ARG 56 2HH1 ARG 56 -20.617 1.822 9.718 439 HH21 ARG 56 1HH2 ARG 56 -17.172 2.218 9.679 440 HH22 ARG 56 2HH2 ARG 56 -18.685 2.812 9.084 441 H TYR 57 H TYR 57 -12.202 1.036 7.789 442 HA TYR 57 HA TYR 57 -9.895 -0.576 8.811 443 HB2 TYR 57 2HB TYR 57 -10.223 -0.210 6.244 444 HB3 TYR 57 1HB TYR 57 -9.676 1.432 6.577 445 HD1 TYR 57 1HD TYR 57 -8.644 -1.890 5.862 446 HD2 TYR 57 2HD TYR 57 -7.485 1.637 8.023 447 HE1 TYR 57 1HE TYR 57 -6.295 -2.689 5.905 448 HE2 TYR 57 2HE TYR 57 -5.137 0.841 8.063 449 HH TYR 57 HH TYR 57 -4.161 -2.015 7.755 450 H TYR 58 H TYR 58 -8.673 0.438 10.332 451 HA TYR 58 HA TYR 58 -8.656 3.404 10.398 452 HB2 TYR 58 2HB TYR 58 -8.940 3.215 12.944 453 HB3 TYR 58 1HB TYR 58 -10.385 2.966 11.963 454 HD1 TYR 58 1HD TYR 58 -10.889 0.515 11.240 455 HD2 TYR 58 2HD TYR 58 -8.293 1.568 14.493 456 HE1 TYR 58 1HE TYR 58 -11.166 -1.758 12.196 457 HE2 TYR 58 2HE TYR 58 -8.571 -0.703 15.450 458 HH TYR 58 HH TYR 58 -9.835 -3.280 13.729 459 H GLU 59 H GLU 59 -6.862 4.265 11.643 460 HA GLU 59 HA GLU 59 -4.753 2.292 12.367 461 HB2 GLU 59 2HB GLU 59 -4.334 4.717 10.589 462 HB3 GLU 59 1HB GLU 59 -3.073 3.610 11.138 463 HG2 GLU 59 2HG GLU 59 -4.216 1.742 9.991 464 HG3 GLU 59 1HG GLU 59 -5.461 2.855 9.427 465 H TRP 60 H TRP 60 -3.321 3.090 14.011 466 HA TRP 60 HA TRP 60 -4.337 5.552 15.364 467 HB2 TRP 60 2HB TRP 60 -2.658 3.268 16.438 468 HB3 TRP 60 1HB TRP 60 -3.174 4.673 17.371 469 HD1 TRP 60 HD TRP 60 -5.928 5.030 17.501 470 HE1 TRP 60 1HE TRP 60 -7.758 3.233 17.765 471 HE3 TRP 60 3HE TRP 60 -3.335 0.897 15.987 472 HZ2 TRP 60 2HZ TRP 60 -8.077 0.415 17.387 473 HZ3 TRP 60 3HZ TRP 60 -4.423 -1.326 15.950 474 HH2 TRP 60 HH TRP 60 -6.788 -1.572 16.646 475 H ASP 61 H ASP 61 -3.006 7.297 15.616 476 HA ASP 61 HA ASP 61 -0.295 7.099 14.402 477 HB2 ASP 61 2HB ASP 61 -2.038 9.468 15.108 478 HB3 ASP 61 1HB ASP 61 -0.408 9.609 14.451 479 H ILE 62 H ILE 62 1.505 8.202 15.532 480 HA ILE 62 HA ILE 62 1.855 7.377 18.194 481 HB ILE 62 HB ILE 62 3.151 9.702 16.768 482 HG12 ILE 62 2HG1 ILE 62 4.126 6.875 17.172 483 HG13 ILE 62 1HG1 ILE 62 3.355 7.444 15.699 484 HG21 ILE 62 1HG2 ILE 62 4.174 10.123 18.720 485 HG22 ILE 62 2HG2 ILE 62 4.900 8.519 18.617 486 HG23 ILE 62 3HG2 ILE 62 3.377 8.743 19.476 487 HD11 ILE 62 1HD1 ILE 62 5.107 9.080 15.338 488 HD12 ILE 62 2HD1 ILE 62 5.862 7.507 15.595 489 HD13 ILE 62 3HD1 ILE 62 5.836 8.695 16.897 490 H ASP 63 H ASP 63 0.836 10.576 16.998 491 HA ASP 63 HA ASP 63 -0.111 11.180 19.776 492 HB2 ASP 63 2HB ASP 63 0.953 13.076 17.662 493 HB3 ASP 63 1HB ASP 63 0.233 13.586 19.188 494 H GLY 64 H GLY 64 -0.865 11.026 16.389 495 HA2 GLY 64 2HA GLY 64 -3.320 12.578 16.579 496 HA3 GLY 64 1HA GLY 64 -2.846 11.565 15.214 497 H THR 65 H THR 65 -5.449 11.720 16.614 498 HA THR 65 HA THR 65 -5.803 9.383 18.248 499 HB THR 65 HB THR 65 -7.334 11.409 18.111 500 HG1 THR 65 1HG THR 65 -9.239 9.766 17.954 501 HG21 THR 65 1HG2 THR 65 -8.603 11.794 16.265 502 HG22 THR 65 2HG2 THR 65 -8.821 10.074 15.936 503 HG23 THR 65 3HG2 THR 65 -7.330 10.883 15.455 504 H GLU 66 H GLU 66 -8.204 8.468 16.787 505 HA GLU 66 HA GLU 66 -6.812 6.650 14.882 506 HB2 GLU 66 2HB GLU 66 -8.090 5.632 16.758 507 HB3 GLU 66 1HB GLU 66 -9.552 6.420 16.167 508 HG2 GLU 66 2HG GLU 66 -9.259 5.224 13.988 509 HG3 GLU 66 1HG GLU 66 -7.894 4.355 14.693 510 H ILE 67 H ILE 67 -7.229 6.834 12.729 511 HA ILE 67 HA ILE 67 -9.687 8.290 11.882 512 HB ILE 67 HB ILE 67 -8.393 9.373 10.080 513 HG12 ILE 67 2HG1 ILE 67 -5.928 8.350 11.507 514 HG13 ILE 67 1HG1 ILE 67 -6.602 7.553 10.086 515 HG21 ILE 67 1HG2 ILE 67 -6.750 10.173 12.372 516 HG22 ILE 67 2HG2 ILE 67 -8.465 10.046 12.765 517 HG23 ILE 67 3HG2 ILE 67 -7.936 11.108 11.460 518 HD11 ILE 67 1HD1 ILE 67 -5.667 9.077 8.715 519 HD12 ILE 67 2HD1 ILE 67 -4.837 9.755 10.115 520 HD13 ILE 67 3HD1 ILE 67 -6.403 10.399 9.621 521 H VAL 68 H VAL 68 -10.207 7.805 9.517 522 HA VAL 68 HA VAL 68 -9.818 4.900 9.098 523 HB VAL 68 HB VAL 68 -12.097 5.986 8.957 524 HG11 VAL 68 1HG1 VAL 68 -12.633 7.466 7.226 525 HG12 VAL 68 2HG1 VAL 68 -11.256 6.969 6.242 526 HG13 VAL 68 3HG1 VAL 68 -11.006 7.989 7.659 527 HG21 VAL 68 1HG2 VAL 68 -10.824 4.137 7.103 528 HG22 VAL 68 2HG2 VAL 68 -12.170 4.984 6.340 529 HG23 VAL 68 3HG2 VAL 68 -12.434 4.062 7.822 530 H TRP 69 H TRP 69 -8.585 4.071 7.464 531 HA TRP 69 HA TRP 69 -7.147 6.032 5.738 532 HB2 TRP 69 2HB TRP 69 -5.511 4.743 6.764 533 HB3 TRP 69 1HB TRP 69 -6.520 3.299 6.790 534 HD1 TRP 69 HD TRP 69 -4.045 5.186 4.657 535 HE1 TRP 69 1HE TRP 69 -3.509 3.806 2.546 536 HE3 TRP 69 3HE TRP 69 -7.589 1.530 5.065 537 HZ2 TRP 69 2HZ TRP 69 -4.457 1.460 1.208 538 HZ3 TRP 69 3HZ TRP 69 -7.750 -0.263 3.362 539 HH2 TRP 69 HH TRP 69 -6.189 -0.305 1.434 540 H GLY 70 H GLY 70 -9.743 3.916 5.588 541 HA2 GLY 70 2HA GLY 70 -10.408 4.248 2.940 542 HA3 GLY 70 1HA GLY 70 -9.284 2.888 2.895 543 H ARG 71 H ARG 71 -10.715 1.200 2.482 544 HA ARG 71 HA ARG 71 -12.351 0.317 4.724 545 HB2 ARG 71 2HB ARG 71 -13.693 2.006 3.107 546 HB3 ARG 71 1HB ARG 71 -13.943 0.510 2.213 547 HG2 ARG 71 2HG ARG 71 -14.754 -0.566 4.316 548 HG3 ARG 71 1HG ARG 71 -14.616 0.993 5.125 549 HD2 ARG 71 2HD ARG 71 -16.182 1.963 3.444 550 HD3 ARG 71 1HD ARG 71 -16.376 0.358 2.740 551 HE ARG 71 HE ARG 71 -16.964 0.549 5.619 552 HH11 ARG 71 1HH1 ARG 71 -19.090 0.016 6.166 553 HH12 ARG 71 2HH1 ARG 71 -20.280 -0.136 4.916 554 HH21 ARG 71 1HH2 ARG 71 -18.069 0.605 2.351 555 HH22 ARG 71 2HH2 ARG 71 -19.701 0.195 2.758 556 H ILE 72 H ILE 72 -13.906 -1.540 3.148 557 HA ILE 72 HA ILE 72 -11.803 -3.096 1.724 558 HB ILE 72 HB ILE 72 -13.650 -4.155 3.886 559 HG12 ILE 72 2HG1 ILE 72 -11.141 -4.858 4.613 560 HG13 ILE 72 1HG1 ILE 72 -10.782 -3.367 3.743 561 HG21 ILE 72 1HG2 ILE 72 -13.466 -5.827 2.160 562 HG22 ILE 72 2HG2 ILE 72 -12.364 -6.297 3.454 563 HG23 ILE 72 3HG2 ILE 72 -11.734 -5.541 1.991 564 HD11 ILE 72 1HD1 ILE 72 -12.670 -3.706 6.084 565 HD12 ILE 72 2HD1 ILE 72 -12.564 -2.232 5.125 566 HD13 ILE 72 3HD1 ILE 72 -11.169 -2.784 6.053 567 H LEU 73 H LEU 73 -12.781 -4.823 0.338 568 HA LEU 73 HA LEU 73 -15.570 -4.114 -0.491 569 HB2 LEU 73 2HB LEU 73 -13.763 -3.405 -2.114 570 HB3 LEU 73 1HB LEU 73 -13.359 -5.109 -2.308 571 HG LEU 73 HG LEU 73 -15.951 -5.349 -2.769 572 HD11 LEU 73 1HD1 LEU 73 -16.517 -3.024 -2.257 573 HD12 LEU 73 2HD1 LEU 73 -16.809 -3.340 -3.966 574 HD13 LEU 73 3HD1 LEU 73 -15.366 -2.457 -3.468 575 HD21 LEU 73 1HD2 LEU 73 -13.796 -4.351 -4.628 576 HD22 LEU 73 2HD2 LEU 73 -15.415 -4.704 -5.231 577 HD23 LEU 73 3HD2 LEU 73 -14.456 -5.980 -4.482 578 H GLU 74 H GLU 74 -13.113 -6.694 -0.682 579 HA GLU 74 HA GLU 74 -14.894 -8.683 0.394 580 HB2 GLU 74 2HB GLU 74 -15.889 -8.388 -1.885 581 HB3 GLU 74 1HB GLU 74 -14.343 -8.884 -2.570 582 HG2 GLU 74 2HG GLU 74 -14.507 -11.030 -1.315 583 HG3 GLU 74 1HG GLU 74 -16.102 -10.540 -0.741 584 H TRP 75 H TRP 75 -13.686 -10.453 1.052 585 HA TRP 75 HA TRP 75 -10.811 -10.424 0.268 586 HB2 TRP 75 2HB TRP 75 -11.779 -10.312 2.759 587 HB3 TRP 75 1HB TRP 75 -11.811 -12.063 2.556 588 HD1 TRP 75 HD TRP 75 -9.528 -13.337 2.435 589 HE1 TRP 75 1HE TRP 75 -7.087 -12.626 2.869 590 HE3 TRP 75 3HE TRP 75 -10.091 -8.262 2.536 591 HZ2 TRP 75 2HZ TRP 75 -5.574 -10.219 3.215 592 HZ3 TRP 75 3HZ TRP 75 -8.137 -6.786 2.919 593 HH2 TRP 75 HH TRP 75 -5.882 -7.758 3.257 594 H ASP 76 H ASP 76 -10.174 -12.026 -1.099 595 HA ASP 76 HA ASP 76 -11.845 -14.498 -1.215 596 HB2 ASP 76 2HB ASP 76 -10.944 -12.704 -3.265 597 HB3 ASP 76 1HB ASP 76 -10.256 -14.306 -3.543 598 HA PRO 77 HA PRO 77 -8.271 -16.539 0.713 599 HB2 PRO 77 2HB PRO 77 -9.318 -18.657 -1.163 600 HB3 PRO 77 1HB PRO 77 -8.746 -18.835 0.507 601 HG2 PRO 77 2HG PRO 77 -11.338 -18.734 -0.052 602 HG3 PRO 77 1HG PRO 77 -10.675 -17.985 1.410 603 HD2 PRO 77 2HD PRO 77 -11.779 -16.698 -1.003 604 HD3 PRO 77 1HD PRO 77 -11.551 -16.019 0.625 605 HA PRO 78 HA PRO 78 -4.625 -16.154 -1.750 606 HB2 PRO 78 2HB PRO 78 -4.746 -19.145 -1.986 607 HB3 PRO 78 1HB PRO 78 -3.348 -18.103 -1.653 608 HG2 PRO 78 2HG PRO 78 -4.809 -19.420 0.271 609 HG3 PRO 78 1HG PRO 78 -3.806 -17.991 0.560 610 HD2 PRO 78 2HD PRO 78 -6.654 -18.176 0.801 611 HD3 PRO 78 1HD PRO 78 -5.658 -16.718 0.973 612 H HIS 79 H HIS 79 -5.881 -15.170 -3.472 613 HA HIS 79 HA HIS 79 -5.578 -16.323 -6.015 614 HB2 HIS 79 2HB HIS 79 -8.010 -17.196 -4.582 615 HB3 HIS 79 1HB HIS 79 -8.295 -16.584 -6.211 616 HD1 HIS 79 1HD HIS 79 -6.275 -17.608 -7.972 617 HD2 HIS 79 2HD HIS 79 -7.449 -19.890 -4.684 618 HE1 HIS 79 1HE HIS 79 -5.599 -19.997 -8.479 619 HE2 HIS 79 2HE HIS 79 -6.309 -21.394 -6.485 620 H ARG 80 H ARG 80 -8.128 -14.471 -4.233 621 HA ARG 80 HA ARG 80 -7.521 -12.212 -6.078 622 HB2 ARG 80 2HB ARG 80 -9.528 -13.435 -6.932 623 HB3 ARG 80 1HB ARG 80 -10.340 -13.080 -5.414 624 HG2 ARG 80 2HG ARG 80 -10.985 -11.382 -7.007 625 HG3 ARG 80 1HG ARG 80 -9.924 -10.637 -5.826 626 HD2 ARG 80 2HD ARG 80 -8.334 -10.198 -7.371 627 HD3 ARG 80 1HD ARG 80 -8.483 -11.790 -8.109 628 HE ARG 80 HE ARG 80 -9.671 -9.396 -9.119 629 HH11 ARG 80 1HH1 ARG 80 -11.225 -9.578 -10.750 630 HH12 ARG 80 2HH1 ARG 80 -12.038 -11.089 -10.989 631 HH21 ARG 80 1HH2 ARG 80 -10.346 -12.706 -8.430 632 HH22 ARG 80 2HH2 ARG 80 -11.539 -12.860 -9.676 633 H LEU 81 H LEU 81 -7.947 -10.154 -5.230 634 HA LEU 81 HA LEU 81 -8.881 -9.989 -2.417 635 HB2 LEU 81 2HB LEU 81 -6.385 -10.214 -2.365 636 HB3 LEU 81 1HB LEU 81 -6.269 -8.770 -3.367 637 HG LEU 81 HG LEU 81 -7.663 -7.590 -1.554 638 HD11 LEU 81 1HD1 LEU 81 -8.351 -8.778 0.226 639 HD12 LEU 81 2HD1 LEU 81 -6.690 -9.249 0.581 640 HD13 LEU 81 3HD1 LEU 81 -7.673 -10.233 -0.503 641 HD21 LEU 81 1HD2 LEU 81 -5.366 -7.971 0.001 642 HD22 LEU 81 2HD2 LEU 81 -5.592 -6.746 -1.248 643 HD23 LEU 81 3HD2 LEU 81 -4.837 -8.289 -1.651 644 H ALA 82 H ALA 82 -10.275 -8.289 -2.250 645 HA ALA 82 HA ALA 82 -9.915 -5.984 -4.116 646 HB1 ALA 82 1HB ALA 82 -11.788 -7.684 -4.752 647 HB2 ALA 82 2HB ALA 82 -12.186 -5.967 -4.730 648 HB3 ALA 82 3HB ALA 82 -12.656 -6.998 -3.378 649 H MET 83 H MET 83 -10.271 -3.984 -3.133 650 HA MET 83 HA MET 83 -11.445 -3.995 -0.400 651 HB2 MET 83 2HB MET 83 -8.806 -2.693 -1.116 652 HB3 MET 83 1HB MET 83 -9.598 -2.635 0.459 653 HG2 MET 83 2HG MET 83 -9.483 -5.149 0.526 654 HG3 MET 83 1HG MET 83 -8.516 -5.089 -0.947 655 HE1 MET 83 1HE MET 83 -9.037 -4.293 2.591 656 HE2 MET 83 2HE MET 83 -8.385 -2.669 2.394 657 HE3 MET 83 3HE MET 83 -7.472 -3.873 3.299 658 H THR 84 H THR 84 -12.623 -2.137 0.069 659 HA THR 84 HA THR 84 -12.786 -0.123 -2.129 660 HB THR 84 HB THR 84 -14.603 -0.467 0.281 661 HG1 THR 84 1HG THR 84 -15.911 -1.621 -1.057 662 HG21 THR 84 1HG2 THR 84 -15.445 1.495 -0.419 663 HG22 THR 84 2HG2 THR 84 -15.926 0.696 -1.915 664 HG23 THR 84 3HG2 THR 84 -14.365 1.509 -1.812 665 H TRP 85 H TRP 85 -12.026 1.970 -1.734 666 HA TRP 85 HA TRP 85 -10.790 2.386 0.938 667 HB2 TRP 85 2HB TRP 85 -10.366 3.625 -1.773 668 HB3 TRP 85 1HB TRP 85 -9.768 4.416 -0.316 669 HD1 TRP 85 HD TRP 85 -9.745 0.675 -0.141 670 HE1 TRP 85 1HE TRP 85 -7.333 -0.196 -0.364 671 HE3 TRP 85 3HE TRP 85 -7.389 4.970 -1.585 672 HZ2 TRP 85 2HZ TRP 85 -4.743 0.795 -1.063 673 HZ3 TRP 85 3HZ TRP 85 -4.950 4.977 -2.022 674 HH2 TRP 85 HH TRP 85 -3.624 2.898 -1.763 675 H ARG 86 H ARG 86 -11.941 3.546 2.393 676 HA ARG 86 HA ARG 86 -13.744 5.701 1.347 677 HB2 ARG 86 2HB ARG 86 -14.921 3.838 2.527 678 HB3 ARG 86 1HB ARG 86 -13.966 4.189 3.969 679 HG2 ARG 86 2HG ARG 86 -14.869 6.502 3.979 680 HG3 ARG 86 1HG ARG 86 -15.865 6.102 2.578 681 HD2 ARG 86 2HD ARG 86 -15.993 4.702 5.267 682 HD3 ARG 86 1HD ARG 86 -17.145 5.908 4.692 683 HE ARG 86 HE ARG 86 -16.846 3.665 2.856 684 HH11 ARG 86 1HH1 ARG 86 -18.664 2.336 2.651 685 HH12 ARG 86 2HH1 ARG 86 -19.929 2.436 3.829 686 HH21 ARG 86 1HH2 ARG 86 -18.360 4.900 5.697 687 HH22 ARG 86 2HH2 ARG 86 -19.758 3.887 5.553 688 H ILE 87 H ILE 87 -12.448 7.512 1.499 689 HA ILE 87 HA ILE 87 -11.541 8.259 4.216 690 HB ILE 87 HB ILE 87 -9.625 7.114 3.061 691 HG12 ILE 87 2HG1 ILE 87 -9.041 10.060 3.362 692 HG13 ILE 87 1HG1 ILE 87 -9.482 9.080 4.760 693 HG21 ILE 87 1HG2 ILE 87 -10.420 8.148 0.790 694 HG22 ILE 87 2HG2 ILE 87 -8.691 7.969 1.089 695 HG23 ILE 87 3HG2 ILE 87 -9.462 9.542 1.291 696 HD11 ILE 87 1HD1 ILE 87 -7.456 7.783 3.101 697 HD12 ILE 87 2HD1 ILE 87 -7.449 8.102 4.834 698 HD13 ILE 87 3HD1 ILE 87 -6.924 9.349 3.707 699 H ASP 88 H ASP 88 -11.032 10.595 4.354 700 HA ASP 88 HA ASP 88 -12.704 12.131 2.442 701 HB2 ASP 88 2HB ASP 88 -13.015 12.384 4.928 702 HB3 ASP 88 1HB ASP 88 -11.396 13.079 5.007 703 H GLY 89 H GLY 89 -11.886 13.934 1.304 704 HA2 GLY 89 2HA GLY 89 -9.254 13.735 0.278 705 HA3 GLY 89 1HA GLY 89 -10.275 15.161 0.128 706 H HIS 90 H HIS 90 -10.475 15.463 3.087 707 HA HIS 90 HA HIS 90 -7.950 16.929 3.425 708 HB2 HIS 90 2HB HIS 90 -10.496 16.778 5.037 709 HB3 HIS 90 1HB HIS 90 -9.092 17.699 5.557 710 HD1 HIS 90 1HD HIS 90 -8.188 18.911 2.889 711 HD2 HIS 90 2HD HIS 90 -12.170 18.784 4.115 712 HE1 HIS 90 1HE HIS 90 -9.390 20.741 1.612 713 HE2 HIS 90 2HE HIS 90 -11.816 20.671 2.348 714 H TRP 91 H TRP 91 -8.279 13.855 3.633 715 HA TRP 91 HA TRP 91 -7.364 12.148 4.961 716 HB2 TRP 91 2HB TRP 91 -5.718 14.554 5.476 717 HB3 TRP 91 1HB TRP 91 -5.615 13.304 6.715 718 HD1 TRP 91 HD TRP 91 -4.058 14.249 3.586 719 HE1 TRP 91 1HE TRP 91 -2.847 12.255 2.487 720 HE3 TRP 91 3HE TRP 91 -6.058 10.406 6.287 721 HZ2 TRP 91 2HZ TRP 91 -2.747 9.402 2.723 722 HZ3 TRP 91 3HZ TRP 91 -5.389 8.067 5.827 723 HH2 TRP 91 HH TRP 91 -3.737 7.559 4.054 724 H GLN 92 H GLN 92 -9.719 13.822 5.875 725 HA GLN 92 HA GLN 92 -9.496 13.701 8.813 726 HB2 GLN 92 2HB GLN 92 -11.806 14.464 6.996 727 HB3 GLN 92 1HB GLN 92 -11.788 14.644 8.752 728 HG2 GLN 92 2HG GLN 92 -9.968 16.223 8.641 729 HG3 GLN 92 1HG GLN 92 -9.740 15.919 6.927 730 HE21 GLN 92 1HE2 GLN 92 -10.271 18.558 7.896 731 HE22 GLN 92 2HE2 GLN 92 -11.811 19.031 7.359 732 H SER 93 H SER 93 -12.610 12.942 7.695 733 HA SER 93 HA SER 93 -12.212 10.031 7.690 734 HB2 SER 93 2HB SER 93 -13.441 9.546 9.659 735 HB3 SER 93 1HB SER 93 -12.344 10.838 10.134 736 HG SER 93 HG SER 93 -14.850 11.515 9.088 737 H VAL 94 H VAL 94 -14.218 8.905 7.088 738 HA VAL 94 HA VAL 94 -16.335 10.714 6.003 739 HB VAL 94 HB VAL 94 -16.178 8.498 4.276 740 HG11 VAL 94 1HG1 VAL 94 -15.174 11.342 3.949 741 HG12 VAL 94 2HG1 VAL 94 -16.829 10.795 3.677 742 HG13 VAL 94 3HG1 VAL 94 -15.529 10.227 2.629 743 HG21 VAL 94 1HG2 VAL 94 -13.885 8.146 5.243 744 HG22 VAL 94 2HG2 VAL 94 -13.451 9.762 4.685 745 HG23 VAL 94 3HG2 VAL 94 -13.873 8.510 3.518 746 HA PRO 95 HA PRO 95 -18.285 7.600 8.818 747 HB2 PRO 95 2HB PRO 95 -20.568 9.423 8.209 748 HB3 PRO 95 1HB PRO 95 -20.024 8.777 9.769 749 HG2 PRO 95 2HG PRO 95 -19.565 11.308 9.058 750 HG3 PRO 95 1HG PRO 95 -18.405 10.376 10.020 751 HD2 PRO 95 2HD PRO 95 -18.255 11.177 7.152 752 HD3 PRO 95 1HD PRO 95 -16.943 10.892 8.316 753 H ASP 96 H ASP 96 -19.114 8.688 5.597 754 HA ASP 96 HA ASP 96 -20.318 6.040 5.065 755 HB2 ASP 96 2HB ASP 96 -22.186 7.618 5.672 756 HB3 ASP 96 1HB ASP 96 -21.726 8.595 4.280 757 H ASP 97 H ASP 97 -20.101 5.427 2.856 758 HA ASP 97 HA ASP 97 -18.071 6.974 1.395 759 HB2 ASP 97 2HB ASP 97 -18.207 5.055 -0.222 760 HB3 ASP 97 1HB ASP 97 -17.817 4.563 1.425 761 H ASP 98 H ASP 98 -18.987 8.790 0.468 762 HA ASP 98 HA ASP 98 -21.610 8.644 -0.832 763 HB2 ASP 98 2HB ASP 98 -20.685 10.680 0.403 764 HB3 ASP 98 1HB ASP 98 -19.631 10.911 -0.988 765 H ARG 99 H ARG 99 -18.290 9.373 -1.885 766 HA ARG 99 HA ARG 99 -19.011 8.291 -4.576 767 HB2 ARG 99 2HB ARG 99 -17.271 10.688 -3.931 768 HB3 ARG 99 1HB ARG 99 -17.467 9.994 -5.541 769 HG2 ARG 99 2HG ARG 99 -19.926 10.391 -5.367 770 HG3 ARG 99 1HG ARG 99 -19.655 11.192 -3.818 771 HD2 ARG 99 2HD ARG 99 -18.082 12.770 -4.999 772 HD3 ARG 99 1HD ARG 99 -18.599 12.050 -6.524 773 HE ARG 99 HE ARG 99 -20.944 12.824 -5.155 774 HH11 ARG 99 1HH1 ARG 99 -21.934 14.795 -5.648 775 HH12 ARG 99 2HH1 ARG 99 -21.006 16.053 -6.394 776 HH21 ARG 99 1HH2 ARG 99 -18.076 14.201 -6.483 777 HH22 ARG 99 2HH2 ARG 99 -18.820 15.716 -6.866 778 H ALA 100 H ALA 100 -17.664 7.026 -2.206 779 HA ALA 100 HA ALA 100 -14.839 6.893 -2.693 780 HB1 ALA 100 1HB ALA 100 -16.204 6.070 -0.639 781 HB2 ALA 100 2HB ALA 100 -14.801 5.126 -1.140 782 HB3 ALA 100 3HB ALA 100 -16.425 4.591 -1.573 783 H SER 101 H SER 101 -13.626 5.357 -3.866 784 HA SER 101 HA SER 101 -15.169 3.952 -5.999 785 HB2 SER 101 2HB SER 101 -12.266 4.817 -5.904 786 HB3 SER 101 1HB SER 101 -13.015 3.954 -7.245 787 HG SER 101 HG SER 101 -13.421 6.578 -6.327 788 H GLU 102 H GLU 102 -14.171 1.842 -6.730 789 HA GLU 102 HA GLU 102 -13.237 0.311 -4.338 790 HB2 GLU 102 2HB GLU 102 -14.605 -0.680 -6.858 791 HB3 GLU 102 1HB GLU 102 -14.172 -1.665 -5.461 792 HG2 GLU 102 2HG GLU 102 -16.421 -1.176 -5.032 793 HG3 GLU 102 1HG GLU 102 -15.586 0.079 -4.115 794 H ILE 103 H ILE 103 -11.516 -1.161 -4.582 795 HA ILE 103 HA ILE 103 -9.834 -0.726 -7.022 796 HB ILE 103 HB ILE 103 -8.933 -1.416 -4.209 797 HG12 ILE 103 2HG1 ILE 103 -8.662 1.210 -5.702 798 HG13 ILE 103 1HG1 ILE 103 -9.905 0.900 -4.488 799 HG21 ILE 103 1HG2 ILE 103 -7.543 -0.911 -6.831 800 HG22 ILE 103 2HG2 ILE 103 -7.289 -2.223 -5.680 801 HG23 ILE 103 3HG2 ILE 103 -6.717 -0.598 -5.304 802 HD11 ILE 103 1HD1 ILE 103 -8.048 2.003 -3.391 803 HD12 ILE 103 2HD1 ILE 103 -6.903 0.847 -4.072 804 HD13 ILE 103 3HD1 ILE 103 -8.075 0.319 -2.862 805 H GLU 104 H GLU 104 -9.005 -2.581 -8.035 806 HA GLU 104 HA GLU 104 -9.953 -5.184 -6.894 807 HB2 GLU 104 2HB GLU 104 -10.879 -4.544 -9.135 808 HB3 GLU 104 1HB GLU 104 -9.232 -4.554 -9.770 809 HG2 GLU 104 2HG GLU 104 -9.004 -6.931 -9.046 810 HG3 GLU 104 1HG GLU 104 -10.691 -6.907 -8.532 811 H VAL 105 H VAL 105 -8.383 -6.510 -6.163 812 HA VAL 105 HA VAL 105 -5.644 -6.240 -7.314 813 HB VAL 105 HB VAL 105 -6.317 -6.740 -4.401 814 HG11 VAL 105 1HG1 VAL 105 -4.167 -7.367 -4.198 815 HG12 VAL 105 2HG1 VAL 105 -3.637 -5.849 -4.920 816 HG13 VAL 105 3HG1 VAL 105 -3.985 -7.241 -5.947 817 HG21 VAL 105 1HG2 VAL 105 -4.922 -4.390 -4.496 818 HG22 VAL 105 2HG2 VAL 105 -6.682 -4.489 -4.423 819 HG23 VAL 105 3HG2 VAL 105 -5.874 -4.279 -5.977 820 H ASP 106 H ASP 106 -4.810 -8.181 -7.980 821 HA ASP 106 HA ASP 106 -6.160 -10.665 -6.995 822 HB2 ASP 106 2HB ASP 106 -6.703 -10.160 -9.364 823 HB3 ASP 106 1HB ASP 106 -4.981 -10.158 -9.741 824 H PHE 107 H PHE 107 -4.828 -12.182 -6.126 825 HA PHE 107 HA PHE 107 -1.892 -11.849 -6.579 826 HB2 PHE 107 2HB PHE 107 -3.466 -12.141 -4.089 827 HB3 PHE 107 1HB PHE 107 -1.972 -13.080 -4.176 828 HD1 PHE 107 1HD PHE 107 0.176 -11.888 -4.823 829 HD2 PHE 107 2HD PHE 107 -3.416 -9.808 -3.726 830 HE1 PHE 107 1HE PHE 107 1.498 -9.830 -4.392 831 HE2 PHE 107 2HE PHE 107 -2.102 -7.753 -3.298 832 HZ PHE 107 HZ PHE 107 0.360 -7.764 -3.629 833 H VAL 108 H VAL 108 -1.006 -13.555 -7.550 834 HA VAL 108 HA VAL 108 -2.131 -16.257 -7.027 835 HB VAL 108 HB VAL 108 -2.079 -14.768 -9.528 836 HG11 VAL 108 1HG1 VAL 108 -0.014 -15.939 -10.019 837 HG12 VAL 108 2HG1 VAL 108 -1.314 -16.699 -10.933 838 HG13 VAL 108 3HG1 VAL 108 -0.701 -17.470 -9.474 839 HG21 VAL 108 1HG2 VAL 108 -3.737 -16.374 -10.137 840 HG22 VAL 108 2HG2 VAL 108 -3.954 -16.071 -8.413 841 HG23 VAL 108 3HG2 VAL 108 -3.139 -17.538 -8.955 842 HA PRO 109 HA PRO 109 2.140 -17.190 -6.204 843 HB2 PRO 109 2HB PRO 109 2.176 -19.853 -7.020 844 HB3 PRO 109 1HB PRO 109 1.655 -19.280 -5.426 845 HG2 PRO 109 2HG PRO 109 0.036 -20.088 -7.767 846 HG3 PRO 109 1HG PRO 109 -0.299 -20.274 -6.038 847 HD2 PRO 109 2HD PRO 109 -1.517 -18.380 -7.574 848 HD3 PRO 109 1HD PRO 109 -1.189 -18.146 -5.843 849 H ASN 110 H ASN 110 3.748 -16.460 -7.511 850 HA ASN 110 HA ASN 110 3.889 -17.491 -10.307 851 HB2 ASN 110 2HB ASN 110 3.355 -15.009 -10.000 852 HB3 ASN 110 1HB ASN 110 4.995 -14.848 -9.376 853 HD21 ASN 110 1HD2 ASN 110 5.273 -13.423 -11.391 854 HD22 ASN 110 2HD2 ASN 110 5.662 -14.192 -12.854 855 H GLY 111 H GLY 111 5.588 -18.879 -10.488 856 HA2 GLY 111 2HA GLY 111 7.909 -19.436 -10.476 857 HA3 GLY 111 1HA GLY 111 8.204 -18.071 -9.399 858 H SER 112 H SER 112 9.503 -20.180 -8.570 859 HA SER 112 HA SER 112 8.100 -22.151 -7.065 860 HB2 SER 112 2HB SER 112 10.855 -21.042 -6.524 861 HB3 SER 112 1HB SER 112 10.232 -22.595 -5.983 862 HG SER 112 HG SER 112 11.451 -22.848 -7.872 863 H GLY 113 H GLY 113 9.307 -18.932 -6.142 864 HA2 GLY 113 2HA GLY 113 7.546 -19.079 -3.755 865 HA3 GLY 113 1HA GLY 113 9.252 -18.728 -3.493 866 H GLY 114 H GLY 114 7.118 -17.593 -6.103 867 HA2 GLY 114 2HA GLY 114 7.381 -14.838 -5.015 868 HA3 GLY 114 1HA GLY 114 7.810 -15.144 -6.697 869 H THR 115 H THR 115 5.677 -13.388 -5.804 870 HA THR 115 HA THR 115 3.337 -14.844 -6.946 871 HB THR 115 HB THR 115 1.982 -13.221 -5.539 872 HG1 THR 115 1HG THR 115 3.170 -11.747 -4.660 873 HG21 THR 115 1HG2 THR 115 2.804 -14.530 -3.347 874 HG22 THR 115 2HG2 THR 115 3.613 -15.505 -4.573 875 HG23 THR 115 3HG2 THR 115 1.861 -15.310 -4.612 876 H ARG 116 H ARG 116 2.144 -13.741 -8.480 877 HA ARG 116 HA ARG 116 3.207 -11.070 -9.323 878 HB2 ARG 116 2HB ARG 116 3.539 -12.911 -10.995 879 HB3 ARG 116 1HB ARG 116 1.791 -13.152 -11.026 880 HG2 ARG 116 2HG ARG 116 1.460 -10.851 -11.801 881 HG3 ARG 116 1HG ARG 116 3.196 -10.553 -11.712 882 HD2 ARG 116 2HD ARG 116 2.669 -11.050 -14.013 883 HD3 ARG 116 1HD ARG 116 3.518 -12.448 -13.351 884 HE ARG 116 HE ARG 116 1.512 -13.703 -13.535 885 HH11 ARG 116 1HH1 ARG 116 -0.616 -13.945 -14.258 886 HH12 ARG 116 2HH1 ARG 116 -1.532 -12.543 -14.697 887 HH21 ARG 116 1HH2 ARG 116 1.032 -10.319 -13.990 888 HH22 ARG 116 2HH2 ARG 116 -0.599 -10.490 -14.546 889 H VAL 117 H VAL 117 1.738 -9.433 -9.033 890 HA VAL 117 HA VAL 117 -1.140 -10.212 -8.877 891 HB VAL 117 HB VAL 117 -0.727 -9.724 -6.659 892 HG11 VAL 117 1HG1 VAL 117 0.814 -7.727 -6.071 893 HG12 VAL 117 2HG1 VAL 117 1.334 -7.814 -7.753 894 HG13 VAL 117 3HG1 VAL 117 1.574 -9.196 -6.683 895 HG21 VAL 117 1HG2 VAL 117 -2.372 -8.066 -7.781 896 HG22 VAL 117 2HG2 VAL 117 -1.071 -6.885 -7.627 897 HG23 VAL 117 3HG2 VAL 117 -1.750 -7.641 -6.187 898 H GLU 118 H GLU 118 -2.617 -8.929 -9.850 899 HA GLU 118 HA GLU 118 -1.568 -6.658 -11.485 900 HB2 GLU 118 2HB GLU 118 -2.650 -8.479 -12.761 901 HB3 GLU 118 1HB GLU 118 -4.102 -8.312 -11.776 902 HG2 GLU 118 2HG GLU 118 -4.330 -5.958 -12.570 903 HG3 GLU 118 1HG GLU 118 -2.939 -6.204 -13.622 904 H LEU 119 H LEU 119 -2.029 -4.687 -10.598 905 HA LEU 119 HA LEU 119 -4.517 -4.451 -8.962 906 HB2 LEU 119 2HB LEU 119 -2.294 -4.163 -7.759 907 HB3 LEU 119 1HB LEU 119 -2.043 -2.719 -8.738 908 HG LEU 119 HG LEU 119 -4.664 -2.905 -7.343 909 HD11 LEU 119 1HD1 LEU 119 -3.727 -2.189 -5.202 910 HD12 LEU 119 2HD1 LEU 119 -2.092 -2.291 -5.856 911 HD13 LEU 119 3HD1 LEU 119 -3.050 -3.757 -5.642 912 HD21 LEU 119 1HD2 LEU 119 -2.577 -0.737 -7.735 913 HD22 LEU 119 2HD2 LEU 119 -4.151 -0.494 -6.979 914 HD23 LEU 119 3HD2 LEU 119 -4.051 -0.943 -8.680 915 H ALA 120 H ALA 120 -6.047 -3.193 -9.889 916 HA ALA 120 HA ALA 120 -5.146 -0.959 -11.655 917 HB1 ALA 120 1HB ALA 120 -6.834 -3.270 -12.319 918 HB2 ALA 120 2HB ALA 120 -5.989 -2.150 -13.388 919 HB3 ALA 120 3HB ALA 120 -7.568 -1.720 -12.732 920 H HIS 121 H HIS 121 -6.247 0.942 -11.348 921 HA HIS 121 HA HIS 121 -8.585 0.887 -9.476 922 HB2 HIS 121 2HB HIS 121 -7.566 2.418 -8.162 923 HB3 HIS 121 1HB HIS 121 -6.097 2.164 -9.105 924 HD1 HIS 121 1HD HIS 121 -9.359 4.093 -9.699 925 HD2 HIS 121 2HD HIS 121 -5.237 4.575 -10.117 926 HE1 HIS 121 1HE HIS 121 -9.006 6.387 -10.712 927 HE2 HIS 121 2HE HIS 121 -6.501 6.700 -10.947 928 H VAL 122 H VAL 122 -10.393 2.017 -10.185 929 HA VAL 122 HA VAL 122 -10.053 3.768 -12.571 930 HB VAL 122 HB VAL 122 -12.065 2.744 -13.599 931 HG11 VAL 122 1HG1 VAL 122 -10.801 1.157 -14.647 932 HG12 VAL 122 2HG1 VAL 122 -10.343 0.380 -13.132 933 HG13 VAL 122 3HG1 VAL 122 -9.499 1.833 -13.668 934 HG21 VAL 122 1HG2 VAL 122 -13.290 1.818 -11.826 935 HG22 VAL 122 2HG2 VAL 122 -11.867 1.055 -11.115 936 HG23 VAL 122 3HG2 VAL 122 -12.586 0.388 -12.582 937 H LYS 123 H LYS 123 -11.582 5.416 -12.746 938 HA LYS 123 HA LYS 123 -13.072 7.035 -11.973 939 HB2 LYS 123 2HB LYS 123 -14.340 4.634 -10.629 940 HB3 LYS 123 1HB LYS 123 -15.114 6.196 -10.899 941 HG2 LYS 123 2HG LYS 123 -14.782 5.916 -13.345 942 HG3 LYS 123 1HG LYS 123 -14.088 4.321 -13.048 943 HD2 LYS 123 2HD LYS 123 -16.218 3.674 -11.896 944 HD3 LYS 123 1HD LYS 123 -16.904 5.220 -12.394 945 HE2 LYS 123 2HE LYS 123 -16.484 4.641 -14.761 946 HE3 LYS 123 1HE LYS 123 -15.823 3.085 -14.257 947 HZ1 LYS 123 1HZ LYS 123 -17.976 2.606 -13.198 948 HZ2 LYS 123 2HZ LYS 123 -18.106 2.812 -14.879 949 HZ3 LYS 123 3HZ LYS 123 -18.597 4.052 -13.828 950 H LEU 124 H LEU 124 -10.679 6.364 -10.243 951 HA LEU 124 HA LEU 124 -11.560 6.600 -7.490 952 HB2 LEU 124 2HB LEU 124 -9.288 5.766 -8.132 953 HB3 LEU 124 1HB LEU 124 -8.882 7.395 -8.676 954 HG LEU 124 HG LEU 124 -9.458 8.216 -6.355 955 HD11 LEU 124 1HD1 LEU 124 -10.774 6.578 -5.346 956 HD12 LEU 124 2HD1 LEU 124 -9.195 6.225 -4.646 957 HD13 LEU 124 3HD1 LEU 124 -9.802 5.254 -5.986 958 HD21 LEU 124 1HD2 LEU 124 -7.136 7.938 -6.969 959 HD22 LEU 124 2HD2 LEU 124 -7.230 6.193 -6.725 960 HD23 LEU 124 3HD2 LEU 124 -7.339 7.284 -5.343 961 H HIS 125 H HIS 125 -10.661 8.848 -10.039 962 HA HIS 125 HA HIS 125 -10.565 11.232 -8.495 963 HB2 HIS 125 2HB HIS 125 -9.753 11.180 -10.792 964 HB3 HIS 125 1HB HIS 125 -11.378 10.835 -11.378 965 HD1 HIS 125 1HD HIS 125 -10.969 13.239 -8.571 966 HD2 HIS 125 2HD HIS 125 -11.475 13.400 -12.708 967 HE1 HIS 125 1HE HIS 125 -11.559 15.635 -9.126 968 HE2 HIS 125 2HE HIS 125 -11.861 15.751 -11.643 969 H ARG 126 H ARG 126 -13.270 9.291 -9.462 970 HA ARG 126 HA ARG 126 -15.354 11.100 -9.695 971 HB2 ARG 126 2HB ARG 126 -16.819 9.376 -8.915 972 HB3 ARG 126 1HB ARG 126 -15.492 8.559 -9.734 973 HG2 ARG 126 2HG ARG 126 -14.373 8.307 -7.483 974 HG3 ARG 126 1HG ARG 126 -15.857 8.911 -6.750 975 HD2 ARG 126 2HD ARG 126 -15.609 6.442 -8.491 976 HD3 ARG 126 1HD ARG 126 -15.882 6.465 -6.748 977 HE ARG 126 HE ARG 126 -17.934 7.987 -8.038 978 HH11 ARG 126 1HH1 ARG 126 -19.970 7.035 -8.273 979 HH12 ARG 126 2HH1 ARG 126 -20.125 5.313 -8.163 980 HH21 ARG 126 1HH2 ARG 126 -16.743 4.781 -7.607 981 HH22 ARG 126 2HH2 ARG 126 -18.297 4.037 -7.785 982 H HIS 127 H HIS 127 -13.554 10.247 -6.793 983 HA HIS 127 HA HIS 127 -15.312 11.359 -4.861 984 HB2 HIS 127 2HB HIS 127 -12.722 10.264 -4.875 985 HB3 HIS 127 1HB HIS 127 -12.526 11.894 -4.237 986 HD1 HIS 127 1HD HIS 127 -15.626 11.679 -3.034 987 HD2 HIS 127 2HD HIS 127 -12.320 9.282 -2.169 988 HE1 HIS 127 1HE HIS 127 -16.072 10.628 -0.771 989 HE2 HIS 127 2HE HIS 127 -14.070 9.166 -0.237 990 H GLY 128 H GLY 128 -12.742 12.857 -6.788 991 HA2 GLY 128 2HA GLY 128 -12.126 15.129 -6.979 992 HA3 GLY 128 1HA GLY 128 -13.852 15.304 -7.301 993 H ASP 129 H ASP 129 -13.040 14.135 -4.167 994 HA ASP 129 HA ASP 129 -13.826 16.774 -3.030 995 HB2 ASP 129 2HB ASP 129 -14.404 15.535 -1.004 996 HB3 ASP 129 1HB ASP 129 -15.179 14.777 -2.395 997 H GLY 130 H GLY 130 -11.060 15.640 -3.940 998 HA2 GLY 130 2HA GLY 130 -8.963 16.597 -3.151 999 HA3 GLY 130 1HA GLY 130 -9.628 16.610 -1.515 1000 H ALA 131 H ALA 131 -10.529 13.755 -2.969 1001 HA ALA 131 HA ALA 131 -9.011 12.084 -1.263 1002 HB1 ALA 131 1HB ALA 131 -9.655 10.247 -2.806 1003 HB2 ALA 131 2HB ALA 131 -10.197 11.443 -3.982 1004 HB3 ALA 131 3HB ALA 131 -11.024 11.294 -2.433 1005 H TRP 132 H TRP 132 -8.258 13.441 -4.421 1006 HA TRP 132 HA TRP 132 -6.062 11.798 -5.112 1007 HB2 TRP 132 2HB TRP 132 -6.880 13.387 -6.720 1008 HB3 TRP 132 1HB TRP 132 -6.584 14.734 -5.624 1009 HD1 TRP 132 HD TRP 132 -4.531 16.035 -6.263 1010 HE1 TRP 132 1HE TRP 132 -2.229 15.504 -7.289 1011 HE3 TRP 132 3HE TRP 132 -4.990 10.988 -6.921 1012 HZ2 TRP 132 2HZ TRP 132 -0.776 13.243 -8.259 1013 HZ3 TRP 132 3HZ TRP 132 -3.136 9.676 -7.894 1014 HH2 TRP 132 HH TRP 132 -1.033 10.795 -8.565 1015 H ASN 133 H ASN 133 -6.263 14.569 -2.919 1016 HA ASN 133 HA ASN 133 -3.479 14.901 -2.436 1017 HB2 ASN 133 2HB ASN 133 -5.383 16.394 -1.621 1018 HB3 ASN 133 1HB ASN 133 -5.644 15.208 -0.342 1019 HD21 ASN 133 1HD2 ASN 133 -4.955 17.579 0.696 1020 HD22 ASN 133 2HD2 ASN 133 -3.317 17.647 1.137 1021 H ILE 134 H ILE 134 -5.868 12.724 -0.958 1022 HA ILE 134 HA ILE 134 -4.181 11.607 1.046 1023 HB ILE 134 HB ILE 134 -6.594 10.628 -0.438 1024 HG12 ILE 134 2HG1 ILE 134 -7.626 10.825 1.740 1025 HG13 ILE 134 1HG1 ILE 134 -6.057 11.071 2.507 1026 HG21 ILE 134 1HG2 ILE 134 -4.812 9.054 1.419 1027 HG22 ILE 134 2HG2 ILE 134 -5.426 8.581 -0.164 1028 HG23 ILE 134 3HG2 ILE 134 -6.521 8.668 1.215 1029 HD11 ILE 134 1HD1 ILE 134 -7.123 12.921 0.369 1030 HD12 ILE 134 2HD1 ILE 134 -5.772 13.200 1.466 1031 HD13 ILE 134 3HD1 ILE 134 -7.422 13.182 2.087 1032 H HIS 135 H HIS 135 -4.659 10.760 -2.363 1033 HA HIS 135 HA HIS 135 -3.096 8.392 -2.426 1034 HB2 HIS 135 2HB HIS 135 -4.512 9.262 -4.309 1035 HB3 HIS 135 1HB HIS 135 -3.297 10.506 -4.592 1036 HD1 HIS 135 1HD HIS 135 -0.807 8.589 -4.038 1037 HD2 HIS 135 2HD HIS 135 -3.949 7.807 -6.669 1038 HE1 HIS 135 1HE HIS 135 0.073 6.922 -5.733 1039 HE2 HIS 135 2HE HIS 135 -1.831 6.439 -7.336 1040 H LYS 136 H LYS 136 -2.159 11.809 -2.726 1041 HA LYS 136 HA LYS 136 0.583 11.419 -3.329 1042 HB2 LYS 136 2HB LYS 136 -0.748 13.608 -1.729 1043 HB3 LYS 136 1HB LYS 136 0.901 13.682 -2.331 1044 HG2 LYS 136 2HG LYS 136 0.014 13.361 -4.639 1045 HG3 LYS 136 1HG LYS 136 -1.616 13.456 -3.983 1046 HD2 LYS 136 2HD LYS 136 -1.077 15.709 -3.061 1047 HD3 LYS 136 1HD LYS 136 0.502 15.617 -3.842 1048 HE2 LYS 136 2HE LYS 136 -0.868 15.137 -6.010 1049 HE3 LYS 136 1HE LYS 136 -2.218 15.828 -5.110 1050 HZ1 LYS 136 1HZ LYS 136 0.206 17.110 -6.103 1051 HZ2 LYS 136 2HZ LYS 136 -0.390 17.649 -4.605 1052 HZ3 LYS 136 3HZ LYS 136 -1.373 17.717 -5.989 1053 H ALA 137 H ALA 137 -1.098 11.518 -0.204 1054 HA ALA 137 HA ALA 137 1.293 11.350 1.387 1055 HB1 ALA 137 1HB ALA 137 -0.637 10.217 2.962 1056 HB2 ALA 137 2HB ALA 137 -1.612 11.164 1.838 1057 HB3 ALA 137 3HB ALA 137 -0.371 11.953 2.809 1058 H LEU 138 H LEU 138 -0.967 8.891 0.160 1059 HA LEU 138 HA LEU 138 0.311 6.661 1.424 1060 HB2 LEU 138 2HB LEU 138 -1.269 6.736 -1.160 1061 HB3 LEU 138 1HB LEU 138 -0.925 5.302 -0.208 1062 HG LEU 138 HG LEU 138 -2.545 7.695 0.695 1063 HD11 LEU 138 1HD1 LEU 138 -3.186 5.097 -0.545 1064 HD12 LEU 138 2HD1 LEU 138 -4.156 6.567 -0.452 1065 HD13 LEU 138 3HD1 LEU 138 -4.114 5.451 0.913 1066 HD21 LEU 138 1HD2 LEU 138 -1.618 6.946 2.679 1067 HD22 LEU 138 2HD2 LEU 138 -1.410 5.302 2.077 1068 HD23 LEU 138 3HD2 LEU 138 -3.007 5.864 2.570 1069 H ASP 139 H ASP 139 0.847 8.334 -1.630 1070 HA ASP 139 HA ASP 139 3.175 6.537 -2.137 1071 HB2 ASP 139 2HB ASP 139 1.400 6.578 -3.903 1072 HB3 ASP 139 1HB ASP 139 1.717 8.300 -4.121 1073 H GLY 140 H GLY 140 5.017 7.504 -1.447 1074 HA2 GLY 140 2HA GLY 140 5.214 10.454 -1.497 1075 HA3 GLY 140 1HA GLY 140 6.340 9.364 -0.688 1076 HA PRO 141 HA PRO 141 9.144 8.973 -4.064 1077 HB2 PRO 141 2HB PRO 141 8.066 6.354 -4.984 1078 HB3 PRO 141 1HB PRO 141 9.714 6.788 -4.494 1079 HG2 PRO 141 2HG PRO 141 8.118 5.337 -2.924 1080 HG3 PRO 141 1HG PRO 141 9.270 6.511 -2.264 1081 HD2 PRO 141 2HD PRO 141 6.300 6.723 -2.511 1082 HD3 PRO 141 1HD PRO 141 7.381 7.402 -1.276 1083 H SER 142 H SER 142 9.302 9.519 -6.268 1084 HA SER 142 HA SER 142 7.066 10.557 -7.605 1085 HB2 SER 142 2HB SER 142 9.837 10.178 -8.189 1086 HB3 SER 142 1HB SER 142 8.909 9.633 -9.583 1087 HG SER 142 HG SER 142 8.168 11.614 -9.877 1088 HA PRO 143 HA PRO 143 7.014 6.309 -10.140 1089 HB2 PRO 143 2HB PRO 143 7.762 4.563 -7.841 1090 HB3 PRO 143 1HB PRO 143 8.167 4.402 -9.561 1091 HG2 PRO 143 2HG PRO 143 9.965 5.223 -7.774 1092 HG3 PRO 143 1HG PRO 143 9.925 5.867 -9.424 1093 HD2 PRO 143 2HD PRO 143 9.063 7.161 -6.877 1094 HD3 PRO 143 1HD PRO 143 9.738 7.896 -8.346 1095 H GLY 144 H GLY 144 5.019 5.244 -10.227 1096 HA2 GLY 144 2HA GLY 144 3.272 5.608 -7.853 1097 HA3 GLY 144 1HA GLY 144 2.705 5.361 -9.504 1098 H GLU 145 H GLU 145 1.558 3.475 -9.398 1099 HA GLU 145 HA GLU 145 1.093 1.203 -9.044 1100 HB2 GLU 145 2HB GLU 145 4.117 1.046 -9.225 1101 HB3 GLU 145 1HB GLU 145 3.018 -0.330 -9.344 1102 HG2 GLU 145 2HG GLU 145 1.936 0.731 -11.312 1103 HG3 GLU 145 1HG GLU 145 3.097 2.056 -11.215 1104 H THR 146 H THR 146 0.330 0.701 -7.041 1105 HA THR 146 HA THR 146 1.628 1.267 -4.575 1106 HB THR 146 HB THR 146 -0.432 -0.828 -5.279 1107 HG1 THR 146 1HG THR 146 -1.615 0.871 -3.929 1108 HG21 THR 146 1HG2 THR 146 -0.853 -0.592 -2.706 1109 HG22 THR 146 2HG2 THR 146 0.825 -0.051 -2.670 1110 HG23 THR 146 3HG2 THR 146 0.430 -1.659 -3.280 1111 H LEU 147 H LEU 147 1.771 -1.495 -6.733 1112 HA LEU 147 HA LEU 147 3.073 -3.353 -5.050 1113 HB2 LEU 147 2HB LEU 147 3.487 -2.959 -8.020 1114 HB3 LEU 147 1HB LEU 147 3.766 -4.441 -7.100 1115 HG LEU 147 HG LEU 147 1.084 -3.054 -7.357 1116 HD11 LEU 147 1HD1 LEU 147 1.877 -4.065 -9.483 1117 HD12 LEU 147 2HD1 LEU 147 0.479 -4.914 -8.824 1118 HD13 LEU 147 3HD1 LEU 147 2.093 -5.604 -8.649 1119 HD21 LEU 147 1HD2 LEU 147 0.969 -4.248 -5.355 1120 HD22 LEU 147 2HD2 LEU 147 2.100 -5.483 -5.910 1121 HD23 LEU 147 3HD2 LEU 147 0.443 -5.471 -6.512 1122 H ALA 148 H ALA 148 4.345 -0.596 -6.843 1123 HA ALA 148 HA ALA 148 7.106 -1.257 -6.734 1124 HB1 ALA 148 1HB ALA 148 5.516 1.039 -7.399 1125 HB2 ALA 148 2HB ALA 148 7.180 0.687 -7.863 1126 HB3 ALA 148 3HB ALA 148 6.847 1.551 -6.362 1127 H ARG 149 H ARG 149 5.249 0.820 -4.478 1128 HA ARG 149 HA ARG 149 7.388 1.048 -2.584 1129 HB2 ARG 149 2HB ARG 149 4.399 1.318 -2.215 1130 HB3 ARG 149 1HB ARG 149 5.608 1.826 -1.040 1131 HG2 ARG 149 2HG ARG 149 6.601 3.324 -2.785 1132 HG3 ARG 149 1HG ARG 149 5.267 2.892 -3.854 1133 HD2 ARG 149 2HD ARG 149 5.022 4.237 -1.148 1134 HD3 ARG 149 1HD ARG 149 4.759 4.998 -2.718 1135 HE ARG 149 HE ARG 149 2.893 3.213 -1.338 1136 HH11 ARG 149 1HH1 ARG 149 0.910 2.918 -2.382 1137 HH12 ARG 149 2HH1 ARG 149 0.733 3.415 -4.032 1138 HH21 ARG 149 1HH2 ARG 149 3.991 4.570 -4.312 1139 HH22 ARG 149 2HH2 ARG 149 2.477 4.350 -5.124 1140 H PHE 150 H PHE 150 4.624 -1.156 -2.840 1141 HA PHE 150 HA PHE 150 5.079 -2.541 -0.372 1142 HB2 PHE 150 2HB PHE 150 2.957 -2.666 -1.623 1143 HB3 PHE 150 1HB PHE 150 3.779 -3.514 -2.927 1144 HD1 PHE 150 1HD PHE 150 3.960 -5.846 -2.896 1145 HD2 PHE 150 2HD PHE 150 3.099 -3.736 0.743 1146 HE1 PHE 150 1HE PHE 150 3.605 -8.004 -1.730 1147 HE2 PHE 150 2HE PHE 150 2.745 -5.893 1.910 1148 HZ PHE 150 HZ PHE 150 2.998 -8.026 0.672 1149 H ALA 151 H ALA 151 6.287 -3.070 -3.668 1150 HA ALA 151 HA ALA 151 7.551 -5.593 -3.084 1151 HB1 ALA 151 1HB ALA 151 8.263 -3.579 -5.231 1152 HB2 ALA 151 2HB ALA 151 6.995 -4.796 -5.380 1153 HB3 ALA 151 3HB ALA 151 8.681 -5.292 -5.222 1154 H ASN 152 H ASN 152 8.774 -2.239 -3.085 1155 HA ASN 152 HA ASN 152 11.508 -2.920 -2.645 1156 HB2 ASN 152 2HB ASN 152 11.861 -0.671 -2.465 1157 HB3 ASN 152 1HB ASN 152 10.216 -0.588 -3.092 1158 HD21 ASN 152 1HD2 ASN 152 8.525 0.063 -1.641 1159 HD22 ASN 152 2HD2 ASN 152 8.835 0.623 -0.072 1160 H VAL 153 H VAL 153 8.985 -2.043 -0.260 1161 HA VAL 153 HA VAL 153 10.704 -2.535 2.002 1162 HB VAL 153 HB VAL 153 8.542 -2.541 3.287 1163 HG11 VAL 153 1HG1 VAL 153 8.012 -0.187 1.752 1164 HG12 VAL 153 2HG1 VAL 153 9.758 -0.440 1.787 1165 HG13 VAL 153 3HG1 VAL 153 8.853 -0.314 3.297 1166 HG21 VAL 153 1HG2 VAL 153 6.793 -1.582 1.293 1167 HG22 VAL 153 2HG2 VAL 153 6.671 -3.109 2.166 1168 HG23 VAL 153 3HG2 VAL 153 7.530 -3.037 0.630 1169 H ILE 154 H ILE 154 8.562 -4.523 0.065 1170 HA ILE 154 HA ILE 154 8.677 -6.802 1.879 1171 HB ILE 154 HB ILE 154 7.701 -6.463 -0.956 1172 HG12 ILE 154 2HG1 ILE 154 6.559 -5.400 1.171 1173 HG13 ILE 154 1HG1 ILE 154 5.573 -6.203 -0.047 1174 HG21 ILE 154 1HG2 ILE 154 8.162 -8.732 -0.893 1175 HG22 ILE 154 2HG2 ILE 154 6.505 -8.694 -0.290 1176 HG23 ILE 154 3HG2 ILE 154 7.852 -8.851 0.839 1177 HD11 ILE 154 1HD1 ILE 154 6.683 -7.813 2.233 1178 HD12 ILE 154 2HD1 ILE 154 5.226 -8.090 1.280 1179 HD13 ILE 154 3HD1 ILE 154 5.257 -6.811 2.492 Start of MODEL 6 1 H1 MET 1 1HT MET 1 2.419 12.413 -4.584 2 H2 MET 1 2HT MET 1 3.847 13.333 -4.519 3 H3 MET 1 3HT MET 1 3.862 11.783 -5.216 4 HA MET 1 HA MET 1 1.944 13.548 -6.427 5 HB2 MET 1 2HB MET 1 3.923 15.058 -5.757 6 HB3 MET 1 1HB MET 1 4.868 14.127 -6.921 7 HG2 MET 1 2HG MET 1 2.593 14.701 -8.360 8 HG3 MET 1 1HG MET 1 2.793 16.161 -7.391 9 HE1 MET 1 1HE MET 1 3.672 14.900 -10.872 10 HE2 MET 1 2HE MET 1 4.124 16.586 -11.106 11 HE3 MET 1 3HE MET 1 2.665 16.191 -10.203 12 HA PRO 2 HA PRO 2 3.385 9.903 -8.817 13 HB2 PRO 2 2HB PRO 2 0.960 8.636 -8.936 14 HB3 PRO 2 1HB PRO 2 2.107 8.422 -7.603 15 HG2 PRO 2 2HG PRO 2 -0.454 9.803 -7.632 16 HG3 PRO 2 1HG PRO 2 0.521 9.267 -6.257 17 HD2 PRO 2 2HD PRO 2 0.302 11.935 -7.380 18 HD3 PRO 2 1HD PRO 2 1.174 11.422 -5.919 19 H GLU 3 H GLU 3 2.578 9.158 -11.024 20 HA GLU 3 HA GLU 3 2.119 11.234 -12.810 21 HB2 GLU 3 2HB GLU 3 0.976 8.437 -13.026 22 HB3 GLU 3 1HB GLU 3 1.221 9.553 -14.368 23 HG2 GLU 3 2HG GLU 3 3.418 8.478 -12.572 24 HG3 GLU 3 1HG GLU 3 3.064 7.896 -14.198 25 H GLU 4 H GLU 4 0.134 12.075 -13.793 26 HA GLU 4 HA GLU 4 -1.881 12.820 -12.017 27 HB2 GLU 4 2HB GLU 4 -2.202 12.328 -14.995 28 HB3 GLU 4 1HB GLU 4 -3.293 13.285 -13.992 29 HG2 GLU 4 2HG GLU 4 -1.402 14.795 -13.417 30 HG3 GLU 4 1HG GLU 4 -0.360 13.869 -14.499 31 H ILE 5 H ILE 5 -4.073 12.035 -11.707 32 HA ILE 5 HA ILE 5 -4.368 9.400 -10.983 33 HB ILE 5 HB ILE 5 -6.421 11.310 -12.113 34 HG12 ILE 5 2HG1 ILE 5 -5.985 10.274 -9.297 35 HG13 ILE 5 1HG1 ILE 5 -5.284 11.777 -9.901 36 HG21 ILE 5 1HG2 ILE 5 -8.024 9.642 -10.896 37 HG22 ILE 5 2HG2 ILE 5 -6.717 8.481 -11.128 38 HG23 ILE 5 3HG2 ILE 5 -7.469 9.253 -12.524 39 HD11 ILE 5 1HD1 ILE 5 -7.762 12.330 -10.584 40 HD12 ILE 5 2HD1 ILE 5 -7.258 12.540 -8.908 41 HD13 ILE 5 3HD1 ILE 5 -8.167 11.105 -9.381 42 HA PRO 6 HA PRO 6 -4.344 7.680 -15.226 43 HB2 PRO 6 2HB PRO 6 -3.099 5.361 -14.675 44 HB3 PRO 6 1HB PRO 6 -2.206 6.894 -14.734 45 HG2 PRO 6 2HG PRO 6 -3.068 5.296 -12.392 46 HG3 PRO 6 1HG PRO 6 -1.626 6.298 -12.611 47 HD2 PRO 6 2HD PRO 6 -3.991 7.055 -11.254 48 HD3 PRO 6 1HD PRO 6 -2.663 8.129 -11.736 49 H ASP 7 H ASP 7 -5.713 6.096 -16.208 50 HA ASP 7 HA ASP 7 -7.948 5.186 -14.632 51 HB2 ASP 7 2HB ASP 7 -8.024 5.656 -17.105 52 HB3 ASP 7 1HB ASP 7 -7.086 4.185 -17.363 53 H VAL 8 H VAL 8 -7.602 2.497 -16.322 54 HA VAL 8 HA VAL 8 -7.052 0.792 -14.146 55 HB VAL 8 HB VAL 8 -6.452 0.200 -17.060 56 HG11 VAL 8 1HG1 VAL 8 -5.772 -1.388 -15.086 57 HG12 VAL 8 2HG1 VAL 8 -6.597 -2.065 -16.489 58 HG13 VAL 8 3HG1 VAL 8 -7.500 -1.735 -15.012 59 HG21 VAL 8 1HG2 VAL 8 -9.007 -0.754 -16.090 60 HG22 VAL 8 2HG2 VAL 8 -8.664 0.265 -17.488 61 HG23 VAL 8 3HG2 VAL 8 -8.897 0.995 -15.899 62 H ARG 9 H ARG 9 -5.166 0.078 -13.208 63 HA ARG 9 HA ARG 9 -2.655 1.311 -14.155 64 HB2 ARG 9 2HB ARG 9 -3.329 -0.259 -11.657 65 HB3 ARG 9 1HB ARG 9 -1.729 0.385 -12.010 66 HG2 ARG 9 2HG ARG 9 -2.732 2.665 -12.189 67 HG3 ARG 9 1HG ARG 9 -4.286 1.985 -11.706 68 HD2 ARG 9 2HD ARG 9 -3.190 1.143 -9.606 69 HD3 ARG 9 1HD ARG 9 -1.731 2.017 -10.074 70 HE ARG 9 HE ARG 9 -3.584 4.004 -10.156 71 HH11 ARG 9 1HH1 ARG 9 -4.300 5.202 -8.379 72 HH12 ARG 9 2HH1 ARG 9 -4.252 4.495 -6.799 73 HH21 ARG 9 1HH2 ARG 9 -2.931 1.483 -7.895 74 HH22 ARG 9 2HH2 ARG 9 -3.477 2.390 -6.525 75 H LYS 10 H LYS 10 -0.939 -0.802 -13.057 76 HA LYS 10 HA LYS 10 -1.459 -2.972 -15.040 77 HB2 LYS 10 2HB LYS 10 0.849 -2.990 -15.716 78 HB3 LYS 10 1HB LYS 10 0.269 -1.331 -15.850 79 HG2 LYS 10 2HG LYS 10 1.231 -0.857 -13.599 80 HG3 LYS 10 1HG LYS 10 1.903 -2.487 -13.570 81 HD2 LYS 10 2HD LYS 10 3.037 -1.903 -15.785 82 HD3 LYS 10 1HD LYS 10 2.584 -0.230 -15.462 83 HE2 LYS 10 2HE LYS 10 3.879 -0.168 -13.451 84 HE3 LYS 10 1HE LYS 10 4.116 -1.917 -13.473 85 HZ1 LYS 10 1HZ LYS 10 5.118 -1.297 -15.833 86 HZ2 LYS 10 2HZ LYS 10 6.056 -1.303 -14.417 87 HZ3 LYS 10 3HZ LYS 10 5.443 0.159 -15.027 88 H SER 11 H SER 11 0.610 -4.639 -14.548 89 HA SER 11 HA SER 11 0.238 -5.351 -11.665 90 HB2 SER 11 2HB SER 11 -0.774 -6.887 -13.405 91 HB3 SER 11 1HB SER 11 0.859 -7.231 -13.949 92 HG SER 11 HG SER 11 1.128 -8.462 -12.270 93 H VAL 12 H VAL 12 2.048 -6.195 -10.546 94 HA VAL 12 HA VAL 12 4.673 -5.996 -11.939 95 HB VAL 12 HB VAL 12 3.882 -4.740 -9.320 96 HG11 VAL 12 1HG1 VAL 12 6.408 -4.214 -9.208 97 HG12 VAL 12 2HG1 VAL 12 6.603 -5.549 -10.344 98 HG13 VAL 12 3HG1 VAL 12 5.905 -5.842 -8.751 99 HG21 VAL 12 1HG2 VAL 12 5.243 -3.764 -11.842 100 HG22 VAL 12 2HG2 VAL 12 5.027 -2.783 -10.392 101 HG23 VAL 12 3HG2 VAL 12 3.620 -3.344 -11.296 102 H VAL 13 H VAL 13 6.271 -7.424 -11.111 103 HA VAL 13 HA VAL 13 5.115 -9.686 -9.560 104 HB VAL 13 HB VAL 13 7.724 -9.523 -11.100 105 HG11 VAL 13 1HG1 VAL 13 6.768 -11.377 -9.177 106 HG12 VAL 13 2HG1 VAL 13 8.188 -11.537 -10.208 107 HG13 VAL 13 3HG1 VAL 13 6.631 -12.163 -10.749 108 HG21 VAL 13 1HG2 VAL 13 5.321 -9.404 -12.268 109 HG22 VAL 13 2HG2 VAL 13 5.375 -11.144 -11.991 110 HG23 VAL 13 3HG2 VAL 13 6.629 -10.366 -12.956 111 H VAL 14 H VAL 14 5.859 -10.194 -7.534 112 HA VAL 14 HA VAL 14 8.217 -8.664 -6.503 113 HB VAL 14 HB VAL 14 7.095 -8.339 -4.403 114 HG11 VAL 14 1HG1 VAL 14 6.370 -7.009 -6.572 115 HG12 VAL 14 2HG1 VAL 14 5.498 -6.782 -5.055 116 HG13 VAL 14 3HG1 VAL 14 4.834 -7.833 -6.305 117 HG21 VAL 14 1HG2 VAL 14 5.016 -10.203 -5.576 118 HG22 VAL 14 2HG2 VAL 14 4.711 -9.215 -4.148 119 HG23 VAL 14 3HG2 VAL 14 5.977 -10.443 -4.118 120 H ALA 15 H ALA 15 9.415 -9.797 -4.812 121 HA ALA 15 HA ALA 15 9.241 -12.734 -5.152 122 HB1 ALA 15 1HB ALA 15 11.424 -12.742 -3.950 123 HB2 ALA 15 2HB ALA 15 11.313 -10.988 -3.789 124 HB3 ALA 15 3HB ALA 15 11.453 -11.720 -5.388 125 H ALA 16 H ALA 16 7.474 -13.309 -3.840 126 HA ALA 16 HA ALA 16 8.024 -13.526 -1.003 127 HB1 ALA 16 1HB ALA 16 6.200 -12.158 -0.167 128 HB2 ALA 16 2HB ALA 16 5.691 -11.762 -1.809 129 HB3 ALA 16 3HB ALA 16 7.223 -11.148 -1.187 130 H SER 17 H SER 17 6.571 -15.026 -0.008 131 HA SER 17 HA SER 17 5.330 -16.902 -1.790 132 HB2 SER 17 2HB SER 17 4.886 -16.535 1.188 133 HB3 SER 17 1HB SER 17 4.468 -17.967 0.250 134 HG SER 17 HG SER 17 7.085 -16.882 0.394 135 H VAL 18 H VAL 18 3.073 -17.288 -2.147 136 HA VAL 18 HA VAL 18 1.461 -14.972 -2.461 137 HB VAL 18 HB VAL 18 0.136 -17.628 -2.130 138 HG11 VAL 18 1HG1 VAL 18 -0.641 -15.237 -3.179 139 HG12 VAL 18 2HG1 VAL 18 -1.322 -16.787 -3.669 140 HG13 VAL 18 3HG1 VAL 18 -0.039 -16.047 -4.623 141 HG21 VAL 18 1HG2 VAL 18 2.401 -17.041 -3.996 142 HG22 VAL 18 2HG2 VAL 18 1.042 -17.978 -4.612 143 HG23 VAL 18 3HG2 VAL 18 1.954 -18.561 -3.220 144 H GLU 19 H GLU 19 1.529 -17.444 0.090 145 HA GLU 19 HA GLU 19 -0.727 -16.516 1.560 146 HB2 GLU 19 2HB GLU 19 1.823 -17.829 2.549 147 HB3 GLU 19 1HB GLU 19 0.359 -17.631 3.511 148 HG2 GLU 19 2HG GLU 19 -0.906 -18.937 1.817 149 HG3 GLU 19 1HG GLU 19 0.591 -19.185 0.917 150 H HIS 20 H HIS 20 2.651 -15.481 1.520 151 HA HIS 20 HA HIS 20 2.573 -13.743 3.767 152 HB2 HIS 20 2HB HIS 20 4.613 -14.498 2.437 153 HB3 HIS 20 1HB HIS 20 4.163 -13.296 1.228 154 HD1 HIS 20 1HD HIS 20 4.457 -13.268 5.036 155 HD2 HIS 20 2HD HIS 20 5.538 -10.961 1.732 156 HE1 HIS 20 1HE HIS 20 5.673 -11.245 5.941 157 HE2 HIS 20 2HE HIS 20 6.337 -9.836 3.942 158 H CYS 21 H CYS 21 1.711 -13.245 0.357 159 HA CYS 21 HA CYS 21 1.346 -10.462 0.347 160 HB2 CYS 21 2HB CYS 21 -0.224 -12.638 -1.065 161 HB3 CYS 21 1HB CYS 21 -0.379 -10.927 -1.433 162 HG CYS 21 HG CYS 21 2.496 -12.042 -1.583 163 H PHE 22 H PHE 22 -1.205 -12.914 0.955 164 HA PHE 22 HA PHE 22 -3.122 -10.931 1.796 165 HB2 PHE 22 2HB PHE 22 -3.152 -13.856 2.551 166 HB3 PHE 22 1HB PHE 22 -4.532 -12.775 2.339 167 HD1 PHE 22 1HD PHE 22 -4.996 -11.815 0.015 168 HD2 PHE 22 2HD PHE 22 -2.221 -15.016 0.724 169 HE1 PHE 22 1HE PHE 22 -5.062 -12.409 -2.392 170 HE2 PHE 22 2HE PHE 22 -2.292 -15.612 -1.677 171 HZ PHE 22 HZ PHE 22 -3.706 -14.306 -3.236 172 H GLU 23 H GLU 23 -0.826 -12.979 3.544 173 HA GLU 23 HA GLU 23 -1.820 -12.308 6.166 174 HB2 GLU 23 2HB GLU 23 0.861 -13.349 5.223 175 HB3 GLU 23 1HB GLU 23 0.443 -13.140 6.924 176 HG2 GLU 23 2HG GLU 23 -1.489 -14.651 6.630 177 HG3 GLU 23 1HG GLU 23 -1.054 -14.879 4.939 178 H VAL 24 H VAL 24 0.595 -10.854 4.028 179 HA VAL 24 HA VAL 24 1.808 -9.110 5.895 180 HB VAL 24 HB VAL 24 1.305 -8.866 2.926 181 HG11 VAL 24 1HG1 VAL 24 1.634 -6.640 3.325 182 HG12 VAL 24 2HG1 VAL 24 3.323 -7.137 3.401 183 HG13 VAL 24 3HG1 VAL 24 2.399 -6.927 4.886 184 HG21 VAL 24 1HG2 VAL 24 4.027 -9.038 4.054 185 HG22 VAL 24 2HG2 VAL 24 3.313 -9.906 2.694 186 HG23 VAL 24 3HG2 VAL 24 3.027 -10.462 4.344 187 H PHE 25 H PHE 25 -1.076 -8.579 3.842 188 HA PHE 25 HA PHE 25 -1.491 -5.870 4.654 189 HB2 PHE 25 2HB PHE 25 -3.790 -7.694 4.034 190 HB3 PHE 25 1HB PHE 25 -3.558 -6.008 3.584 191 HD1 PHE 25 1HD PHE 25 -4.030 -8.851 2.034 192 HD2 PHE 25 2HD PHE 25 -0.827 -6.028 2.471 193 HE1 PHE 25 1HE PHE 25 -3.097 -9.572 -0.153 194 HE2 PHE 25 2HE PHE 25 0.111 -6.748 0.289 195 HZ PHE 25 HZ PHE 25 -1.025 -8.521 -1.023 196 H THR 26 H THR 26 -2.961 -8.886 5.886 197 HA THR 26 HA THR 26 -4.291 -7.403 8.036 198 HB THR 26 HB THR 26 -5.289 -9.539 8.600 199 HG1 THR 26 1HG THR 26 -4.597 -11.392 7.405 200 HG21 THR 26 1HG2 THR 26 -6.220 -8.362 6.663 201 HG22 THR 26 2HG2 THR 26 -6.296 -10.106 6.407 202 HG23 THR 26 3HG2 THR 26 -5.049 -9.150 5.605 203 H SER 27 H SER 27 -1.336 -9.268 7.715 204 HA SER 27 HA SER 27 -1.052 -9.923 10.501 205 HB2 SER 27 2HB SER 27 0.311 -11.052 8.825 206 HB3 SER 27 1HB SER 27 1.066 -9.525 8.381 207 HG SER 27 HG SER 27 2.272 -10.847 9.897 208 H ARG 28 H ARG 28 0.295 -7.225 8.577 209 HA ARG 28 HA ARG 28 -0.054 -5.199 10.462 210 HB2 ARG 28 2HB ARG 28 2.452 -5.158 11.298 211 HB3 ARG 28 1HB ARG 28 1.254 -6.125 12.155 212 HG2 ARG 28 2HG ARG 28 2.179 -8.103 11.478 213 HG3 ARG 28 1HG ARG 28 2.588 -7.478 9.879 214 HD2 ARG 28 2HD ARG 28 4.520 -8.011 11.561 215 HD3 ARG 28 1HD ARG 28 4.590 -6.515 10.624 216 HE ARG 28 HE ARG 28 3.271 -6.256 13.234 217 HH11 ARG 28 1HH1 ARG 28 4.326 -4.879 14.685 218 HH12 ARG 28 2HH1 ARG 28 5.945 -4.364 14.348 219 HH21 ARG 28 1HH2 ARG 28 6.166 -6.120 11.365 220 HH22 ARG 28 2HH2 ARG 28 6.986 -5.066 12.468 221 HA PRO 29 HA PRO 29 1.684 -4.106 6.288 222 HB2 PRO 29 2HB PRO 29 0.035 -1.707 6.886 223 HB3 PRO 29 1HB PRO 29 0.095 -2.696 5.416 224 HG2 PRO 29 2HG PRO 29 -1.963 -2.809 7.122 225 HG3 PRO 29 1HG PRO 29 -1.402 -4.224 6.220 226 HD2 PRO 29 2HD PRO 29 -1.032 -3.568 9.108 227 HD3 PRO 29 1HD PRO 29 -1.178 -5.154 8.319 228 H ALA 30 H ALA 30 1.614 -2.475 9.374 229 HA ALA 30 HA ALA 30 3.259 -0.226 8.712 230 HB1 ALA 30 1HB ALA 30 2.134 -1.424 11.091 231 HB2 ALA 30 2HB ALA 30 2.630 0.247 10.821 232 HB3 ALA 30 3HB ALA 30 3.805 -0.942 11.383 233 H ASP 31 H ASP 31 4.012 -3.461 8.589 234 HA ASP 31 HA ASP 31 6.550 -3.696 9.783 235 HB2 ASP 31 2HB ASP 31 5.234 -5.536 8.660 236 HB3 ASP 31 1HB ASP 31 5.773 -4.888 7.110 237 H TRP 32 H TRP 32 5.630 -2.071 6.788 238 HA TRP 32 HA TRP 32 8.490 -1.229 6.488 239 HB2 TRP 32 2HB TRP 32 7.450 -0.985 3.960 240 HB3 TRP 32 1HB TRP 32 8.394 -2.364 4.527 241 HD1 TRP 32 HD TRP 32 7.143 -4.609 4.984 242 HE1 TRP 32 1HE TRP 32 4.756 -5.439 4.495 243 HE3 TRP 32 3HE TRP 32 4.919 -0.188 3.793 244 HZ2 TRP 32 2HZ TRP 32 2.234 -4.364 3.704 245 HZ3 TRP 32 3HZ TRP 32 2.519 -0.111 3.172 246 HH2 TRP 32 HH TRP 32 1.174 -2.195 3.125 247 H TRP 33 H TRP 33 5.870 0.017 7.673 248 HA TRP 33 HA TRP 33 5.010 2.169 6.100 249 HB2 TRP 33 2HB TRP 33 4.793 1.442 8.828 250 HB3 TRP 33 1HB TRP 33 5.361 3.110 8.791 251 HD1 TRP 33 HD TRP 33 3.443 4.747 8.817 252 HE1 TRP 33 1HE TRP 33 1.071 4.843 7.814 253 HE3 TRP 33 3HE TRP 33 3.298 0.226 6.459 254 HZ2 TRP 33 2HZ TRP 33 -0.661 3.217 6.224 255 HZ3 TRP 33 3HZ TRP 33 1.274 -0.479 5.212 256 HH2 TRP 33 HH TRP 33 -0.703 1.011 5.090 257 HA PRO 34 HA PRO 34 8.784 4.732 8.387 258 HB2 PRO 34 2HB PRO 34 10.531 2.442 7.523 259 HB3 PRO 34 1HB PRO 34 10.805 3.642 8.803 260 HG2 PRO 34 2HG PRO 34 9.857 1.169 9.305 261 HG3 PRO 34 1HG PRO 34 9.432 2.583 10.281 262 HD2 PRO 34 2HD PRO 34 7.718 1.006 8.536 263 HD3 PRO 34 1HD PRO 34 7.259 2.294 9.666 264 HA PRO 35 HA PRO 35 9.174 5.304 3.840 265 HB2 PRO 35 2HB PRO 35 7.850 7.724 3.758 266 HB3 PRO 35 1HB PRO 35 7.062 6.147 3.586 267 HG2 PRO 35 2HG PRO 35 6.861 8.037 5.749 268 HG3 PRO 35 1HG PRO 35 5.957 6.540 5.492 269 HD2 PRO 35 2HD PRO 35 8.256 7.024 7.258 270 HD3 PRO 35 1HD PRO 35 7.117 5.662 7.243 271 H SER 36 H SER 36 10.465 6.881 2.644 272 HA SER 36 HA SER 36 12.639 8.011 4.111 273 HB2 SER 36 2HB SER 36 13.329 8.993 2.013 274 HB3 SER 36 1HB SER 36 12.654 7.405 1.659 275 HG SER 36 HG SER 36 10.653 8.514 1.223 276 H HIS 37 H HIS 37 9.494 9.234 3.278 277 HA HIS 37 HA HIS 37 10.239 11.886 4.454 278 HB2 HIS 37 2HB HIS 37 8.037 11.294 2.451 279 HB3 HIS 37 1HB HIS 37 8.481 12.882 3.077 280 HD1 HIS 37 1HD HIS 37 11.107 13.564 2.572 281 HD2 HIS 37 2HD HIS 37 9.423 10.612 0.154 282 HE1 HIS 37 1HE HIS 37 12.578 13.396 0.515 283 HE2 HIS 37 2HE HIS 37 11.562 11.603 -0.963 284 H VAL 38 H VAL 38 7.913 12.942 5.169 285 HA VAL 38 HA VAL 38 6.791 10.923 7.053 286 HB VAL 38 HB VAL 38 6.542 13.945 7.095 287 HG11 VAL 38 1HG1 VAL 38 4.738 13.051 8.338 288 HG12 VAL 38 2HG1 VAL 38 5.978 13.365 9.552 289 HG13 VAL 38 3HG1 VAL 38 5.715 11.723 8.964 290 HG21 VAL 38 1HG2 VAL 38 8.424 12.034 8.507 291 HG22 VAL 38 2HG2 VAL 38 8.166 13.697 9.033 292 HG23 VAL 38 3HG2 VAL 38 8.856 13.372 7.444 293 H LEU 39 H LEU 39 4.733 10.218 6.782 294 HA LEU 39 HA LEU 39 3.036 11.618 4.761 295 HB2 LEU 39 2HB LEU 39 2.799 8.774 5.789 296 HB3 LEU 39 1HB LEU 39 1.891 9.489 4.457 297 HG LEU 39 HG LEU 39 4.887 9.035 4.551 298 HD11 LEU 39 1HD1 LEU 39 4.191 7.676 2.435 299 HD12 LEU 39 2HD1 LEU 39 2.574 7.723 3.137 300 HD13 LEU 39 3HD1 LEU 39 3.898 6.969 4.024 301 HD21 LEU 39 1HD2 LEU 39 3.103 10.601 2.716 302 HD22 LEU 39 2HD2 LEU 39 4.489 9.755 2.031 303 HD23 LEU 39 3HD2 LEU 39 4.730 10.979 3.278 304 H VAL 40 H VAL 40 0.836 12.053 5.298 305 HA VAL 40 HA VAL 40 -0.936 12.595 6.741 306 HB VAL 40 HB VAL 40 0.097 10.737 8.837 307 HG11 VAL 40 1HG1 VAL 40 -2.226 12.064 8.550 308 HG12 VAL 40 2HG1 VAL 40 -2.132 10.493 9.342 309 HG13 VAL 40 3HG1 VAL 40 -2.633 10.601 7.655 310 HG21 VAL 40 1HG2 VAL 40 -0.500 10.006 6.007 311 HG22 VAL 40 2HG2 VAL 40 -1.170 8.961 7.258 312 HG23 VAL 40 3HG2 VAL 40 0.571 9.219 7.168 313 H LYS 41 H LYS 41 -1.295 13.496 9.062 314 HA LYS 41 HA LYS 41 0.593 15.545 9.570 315 HB2 LYS 41 2HB LYS 41 -1.779 15.546 10.360 316 HB3 LYS 41 1HB LYS 41 -1.332 14.337 11.562 317 HG2 LYS 41 2HG LYS 41 0.352 15.903 12.493 318 HG3 LYS 41 1HG LYS 41 -0.163 17.122 11.325 319 HD2 LYS 41 2HD LYS 41 -2.483 16.959 12.263 320 HD3 LYS 41 1HD LYS 41 -1.859 15.876 13.508 321 HE2 LYS 41 2HE LYS 41 -0.092 17.984 13.641 322 HE3 LYS 41 1HE LYS 41 -1.613 18.798 13.275 323 HZ1 LYS 41 1HZ LYS 41 -2.399 18.358 15.293 324 HZ2 LYS 41 2HZ LYS 41 -0.812 17.936 15.729 325 HZ3 LYS 41 3HZ LYS 41 -1.909 16.736 15.237 326 H LYS 42 H LYS 42 0.200 12.359 11.114 327 HA LYS 42 HA LYS 42 2.963 12.680 12.194 328 HB2 LYS 42 2HB LYS 42 1.158 12.955 13.963 329 HB3 LYS 42 1HB LYS 42 0.708 11.281 13.651 330 HG2 LYS 42 2HG LYS 42 2.218 11.220 15.498 331 HG3 LYS 42 1HG LYS 42 3.138 10.667 14.100 332 HD2 LYS 42 2HD LYS 42 3.331 13.532 14.257 333 HD3 LYS 42 1HD LYS 42 3.735 12.845 15.829 334 HE2 LYS 42 2HE LYS 42 5.339 11.310 14.747 335 HE3 LYS 42 1HE LYS 42 4.948 12.013 13.177 336 HZ1 LYS 42 1HZ LYS 42 5.561 14.216 14.329 337 HZ2 LYS 42 2HZ LYS 42 6.809 13.185 13.814 338 HZ3 LYS 42 3HZ LYS 42 6.365 13.234 15.454 339 H GLU 43 H GLU 43 4.241 10.823 12.033 340 HA GLU 43 HA GLU 43 3.670 8.939 10.014 341 HB2 GLU 43 2HB GLU 43 5.937 9.395 10.974 342 HB3 GLU 43 1HB GLU 43 5.466 8.493 12.415 343 HG2 GLU 43 2HG GLU 43 5.003 6.508 10.978 344 HG3 GLU 43 1HG GLU 43 5.595 7.413 9.584 345 H ARG 44 H ARG 44 2.591 6.998 9.988 346 HA ARG 44 HA ARG 44 1.043 6.303 12.400 347 HB2 ARG 44 2HB ARG 44 0.960 5.302 9.551 348 HB3 ARG 44 1HB ARG 44 -0.027 4.613 10.841 349 HG2 ARG 44 2HG ARG 44 -0.820 7.000 11.302 350 HG3 ARG 44 1HG ARG 44 -0.082 7.432 9.761 351 HD2 ARG 44 2HD ARG 44 -1.497 5.906 8.563 352 HD3 ARG 44 1HD ARG 44 -2.099 5.198 10.064 353 HE ARG 44 HE ARG 44 -2.864 7.758 10.402 354 HH11 ARG 44 1HH1 ARG 44 -4.693 8.751 9.522 355 HH12 ARG 44 2HH1 ARG 44 -5.345 8.167 8.027 356 HH21 ARG 44 1HH2 ARG 44 -2.970 5.671 7.654 357 HH22 ARG 44 2HH2 ARG 44 -4.371 6.426 6.972 358 H ALA 45 H ALA 45 1.208 4.358 13.491 359 HA ALA 45 HA ALA 45 3.475 2.578 12.686 360 HB1 ALA 45 1HB ALA 45 4.463 3.658 14.479 361 HB2 ALA 45 2HB ALA 45 3.668 2.321 15.312 362 HB3 ALA 45 3HB ALA 45 2.925 3.922 15.302 363 H GLY 46 H GLY 46 0.240 2.872 13.976 364 HA2 GLY 46 2HA GLY 46 0.155 -0.109 14.303 365 HA3 GLY 46 1HA GLY 46 -0.866 1.001 15.205 366 H LEU 47 H LEU 47 -1.637 -1.227 13.415 367 HA LEU 47 HA LEU 47 -3.572 0.301 11.781 368 HB2 LEU 47 2HB LEU 47 -1.754 -1.834 10.619 369 HB3 LEU 47 1HB LEU 47 -3.143 -1.131 9.795 370 HG LEU 47 HG LEU 47 -1.952 1.154 10.351 371 HD11 LEU 47 1HD1 LEU 47 0.222 1.092 10.991 372 HD12 LEU 47 2HD1 LEU 47 0.595 -0.231 9.888 373 HD13 LEU 47 3HD1 LEU 47 -0.099 -0.573 11.471 374 HD21 LEU 47 1HD2 LEU 47 -0.393 0.462 8.214 375 HD22 LEU 47 2HD2 LEU 47 -2.098 0.890 8.091 376 HD23 LEU 47 3HD2 LEU 47 -1.620 -0.804 8.158 377 H ALA 48 H ALA 48 -5.560 -0.703 11.820 378 HA ALA 48 HA ALA 48 -5.730 -3.611 12.266 379 HB1 ALA 48 1HB ALA 48 -7.403 -3.165 14.180 380 HB2 ALA 48 2HB ALA 48 -6.682 -1.559 14.267 381 HB3 ALA 48 3HB ALA 48 -5.689 -2.987 14.558 382 H PHE 49 H PHE 49 -7.367 -4.335 10.973 383 HA PHE 49 HA PHE 49 -9.765 -2.649 10.615 384 HB2 PHE 49 2HB PHE 49 -9.641 -2.796 8.152 385 HB3 PHE 49 1HB PHE 49 -8.273 -1.905 8.820 386 HD1 PHE 49 1HD PHE 49 -9.347 -4.920 7.062 387 HD2 PHE 49 2HD PHE 49 -6.039 -2.961 8.975 388 HE1 PHE 49 1HE PHE 49 -7.780 -6.485 5.951 389 HE2 PHE 49 2HE PHE 49 -4.469 -4.526 7.867 390 HZ PHE 49 HZ PHE 49 -5.335 -6.284 6.351 391 H GLU 50 H GLU 50 -11.596 -3.829 9.930 392 HA GLU 50 HA GLU 50 -11.379 -6.739 10.363 393 HB2 GLU 50 2HB GLU 50 -13.989 -5.547 9.623 394 HB3 GLU 50 1HB GLU 50 -13.590 -6.646 10.943 395 HG2 GLU 50 2HG GLU 50 -12.410 -4.677 12.054 396 HG3 GLU 50 1HG GLU 50 -13.179 -3.653 10.842 397 HA PRO 51 HA PRO 51 -11.239 -6.936 5.818 398 HB2 PRO 51 2HB PRO 51 -10.586 -9.569 5.597 399 HB3 PRO 51 1HB PRO 51 -9.406 -8.305 5.993 400 HG2 PRO 51 2HG PRO 51 -10.726 -10.285 7.761 401 HG3 PRO 51 1HG PRO 51 -9.089 -9.613 7.833 402 HD2 PRO 51 2HD PRO 51 -11.202 -8.799 9.443 403 HD3 PRO 51 1HD PRO 51 -9.749 -7.831 9.116 404 H PHE 52 H PHE 52 -13.489 -6.675 5.424 405 HA PHE 52 HA PHE 52 -14.870 -9.120 4.612 406 HB2 PHE 52 2HB PHE 52 -16.153 -7.364 6.729 407 HB3 PHE 52 1HB PHE 52 -16.823 -8.838 6.028 408 HD1 PHE 52 1HD PHE 52 -14.564 -7.446 8.497 409 HD2 PHE 52 2HD PHE 52 -15.673 -11.046 6.438 410 HE1 PHE 52 1HE PHE 52 -13.363 -8.785 10.197 411 HE2 PHE 52 2HE PHE 52 -14.471 -12.389 8.142 412 HZ PHE 52 HZ PHE 52 -13.311 -11.258 10.021 413 H VAL 53 H VAL 53 -17.205 -8.341 3.769 414 HA VAL 53 HA VAL 53 -16.632 -6.082 1.997 415 HB VAL 53 HB VAL 53 -19.280 -7.521 2.374 416 HG11 VAL 53 1HG1 VAL 53 -19.827 -5.781 0.989 417 HG12 VAL 53 2HG1 VAL 53 -19.149 -6.849 -0.237 418 HG13 VAL 53 3HG1 VAL 53 -18.166 -5.549 0.438 419 HG21 VAL 53 1HG2 VAL 53 -17.604 -8.281 0.076 420 HG22 VAL 53 2HG2 VAL 53 -18.537 -9.298 1.173 421 HG23 VAL 53 3HG2 VAL 53 -16.926 -8.754 1.632 422 H GLY 54 H GLY 54 -17.039 -3.986 2.574 423 HA2 GLY 54 2HA GLY 54 -18.190 -2.166 3.562 424 HA3 GLY 54 1HA GLY 54 -19.411 -3.305 4.144 425 H GLY 55 H GLY 55 -16.112 -4.091 4.755 426 HA2 GLY 55 2HA GLY 55 -16.519 -4.071 7.622 427 HA3 GLY 55 1HA GLY 55 -14.991 -4.392 6.798 428 H ARG 56 H ARG 56 -14.580 -2.915 8.926 429 HA ARG 56 HA ARG 56 -14.522 -0.074 7.968 430 HB2 ARG 56 2HB ARG 56 -14.562 -1.164 10.800 431 HB3 ARG 56 1HB ARG 56 -14.401 0.542 10.379 432 HG2 ARG 56 2HG ARG 56 -16.581 0.413 9.172 433 HG3 ARG 56 1HG ARG 56 -16.753 -1.255 9.718 434 HD2 ARG 56 2HD ARG 56 -16.532 -0.411 12.089 435 HD3 ARG 56 1HD ARG 56 -16.614 1.230 11.446 436 HE ARG 56 HE ARG 56 -18.848 -0.671 11.620 437 HH11 ARG 56 1HH1 ARG 56 -20.858 0.199 11.062 438 HH12 ARG 56 2HH1 ARG 56 -20.931 1.740 10.272 439 HH21 ARG 56 1HH2 ARG 56 -17.492 2.183 10.241 440 HH22 ARG 56 2HH2 ARG 56 -19.025 2.862 9.807 441 H TYR 57 H TYR 57 -12.527 0.896 7.845 442 HA TYR 57 HA TYR 57 -10.197 -0.708 8.815 443 HB2 TYR 57 2HB TYR 57 -10.601 -0.296 6.249 444 HB3 TYR 57 1HB TYR 57 -9.980 1.317 6.606 445 HD1 TYR 57 1HD TYR 57 -7.766 1.364 8.071 446 HD2 TYR 57 2HD TYR 57 -9.082 -1.990 5.732 447 HE1 TYR 57 1HE TYR 57 -5.448 0.482 8.028 448 HE2 TYR 57 2HE TYR 57 -6.764 -2.877 5.696 449 HH TYR 57 HH TYR 57 -4.458 -1.989 5.933 450 H TYR 58 H TYR 58 -8.917 0.289 10.283 451 HA TYR 58 HA TYR 58 -8.887 3.251 10.382 452 HB2 TYR 58 2HB TYR 58 -9.160 3.112 12.895 453 HB3 TYR 58 1HB TYR 58 -10.611 2.725 11.970 454 HD1 TYR 58 1HD TYR 58 -11.005 0.242 11.381 455 HD2 TYR 58 2HD TYR 58 -8.314 1.559 14.455 456 HE1 TYR 58 1HE TYR 58 -11.096 -2.009 12.422 457 HE2 TYR 58 2HE TYR 58 -8.404 -0.692 15.496 458 HH TYR 58 HH TYR 58 -9.406 -2.687 15.477 459 H GLU 59 H GLU 59 -7.032 4.084 11.536 460 HA GLU 59 HA GLU 59 -4.948 2.069 12.222 461 HB2 GLU 59 2HB GLU 59 -4.507 4.497 10.451 462 HB3 GLU 59 1HB GLU 59 -3.266 3.354 10.969 463 HG2 GLU 59 2HG GLU 59 -4.494 1.525 9.828 464 HG3 GLU 59 1HG GLU 59 -5.691 2.695 9.270 465 H TRP 60 H TRP 60 -3.340 2.925 13.719 466 HA TRP 60 HA TRP 60 -4.361 5.304 15.206 467 HB2 TRP 60 2HB TRP 60 -2.465 3.103 16.074 468 HB3 TRP 60 1HB TRP 60 -2.955 4.469 17.074 469 HD1 TRP 60 HD TRP 60 -5.686 4.679 17.501 470 HE1 TRP 60 1HE TRP 60 -7.388 2.789 17.926 471 HE3 TRP 60 3HE TRP 60 -3.070 0.703 15.643 472 HZ2 TRP 60 2HZ TRP 60 -7.608 -0.034 17.532 473 HZ3 TRP 60 3HZ TRP 60 -4.050 -1.571 15.680 474 HH2 TRP 60 HH TRP 60 -6.313 -1.946 16.620 475 H ASP 61 H ASP 61 -3.128 7.129 15.292 476 HA ASP 61 HA ASP 61 -0.529 7.072 13.856 477 HB2 ASP 61 2HB ASP 61 -2.178 9.406 14.850 478 HB3 ASP 61 1HB ASP 61 -0.731 9.527 13.856 479 H ILE 62 H ILE 62 1.381 7.973 14.884 480 HA ILE 62 HA ILE 62 1.764 7.200 17.564 481 HB ILE 62 HB ILE 62 3.271 9.280 15.984 482 HG12 ILE 62 2HG1 ILE 62 3.868 6.366 16.493 483 HG13 ILE 62 1HG1 ILE 62 3.172 6.989 15.006 484 HG21 ILE 62 1HG2 ILE 62 4.410 9.659 17.885 485 HG22 ILE 62 2HG2 ILE 62 4.933 7.976 17.833 486 HG23 ILE 62 3HG2 ILE 62 3.481 8.419 18.730 487 HD11 ILE 62 1HD1 ILE 62 5.359 8.629 15.353 488 HD12 ILE 62 2HD1 ILE 62 5.318 7.211 14.305 489 HD13 ILE 62 3HD1 ILE 62 5.952 7.077 15.944 490 H ASP 63 H ASP 63 0.872 10.380 16.259 491 HA ASP 63 HA ASP 63 0.328 11.252 19.074 492 HB2 ASP 63 2HB ASP 63 1.150 12.881 16.656 493 HB3 ASP 63 1HB ASP 63 0.607 13.589 18.178 494 H GLY 64 H GLY 64 -0.965 10.792 15.890 495 HA2 GLY 64 2HA GLY 64 -3.364 12.408 16.436 496 HA3 GLY 64 1HA GLY 64 -3.052 11.490 14.963 497 H THR 65 H THR 65 -5.472 11.498 16.652 498 HA THR 65 HA THR 65 -5.610 9.078 18.193 499 HB THR 65 HB THR 65 -7.992 9.470 18.221 500 HG1 THR 65 1HG THR 65 -8.979 10.704 16.734 501 HG21 THR 65 1HG2 THR 65 -7.990 11.550 19.252 502 HG22 THR 65 2HG2 THR 65 -6.921 12.260 18.041 503 HG23 THR 65 3HG2 THR 65 -6.268 11.169 19.264 504 H GLU 66 H GLU 66 -8.128 8.165 16.917 505 HA GLU 66 HA GLU 66 -6.874 6.407 14.882 506 HB2 GLU 66 2HB GLU 66 -8.175 5.402 16.749 507 HB3 GLU 66 1HB GLU 66 -9.608 6.263 16.189 508 HG2 GLU 66 2HG GLU 66 -9.390 5.105 13.987 509 HG3 GLU 66 1HG GLU 66 -8.045 4.172 14.648 510 H ILE 67 H ILE 67 -7.277 6.692 12.739 511 HA ILE 67 HA ILE 67 -9.692 8.265 11.942 512 HB ILE 67 HB ILE 67 -6.933 8.477 10.701 513 HG12 ILE 67 2HG1 ILE 67 -8.511 10.476 12.354 514 HG13 ILE 67 1HG1 ILE 67 -7.107 9.570 12.927 515 HG21 ILE 67 1HG2 ILE 67 -8.669 10.600 9.964 516 HG22 ILE 67 2HG2 ILE 67 -9.572 9.102 9.740 517 HG23 ILE 67 3HG2 ILE 67 -8.024 9.328 8.927 518 HD11 ILE 67 1HD1 ILE 67 -7.242 11.838 10.999 519 HD12 ILE 67 2HD1 ILE 67 -6.040 10.584 10.687 520 HD13 ILE 67 3HD1 ILE 67 -6.019 11.468 12.214 521 H VAL 68 H VAL 68 -10.688 7.553 10.006 522 HA VAL 68 HA VAL 68 -10.235 4.786 9.300 523 HB VAL 68 HB VAL 68 -11.791 6.877 7.746 524 HG11 VAL 68 1HG1 VAL 68 -12.580 5.160 6.485 525 HG12 VAL 68 2HG1 VAL 68 -12.714 4.084 7.876 526 HG13 VAL 68 3HG1 VAL 68 -11.162 4.287 7.066 527 HG21 VAL 68 1HG2 VAL 68 -12.567 5.136 10.103 528 HG22 VAL 68 2HG2 VAL 68 -13.747 5.924 9.057 529 HG23 VAL 68 3HG2 VAL 68 -12.624 6.896 10.008 530 H TRP 69 H TRP 69 -8.838 3.989 7.786 531 HA TRP 69 HA TRP 69 -7.330 5.961 6.141 532 HB2 TRP 69 2HB TRP 69 -5.749 4.683 7.254 533 HB3 TRP 69 1HB TRP 69 -6.755 3.237 7.240 534 HD1 TRP 69 HD TRP 69 -4.046 4.986 5.350 535 HE1 TRP 69 1HE TRP 69 -3.407 3.612 3.265 536 HE3 TRP 69 3HE TRP 69 -7.870 1.602 5.316 537 HZ2 TRP 69 2HZ TRP 69 -4.386 1.369 1.783 538 HZ3 TRP 69 3HZ TRP 69 -7.992 -0.143 3.561 539 HH2 TRP 69 HH TRP 69 -6.256 -0.265 1.793 540 H GLY 70 H GLY 70 -9.904 3.845 5.847 541 HA2 GLY 70 2HA GLY 70 -10.443 4.174 3.168 542 HA3 GLY 70 1HA GLY 70 -9.320 2.811 3.181 543 H ARG 71 H ARG 71 -10.748 1.131 2.703 544 HA ARG 71 HA ARG 71 -12.474 0.256 4.875 545 HB2 ARG 71 2HB ARG 71 -13.727 1.973 3.212 546 HB3 ARG 71 1HB ARG 71 -13.979 0.477 2.321 547 HG2 ARG 71 2HG ARG 71 -14.887 -0.570 4.393 548 HG3 ARG 71 1HG ARG 71 -14.718 0.981 5.215 549 HD2 ARG 71 2HD ARG 71 -16.998 0.829 4.457 550 HD3 ARG 71 1HD ARG 71 -16.180 1.987 3.410 551 HE ARG 71 HE ARG 71 -16.200 -0.782 2.418 552 HH11 ARG 71 1HH1 ARG 71 -17.301 -1.065 0.466 553 HH12 ARG 71 2HH1 ARG 71 -18.306 0.210 -0.139 554 HH21 ARG 71 1HH2 ARG 71 -17.662 2.339 2.520 555 HH22 ARG 71 2HH2 ARG 71 -18.511 2.136 1.024 556 H ILE 72 H ILE 72 -14.003 -1.560 3.241 557 HA ILE 72 HA ILE 72 -11.889 -3.137 1.861 558 HB ILE 72 HB ILE 72 -13.807 -4.201 3.959 559 HG12 ILE 72 2HG1 ILE 72 -11.324 -4.909 4.766 560 HG13 ILE 72 1HG1 ILE 72 -10.937 -3.410 3.922 561 HG21 ILE 72 1HG2 ILE 72 -11.809 -5.576 2.139 562 HG22 ILE 72 2HG2 ILE 72 -13.551 -5.849 2.207 563 HG23 ILE 72 3HG2 ILE 72 -12.528 -6.342 3.556 564 HD11 ILE 72 1HD1 ILE 72 -11.402 -2.820 6.205 565 HD12 ILE 72 2HD1 ILE 72 -12.880 -3.780 6.212 566 HD13 ILE 72 3HD1 ILE 72 -12.793 -2.305 5.253 567 H LEU 73 H LEU 73 -12.857 -4.823 0.422 568 HA LEU 73 HA LEU 73 -15.617 -4.062 -0.454 569 HB2 LEU 73 2HB LEU 73 -13.777 -3.366 -2.036 570 HB3 LEU 73 1HB LEU 73 -13.373 -5.072 -2.224 571 HG LEU 73 HG LEU 73 -15.938 -5.321 -2.772 572 HD11 LEU 73 1HD1 LEU 73 -16.766 -3.286 -3.978 573 HD12 LEU 73 2HD1 LEU 73 -15.376 -2.400 -3.355 574 HD13 LEU 73 3HD1 LEU 73 -16.587 -3.036 -2.241 575 HD21 LEU 73 1HD2 LEU 73 -14.507 -5.912 -4.507 576 HD22 LEU 73 2HD2 LEU 73 -13.685 -4.351 -4.497 577 HD23 LEU 73 3HD2 LEU 73 -15.293 -4.496 -5.206 578 H GLU 74 H GLU 74 -13.203 -6.683 -0.620 579 HA GLU 74 HA GLU 74 -14.994 -8.647 0.446 580 HB2 GLU 74 2HB GLU 74 -16.063 -8.309 -1.795 581 HB3 GLU 74 1HB GLU 74 -14.553 -8.833 -2.537 582 HG2 GLU 74 2HG GLU 74 -14.721 -10.984 -1.295 583 HG3 GLU 74 1HG GLU 74 -16.283 -10.463 -0.659 584 H TRP 75 H TRP 75 -13.813 -10.448 1.036 585 HA TRP 75 HA TRP 75 -10.965 -10.471 0.174 586 HB2 TRP 75 2HB TRP 75 -10.853 -10.466 2.477 587 HB3 TRP 75 1HB TRP 75 -12.410 -11.274 2.658 588 HD1 TRP 75 HD TRP 75 -8.709 -11.953 2.220 589 HE1 TRP 75 1HE TRP 75 -8.273 -14.478 2.508 590 HE3 TRP 75 3HE TRP 75 -13.516 -13.666 2.344 591 HZ2 TRP 75 2HZ TRP 75 -9.769 -16.906 2.757 592 HZ3 TRP 75 3HZ TRP 75 -13.984 -16.083 2.605 593 HH2 TRP 75 HH TRP 75 -12.119 -17.706 2.813 594 H ASP 76 H ASP 76 -10.404 -12.011 -1.279 595 HA ASP 76 HA ASP 76 -12.154 -14.416 -1.508 596 HB2 ASP 76 2HB ASP 76 -11.453 -12.611 -3.460 597 HB3 ASP 76 1HB ASP 76 -10.276 -13.902 -3.704 598 HA PRO 77 HA PRO 77 -8.855 -16.782 0.465 599 HB2 PRO 77 2HB PRO 77 -9.705 -18.658 -1.735 600 HB3 PRO 77 1HB PRO 77 -9.328 -19.027 -0.042 601 HG2 PRO 77 2HG PRO 77 -11.844 -18.792 -0.889 602 HG3 PRO 77 1HG PRO 77 -11.345 -18.256 0.724 603 HD2 PRO 77 2HD PRO 77 -12.168 -16.637 -1.594 604 HD3 PRO 77 1HD PRO 77 -12.068 -16.170 0.119 605 HA PRO 78 HA PRO 78 -4.994 -16.132 -1.549 606 HB2 PRO 78 2HB PRO 78 -4.956 -19.109 -1.938 607 HB3 PRO 78 1HB PRO 78 -3.661 -18.035 -1.372 608 HG2 PRO 78 2HG PRO 78 -5.272 -19.521 0.278 609 HG3 PRO 78 1HG PRO 78 -4.408 -18.055 0.764 610 HD2 PRO 78 2HD PRO 78 -7.258 -18.428 0.577 611 HD3 PRO 78 1HD PRO 78 -6.386 -16.949 1.031 612 H HIS 79 H HIS 79 -5.936 -15.104 -3.405 613 HA HIS 79 HA HIS 79 -5.346 -16.098 -5.920 614 HB2 HIS 79 2HB HIS 79 -7.810 -17.288 -4.828 615 HB3 HIS 79 1HB HIS 79 -8.005 -16.572 -6.428 616 HD1 HIS 79 1HD HIS 79 -7.167 -19.685 -4.978 617 HD2 HIS 79 2HD HIS 79 -5.554 -17.482 -8.131 618 HE1 HIS 79 1HE HIS 79 -5.838 -21.318 -6.388 619 HE2 HIS 79 2HE HIS 79 -4.852 -19.988 -8.309 620 H ARG 80 H ARG 80 -7.944 -14.378 -4.122 621 HA ARG 80 HA ARG 80 -7.500 -12.118 -5.984 622 HB2 ARG 80 2HB ARG 80 -9.691 -13.818 -6.291 623 HB3 ARG 80 1HB ARG 80 -10.338 -12.420 -5.433 624 HG2 ARG 80 2HG ARG 80 -8.619 -12.184 -7.915 625 HG3 ARG 80 1HG ARG 80 -10.381 -12.220 -7.958 626 HD2 ARG 80 2HD ARG 80 -10.414 -10.259 -6.412 627 HD3 ARG 80 1HD ARG 80 -8.655 -10.194 -6.511 628 HE ARG 80 HE ARG 80 -8.898 -9.151 -8.604 629 HH11 ARG 80 1HH1 ARG 80 -10.065 -8.495 -10.425 630 HH12 ARG 80 2HH1 ARG 80 -11.684 -9.069 -10.653 631 HH21 ARG 80 1HH2 ARG 80 -11.707 -10.956 -7.745 632 HH22 ARG 80 2HH2 ARG 80 -12.613 -10.462 -9.135 633 H LEU 81 H LEU 81 -7.643 -10.162 -5.027 634 HA LEU 81 HA LEU 81 -8.805 -10.025 -2.275 635 HB2 LEU 81 2HB LEU 81 -6.303 -10.151 -2.190 636 HB3 LEU 81 1HB LEU 81 -6.230 -8.689 -3.168 637 HG LEU 81 HG LEU 81 -7.757 -7.650 -1.329 638 HD11 LEU 81 1HD1 LEU 81 -6.469 -9.365 0.661 639 HD12 LEU 81 2HD1 LEU 81 -7.626 -10.243 -0.338 640 HD13 LEU 81 3HD1 LEU 81 -8.143 -8.820 0.566 641 HD21 LEU 81 1HD2 LEU 81 -5.584 -6.770 -1.517 642 HD22 LEU 81 2HD2 LEU 81 -4.825 -8.306 -1.094 643 HD23 LEU 81 3HD2 LEU 81 -5.629 -7.348 0.149 644 H ALA 82 H ALA 82 -10.216 -8.332 -2.058 645 HA ALA 82 HA ALA 82 -9.968 -6.045 -3.968 646 HB1 ALA 82 1HB ALA 82 -12.232 -6.114 -4.545 647 HB2 ALA 82 2HB ALA 82 -12.671 -7.050 -3.117 648 HB3 ALA 82 3HB ALA 82 -11.837 -7.829 -4.462 649 H MET 83 H MET 83 -10.415 -4.023 -3.022 650 HA MET 83 HA MET 83 -11.461 -4.029 -0.240 651 HB2 MET 83 2HB MET 83 -8.892 -2.649 -1.060 652 HB3 MET 83 1HB MET 83 -9.626 -2.616 0.543 653 HG2 MET 83 2HG MET 83 -9.423 -5.129 0.598 654 HG3 MET 83 1HG MET 83 -8.497 -5.024 -0.900 655 HE1 MET 83 1HE MET 83 -6.804 -2.094 -0.222 656 HE2 MET 83 2HE MET 83 -6.695 -3.496 -1.283 657 HE3 MET 83 3HE MET 83 -5.386 -3.151 -0.154 658 H THR 84 H THR 84 -12.649 -2.187 0.261 659 HA THR 84 HA THR 84 -12.947 -0.195 -1.940 660 HB THR 84 HB THR 84 -14.666 -0.662 0.521 661 HG1 THR 84 1HG THR 84 -15.796 -1.960 -0.680 662 HG21 THR 84 1HG2 THR 84 -14.543 1.457 -1.474 663 HG22 THR 84 2HG2 THR 84 -15.459 1.391 0.031 664 HG23 THR 84 3HG2 THR 84 -16.125 0.677 -1.438 665 H TRP 85 H TRP 85 -12.275 1.944 -1.566 666 HA TRP 85 HA TRP 85 -10.871 2.374 1.023 667 HB2 TRP 85 2HB TRP 85 -9.737 2.661 -1.269 668 HB3 TRP 85 1HB TRP 85 -10.682 4.144 -1.408 669 HD1 TRP 85 HD TRP 85 -10.482 5.697 1.032 670 HE1 TRP 85 1HE TRP 85 -8.281 6.365 2.197 671 HE3 TRP 85 3HE TRP 85 -7.345 2.176 -0.923 672 HZ2 TRP 85 2HZ TRP 85 -5.551 5.519 2.285 673 HZ3 TRP 85 3HZ TRP 85 -4.952 2.132 -0.288 674 HH2 TRP 85 HH TRP 85 -4.051 3.796 1.315 675 H ARG 86 H ARG 86 -11.988 3.503 2.547 676 HA ARG 86 HA ARG 86 -13.814 5.681 1.589 677 HB2 ARG 86 2HB ARG 86 -14.972 3.828 2.789 678 HB3 ARG 86 1HB ARG 86 -13.954 4.135 4.197 679 HG2 ARG 86 2HG ARG 86 -14.811 6.486 4.236 680 HG3 ARG 86 1HG ARG 86 -15.916 6.067 2.927 681 HD2 ARG 86 2HD ARG 86 -15.833 4.730 5.649 682 HD3 ARG 86 1HD ARG 86 -17.036 5.907 5.126 683 HE ARG 86 HE ARG 86 -16.975 3.756 3.245 684 HH11 ARG 86 1HH1 ARG 86 -18.615 2.202 3.351 685 HH12 ARG 86 2HH1 ARG 86 -19.533 2.030 4.809 686 HH21 ARG 86 1HH2 ARG 86 -17.831 4.538 6.492 687 HH22 ARG 86 2HH2 ARG 86 -19.090 3.352 6.587 688 H ILE 87 H ILE 87 -12.373 7.422 1.669 689 HA ILE 87 HA ILE 87 -11.465 8.186 4.386 690 HB ILE 87 HB ILE 87 -9.575 6.991 3.215 691 HG12 ILE 87 2HG1 ILE 87 -8.946 9.924 3.568 692 HG13 ILE 87 1HG1 ILE 87 -9.377 8.911 4.946 693 HG21 ILE 87 1HG2 ILE 87 -8.559 7.943 1.289 694 HG22 ILE 87 2HG2 ILE 87 -9.464 9.447 1.459 695 HG23 ILE 87 3HG2 ILE 87 -10.289 7.977 0.943 696 HD11 ILE 87 1HD1 ILE 87 -7.389 7.636 3.230 697 HD12 ILE 87 2HD1 ILE 87 -7.350 7.920 4.969 698 HD13 ILE 87 3HD1 ILE 87 -6.830 9.185 3.859 699 H ASP 88 H ASP 88 -10.833 10.515 4.467 700 HA ASP 88 HA ASP 88 -12.472 12.069 2.526 701 HB2 ASP 88 2HB ASP 88 -12.885 12.321 4.996 702 HB3 ASP 88 1HB ASP 88 -11.261 12.994 5.147 703 H GLY 89 H GLY 89 -11.581 13.863 1.428 704 HA2 GLY 89 2HA GLY 89 -8.889 13.631 0.547 705 HA3 GLY 89 1HA GLY 89 -9.905 15.049 0.302 706 H HIS 90 H HIS 90 -10.240 15.240 3.328 707 HA HIS 90 HA HIS 90 -7.850 16.893 3.751 708 HB2 HIS 90 2HB HIS 90 -10.299 16.421 5.456 709 HB3 HIS 90 1HB HIS 90 -9.040 17.595 5.809 710 HD1 HIS 90 1HD HIS 90 -8.548 18.819 3.064 711 HD2 HIS 90 2HD HIS 90 -12.364 18.019 4.542 712 HE1 HIS 90 1HE HIS 90 -10.139 20.330 1.796 713 HE2 HIS 90 2HE HIS 90 -12.466 19.850 2.685 714 H TRP 91 H TRP 91 -7.974 13.778 3.872 715 HA TRP 91 HA TRP 91 -6.882 12.118 5.113 716 HB2 TRP 91 2HB TRP 91 -5.456 14.623 5.752 717 HB3 TRP 91 1HB TRP 91 -5.289 13.362 6.971 718 HD1 TRP 91 HD TRP 91 -3.782 14.484 3.860 719 HE1 TRP 91 1HE TRP 91 -2.358 12.625 2.780 720 HE3 TRP 91 3HE TRP 91 -5.401 10.456 6.549 721 HZ2 TRP 91 2HZ TRP 91 -1.961 9.801 3.025 722 HZ3 TRP 91 3HZ TRP 91 -4.485 8.198 6.103 723 HH2 TRP 91 HH TRP 91 -2.768 7.866 4.348 724 H GLN 92 H GLN 92 -9.413 13.496 6.091 725 HA GLN 92 HA GLN 92 -9.154 12.901 9.001 726 HB2 GLN 92 2HB GLN 92 -11.341 14.352 7.484 727 HB3 GLN 92 1HB GLN 92 -11.311 14.091 9.229 728 HG2 GLN 92 2HG GLN 92 -9.250 15.635 7.631 729 HG3 GLN 92 1HG GLN 92 -10.473 16.329 8.687 730 HE21 GLN 92 1HE2 GLN 92 -7.281 15.848 8.727 731 HE22 GLN 92 2HE2 GLN 92 -7.031 15.442 10.357 732 H SER 93 H SER 93 -12.343 12.820 7.967 733 HA SER 93 HA SER 93 -12.385 10.016 7.125 734 HB2 SER 93 2HB SER 93 -13.506 9.123 9.032 735 HB3 SER 93 1HB SER 93 -12.133 10.019 9.670 736 HG SER 93 HG SER 93 -13.465 11.368 10.580 737 H VAL 94 H VAL 94 -14.673 9.322 6.679 738 HA VAL 94 HA VAL 94 -16.474 11.675 6.259 739 HB VAL 94 HB VAL 94 -17.196 9.965 4.249 740 HG11 VAL 94 1HG1 VAL 94 -15.011 12.066 4.104 741 HG12 VAL 94 2HG1 VAL 94 -16.741 12.408 4.102 742 HG13 VAL 94 3HG1 VAL 94 -16.018 11.515 2.764 743 HG21 VAL 94 1HG2 VAL 94 -15.098 8.612 5.005 744 HG22 VAL 94 2HG2 VAL 94 -14.181 9.898 4.218 745 HG23 VAL 94 3HG2 VAL 94 -15.316 8.924 3.283 746 HA PRO 95 HA PRO 95 -19.543 9.298 8.354 747 HB2 PRO 95 2HB PRO 95 -21.821 10.073 7.017 748 HB3 PRO 95 1HB PRO 95 -20.990 11.073 8.223 749 HG2 PRO 95 2HG PRO 95 -20.907 11.225 5.258 750 HG3 PRO 95 1HG PRO 95 -20.890 12.525 6.460 751 HD2 PRO 95 2HD PRO 95 -18.638 11.680 5.155 752 HD3 PRO 95 1HD PRO 95 -18.606 12.378 6.789 753 H ASP 96 H ASP 96 -19.555 9.101 4.817 754 HA ASP 96 HA ASP 96 -19.933 6.218 4.933 755 HB2 ASP 96 2HB ASP 96 -22.272 7.141 5.217 756 HB3 ASP 96 1HB ASP 96 -22.111 7.829 3.602 757 H ASP 97 H ASP 97 -20.074 5.332 2.608 758 HA ASP 97 HA ASP 97 -18.066 6.724 1.003 759 HB2 ASP 97 2HB ASP 97 -18.092 4.259 1.158 760 HB3 ASP 97 1HB ASP 97 -19.690 4.229 0.410 761 H ASP 98 H ASP 98 -18.855 8.565 0.020 762 HA ASP 98 HA ASP 98 -21.494 8.442 -1.321 763 HB2 ASP 98 2HB ASP 98 -20.802 10.388 0.171 764 HB3 ASP 98 1HB ASP 98 -19.660 10.823 -1.096 765 H ARG 99 H ARG 99 -18.178 9.503 -2.066 766 HA ARG 99 HA ARG 99 -18.646 8.660 -4.893 767 HB2 ARG 99 2HB ARG 99 -17.051 11.040 -3.892 768 HB3 ARG 99 1HB ARG 99 -17.155 10.522 -5.574 769 HG2 ARG 99 2HG ARG 99 -19.630 10.821 -5.476 770 HG3 ARG 99 1HG ARG 99 -19.459 11.446 -3.835 771 HD2 ARG 99 2HD ARG 99 -17.895 13.200 -4.754 772 HD3 ARG 99 1HD ARG 99 -18.318 12.643 -6.373 773 HE ARG 99 HE ARG 99 -20.771 13.149 -5.197 774 HH11 ARG 99 1HH1 ARG 99 -21.782 15.169 -5.299 775 HH12 ARG 99 2HH1 ARG 99 -20.822 16.593 -5.528 776 HH21 ARG 99 1HH2 ARG 99 -17.816 14.867 -5.641 777 HH22 ARG 99 2HH2 ARG 99 -18.576 16.421 -5.722 778 H ALA 100 H ALA 100 -17.299 7.499 -2.339 779 HA ALA 100 HA ALA 100 -14.480 7.395 -2.863 780 HB1 ALA 100 1HB ALA 100 -16.103 6.526 -0.828 781 HB2 ALA 100 2HB ALA 100 -14.405 6.090 -1.006 782 HB3 ALA 100 3HB ALA 100 -15.659 5.005 -1.603 783 H SER 101 H SER 101 -13.262 5.724 -3.881 784 HA SER 101 HA SER 101 -14.816 4.215 -5.932 785 HB2 SER 101 2HB SER 101 -13.120 5.823 -6.758 786 HB3 SER 101 1HB SER 101 -11.874 4.939 -5.881 787 HG SER 101 HG SER 101 -13.542 3.465 -7.548 788 H GLU 102 H GLU 102 -13.911 2.054 -6.520 789 HA GLU 102 HA GLU 102 -12.949 0.642 -4.068 790 HB2 GLU 102 2HB GLU 102 -14.411 -0.455 -6.491 791 HB3 GLU 102 1HB GLU 102 -13.969 -1.370 -5.049 792 HG2 GLU 102 2HG GLU 102 -15.370 0.138 -3.673 793 HG3 GLU 102 1HG GLU 102 -15.831 1.023 -5.126 794 H ILE 103 H ILE 103 -11.266 -0.888 -4.286 795 HA ILE 103 HA ILE 103 -9.647 -0.602 -6.791 796 HB ILE 103 HB ILE 103 -8.666 -1.254 -3.999 797 HG12 ILE 103 2HG1 ILE 103 -8.395 1.370 -5.487 798 HG13 ILE 103 1HG1 ILE 103 -9.651 1.074 -4.283 799 HG21 ILE 103 1HG2 ILE 103 -6.689 -0.115 -5.688 800 HG22 ILE 103 2HG2 ILE 103 -7.498 -1.375 -6.618 801 HG23 ILE 103 3HG2 ILE 103 -6.757 -1.764 -5.066 802 HD11 ILE 103 1HD1 ILE 103 -6.654 0.985 -3.851 803 HD12 ILE 103 2HD1 ILE 103 -7.833 0.445 -2.654 804 HD13 ILE 103 3HD1 ILE 103 -7.795 2.137 -3.158 805 H GLU 104 H GLU 104 -9.009 -2.516 -7.808 806 HA GLU 104 HA GLU 104 -9.873 -5.047 -6.454 807 HB2 GLU 104 2HB GLU 104 -10.988 -4.455 -8.653 808 HB3 GLU 104 1HB GLU 104 -9.411 -4.647 -9.418 809 HG2 GLU 104 2HG GLU 104 -10.545 -6.760 -9.632 810 HG3 GLU 104 1HG GLU 104 -9.313 -6.969 -8.388 811 H VAL 105 H VAL 105 -8.257 -6.379 -5.844 812 HA VAL 105 HA VAL 105 -5.626 -6.144 -7.236 813 HB VAL 105 HB VAL 105 -6.046 -6.718 -4.290 814 HG11 VAL 105 1HG1 VAL 105 -3.652 -6.404 -6.090 815 HG12 VAL 105 2HG1 VAL 105 -3.989 -7.671 -4.910 816 HG13 VAL 105 3HG1 VAL 105 -3.526 -6.059 -4.365 817 HG21 VAL 105 1HG2 VAL 105 -5.537 -4.177 -5.811 818 HG22 VAL 105 2HG2 VAL 105 -4.861 -4.371 -4.194 819 HG23 VAL 105 3HG2 VAL 105 -6.605 -4.455 -4.435 820 H ASP 106 H ASP 106 -4.877 -8.089 -7.995 821 HA ASP 106 HA ASP 106 -6.247 -10.553 -6.989 822 HB2 ASP 106 2HB ASP 106 -6.792 -10.005 -9.344 823 HB3 ASP 106 1HB ASP 106 -5.072 -10.037 -9.735 824 H PHE 107 H PHE 107 -4.936 -12.103 -6.129 825 HA PHE 107 HA PHE 107 -1.995 -11.839 -6.615 826 HB2 PHE 107 2HB PHE 107 -3.549 -12.207 -4.107 827 HB3 PHE 107 1HB PHE 107 -2.055 -13.134 -4.256 828 HD1 PHE 107 1HD PHE 107 0.109 -12.007 -4.541 829 HD2 PHE 107 2HD PHE 107 -3.515 -9.783 -3.947 830 HE1 PHE 107 1HE PHE 107 1.441 -9.988 -4.013 831 HE2 PHE 107 2HE PHE 107 -2.184 -7.758 -3.419 832 HZ PHE 107 HZ PHE 107 0.299 -7.865 -3.452 833 H VAL 108 H VAL 108 -1.226 -13.535 -7.722 834 HA VAL 108 HA VAL 108 -2.372 -16.234 -7.183 835 HB VAL 108 HB VAL 108 -2.772 -16.684 -9.413 836 HG11 VAL 108 1HG1 VAL 108 -4.051 -14.604 -8.716 837 HG12 VAL 108 2HG1 VAL 108 -3.843 -14.806 -10.456 838 HG13 VAL 108 3HG1 VAL 108 -2.832 -13.661 -9.574 839 HG21 VAL 108 1HG2 VAL 108 -0.518 -14.738 -9.951 840 HG22 VAL 108 2HG2 VAL 108 -1.535 -15.369 -11.245 841 HG23 VAL 108 3HG2 VAL 108 -0.559 -16.472 -10.275 842 HA PRO 109 HA PRO 109 1.861 -17.386 -6.660 843 HB2 PRO 109 2HB PRO 109 1.844 -19.900 -7.859 844 HB3 PRO 109 1HB PRO 109 1.354 -19.562 -6.194 845 HG2 PRO 109 2HG PRO 109 -0.311 -19.985 -8.602 846 HG3 PRO 109 1HG PRO 109 -0.626 -20.424 -6.915 847 HD2 PRO 109 2HD PRO 109 -1.835 -18.302 -8.119 848 HD3 PRO 109 1HD PRO 109 -1.459 -18.328 -6.380 849 H ASN 110 H ASN 110 3.578 -16.669 -7.822 850 HA ASN 110 HA ASN 110 3.568 -17.094 -10.777 851 HB2 ASN 110 2HB ASN 110 3.311 -14.711 -10.067 852 HB3 ASN 110 1HB ASN 110 4.872 -14.832 -9.258 853 HD21 ASN 110 1HD2 ASN 110 3.376 -15.270 -12.503 854 HD22 ASN 110 2HD2 ASN 110 4.770 -14.836 -13.368 855 H GLY 111 H GLY 111 5.086 -18.579 -11.319 856 HA2 GLY 111 2HA GLY 111 7.091 -19.797 -11.302 857 HA3 GLY 111 1HA GLY 111 7.839 -18.326 -10.673 858 H SER 112 H SER 112 8.984 -18.933 -8.891 859 HA SER 112 HA SER 112 7.504 -20.436 -6.778 860 HB2 SER 112 2HB SER 112 9.506 -21.727 -6.268 861 HB3 SER 112 1HB SER 112 9.103 -21.949 -7.968 862 HG SER 112 HG SER 112 11.283 -20.770 -6.802 863 H GLY 113 H GLY 113 8.023 -19.788 -4.651 864 HA2 GLY 113 2HA GLY 113 8.685 -18.262 -3.001 865 HA3 GLY 113 1HA GLY 113 10.201 -18.145 -3.894 866 H GLY 114 H GLY 114 7.642 -17.337 -5.937 867 HA2 GLY 114 2HA GLY 114 7.759 -14.464 -5.170 868 HA3 GLY 114 1HA GLY 114 8.171 -14.926 -6.820 869 H THR 115 H THR 115 5.877 -13.301 -5.690 870 HA THR 115 HA THR 115 3.674 -14.886 -6.950 871 HB THR 115 HB THR 115 3.304 -12.843 -4.750 872 HG1 THR 115 1HG THR 115 4.573 -14.862 -4.269 873 HG21 THR 115 1HG2 THR 115 1.569 -15.043 -5.896 874 HG22 THR 115 2HG2 THR 115 1.331 -13.310 -6.113 875 HG23 THR 115 3HG2 THR 115 1.131 -14.036 -4.518 876 H ARG 116 H ARG 116 2.427 -13.771 -8.446 877 HA ARG 116 HA ARG 116 3.292 -10.964 -9.028 878 HB2 ARG 116 2HB ARG 116 3.755 -12.615 -10.837 879 HB3 ARG 116 1HB ARG 116 2.032 -12.988 -10.906 880 HG2 ARG 116 2HG ARG 116 1.561 -10.606 -11.432 881 HG3 ARG 116 1HG ARG 116 3.295 -10.281 -11.429 882 HD2 ARG 116 2HD ARG 116 3.576 -11.987 -13.232 883 HD3 ARG 116 1HD ARG 116 1.823 -12.175 -13.283 884 HE ARG 116 HE ARG 116 2.474 -9.406 -13.598 885 HH11 ARG 116 1HH1 ARG 116 2.372 -8.523 -15.676 886 HH12 ARG 116 2HH1 ARG 116 2.422 -9.574 -17.053 887 HH21 ARG 116 1HH2 ARG 116 2.664 -12.472 -15.165 888 HH22 ARG 116 2HH2 ARG 116 2.586 -11.809 -16.763 889 H VAL 117 H VAL 117 1.755 -9.410 -8.792 890 HA VAL 117 HA VAL 117 -1.090 -10.307 -8.647 891 HB VAL 117 HB VAL 117 -0.783 -9.778 -6.434 892 HG11 VAL 117 1HG1 VAL 117 1.449 -8.108 -7.506 893 HG12 VAL 117 2HG1 VAL 117 1.462 -9.291 -6.200 894 HG13 VAL 117 3HG1 VAL 117 0.789 -7.685 -5.927 895 HG21 VAL 117 1HG2 VAL 117 -1.732 -7.643 -5.980 896 HG22 VAL 117 2HG2 VAL 117 -2.362 -8.083 -7.566 897 HG23 VAL 117 3HG2 VAL 117 -1.031 -6.935 -7.434 898 H GLU 118 H GLU 118 -2.600 -9.062 -9.672 899 HA GLU 118 HA GLU 118 -1.559 -6.772 -11.279 900 HB2 GLU 118 2HB GLU 118 -2.552 -8.588 -12.605 901 HB3 GLU 118 1HB GLU 118 -4.028 -8.502 -11.646 902 HG2 GLU 118 2HG GLU 118 -4.375 -6.166 -12.417 903 HG3 GLU 118 1HG GLU 118 -2.930 -6.291 -13.413 904 H LEU 119 H LEU 119 -2.163 -4.784 -10.607 905 HA LEU 119 HA LEU 119 -4.630 -4.554 -8.945 906 HB2 LEU 119 2HB LEU 119 -2.451 -4.108 -7.749 907 HB3 LEU 119 1HB LEU 119 -2.200 -2.747 -8.841 908 HG LEU 119 HG LEU 119 -4.850 -2.825 -7.516 909 HD11 LEU 119 1HD1 LEU 119 -2.330 -2.172 -5.963 910 HD12 LEU 119 2HD1 LEU 119 -3.327 -3.600 -5.702 911 HD13 LEU 119 3HD1 LEU 119 -3.984 -1.995 -5.382 912 HD21 LEU 119 1HD2 LEU 119 -3.677 -1.010 -9.020 913 HD22 LEU 119 2HD2 LEU 119 -2.871 -0.561 -7.517 914 HD23 LEU 119 3HD2 LEU 119 -4.630 -0.500 -7.628 915 H ALA 120 H ALA 120 -6.193 -3.275 -9.794 916 HA ALA 120 HA ALA 120 -5.392 -1.231 -11.819 917 HB1 ALA 120 1HB ALA 120 -7.323 -3.481 -12.072 918 HB2 ALA 120 2HB ALA 120 -6.328 -2.708 -13.305 919 HB3 ALA 120 3HB ALA 120 -7.815 -1.933 -12.757 920 H HIS 121 H HIS 121 -6.422 0.719 -11.595 921 HA HIS 121 HA HIS 121 -8.608 0.890 -9.557 922 HB2 HIS 121 2HB HIS 121 -7.447 2.472 -8.442 923 HB3 HIS 121 1HB HIS 121 -6.067 2.114 -9.480 924 HD1 HIS 121 1HD HIS 121 -9.329 4.064 -10.028 925 HD2 HIS 121 2HD HIS 121 -5.219 4.471 -10.617 926 HE1 HIS 121 1HE HIS 121 -8.984 6.307 -11.155 927 HE2 HIS 121 2HE HIS 121 -6.487 6.571 -11.501 928 H VAL 122 H VAL 122 -10.426 2.043 -10.191 929 HA VAL 122 HA VAL 122 -10.250 3.573 -12.740 930 HB VAL 122 HB VAL 122 -12.367 2.532 -13.510 931 HG11 VAL 122 1HG1 VAL 122 -9.967 1.621 -13.975 932 HG12 VAL 122 2HG1 VAL 122 -11.346 0.593 -14.366 933 HG13 VAL 122 3HG1 VAL 122 -10.428 0.310 -12.889 934 HG21 VAL 122 1HG2 VAL 122 -12.021 1.079 -10.901 935 HG22 VAL 122 2HG2 VAL 122 -12.819 0.262 -12.245 936 HG23 VAL 122 3HG2 VAL 122 -13.485 1.765 -11.608 937 H LYS 123 H LYS 123 -11.683 5.297 -12.876 938 HA LYS 123 HA LYS 123 -13.051 7.019 -12.087 939 HB2 LYS 123 2HB LYS 123 -14.355 4.740 -10.575 940 HB3 LYS 123 1HB LYS 123 -15.078 6.314 -10.911 941 HG2 LYS 123 2HG LYS 123 -14.849 5.881 -13.344 942 HG3 LYS 123 1HG LYS 123 -14.197 4.282 -12.981 943 HD2 LYS 123 2HD LYS 123 -16.312 3.783 -11.720 944 HD3 LYS 123 1HD LYS 123 -16.962 5.315 -12.308 945 HE2 LYS 123 2HE LYS 123 -16.342 4.452 -14.665 946 HE3 LYS 123 1HE LYS 123 -16.199 2.869 -13.903 947 HZ1 LYS 123 1HZ LYS 123 -18.529 4.227 -14.691 948 HZ2 LYS 123 2HZ LYS 123 -18.569 4.025 -13.005 949 HZ3 LYS 123 3HZ LYS 123 -18.386 2.676 -14.022 950 H LEU 124 H LEU 124 -10.599 6.336 -10.493 951 HA LEU 124 HA LEU 124 -11.213 6.594 -7.694 952 HB2 LEU 124 2HB LEU 124 -9.006 5.840 -8.508 953 HB3 LEU 124 1HB LEU 124 -8.713 7.442 -9.190 954 HG LEU 124 HG LEU 124 -8.996 8.390 -6.868 955 HD11 LEU 124 1HD1 LEU 124 -8.563 6.525 -5.077 956 HD12 LEU 124 2HD1 LEU 124 -9.265 5.450 -6.284 957 HD13 LEU 124 3HD1 LEU 124 -10.208 6.799 -5.650 958 HD21 LEU 124 1HD2 LEU 124 -6.813 6.639 -6.278 959 HD22 LEU 124 2HD2 LEU 124 -6.747 8.295 -6.883 960 HD23 LEU 124 3HD2 LEU 124 -6.813 6.943 -8.015 961 H HIS 125 H HIS 125 -10.587 8.939 -10.266 962 HA HIS 125 HA HIS 125 -10.528 11.271 -8.633 963 HB2 HIS 125 2HB HIS 125 -9.805 11.365 -10.954 964 HB3 HIS 125 1HB HIS 125 -11.431 10.949 -11.498 965 HD1 HIS 125 1HD HIS 125 -11.286 13.194 -8.585 966 HD2 HIS 125 2HD HIS 125 -11.499 13.622 -12.729 967 HE1 HIS 125 1HE HIS 125 -11.983 15.586 -9.019 968 HE2 HIS 125 2HE HIS 125 -12.105 15.866 -11.540 969 H ARG 126 H ARG 126 -13.200 9.304 -9.735 970 HA ARG 126 HA ARG 126 -15.348 11.056 -9.683 971 HB2 ARG 126 2HB ARG 126 -16.702 9.202 -9.382 972 HB3 ARG 126 1HB ARG 126 -15.207 8.399 -9.858 973 HG2 ARG 126 2HG ARG 126 -14.637 8.295 -7.365 974 HG3 ARG 126 1HG ARG 126 -16.313 8.764 -7.070 975 HD2 ARG 126 2HD ARG 126 -15.386 6.321 -8.606 976 HD3 ARG 126 1HD ARG 126 -16.131 6.328 -7.007 977 HE ARG 126 HE ARG 126 -17.526 6.726 -9.566 978 HH11 ARG 126 1HH1 ARG 126 -19.778 6.795 -9.394 979 HH12 ARG 126 2HH1 ARG 126 -20.511 6.949 -7.832 980 HH21 ARG 126 1HH2 ARG 126 -17.491 7.028 -6.130 981 HH22 ARG 126 2HH2 ARG 126 -19.216 7.081 -5.985 982 H HIS 127 H HIS 127 -13.331 10.036 -7.027 983 HA HIS 127 HA HIS 127 -15.004 10.724 -4.842 984 HB2 HIS 127 2HB HIS 127 -12.559 9.687 -4.976 985 HB3 HIS 127 1HB HIS 127 -12.083 11.368 -4.748 986 HD1 HIS 127 1HD HIS 127 -14.855 11.799 -2.964 987 HD2 HIS 127 2HD HIS 127 -11.683 9.183 -2.250 988 HE1 HIS 127 1HE HIS 127 -14.913 11.258 -0.488 989 HE2 HIS 127 2HE HIS 127 -12.987 9.667 -0.044 990 H GLY 128 H GLY 128 -12.829 12.698 -6.820 991 HA2 GLY 128 2HA GLY 128 -12.470 15.037 -6.813 992 HA3 GLY 128 1HA GLY 128 -14.227 15.038 -6.963 993 H ASP 129 H ASP 129 -12.909 13.711 -4.051 994 HA ASP 129 HA ASP 129 -13.911 16.105 -2.582 995 HB2 ASP 129 2HB ASP 129 -13.414 13.255 -1.677 996 HB3 ASP 129 1HB ASP 129 -13.939 14.557 -0.610 997 H GLY 130 H GLY 130 -11.107 15.309 -3.838 998 HA2 GLY 130 2HA GLY 130 -9.026 16.375 -3.238 999 HA3 GLY 130 1HA GLY 130 -9.580 16.453 -1.564 1000 H ALA 131 H ALA 131 -10.286 13.459 -2.939 1001 HA ALA 131 HA ALA 131 -8.655 11.978 -1.164 1002 HB1 ALA 131 1HB ALA 131 -9.608 10.142 -2.130 1003 HB2 ALA 131 2HB ALA 131 -9.261 10.701 -3.767 1004 HB3 ALA 131 3HB ALA 131 -10.654 11.341 -2.892 1005 H TRP 132 H TRP 132 -7.963 13.320 -4.333 1006 HA TRP 132 HA TRP 132 -5.704 11.800 -5.058 1007 HB2 TRP 132 2HB TRP 132 -6.754 13.538 -6.493 1008 HB3 TRP 132 1HB TRP 132 -6.094 14.784 -5.433 1009 HD1 TRP 132 HD TRP 132 -3.932 15.769 -6.282 1010 HE1 TRP 132 1HE TRP 132 -1.949 14.950 -7.712 1011 HE3 TRP 132 3HE TRP 132 -5.390 10.951 -7.143 1012 HZ2 TRP 132 2HZ TRP 132 -1.097 12.567 -9.043 1013 HZ3 TRP 132 3HZ TRP 132 -3.974 9.429 -8.484 1014 HH2 TRP 132 HH TRP 132 -1.832 10.229 -9.432 1015 H ASN 133 H ASN 133 -5.934 14.569 -2.842 1016 HA ASN 133 HA ASN 133 -3.135 14.864 -2.358 1017 HB2 ASN 133 2HB ASN 133 -5.017 16.419 -1.594 1018 HB3 ASN 133 1HB ASN 133 -5.306 15.273 -0.285 1019 HD21 ASN 133 1HD2 ASN 133 -4.622 17.287 1.053 1020 HD22 ASN 133 2HD2 ASN 133 -2.962 17.489 1.344 1021 H ILE 134 H ILE 134 -5.584 12.758 -0.884 1022 HA ILE 134 HA ILE 134 -3.948 11.653 1.175 1023 HB ILE 134 HB ILE 134 -6.113 10.246 -0.400 1024 HG12 ILE 134 2HG1 ILE 134 -7.033 12.330 0.376 1025 HG13 ILE 134 1HG1 ILE 134 -7.597 11.079 1.483 1026 HG21 ILE 134 1HG2 ILE 134 -5.169 9.880 2.454 1027 HG22 ILE 134 2HG2 ILE 134 -4.719 8.833 1.108 1028 HG23 ILE 134 3HG2 ILE 134 -6.402 8.928 1.627 1029 HD11 ILE 134 1HD1 ILE 134 -6.867 12.776 2.931 1030 HD12 ILE 134 2HD1 ILE 134 -5.478 13.172 1.921 1031 HD13 ILE 134 3HD1 ILE 134 -5.482 11.687 2.871 1032 H HIS 135 H HIS 135 -4.481 10.667 -2.197 1033 HA HIS 135 HA HIS 135 -2.797 8.355 -2.131 1034 HB2 HIS 135 2HB HIS 135 -4.404 8.835 -3.963 1035 HB3 HIS 135 1HB HIS 135 -3.409 10.203 -4.462 1036 HD1 HIS 135 1HD HIS 135 -0.964 7.935 -3.443 1037 HD2 HIS 135 2HD HIS 135 -3.494 8.014 -6.757 1038 HE1 HIS 135 1HE HIS 135 0.107 6.459 -5.200 1039 HE2 HIS 135 2HE HIS 135 -1.426 6.496 -7.219 1040 H LYS 136 H LYS 136 -2.161 11.782 -2.692 1041 HA LYS 136 HA LYS 136 0.494 11.618 -3.637 1042 HB2 LYS 136 2HB LYS 136 -0.866 13.704 -3.521 1043 HB3 LYS 136 1HB LYS 136 -0.644 13.708 -1.778 1044 HG2 LYS 136 2HG LYS 136 1.798 13.797 -2.099 1045 HG3 LYS 136 1HG LYS 136 1.552 13.853 -3.840 1046 HD2 LYS 136 2HD LYS 136 0.183 15.929 -3.524 1047 HD3 LYS 136 1HD LYS 136 0.620 15.902 -1.815 1048 HE2 LYS 136 2HE LYS 136 2.935 16.224 -2.299 1049 HE3 LYS 136 1HE LYS 136 2.696 15.886 -4.013 1050 HZ1 LYS 136 1HZ LYS 136 2.855 18.326 -3.161 1051 HZ2 LYS 136 2HZ LYS 136 1.215 18.099 -2.781 1052 HZ3 LYS 136 3HZ LYS 136 1.752 17.919 -4.382 1053 H ALA 137 H ALA 137 -0.718 11.668 -0.289 1054 HA ALA 137 HA ALA 137 1.903 11.605 0.913 1055 HB1 ALA 137 1HB ALA 137 0.501 12.156 2.607 1056 HB2 ALA 137 2HB ALA 137 0.223 10.420 2.758 1057 HB3 ALA 137 3HB ALA 137 -0.884 11.411 1.810 1058 H LEU 138 H LEU 138 -0.437 9.095 0.023 1059 HA LEU 138 HA LEU 138 1.019 6.887 1.115 1060 HB2 LEU 138 2HB LEU 138 -0.894 6.962 -1.234 1061 HB3 LEU 138 1HB LEU 138 -0.389 5.516 -0.376 1062 HG LEU 138 HG LEU 138 -1.877 7.854 0.846 1063 HD11 LEU 138 1HD1 LEU 138 -3.659 6.041 1.113 1064 HD12 LEU 138 2HD1 LEU 138 -2.718 5.082 -0.028 1065 HD13 LEU 138 3HD1 LEU 138 -3.403 6.628 -0.530 1066 HD21 LEU 138 1HD2 LEU 138 -0.750 7.000 2.659 1067 HD22 LEU 138 2HD2 LEU 138 -0.543 5.418 1.911 1068 HD23 LEU 138 3HD2 LEU 138 -2.093 5.858 2.626 1069 H ASP 139 H ASP 139 1.294 8.724 -1.846 1070 HA ASP 139 HA ASP 139 2.944 6.778 -3.230 1071 HB2 ASP 139 2HB ASP 139 1.630 8.555 -4.395 1072 HB3 ASP 139 1HB ASP 139 2.713 9.764 -3.705 1073 H GLY 140 H GLY 140 4.826 6.231 -2.238 1074 HA2 GLY 140 2HA GLY 140 6.479 8.333 -0.967 1075 HA3 GLY 140 1HA GLY 140 6.739 6.596 -0.818 1076 HA PRO 141 HA PRO 141 9.999 8.241 -3.710 1077 HB2 PRO 141 2HB PRO 141 11.220 5.699 -2.751 1078 HB3 PRO 141 1HB PRO 141 11.938 7.316 -2.888 1079 HG2 PRO 141 2HG PRO 141 11.250 6.271 -0.527 1080 HG3 PRO 141 1HG PRO 141 11.108 8.004 -0.870 1081 HD2 PRO 141 2HD PRO 141 8.957 5.945 -0.670 1082 HD3 PRO 141 1HD PRO 141 8.899 7.681 -0.291 1083 H SER 142 H SER 142 10.518 7.464 -5.805 1084 HA SER 142 HA SER 142 10.209 6.200 -7.757 1085 HB2 SER 142 2HB SER 142 9.629 3.780 -6.079 1086 HB3 SER 142 1HB SER 142 10.546 3.900 -7.578 1087 HG SER 142 HG SER 142 11.312 4.370 -4.947 1088 HA PRO 143 HA PRO 143 5.600 6.639 -6.810 1089 HB2 PRO 143 2HB PRO 143 5.827 8.147 -9.361 1090 HB3 PRO 143 1HB PRO 143 4.976 8.577 -7.866 1091 HG2 PRO 143 2HG PRO 143 7.269 9.752 -8.588 1092 HG3 PRO 143 1HG PRO 143 6.847 9.456 -6.893 1093 HD2 PRO 143 2HD PRO 143 8.826 8.032 -8.615 1094 HD3 PRO 143 1HD PRO 143 8.847 8.312 -6.860 1095 H GLY 144 H GLY 144 4.001 5.377 -7.779 1096 HA2 GLY 144 2HA GLY 144 3.693 4.575 -10.407 1097 HA3 GLY 144 1HA GLY 144 4.863 3.425 -9.759 1098 H GLU 145 H GLU 145 2.909 1.960 -10.325 1099 HA GLU 145 HA GLU 145 0.481 1.980 -8.920 1100 HB2 GLU 145 2HB GLU 145 2.172 -0.422 -9.676 1101 HB3 GLU 145 1HB GLU 145 0.465 -0.478 -9.235 1102 HG2 GLU 145 2HG GLU 145 0.371 -0.390 -11.570 1103 HG3 GLU 145 1HG GLU 145 0.170 1.302 -11.120 1104 H THR 146 H THR 146 -0.169 0.748 -7.002 1105 HA THR 146 HA THR 146 1.429 1.272 -4.717 1106 HB THR 146 HB THR 146 -0.768 -0.764 -5.102 1107 HG1 THR 146 1HG THR 146 -0.716 1.905 -4.910 1108 HG21 THR 146 1HG2 THR 146 -0.927 -0.284 -2.520 1109 HG22 THR 146 2HG2 THR 146 0.776 0.139 -2.705 1110 HG23 THR 146 3HG2 THR 146 0.217 -1.480 -3.131 1111 H LEU 147 H LEU 147 1.213 -1.547 -6.804 1112 HA LEU 147 HA LEU 147 2.649 -3.378 -5.178 1113 HB2 LEU 147 2HB LEU 147 2.648 -3.188 -8.200 1114 HB3 LEU 147 1HB LEU 147 2.997 -4.623 -7.229 1115 HG LEU 147 HG LEU 147 0.360 -3.132 -7.317 1116 HD11 LEU 147 1HD1 LEU 147 -0.490 -4.993 -8.512 1117 HD12 LEU 147 2HD1 LEU 147 0.923 -5.981 -8.141 1118 HD13 LEU 147 3HD1 LEU 147 1.057 -4.641 -9.279 1119 HD21 LEU 147 1HD2 LEU 147 -0.277 -5.327 -6.002 1120 HD22 LEU 147 2HD2 LEU 147 0.440 -3.968 -5.137 1121 HD23 LEU 147 3HD2 LEU 147 1.440 -5.348 -5.595 1122 H ALA 148 H ALA 148 3.733 -0.750 -7.251 1123 HA ALA 148 HA ALA 148 6.461 -1.511 -7.521 1124 HB1 ALA 148 1HB ALA 148 6.720 0.524 -8.512 1125 HB2 ALA 148 2HB ALA 148 5.935 1.377 -7.183 1126 HB3 ALA 148 3HB ALA 148 4.960 0.579 -8.416 1127 H ARG 149 H ARG 149 5.075 0.808 -5.158 1128 HA ARG 149 HA ARG 149 7.502 0.964 -3.628 1129 HB2 ARG 149 2HB ARG 149 6.155 2.119 -1.960 1130 HB3 ARG 149 1HB ARG 149 5.699 2.687 -3.564 1131 HG2 ARG 149 2HG ARG 149 3.821 1.021 -3.541 1132 HG3 ARG 149 1HG ARG 149 4.221 0.664 -1.861 1133 HD2 ARG 149 2HD ARG 149 3.908 3.091 -1.329 1134 HD3 ARG 149 1HD ARG 149 3.371 3.348 -2.989 1135 HE ARG 149 HE ARG 149 1.879 1.253 -1.601 1136 HH11 ARG 149 1HH1 ARG 149 -0.296 1.723 -1.208 1137 HH12 ARG 149 2HH1 ARG 149 -0.859 3.354 -1.369 1138 HH21 ARG 149 1HH2 ARG 149 2.243 4.616 -2.267 1139 HH22 ARG 149 2HH2 ARG 149 0.578 4.991 -1.970 1140 H PHE 150 H PHE 150 4.572 -1.009 -3.323 1141 HA PHE 150 HA PHE 150 5.219 -2.222 -0.817 1142 HB2 PHE 150 2HB PHE 150 2.980 -2.370 -1.806 1143 HB3 PHE 150 1HB PHE 150 3.622 -3.299 -3.154 1144 HD1 PHE 150 1HD PHE 150 3.785 -5.633 -3.035 1145 HD2 PHE 150 2HD PHE 150 3.304 -3.353 0.575 1146 HE1 PHE 150 1HE PHE 150 3.501 -7.732 -1.749 1147 HE2 PHE 150 2HE PHE 150 3.022 -5.457 1.861 1148 HZ PHE 150 HZ PHE 150 3.121 -7.645 0.698 1149 H ALA 151 H ALA 151 6.000 -3.166 -4.165 1150 HA ALA 151 HA ALA 151 7.254 -5.651 -3.455 1151 HB1 ALA 151 1HB ALA 151 8.035 -5.718 -5.697 1152 HB2 ALA 151 2HB ALA 151 8.005 -3.960 -5.841 1153 HB3 ALA 151 3HB ALA 151 6.494 -4.866 -5.781 1154 H ASN 152 H ASN 152 8.551 -2.366 -3.914 1155 HA ASN 152 HA ASN 152 11.299 -3.072 -3.625 1156 HB2 ASN 152 2HB ASN 152 9.875 -0.494 -2.964 1157 HB3 ASN 152 1HB ASN 152 11.626 -0.671 -3.043 1158 HD21 ASN 152 1HD2 ASN 152 10.244 1.104 -4.816 1159 HD22 ASN 152 2HD2 ASN 152 10.363 0.487 -6.392 1160 H VAL 153 H VAL 153 8.998 -1.847 -1.177 1161 HA VAL 153 HA VAL 153 10.886 -2.125 0.984 1162 HB VAL 153 HB VAL 153 9.002 -1.669 2.435 1163 HG11 VAL 153 1HG1 VAL 153 8.226 0.420 1.462 1164 HG12 VAL 153 2HG1 VAL 153 8.657 -0.137 -0.155 1165 HG13 VAL 153 3HG1 VAL 153 9.921 0.185 1.033 1166 HG21 VAL 153 1HG2 VAL 153 7.265 -3.064 1.670 1167 HG22 VAL 153 2HG2 VAL 153 7.415 -2.486 0.011 1168 HG23 VAL 153 3HG2 VAL 153 6.703 -1.448 1.245 1169 H ILE 154 H ILE 154 8.672 -4.309 -0.594 1170 HA ILE 154 HA ILE 154 8.741 -6.278 1.568 1171 HB ILE 154 HB ILE 154 7.640 -6.264 -1.234 1172 HG12 ILE 154 2HG1 ILE 154 6.628 -5.136 0.979 1173 HG13 ILE 154 1HG1 ILE 154 5.601 -5.880 -0.241 1174 HG21 ILE 154 1HG2 ILE 154 6.575 -8.473 -0.471 1175 HG22 ILE 154 2HG2 ILE 154 7.844 -8.512 0.755 1176 HG23 ILE 154 3HG2 ILE 154 8.268 -8.515 -0.957 1177 HD11 ILE 154 1HD1 ILE 154 6.699 -7.446 2.098 1178 HD12 ILE 154 2HD1 ILE 154 5.368 -7.884 1.025 1179 HD13 ILE 154 3HD1 ILE 154 5.169 -6.574 2.189 Start of MODEL 7 1 H1 MET 1 1HT MET 1 -0.120 4.261 -5.223 2 H2 MET 1 2HT MET 1 1.466 3.953 -4.698 3 H3 MET 1 3HT MET 1 1.155 4.265 -6.340 4 HA MET 1 HA MET 1 0.145 6.411 -4.853 5 HB2 MET 1 2HB MET 1 3.068 5.807 -4.316 6 HB3 MET 1 1HB MET 1 2.149 7.196 -3.735 7 HG2 MET 1 2HG MET 1 1.764 5.950 -1.882 8 HG3 MET 1 1HG MET 1 0.615 5.063 -2.882 9 HE1 MET 1 1HE MET 1 3.956 5.310 -1.213 10 HE2 MET 1 2HE MET 1 4.316 3.614 -0.898 11 HE3 MET 1 3HE MET 1 2.828 4.321 -0.276 12 HA PRO 2 HA PRO 2 2.268 6.638 -9.109 13 HB2 PRO 2 2HB PRO 2 -0.068 7.343 -10.436 14 HB3 PRO 2 1HB PRO 2 0.592 5.701 -10.348 15 HG2 PRO 2 2HG PRO 2 -1.608 6.943 -8.792 16 HG3 PRO 2 1HG PRO 2 -1.433 5.280 -9.379 17 HD2 PRO 2 2HD PRO 2 -1.011 5.961 -6.775 18 HD3 PRO 2 1HD PRO 2 -0.140 4.630 -7.570 19 H GLU 3 H GLU 3 3.020 8.614 -9.847 20 HA GLU 3 HA GLU 3 2.450 11.002 -8.388 21 HB2 GLU 3 2HB GLU 3 3.700 10.647 -11.121 22 HB3 GLU 3 1HB GLU 3 3.739 12.140 -10.185 23 HG2 GLU 3 2HG GLU 3 4.889 10.922 -8.344 24 HG3 GLU 3 1HG GLU 3 4.915 9.471 -9.348 25 H GLU 4 H GLU 4 1.126 9.660 -11.352 26 HA GLU 4 HA GLU 4 -0.676 12.020 -11.603 27 HB2 GLU 4 2HB GLU 4 -0.091 9.857 -13.642 28 HB3 GLU 4 1HB GLU 4 -1.015 11.336 -13.910 29 HG2 GLU 4 2HG GLU 4 1.029 12.655 -13.313 30 HG3 GLU 4 1HG GLU 4 1.931 11.144 -13.226 31 H ILE 5 H ILE 5 -2.927 11.336 -12.499 32 HA ILE 5 HA ILE 5 -3.845 8.934 -10.964 33 HB ILE 5 HB ILE 5 -4.747 11.142 -10.227 34 HG12 ILE 5 2HG1 ILE 5 -7.133 9.898 -11.464 35 HG13 ILE 5 1HG1 ILE 5 -6.111 8.795 -10.542 36 HG21 ILE 5 1HG2 ILE 5 -6.529 11.441 -12.528 37 HG22 ILE 5 2HG2 ILE 5 -4.831 11.671 -12.946 38 HG23 ILE 5 3HG2 ILE 5 -5.570 12.657 -11.684 39 HD11 ILE 5 1HD1 ILE 5 -8.022 10.177 -9.333 40 HD12 ILE 5 2HD1 ILE 5 -6.807 11.455 -9.336 41 HD13 ILE 5 3HD1 ILE 5 -6.471 9.918 -8.538 42 HA PRO 6 HA PRO 6 -4.699 7.935 -15.420 43 HB2 PRO 6 2HB PRO 6 -3.474 5.559 -15.555 44 HB3 PRO 6 1HB PRO 6 -2.531 7.066 -15.583 45 HG2 PRO 6 2HG PRO 6 -3.018 5.184 -13.318 46 HG3 PRO 6 1HG PRO 6 -1.522 6.002 -13.801 47 HD2 PRO 6 2HD PRO 6 -3.192 6.895 -11.771 48 HD3 PRO 6 1HD PRO 6 -2.059 7.920 -12.675 49 H ASP 7 H ASP 7 -6.110 6.231 -16.306 50 HA ASP 7 HA ASP 7 -8.124 5.312 -14.462 51 HB2 ASP 7 2HB ASP 7 -7.546 4.550 -17.341 52 HB3 ASP 7 1HB ASP 7 -8.994 4.080 -16.455 53 H VAL 8 H VAL 8 -8.003 2.639 -16.204 54 HA VAL 8 HA VAL 8 -7.271 0.865 -14.182 55 HB VAL 8 HB VAL 8 -8.299 -0.141 -16.034 56 HG11 VAL 8 1HG1 VAL 8 -6.232 1.334 -17.683 57 HG12 VAL 8 2HG1 VAL 8 -7.980 1.564 -17.690 58 HG13 VAL 8 3HG1 VAL 8 -7.281 0.089 -18.359 59 HG21 VAL 8 1HG2 VAL 8 -6.063 -1.247 -15.156 60 HG22 VAL 8 2HG2 VAL 8 -5.476 -0.851 -16.771 61 HG23 VAL 8 3HG2 VAL 8 -6.876 -1.906 -16.576 62 H ARG 9 H ARG 9 -5.331 -0.010 -13.447 63 HA ARG 9 HA ARG 9 -2.882 1.350 -14.430 64 HB2 ARG 9 2HB ARG 9 -3.396 -0.236 -11.906 65 HB3 ARG 9 1HB ARG 9 -1.852 0.504 -12.325 66 HG2 ARG 9 2HG ARG 9 -3.132 2.706 -12.546 67 HG3 ARG 9 1HG ARG 9 -4.480 1.884 -11.759 68 HD2 ARG 9 2HD ARG 9 -3.187 3.020 -10.050 69 HD3 ARG 9 1HD ARG 9 -2.926 1.284 -9.875 70 HE ARG 9 HE ARG 9 -0.666 1.634 -10.444 71 HH11 ARG 9 1HH1 ARG 9 1.071 2.893 -11.170 72 HH12 ARG 9 2HH1 ARG 9 0.767 4.470 -11.818 73 HH21 ARG 9 1HH2 ARG 9 -2.668 4.273 -11.394 74 HH22 ARG 9 2HH2 ARG 9 -1.349 5.251 -11.947 75 H LYS 10 H LYS 10 -1.131 -0.753 -13.323 76 HA LYS 10 HA LYS 10 -1.604 -2.902 -15.345 77 HB2 LYS 10 2HB LYS 10 0.731 -2.869 -15.952 78 HB3 LYS 10 1HB LYS 10 0.114 -1.223 -16.083 79 HG2 LYS 10 2HG LYS 10 0.984 -0.770 -13.775 80 HG3 LYS 10 1HG LYS 10 1.721 -2.374 -13.784 81 HD2 LYS 10 2HD LYS 10 2.892 -1.685 -15.941 82 HD3 LYS 10 1HD LYS 10 2.354 -0.040 -15.599 83 HE2 LYS 10 2HE LYS 10 3.909 -1.702 -13.606 84 HE3 LYS 10 1HE LYS 10 4.684 -0.613 -14.756 85 HZ1 LYS 10 1HZ LYS 10 3.399 0.006 -12.316 86 HZ2 LYS 10 2HZ LYS 10 2.623 0.816 -13.593 87 HZ3 LYS 10 3HZ LYS 10 4.291 1.023 -13.340 88 H SER 11 H SER 11 0.442 -4.577 -14.854 89 HA SER 11 HA SER 11 0.135 -5.283 -11.958 90 HB2 SER 11 2HB SER 11 0.124 -7.598 -12.578 91 HB3 SER 11 1HB SER 11 -1.008 -6.794 -13.657 92 HG SER 11 HG SER 11 0.473 -6.870 -15.274 93 H VAL 12 H VAL 12 1.982 -6.327 -10.974 94 HA VAL 12 HA VAL 12 4.518 -6.210 -12.511 95 HB VAL 12 HB VAL 12 3.788 -4.234 -10.639 96 HG11 VAL 12 1HG1 VAL 12 5.995 -6.001 -9.531 97 HG12 VAL 12 2HG1 VAL 12 4.374 -5.874 -8.840 98 HG13 VAL 12 3HG1 VAL 12 5.437 -4.471 -8.860 99 HG21 VAL 12 1HG2 VAL 12 5.293 -3.842 -12.475 100 HG22 VAL 12 2HG2 VAL 12 6.424 -5.057 -11.880 101 HG23 VAL 12 3HG2 VAL 12 6.204 -3.549 -10.992 102 H VAL 13 H VAL 13 6.233 -7.505 -11.480 103 HA VAL 13 HA VAL 13 5.051 -9.725 -9.885 104 HB VAL 13 HB VAL 13 7.718 -9.613 -11.326 105 HG11 VAL 13 1HG1 VAL 13 7.183 -12.209 -11.145 106 HG12 VAL 13 2HG1 VAL 13 6.222 -11.685 -9.763 107 HG13 VAL 13 3HG1 VAL 13 7.953 -11.352 -9.811 108 HG21 VAL 13 1HG2 VAL 13 6.627 -10.078 -13.244 109 HG22 VAL 13 2HG2 VAL 13 5.107 -9.765 -12.406 110 HG23 VAL 13 3HG2 VAL 13 5.757 -11.403 -12.469 111 H VAL 14 H VAL 14 5.726 -10.077 -7.798 112 HA VAL 14 HA VAL 14 8.035 -8.448 -6.805 113 HB VAL 14 HB VAL 14 6.836 -7.996 -4.770 114 HG11 VAL 14 1HG1 VAL 14 6.244 -6.699 -6.910 115 HG12 VAL 14 2HG1 VAL 14 5.090 -6.598 -5.580 116 HG13 VAL 14 3HG1 VAL 14 4.768 -7.663 -6.947 117 HG21 VAL 14 1HG2 VAL 14 4.844 -9.979 -5.890 118 HG22 VAL 14 2HG2 VAL 14 4.429 -8.869 -4.584 119 HG23 VAL 14 3HG2 VAL 14 5.710 -10.060 -4.356 120 H ALA 15 H ALA 15 9.169 -9.424 -4.973 121 HA ALA 15 HA ALA 15 9.105 -12.375 -5.126 122 HB1 ALA 15 1HB ALA 15 11.135 -10.431 -4.727 123 HB2 ALA 15 2HB ALA 15 11.319 -12.184 -4.795 124 HB3 ALA 15 3HB ALA 15 11.040 -11.385 -3.246 125 H ALA 16 H ALA 16 7.275 -12.949 -3.917 126 HA ALA 16 HA ALA 16 7.605 -13.037 -1.050 127 HB1 ALA 16 1HB ALA 16 6.634 -11.062 -0.522 128 HB2 ALA 16 2HB ALA 16 5.123 -11.752 -1.111 129 HB3 ALA 16 3HB ALA 16 6.132 -10.789 -2.190 130 H SER 17 H SER 17 6.271 -14.663 -0.203 131 HA SER 17 HA SER 17 5.018 -16.456 -2.057 132 HB2 SER 17 2HB SER 17 4.620 -16.263 0.944 133 HB3 SER 17 1HB SER 17 4.224 -17.650 -0.066 134 HG SER 17 HG SER 17 6.774 -16.525 0.466 135 H VAL 18 H VAL 18 2.765 -16.857 -2.403 136 HA VAL 18 HA VAL 18 1.103 -14.555 -2.540 137 HB VAL 18 HB VAL 18 -0.148 -17.267 -2.364 138 HG11 VAL 18 1HG1 VAL 18 -0.990 -14.810 -3.256 139 HG12 VAL 18 2HG1 VAL 18 -1.689 -16.347 -3.757 140 HG13 VAL 18 3HG1 VAL 18 -0.461 -15.572 -4.754 141 HG21 VAL 18 1HG2 VAL 18 2.054 -16.483 -4.228 142 HG22 VAL 18 2HG2 VAL 18 0.702 -17.403 -4.888 143 HG23 VAL 18 3HG2 VAL 18 1.656 -18.069 -3.563 144 H GLU 19 H GLU 19 1.263 -17.205 -0.179 145 HA GLU 19 HA GLU 19 -0.975 -16.440 1.400 146 HB2 GLU 19 2HB GLU 19 1.625 -17.760 2.235 147 HB3 GLU 19 1HB GLU 19 0.179 -17.668 3.241 148 HG2 GLU 19 2HG GLU 19 -1.097 -18.875 1.483 149 HG3 GLU 19 1HG GLU 19 0.383 -19.021 0.535 150 H HIS 20 H HIS 20 2.394 -15.365 1.415 151 HA HIS 20 HA HIS 20 2.292 -13.772 3.765 152 HB2 HIS 20 2HB HIS 20 4.346 -14.445 2.427 153 HB3 HIS 20 1HB HIS 20 3.909 -13.186 1.273 154 HD1 HIS 20 1HD HIS 20 4.190 -13.360 5.078 155 HD2 HIS 20 2HD HIS 20 5.241 -10.862 1.907 156 HE1 HIS 20 1HE HIS 20 5.384 -11.378 6.094 157 HE2 HIS 20 2HE HIS 20 6.031 -9.852 4.175 158 H CYS 21 H CYS 21 1.480 -13.047 0.381 159 HA CYS 21 HA CYS 21 1.133 -10.273 0.541 160 HB2 CYS 21 2HB CYS 21 -0.433 -12.347 -1.018 161 HB3 CYS 21 1HB CYS 21 -0.595 -10.613 -1.270 162 HG CYS 21 HG CYS 21 2.162 -12.043 -1.646 163 H PHE 22 H PHE 22 -1.475 -12.709 0.972 164 HA PHE 22 HA PHE 22 -3.349 -10.736 1.923 165 HB2 PHE 22 2HB PHE 22 -3.522 -13.671 2.572 166 HB3 PHE 22 1HB PHE 22 -4.833 -12.535 2.246 167 HD1 PHE 22 1HD PHE 22 -5.088 -11.586 -0.109 168 HD2 PHE 22 2HD PHE 22 -2.463 -14.847 0.828 169 HE1 PHE 22 1HE PHE 22 -4.976 -12.189 -2.512 170 HE2 PHE 22 2HE PHE 22 -2.352 -15.456 -1.566 171 HZ PHE 22 HZ PHE 22 -3.605 -14.124 -3.239 172 H GLU 23 H GLU 23 -1.112 -12.943 3.548 173 HA GLU 23 HA GLU 23 -2.109 -12.427 6.204 174 HB2 GLU 23 2HB GLU 23 0.557 -13.449 5.205 175 HB3 GLU 23 1HB GLU 23 0.141 -13.339 6.914 176 HG2 GLU 23 2HG GLU 23 -1.815 -14.797 6.529 177 HG3 GLU 23 1HG GLU 23 -1.384 -14.926 4.826 178 H VAL 24 H VAL 24 0.349 -10.870 4.183 179 HA VAL 24 HA VAL 24 1.563 -9.272 6.173 180 HB VAL 24 HB VAL 24 1.065 -8.751 3.235 181 HG11 VAL 24 1HG1 VAL 24 2.156 -7.043 5.363 182 HG12 VAL 24 2HG1 VAL 24 1.592 -6.610 3.750 183 HG13 VAL 24 3HG1 VAL 24 3.227 -7.228 3.978 184 HG21 VAL 24 1HG2 VAL 24 2.753 -10.537 4.530 185 HG22 VAL 24 2HG2 VAL 24 3.796 -9.149 4.220 186 HG23 VAL 24 3HG2 VAL 24 2.960 -9.940 2.884 187 H PHE 25 H PHE 25 -1.306 -8.598 4.147 188 HA PHE 25 HA PHE 25 -1.752 -5.966 5.200 189 HB2 PHE 25 2HB PHE 25 -4.030 -7.723 4.350 190 HB3 PHE 25 1HB PHE 25 -3.780 -6.005 4.050 191 HD1 PHE 25 1HD PHE 25 -0.987 -5.990 3.042 192 HD2 PHE 25 2HD PHE 25 -4.246 -8.661 2.226 193 HE1 PHE 25 1HE PHE 25 0.016 -6.533 0.838 194 HE2 PHE 25 2HE PHE 25 -3.248 -9.206 0.016 195 HZ PHE 25 HZ PHE 25 -1.116 -8.141 -0.676 196 H THR 26 H THR 26 -2.943 -9.165 6.189 197 HA THR 26 HA THR 26 -4.397 -7.902 8.440 198 HB THR 26 HB THR 26 -5.474 -10.054 8.702 199 HG1 THR 26 1HG THR 26 -4.351 -11.314 6.599 200 HG21 THR 26 1HG2 THR 26 -5.160 -9.188 5.820 201 HG22 THR 26 2HG2 THR 26 -6.424 -8.703 6.952 202 HG23 THR 26 3HG2 THR 26 -6.363 -10.362 6.357 203 H SER 27 H SER 27 -1.298 -9.136 7.968 204 HA SER 27 HA SER 27 -1.168 -10.303 10.701 205 HB2 SER 27 2HB SER 27 1.117 -10.991 10.081 206 HB3 SER 27 1HB SER 27 -0.057 -11.555 8.897 207 HG SER 27 HG SER 27 1.742 -9.375 8.738 208 H ARG 28 H ARG 28 0.980 -8.075 8.862 209 HA ARG 28 HA ARG 28 0.860 -6.128 11.041 210 HB2 ARG 28 2HB ARG 28 2.484 -7.914 11.815 211 HB3 ARG 28 1HB ARG 28 3.513 -7.461 10.455 212 HG2 ARG 28 2HG ARG 28 2.720 -5.068 11.802 213 HG3 ARG 28 1HG ARG 28 3.319 -6.203 13.002 214 HD2 ARG 28 2HD ARG 28 5.323 -6.572 11.516 215 HD3 ARG 28 1HD ARG 28 4.744 -5.231 10.530 216 HE ARG 28 HE ARG 28 4.827 -4.215 13.122 217 HH11 ARG 28 1HH1 ARG 28 6.651 -3.144 13.920 218 HH12 ARG 28 2HH1 ARG 28 8.202 -3.464 13.220 219 HH21 ARG 28 1HH2 ARG 28 6.986 -5.755 10.919 220 HH22 ARG 28 2HH2 ARG 28 8.393 -4.941 11.521 221 HA PRO 29 HA PRO 29 1.672 -4.461 6.753 222 HB2 PRO 29 2HB PRO 29 -0.044 -2.311 7.845 223 HB3 PRO 29 1HB PRO 29 -0.175 -3.184 6.308 224 HG2 PRO 29 2HG PRO 29 -1.874 -3.599 8.340 225 HG3 PRO 29 1HG PRO 29 -1.393 -4.884 7.221 226 HD2 PRO 29 2HD PRO 29 -0.517 -4.421 10.041 227 HD3 PRO 29 1HD PRO 29 -0.736 -5.951 9.161 228 H ALA 30 H ALA 30 2.026 -3.265 9.996 229 HA ALA 30 HA ALA 30 3.267 -0.751 9.440 230 HB1 ALA 30 1HB ALA 30 3.232 -2.628 11.777 231 HB2 ALA 30 2HB ALA 30 2.655 -0.965 11.671 232 HB3 ALA 30 3HB ALA 30 4.385 -1.294 11.771 233 H ASP 31 H ASP 31 4.400 -3.954 8.963 234 HA ASP 31 HA ASP 31 7.173 -3.705 9.433 235 HB2 ASP 31 2HB ASP 31 5.997 -5.805 8.710 236 HB3 ASP 31 1HB ASP 31 5.895 -5.135 7.083 237 H TRP 32 H TRP 32 5.173 -2.421 6.848 238 HA TRP 32 HA TRP 32 7.569 -0.952 5.830 239 HB2 TRP 32 2HB TRP 32 6.277 -1.066 3.557 240 HB3 TRP 32 1HB TRP 32 7.211 -2.469 4.074 241 HD1 TRP 32 HD TRP 32 5.902 -4.601 4.873 242 HE1 TRP 32 1HE TRP 32 3.455 -5.353 4.621 243 HE3 TRP 32 3HE TRP 32 3.796 -0.204 3.413 244 HZ2 TRP 32 2HZ TRP 32 0.936 -4.231 3.890 245 HZ3 TRP 32 3HZ TRP 32 1.372 -0.067 2.940 246 HH2 TRP 32 HH TRP 32 -0.066 -2.070 3.173 247 H TRP 33 H TRP 33 5.540 -0.161 7.773 248 HA TRP 33 HA TRP 33 3.439 1.387 6.774 249 HB2 TRP 33 2HB TRP 33 3.220 1.817 8.965 250 HB3 TRP 33 1HB TRP 33 4.812 1.123 9.256 251 HD1 TRP 33 HD TRP 33 3.409 4.511 7.956 252 HE1 TRP 33 1HE TRP 33 4.865 6.396 8.941 253 HE3 TRP 33 3HE TRP 33 6.793 1.734 10.594 254 HZ2 TRP 33 2HZ TRP 33 7.157 6.690 10.627 255 HZ3 TRP 33 3HZ TRP 33 8.595 2.843 11.884 256 HH2 TRP 33 HH TRP 33 8.780 5.316 11.905 257 HA PRO 34 HA PRO 34 6.365 4.997 5.920 258 HB2 PRO 34 2HB PRO 34 8.987 4.834 6.530 259 HB3 PRO 34 1HB PRO 34 7.750 5.126 7.767 260 HG2 PRO 34 2HG PRO 34 9.342 2.713 7.245 261 HG3 PRO 34 1HG PRO 34 8.526 3.232 8.726 262 HD2 PRO 34 2HD PRO 34 7.596 1.329 6.754 263 HD3 PRO 34 1HD PRO 34 6.803 1.804 8.270 264 HA PRO 35 HA PRO 35 7.971 3.001 2.100 265 HB2 PRO 35 2HB PRO 35 6.747 4.626 0.318 266 HB3 PRO 35 1HB PRO 35 5.876 3.321 1.148 267 HG2 PRO 35 2HG PRO 35 5.840 6.243 1.657 268 HG3 PRO 35 1HG PRO 35 4.535 5.054 1.791 269 HD2 PRO 35 2HD PRO 35 6.023 6.062 3.937 270 HD3 PRO 35 1HD PRO 35 5.043 4.583 3.969 271 H SER 36 H SER 36 8.202 6.232 3.292 272 HA SER 36 HA SER 36 10.855 6.711 2.633 273 HB2 SER 36 2HB SER 36 10.777 6.799 0.352 274 HB3 SER 36 1HB SER 36 9.036 7.069 0.327 275 HG SER 36 HG SER 36 10.546 9.122 1.391 276 H HIS 37 H HIS 37 8.272 8.936 1.634 277 HA HIS 37 HA HIS 37 8.809 10.533 4.110 278 HB2 HIS 37 2HB HIS 37 8.220 11.553 1.314 279 HB3 HIS 37 1HB HIS 37 8.414 12.563 2.748 280 HD1 HIS 37 1HD HIS 37 10.842 12.177 4.024 281 HD2 HIS 37 2HD HIS 37 10.610 11.084 0.004 282 HE1 HIS 37 1HE HIS 37 13.228 12.023 3.183 283 HE2 HIS 37 2HE HIS 37 13.097 11.359 0.738 284 H VAL 38 H VAL 38 6.988 11.293 5.183 285 HA VAL 38 HA VAL 38 4.340 10.786 3.889 286 HB VAL 38 HB VAL 38 3.473 9.992 6.039 287 HG11 VAL 38 1HG1 VAL 38 4.702 7.872 6.168 288 HG12 VAL 38 2HG1 VAL 38 6.057 8.588 5.295 289 HG13 VAL 38 3HG1 VAL 38 4.509 8.357 4.483 290 HG21 VAL 38 1HG2 VAL 38 6.257 10.711 6.944 291 HG22 VAL 38 2HG2 VAL 38 5.323 9.490 7.808 292 HG23 VAL 38 3HG2 VAL 38 4.712 11.139 7.680 293 H LEU 39 H LEU 39 2.809 12.396 4.239 294 HA LEU 39 HA LEU 39 3.822 14.857 5.543 295 HB2 LEU 39 2HB LEU 39 1.289 14.434 3.929 296 HB3 LEU 39 1HB LEU 39 1.964 15.984 4.429 297 HG LEU 39 HG LEU 39 3.241 13.985 2.539 298 HD11 LEU 39 1HD1 LEU 39 2.593 15.364 0.827 299 HD12 LEU 39 2HD1 LEU 39 2.744 16.822 1.808 300 HD13 LEU 39 3HD1 LEU 39 1.316 15.799 1.962 301 HD21 LEU 39 1HD2 LEU 39 5.096 14.903 3.620 302 HD22 LEU 39 2HD2 LEU 39 4.278 16.433 3.939 303 HD23 LEU 39 3HD2 LEU 39 4.853 16.064 2.313 304 H VAL 40 H VAL 40 2.226 12.194 6.587 305 HA VAL 40 HA VAL 40 -0.056 13.219 7.970 306 HB VAL 40 HB VAL 40 1.730 11.049 9.055 307 HG11 VAL 40 1HG1 VAL 40 -0.224 11.826 10.390 308 HG12 VAL 40 2HG1 VAL 40 -0.373 10.142 9.886 309 HG13 VAL 40 3HG1 VAL 40 -1.278 11.399 9.042 310 HG21 VAL 40 1HG2 VAL 40 -0.368 10.770 6.877 311 HG22 VAL 40 2HG2 VAL 40 0.568 9.458 7.593 312 HG23 VAL 40 3HG2 VAL 40 1.371 10.679 6.608 313 H LYS 41 H LYS 41 -0.209 14.374 9.893 314 HA LYS 41 HA LYS 41 2.043 15.779 10.895 315 HB2 LYS 41 2HB LYS 41 -0.551 15.077 12.287 316 HB3 LYS 41 1HB LYS 41 0.605 16.270 12.871 317 HG2 LYS 41 2HG LYS 41 0.347 17.510 10.716 318 HG3 LYS 41 1HG LYS 41 -0.903 16.360 10.242 319 HD2 LYS 41 2HD LYS 41 -2.184 16.974 12.302 320 HD3 LYS 41 1HD LYS 41 -0.973 18.211 12.642 321 HE2 LYS 41 2HE LYS 41 -2.758 19.322 11.494 322 HE3 LYS 41 1HE LYS 41 -1.453 19.145 10.323 323 HZ1 LYS 41 1HZ LYS 41 -3.311 16.928 10.452 324 HZ2 LYS 41 2HZ LYS 41 -2.626 17.697 9.101 325 HZ3 LYS 41 3HZ LYS 41 -3.972 18.381 9.879 326 H LYS 42 H LYS 42 0.496 12.770 11.977 327 HA LYS 42 HA LYS 42 2.896 12.253 13.684 328 HB2 LYS 42 2HB LYS 42 0.139 11.064 14.025 329 HB3 LYS 42 1HB LYS 42 1.492 10.934 15.143 330 HG2 LYS 42 2HG LYS 42 0.268 13.591 14.377 331 HG3 LYS 42 1HG LYS 42 -0.304 12.648 15.750 332 HD2 LYS 42 2HD LYS 42 1.408 13.350 17.028 333 HD3 LYS 42 1HD LYS 42 2.584 12.840 15.822 334 HE2 LYS 42 2HE LYS 42 2.864 15.206 16.088 335 HE3 LYS 42 1HE LYS 42 2.034 14.976 14.551 336 HZ1 LYS 42 1HZ LYS 42 0.002 15.609 15.470 337 HZ2 LYS 42 2HZ LYS 42 1.109 16.718 16.127 338 HZ3 LYS 42 3HZ LYS 42 0.545 15.419 17.065 339 H GLU 43 H GLU 43 3.983 10.335 13.292 340 HA GLU 43 HA GLU 43 3.496 8.956 10.820 341 HB2 GLU 43 2HB GLU 43 5.171 8.158 13.207 342 HB3 GLU 43 1HB GLU 43 5.232 7.378 11.630 343 HG2 GLU 43 2HG GLU 43 5.859 9.550 10.602 344 HG3 GLU 43 1HG GLU 43 5.863 10.287 12.205 345 H ARG 44 H ARG 44 2.301 7.110 10.417 346 HA ARG 44 HA ARG 44 0.544 6.156 12.570 347 HB2 ARG 44 2HB ARG 44 -0.502 4.795 10.829 348 HB3 ARG 44 1HB ARG 44 -0.281 6.439 10.227 349 HG2 ARG 44 2HG ARG 44 1.873 5.691 9.170 350 HG3 ARG 44 1HG ARG 44 1.473 4.039 9.639 351 HD2 ARG 44 2HD ARG 44 0.757 4.421 7.335 352 HD3 ARG 44 1HD ARG 44 -0.660 4.230 8.366 353 HE ARG 44 HE ARG 44 -0.364 6.930 8.382 354 HH11 ARG 44 1HH1 ARG 44 -1.128 8.342 6.792 355 HH12 ARG 44 2HH1 ARG 44 -1.324 7.774 5.167 356 HH21 ARG 44 1HH2 ARG 44 -0.232 4.560 5.879 357 HH22 ARG 44 2HH2 ARG 44 -0.816 5.633 4.651 358 H ALA 45 H ALA 45 0.778 4.211 13.650 359 HA ALA 45 HA ALA 45 2.980 2.407 12.743 360 HB1 ALA 45 1HB ALA 45 4.155 2.739 14.628 361 HB2 ALA 45 2HB ALA 45 2.734 2.408 15.619 362 HB3 ALA 45 3HB ALA 45 3.041 4.044 15.036 363 H GLY 46 H GLY 46 -0.069 2.763 14.533 364 HA2 GLY 46 2HA GLY 46 -0.239 -0.200 14.736 365 HA3 GLY 46 1HA GLY 46 -1.309 0.942 15.544 366 H LEU 47 H LEU 47 -1.996 -1.361 13.804 367 HA LEU 47 HA LEU 47 -3.832 0.110 12.013 368 HB2 LEU 47 2HB LEU 47 -1.932 -2.047 11.050 369 HB3 LEU 47 1HB LEU 47 -3.319 -1.468 10.131 370 HG LEU 47 HG LEU 47 -2.193 0.905 10.645 371 HD11 LEU 47 1HD1 LEU 47 0.059 0.892 11.069 372 HD12 LEU 47 2HD1 LEU 47 0.319 -0.616 10.193 373 HD13 LEU 47 3HD1 LEU 47 -0.326 -0.651 11.833 374 HD21 LEU 47 1HD2 LEU 47 -2.448 0.555 8.395 375 HD22 LEU 47 2HD2 LEU 47 -1.844 -1.097 8.474 376 HD23 LEU 47 3HD2 LEU 47 -0.713 0.254 8.470 377 H ALA 48 H ALA 48 -5.830 -0.823 12.057 378 HA ALA 48 HA ALA 48 -6.092 -3.719 12.574 379 HB1 ALA 48 1HB ALA 48 -6.207 -3.063 14.836 380 HB2 ALA 48 2HB ALA 48 -7.900 -3.103 14.347 381 HB3 ALA 48 3HB ALA 48 -7.050 -1.563 14.452 382 H PHE 49 H PHE 49 -7.664 -4.444 11.204 383 HA PHE 49 HA PHE 49 -9.985 -2.707 10.635 384 HB2 PHE 49 2HB PHE 49 -9.684 -2.907 8.195 385 HB3 PHE 49 1HB PHE 49 -8.322 -2.071 8.944 386 HD1 PHE 49 1HD PHE 49 -6.176 -3.239 9.317 387 HD2 PHE 49 2HD PHE 49 -9.403 -5.061 7.150 388 HE1 PHE 49 1HE PHE 49 -4.604 -4.906 8.385 389 HE2 PHE 49 2HE PHE 49 -7.830 -6.734 6.214 390 HZ PHE 49 HZ PHE 49 -5.427 -6.654 6.830 391 H GLU 50 H GLU 50 -11.803 -3.868 9.873 392 HA GLU 50 HA GLU 50 -11.679 -6.769 10.397 393 HB2 GLU 50 2HB GLU 50 -14.218 -5.562 9.472 394 HB3 GLU 50 1HB GLU 50 -13.912 -6.614 10.853 395 HG2 GLU 50 2HG GLU 50 -12.703 -4.560 11.880 396 HG3 GLU 50 1HG GLU 50 -13.564 -3.627 10.654 397 HA PRO 51 HA PRO 51 -11.293 -7.098 5.876 398 HB2 PRO 51 2HB PRO 51 -10.652 -9.738 5.765 399 HB3 PRO 51 1HB PRO 51 -9.484 -8.476 6.203 400 HG2 PRO 51 2HG PRO 51 -10.932 -10.398 7.935 401 HG3 PRO 51 1HG PRO 51 -9.296 -9.741 8.091 402 HD2 PRO 51 2HD PRO 51 -11.499 -8.864 9.544 403 HD3 PRO 51 1HD PRO 51 -10.013 -7.925 9.291 404 H PHE 52 H PHE 52 -13.533 -6.821 5.402 405 HA PHE 52 HA PHE 52 -14.887 -9.257 4.527 406 HB2 PHE 52 2HB PHE 52 -16.282 -7.492 6.564 407 HB3 PHE 52 1HB PHE 52 -16.888 -8.993 5.862 408 HD1 PHE 52 1HD PHE 52 -14.821 -7.508 8.434 409 HD2 PHE 52 2HD PHE 52 -15.680 -11.165 6.354 410 HE1 PHE 52 1HE PHE 52 -13.682 -8.790 10.220 411 HE2 PHE 52 2HE PHE 52 -14.541 -12.450 8.144 412 HZ PHE 52 HZ PHE 52 -13.537 -11.261 10.076 413 H VAL 53 H VAL 53 -17.196 -8.423 3.592 414 HA VAL 53 HA VAL 53 -16.479 -6.174 1.856 415 HB VAL 53 HB VAL 53 -19.171 -7.555 2.091 416 HG11 VAL 53 1HG1 VAL 53 -18.587 -6.759 -0.549 417 HG12 VAL 53 2HG1 VAL 53 -18.099 -5.403 0.469 418 HG13 VAL 53 3HG1 VAL 53 -19.752 -6.019 0.549 419 HG21 VAL 53 1HG2 VAL 53 -16.922 -8.925 1.527 420 HG22 VAL 53 2HG2 VAL 53 -17.238 -8.254 -0.071 421 HG23 VAL 53 3HG2 VAL 53 -18.450 -9.260 0.717 422 H GLY 54 H GLY 54 -16.873 -4.067 2.397 423 HA2 GLY 54 2HA GLY 54 -18.059 -2.225 3.303 424 HA3 GLY 54 1HA GLY 54 -19.291 -3.348 3.888 425 H GLY 55 H GLY 55 -16.032 -4.169 4.610 426 HA2 GLY 55 2HA GLY 55 -16.513 -4.010 7.462 427 HA3 GLY 55 1HA GLY 55 -14.975 -4.413 6.697 428 H ARG 56 H ARG 56 -14.573 -2.850 8.768 429 HA ARG 56 HA ARG 56 -14.381 -0.068 7.665 430 HB2 ARG 56 2HB ARG 56 -14.645 -0.988 10.543 431 HB3 ARG 56 1HB ARG 56 -14.371 0.683 10.046 432 HG2 ARG 56 2HG ARG 56 -16.470 0.580 8.693 433 HG3 ARG 56 1HG ARG 56 -16.763 -1.038 9.332 434 HD2 ARG 56 2HD ARG 56 -16.534 1.513 10.957 435 HD3 ARG 56 1HD ARG 56 -18.012 0.601 10.651 436 HE ARG 56 HE ARG 56 -15.899 -0.127 12.554 437 HH11 ARG 56 1HH1 ARG 56 -16.366 -1.933 13.831 438 HH12 ARG 56 2HH1 ARG 56 -17.702 -2.953 13.410 439 HH21 ARG 56 1HH2 ARG 56 -18.592 -1.087 10.625 440 HH22 ARG 56 2HH2 ARG 56 -18.961 -2.474 11.595 441 H TYR 57 H TYR 57 -12.358 0.883 7.687 442 HA TYR 57 HA TYR 57 -10.141 -0.763 8.835 443 HB2 TYR 57 2HB TYR 57 -10.361 -0.427 6.242 444 HB3 TYR 57 1HB TYR 57 -9.739 1.188 6.582 445 HD1 TYR 57 1HD TYR 57 -7.607 1.299 8.116 446 HD2 TYR 57 2HD TYR 57 -8.855 -2.198 5.956 447 HE1 TYR 57 1HE TYR 57 -5.305 0.384 8.263 448 HE2 TYR 57 2HE TYR 57 -6.556 -3.116 6.106 449 HH TYR 57 HH TYR 57 -4.115 -1.629 8.102 450 H TYR 58 H TYR 58 -8.922 0.249 10.361 451 HA TYR 58 HA TYR 58 -8.828 3.213 10.391 452 HB2 TYR 58 2HB TYR 58 -9.260 3.123 12.897 453 HB3 TYR 58 1HB TYR 58 -10.659 2.787 11.873 454 HD1 TYR 58 1HD TYR 58 -8.611 1.557 14.532 455 HD2 TYR 58 2HD TYR 58 -11.095 0.309 11.261 456 HE1 TYR 58 1HE TYR 58 -8.857 -0.682 15.574 457 HE2 TYR 58 2HE TYR 58 -11.343 -1.931 12.297 458 HH TYR 58 HH TYR 58 -9.474 -2.863 15.117 459 H GLU 59 H GLU 59 -7.053 4.035 11.709 460 HA GLU 59 HA GLU 59 -5.024 1.984 12.470 461 HB2 GLU 59 2HB GLU 59 -4.470 4.526 10.907 462 HB3 GLU 59 1HB GLU 59 -3.264 3.353 11.434 463 HG2 GLU 59 2HG GLU 59 -4.379 1.609 10.072 464 HG3 GLU 59 1HG GLU 59 -5.550 2.805 9.517 465 H TRP 60 H TRP 60 -3.456 2.823 14.077 466 HA TRP 60 HA TRP 60 -4.673 5.019 15.694 467 HB2 TRP 60 2HB TRP 60 -2.751 2.798 16.428 468 HB3 TRP 60 1HB TRP 60 -3.142 4.134 17.509 469 HD1 TRP 60 HD TRP 60 -5.815 4.412 18.121 470 HE1 TRP 60 1HE TRP 60 -7.583 2.577 18.509 471 HE3 TRP 60 3HE TRP 60 -3.508 0.469 15.842 472 HZ2 TRP 60 2HZ TRP 60 -7.966 -0.199 17.931 473 HZ3 TRP 60 3HZ TRP 60 -4.591 -1.756 15.778 474 HH2 TRP 60 HH TRP 60 -6.816 -2.096 16.818 475 H ASP 61 H ASP 61 -3.598 6.911 15.921 476 HA ASP 61 HA ASP 61 -0.963 7.180 14.584 477 HB2 ASP 61 2HB ASP 61 -2.924 9.216 15.671 478 HB3 ASP 61 1HB ASP 61 -1.378 9.636 14.936 479 H ILE 62 H ILE 62 0.767 8.398 15.726 480 HA ILE 62 HA ILE 62 1.423 7.329 18.235 481 HB ILE 62 HB ILE 62 2.282 9.978 17.064 482 HG12 ILE 62 2HG1 ILE 62 3.656 7.291 17.020 483 HG13 ILE 62 1HG1 ILE 62 2.705 7.926 15.687 484 HG21 ILE 62 1HG2 ILE 62 4.303 8.809 18.636 485 HG22 ILE 62 2HG2 ILE 62 2.829 8.727 19.600 486 HG23 ILE 62 3HG2 ILE 62 3.398 10.280 18.990 487 HD11 ILE 62 1HD1 ILE 62 4.341 9.357 15.045 488 HD12 ILE 62 2HD1 ILE 62 5.403 8.361 16.041 489 HD13 ILE 62 3HD1 ILE 62 4.691 9.829 16.708 490 H ASP 63 H ASP 63 -0.126 10.452 17.518 491 HA ASP 63 HA ASP 63 -0.978 10.554 20.388 492 HB2 ASP 63 2HB ASP 63 -0.223 12.843 18.547 493 HB3 ASP 63 1HB ASP 63 -0.942 13.046 20.145 494 H GLY 64 H GLY 64 -1.880 10.668 17.063 495 HA2 GLY 64 2HA GLY 64 -4.485 11.913 17.547 496 HA3 GLY 64 1HA GLY 64 -3.940 11.213 16.021 497 H THR 65 H THR 65 -6.493 10.809 17.463 498 HA THR 65 HA THR 65 -6.515 8.183 18.645 499 HB THR 65 HB THR 65 -8.279 9.996 18.931 500 HG1 THR 65 1HG THR 65 -9.739 7.853 18.113 501 HG21 THR 65 1HG2 THR 65 -8.307 9.997 16.220 502 HG22 THR 65 2HG2 THR 65 -9.648 10.575 17.210 503 HG23 THR 65 3HG2 THR 65 -9.677 8.939 16.553 504 H GLU 66 H GLU 66 -8.854 7.279 17.034 505 HA GLU 66 HA GLU 66 -7.308 5.844 14.991 506 HB2 GLU 66 2HB GLU 66 -10.193 5.636 15.890 507 HB3 GLU 66 1HB GLU 66 -9.450 4.591 14.684 508 HG2 GLU 66 2HG GLU 66 -7.770 3.874 16.347 509 HG3 GLU 66 1HG GLU 66 -8.546 4.892 17.560 510 H ILE 67 H ILE 67 -7.344 6.339 12.851 511 HA ILE 67 HA ILE 67 -9.469 8.209 11.873 512 HB ILE 67 HB ILE 67 -6.593 8.038 10.919 513 HG12 ILE 67 2HG1 ILE 67 -8.021 10.159 12.556 514 HG13 ILE 67 1HG1 ILE 67 -6.757 9.077 13.146 515 HG21 ILE 67 1HG2 ILE 67 -8.943 8.997 9.661 516 HG22 ILE 67 2HG2 ILE 67 -7.276 9.219 9.130 517 HG23 ILE 67 3HG2 ILE 67 -8.038 10.419 10.175 518 HD11 ILE 67 1HD1 ILE 67 -6.539 11.445 11.357 519 HD12 ILE 67 2HD1 ILE 67 -5.477 10.082 11.005 520 HD13 ILE 67 3HD1 ILE 67 -5.418 10.861 12.587 521 H VAL 68 H VAL 68 -10.491 7.574 9.968 522 HA VAL 68 HA VAL 68 -10.199 4.827 9.145 523 HB VAL 68 HB VAL 68 -11.561 7.105 7.672 524 HG11 VAL 68 1HG1 VAL 68 -11.191 5.079 6.313 525 HG12 VAL 68 2HG1 VAL 68 -12.904 5.282 6.683 526 HG13 VAL 68 3HG1 VAL 68 -11.945 4.096 7.568 527 HG21 VAL 68 1HG2 VAL 68 -12.696 5.129 9.679 528 HG22 VAL 68 2HG2 VAL 68 -13.591 6.400 8.846 529 HG23 VAL 68 3HG2 VAL 68 -12.349 6.823 10.024 530 H TRP 69 H TRP 69 -8.709 4.012 7.760 531 HA TRP 69 HA TRP 69 -7.100 5.923 6.142 532 HB2 TRP 69 2HB TRP 69 -5.594 4.571 7.292 533 HB3 TRP 69 1HB TRP 69 -6.649 3.161 7.222 534 HD1 TRP 69 HD TRP 69 -3.947 4.978 5.317 535 HE1 TRP 69 1HE TRP 69 -3.292 3.601 3.238 536 HE3 TRP 69 3HE TRP 69 -7.636 1.448 5.397 537 HZ2 TRP 69 2HZ TRP 69 -4.210 1.305 1.800 538 HZ3 TRP 69 3HZ TRP 69 -7.723 -0.320 3.663 539 HH2 TRP 69 HH TRP 69 -6.016 -0.398 1.865 540 H GLY 70 H GLY 70 -9.760 3.963 5.824 541 HA2 GLY 70 2HA GLY 70 -10.233 4.283 3.132 542 HA3 GLY 70 1HA GLY 70 -9.215 2.842 3.190 543 H ARG 71 H ARG 71 -10.752 1.251 2.733 544 HA ARG 71 HA ARG 71 -12.584 0.586 4.902 545 HB2 ARG 71 2HB ARG 71 -13.680 2.277 3.095 546 HB3 ARG 71 1HB ARG 71 -13.994 0.743 2.289 547 HG2 ARG 71 2HG ARG 71 -15.058 -0.125 4.338 548 HG3 ARG 71 1HG ARG 71 -14.757 1.414 5.142 549 HD2 ARG 71 2HD ARG 71 -17.032 1.449 4.340 550 HD3 ARG 71 1HD ARG 71 -16.091 2.532 3.315 551 HE ARG 71 HE ARG 71 -16.336 -0.226 2.319 552 HH11 ARG 71 1HH1 ARG 71 -17.393 -0.403 0.331 553 HH12 ARG 71 2HH1 ARG 71 -18.256 0.958 -0.301 554 HH21 ARG 71 1HH2 ARG 71 -17.506 3.018 2.385 555 HH22 ARG 71 2HH2 ARG 71 -18.319 2.895 0.861 556 H ILE 72 H ILE 72 -14.149 -1.250 3.335 557 HA ILE 72 HA ILE 72 -12.041 -3.036 2.197 558 HB ILE 72 HB ILE 72 -14.355 -4.091 3.811 559 HG12 ILE 72 2HG1 ILE 72 -13.120 -2.520 5.262 560 HG13 ILE 72 1HG1 ILE 72 -12.905 -4.180 5.786 561 HG21 ILE 72 1HG2 ILE 72 -12.679 -5.948 4.163 562 HG22 ILE 72 2HG2 ILE 72 -11.632 -5.127 3.009 563 HG23 ILE 72 3HG2 ILE 72 -13.206 -5.735 2.494 564 HD11 ILE 72 1HD1 ILE 72 -10.817 -3.704 3.955 565 HD12 ILE 72 2HD1 ILE 72 -10.686 -3.835 5.704 566 HD13 ILE 72 3HD1 ILE 72 -10.908 -2.258 4.956 567 H LEU 73 H LEU 73 -12.900 -4.607 0.639 568 HA LEU 73 HA LEU 73 -15.567 -3.815 -0.470 569 HB2 LEU 73 2HB LEU 73 -13.643 -3.072 -1.899 570 HB3 LEU 73 1HB LEU 73 -13.153 -4.758 -2.049 571 HG LEU 73 HG LEU 73 -15.644 -5.106 -2.848 572 HD11 LEU 73 1HD1 LEU 73 -15.156 -2.176 -3.465 573 HD12 LEU 73 2HD1 LEU 73 -16.361 -2.798 -2.336 574 HD13 LEU 73 3HD1 LEU 73 -16.507 -3.140 -4.058 575 HD21 LEU 73 1HD2 LEU 73 -13.204 -4.196 -4.262 576 HD22 LEU 73 2HD2 LEU 73 -14.703 -4.065 -5.181 577 HD23 LEU 73 3HD2 LEU 73 -14.198 -5.627 -4.538 578 H GLU 74 H GLU 74 -13.146 -6.441 -0.497 579 HA GLU 74 HA GLU 74 -15.012 -8.425 0.388 580 HB2 GLU 74 2HB GLU 74 -15.917 -8.019 -1.919 581 HB3 GLU 74 1HB GLU 74 -14.364 -8.544 -2.560 582 HG2 GLU 74 2HG GLU 74 -14.641 -10.719 -1.382 583 HG3 GLU 74 1HG GLU 74 -16.240 -10.196 -0.850 584 H TRP 75 H TRP 75 -13.911 -10.303 0.939 585 HA TRP 75 HA TRP 75 -11.002 -10.328 0.288 586 HB2 TRP 75 2HB TRP 75 -11.018 -10.387 2.590 587 HB3 TRP 75 1HB TRP 75 -12.610 -11.142 2.661 588 HD1 TRP 75 HD TRP 75 -8.915 -11.945 2.414 589 HE1 TRP 75 1HE TRP 75 -8.584 -14.488 2.684 590 HE3 TRP 75 3HE TRP 75 -13.779 -13.486 2.256 591 HZ2 TRP 75 2HZ TRP 75 -10.176 -16.863 2.816 592 HZ3 TRP 75 3HZ TRP 75 -14.345 -15.890 2.454 593 HH2 TRP 75 HH TRP 75 -12.551 -17.580 2.735 594 H ASP 76 H ASP 76 -10.403 -11.829 -1.195 595 HA ASP 76 HA ASP 76 -12.141 -14.233 -1.527 596 HB2 ASP 76 2HB ASP 76 -11.302 -12.326 -3.412 597 HB3 ASP 76 1HB ASP 76 -10.353 -13.776 -3.749 598 HA PRO 77 HA PRO 77 -8.743 -16.537 0.405 599 HB2 PRO 77 2HB PRO 77 -9.730 -18.457 -1.699 600 HB3 PRO 77 1HB PRO 77 -9.253 -18.793 -0.024 601 HG2 PRO 77 2HG PRO 77 -11.810 -18.565 -0.707 602 HG3 PRO 77 1HG PRO 77 -11.207 -17.967 0.848 603 HD2 PRO 77 2HD PRO 77 -12.154 -16.441 -1.491 604 HD3 PRO 77 1HD PRO 77 -11.979 -15.910 0.197 605 HA PRO 78 HA PRO 78 -4.971 -16.002 -1.810 606 HB2 PRO 78 2HB PRO 78 -5.023 -18.982 -2.165 607 HB3 PRO 78 1HB PRO 78 -3.675 -17.935 -1.683 608 HG2 PRO 78 2HG PRO 78 -5.239 -19.362 0.066 609 HG3 PRO 78 1HG PRO 78 -4.304 -17.921 0.491 610 HD2 PRO 78 2HD PRO 78 -7.164 -18.198 0.477 611 HD3 PRO 78 1HD PRO 78 -6.224 -16.738 0.840 612 H HIS 79 H HIS 79 -5.908 -14.966 -3.636 613 HA HIS 79 HA HIS 79 -5.488 -15.977 -6.164 614 HB2 HIS 79 2HB HIS 79 -7.937 -17.108 -4.966 615 HB3 HIS 79 1HB HIS 79 -8.172 -16.395 -6.561 616 HD1 HIS 79 1HD HIS 79 -5.946 -17.131 -8.238 617 HD2 HIS 79 2HD HIS 79 -7.219 -19.753 -5.254 618 HE1 HIS 79 1HE HIS 79 -5.084 -19.427 -8.882 619 HE2 HIS 79 2HE HIS 79 -5.853 -21.028 -7.073 620 H ARG 80 H ARG 80 -8.025 -14.245 -4.282 621 HA ARG 80 HA ARG 80 -7.575 -11.960 -6.113 622 HB2 ARG 80 2HB ARG 80 -9.756 -13.613 -6.487 623 HB3 ARG 80 1HB ARG 80 -10.416 -12.314 -5.498 624 HG2 ARG 80 2HG ARG 80 -8.771 -11.813 -7.992 625 HG3 ARG 80 1HG ARG 80 -10.532 -11.902 -7.994 626 HD2 ARG 80 2HD ARG 80 -9.718 -10.165 -5.866 627 HD3 ARG 80 1HD ARG 80 -8.901 -9.661 -7.344 628 HE ARG 80 HE ARG 80 -11.681 -9.283 -6.797 629 HH11 ARG 80 1HH1 ARG 80 -13.025 -8.642 -8.497 630 HH12 ARG 80 2HH1 ARG 80 -12.507 -8.886 -10.133 631 HH21 ARG 80 1HH2 ARG 80 -9.483 -10.329 -9.239 632 HH22 ARG 80 2HH2 ARG 80 -10.502 -9.842 -10.552 633 H LEU 81 H LEU 81 -7.608 -10.035 -5.094 634 HA LEU 81 HA LEU 81 -8.759 -9.922 -2.336 635 HB2 LEU 81 2HB LEU 81 -6.254 -10.082 -2.288 636 HB3 LEU 81 1HB LEU 81 -6.183 -8.599 -3.237 637 HG LEU 81 HG LEU 81 -7.565 -7.487 -1.423 638 HD11 LEU 81 1HD1 LEU 81 -7.537 -10.211 -0.430 639 HD12 LEU 81 2HD1 LEU 81 -8.469 -8.830 0.143 640 HD13 LEU 81 3HD1 LEU 81 -6.843 -9.112 0.760 641 HD21 LEU 81 1HD2 LEU 81 -5.314 -8.111 0.194 642 HD22 LEU 81 2HD2 LEU 81 -5.528 -6.713 -0.860 643 HD23 LEU 81 3HD2 LEU 81 -4.774 -8.181 -1.483 644 H ALA 82 H ALA 82 -10.135 -8.201 -2.069 645 HA ALA 82 HA ALA 82 -9.847 -5.876 -3.917 646 HB1 ALA 82 1HB ALA 82 -11.962 -6.053 -4.755 647 HB2 ALA 82 2HB ALA 82 -12.621 -6.643 -3.230 648 HB3 ALA 82 3HB ALA 82 -11.787 -7.752 -4.317 649 H MET 83 H MET 83 -10.318 -3.888 -2.923 650 HA MET 83 HA MET 83 -11.529 -3.940 -0.219 651 HB2 MET 83 2HB MET 83 -8.861 -2.610 -0.740 652 HB3 MET 83 1HB MET 83 -9.694 -2.758 0.807 653 HG2 MET 83 2HG MET 83 -9.533 -5.265 0.555 654 HG3 MET 83 1HG MET 83 -8.504 -4.991 -0.850 655 HE1 MET 83 1HE MET 83 -8.614 -3.069 2.793 656 HE2 MET 83 2HE MET 83 -7.675 -4.343 3.565 657 HE3 MET 83 3HE MET 83 -9.181 -4.744 2.744 658 H THR 84 H THR 84 -12.661 -2.031 0.244 659 HA THR 84 HA THR 84 -12.658 0.005 -1.937 660 HB THR 84 HB THR 84 -14.577 -0.333 0.393 661 HG1 THR 84 1HG THR 84 -15.463 -1.789 -0.790 662 HG21 THR 84 1HG2 THR 84 -14.418 1.517 -1.966 663 HG22 THR 84 2HG2 THR 84 -14.808 1.888 -0.286 664 HG23 THR 84 3HG2 THR 84 -15.993 1.073 -1.307 665 H TRP 85 H TRP 85 -11.810 2.049 -1.515 666 HA TRP 85 HA TRP 85 -10.685 2.435 1.215 667 HB2 TRP 85 2HB TRP 85 -10.018 3.577 -1.491 668 HB3 TRP 85 1HB TRP 85 -9.447 4.352 -0.016 669 HD1 TRP 85 HD TRP 85 -9.680 0.633 0.281 670 HE1 TRP 85 1HE TRP 85 -7.327 -0.404 0.180 671 HE3 TRP 85 3HE TRP 85 -6.989 4.695 -1.249 672 HZ2 TRP 85 2HZ TRP 85 -4.655 0.380 -0.463 673 HZ3 TRP 85 3HZ TRP 85 -4.542 4.521 -1.597 674 HH2 TRP 85 HH TRP 85 -3.372 2.370 -1.206 675 H ARG 86 H ARG 86 -11.816 3.713 2.570 676 HA ARG 86 HA ARG 86 -13.391 5.975 1.391 677 HB2 ARG 86 2HB ARG 86 -14.763 4.219 2.538 678 HB3 ARG 86 1HB ARG 86 -13.873 4.547 4.025 679 HG2 ARG 86 2HG ARG 86 -14.627 6.887 3.978 680 HG3 ARG 86 1HG ARG 86 -15.498 6.584 2.474 681 HD2 ARG 86 2HD ARG 86 -17.098 6.437 4.272 682 HD3 ARG 86 1HD ARG 86 -16.804 4.798 3.693 683 HE ARG 86 HE ARG 86 -15.051 5.522 5.897 684 HH11 ARG 86 1HH1 ARG 86 -15.434 4.448 7.850 685 HH12 ARG 86 2HH1 ARG 86 -16.931 3.610 8.082 686 HH21 ARG 86 1HH2 ARG 86 -18.176 4.419 4.948 687 HH22 ARG 86 2HH2 ARG 86 -18.483 3.592 6.440 688 H ILE 87 H ILE 87 -12.053 7.747 1.641 689 HA ILE 87 HA ILE 87 -11.110 8.312 4.401 690 HB ILE 87 HB ILE 87 -9.223 7.299 3.080 691 HG12 ILE 87 2HG1 ILE 87 -8.523 10.179 3.509 692 HG13 ILE 87 1HG1 ILE 87 -9.110 9.253 4.890 693 HG21 ILE 87 1HG2 ILE 87 -9.952 8.265 0.885 694 HG22 ILE 87 2HG2 ILE 87 -8.254 8.568 1.248 695 HG23 ILE 87 3HG2 ILE 87 -9.443 9.853 1.460 696 HD11 ILE 87 1HD1 ILE 87 -6.531 9.294 4.328 697 HD12 ILE 87 2HD1 ILE 87 -6.980 8.061 3.151 698 HD13 ILE 87 3HD1 ILE 87 -7.297 7.800 4.865 699 H ASP 88 H ASP 88 -10.531 10.652 4.666 700 HA ASP 88 HA ASP 88 -12.313 12.305 2.942 701 HB2 ASP 88 2HB ASP 88 -12.665 12.292 5.435 702 HB3 ASP 88 1HB ASP 88 -11.072 13.027 5.612 703 H GLY 89 H GLY 89 -11.543 14.235 2.004 704 HA2 GLY 89 2HA GLY 89 -8.864 14.227 1.048 705 HA3 GLY 89 1HA GLY 89 -9.961 15.603 0.952 706 H HIS 90 H HIS 90 -10.247 15.561 3.970 707 HA HIS 90 HA HIS 90 -7.908 17.259 4.488 708 HB2 HIS 90 2HB HIS 90 -10.326 16.587 6.170 709 HB3 HIS 90 1HB HIS 90 -9.096 17.761 6.611 710 HD1 HIS 90 1HD HIS 90 -8.654 19.210 3.967 711 HD2 HIS 90 2HD HIS 90 -12.436 18.202 5.399 712 HE1 HIS 90 1HE HIS 90 -10.291 20.777 2.831 713 HE2 HIS 90 2HE HIS 90 -12.598 20.170 3.694 714 H TRP 91 H TRP 91 -7.960 14.133 4.398 715 HA TRP 91 HA TRP 91 -6.821 12.417 5.514 716 HB2 TRP 91 2HB TRP 91 -5.412 14.911 6.267 717 HB3 TRP 91 1HB TRP 91 -5.142 13.540 7.342 718 HD1 TRP 91 HD TRP 91 -3.749 15.017 4.371 719 HE1 TRP 91 1HE TRP 91 -2.392 13.312 2.996 720 HE3 TRP 91 3HE TRP 91 -5.371 10.672 6.507 721 HZ2 TRP 91 2HZ TRP 91 -2.042 10.473 2.824 722 HZ3 TRP 91 3HZ TRP 91 -4.512 8.486 5.718 723 HH2 TRP 91 HH TRP 91 -2.851 8.382 3.882 724 H GLN 92 H GLN 92 -9.321 13.717 6.691 725 HA GLN 92 HA GLN 92 -8.899 13.017 9.556 726 HB2 GLN 92 2HB GLN 92 -11.221 14.408 8.191 727 HB3 GLN 92 1HB GLN 92 -11.098 14.093 9.922 728 HG2 GLN 92 2HG GLN 92 -9.189 15.786 8.288 729 HG3 GLN 92 1HG GLN 92 -10.391 16.383 9.423 730 HE21 GLN 92 1HE2 GLN 92 -7.177 16.034 9.292 731 HE22 GLN 92 2HE2 GLN 92 -6.833 15.596 10.896 732 H SER 93 H SER 93 -12.126 12.817 8.676 733 HA SER 93 HA SER 93 -12.063 10.014 7.801 734 HB2 SER 93 2HB SER 93 -13.113 9.079 9.722 735 HB3 SER 93 1HB SER 93 -11.803 10.065 10.358 736 HG SER 93 HG SER 93 -14.245 10.238 11.071 737 H VAL 94 H VAL 94 -14.289 9.257 7.275 738 HA VAL 94 HA VAL 94 -16.201 11.531 6.935 739 HB VAL 94 HB VAL 94 -16.735 9.707 4.871 740 HG11 VAL 94 1HG1 VAL 94 -15.288 12.359 5.005 741 HG12 VAL 94 2HG1 VAL 94 -16.960 12.053 4.536 742 HG13 VAL 94 3HG1 VAL 94 -15.641 11.564 3.472 743 HG21 VAL 94 1HG2 VAL 94 -14.482 8.709 5.422 744 HG22 VAL 94 2HG2 VAL 94 -13.756 10.265 5.020 745 HG23 VAL 94 3HG2 VAL 94 -14.603 9.341 3.779 746 HA PRO 95 HA PRO 95 -19.007 8.814 9.071 747 HB2 PRO 95 2HB PRO 95 -21.399 9.803 8.118 748 HB3 PRO 95 1HB PRO 95 -20.449 10.565 9.407 749 HG2 PRO 95 2HG PRO 95 -20.641 11.268 6.528 750 HG3 PRO 95 1HG PRO 95 -20.495 12.322 7.944 751 HD2 PRO 95 2HD PRO 95 -18.387 11.758 6.300 752 HD3 PRO 95 1HD PRO 95 -18.192 12.118 8.030 753 H ASP 96 H ASP 96 -19.214 9.221 5.596 754 HA ASP 96 HA ASP 96 -19.791 6.370 5.265 755 HB2 ASP 96 2HB ASP 96 -21.836 6.693 3.950 756 HB3 ASP 96 1HB ASP 96 -22.060 7.350 5.571 757 H ASP 97 H ASP 97 -19.820 5.854 2.830 758 HA ASP 97 HA ASP 97 -17.636 7.359 1.584 759 HB2 ASP 97 2HB ASP 97 -17.899 5.654 -0.240 760 HB3 ASP 97 1HB ASP 97 -17.643 4.940 1.353 761 H ASP 98 H ASP 98 -18.349 9.364 0.846 762 HA ASP 98 HA ASP 98 -20.930 9.643 -0.495 763 HB2 ASP 98 2HB ASP 98 -19.732 11.457 0.861 764 HB3 ASP 98 1HB ASP 98 -18.664 11.633 -0.529 765 H ARG 99 H ARG 99 -17.542 10.035 -1.517 766 HA ARG 99 HA ARG 99 -18.357 9.129 -4.238 767 HB2 ARG 99 2HB ARG 99 -16.394 11.343 -3.566 768 HB3 ARG 99 1HB ARG 99 -16.744 10.739 -5.185 769 HG2 ARG 99 2HG ARG 99 -19.135 11.370 -4.871 770 HG3 ARG 99 1HG ARG 99 -18.716 12.067 -3.306 771 HD2 ARG 99 2HD ARG 99 -17.047 13.538 -4.497 772 HD3 ARG 99 1HD ARG 99 -17.703 12.945 -6.023 773 HE ARG 99 HE ARG 99 -19.037 14.802 -4.175 774 HH11 ARG 99 1HH1 ARG 99 -20.968 15.673 -4.963 775 HH12 ARG 99 2HH1 ARG 99 -21.702 14.983 -6.372 776 HH21 ARG 99 1HH2 ARG 99 -19.249 12.570 -6.794 777 HH22 ARG 99 2HH2 ARG 99 -20.728 13.227 -7.409 778 H ALA 100 H ALA 100 -17.122 7.687 -1.920 779 HA ALA 100 HA ALA 100 -14.310 7.374 -2.388 780 HB1 ALA 100 1HB ALA 100 -15.818 6.568 -0.393 781 HB2 ALA 100 2HB ALA 100 -14.395 5.631 -0.846 782 HB3 ALA 100 3HB ALA 100 -15.995 5.111 -1.369 783 H SER 101 H SER 101 -13.197 5.690 -3.498 784 HA SER 101 HA SER 101 -14.782 4.446 -5.708 785 HB2 SER 101 2HB SER 101 -13.002 6.098 -6.361 786 HB3 SER 101 1HB SER 101 -11.810 5.028 -5.628 787 HG SER 101 HG SER 101 -13.601 4.394 -7.743 788 H GLU 102 H GLU 102 -13.904 2.297 -6.447 789 HA GLU 102 HA GLU 102 -12.981 0.718 -4.082 790 HB2 GLU 102 2HB GLU 102 -14.472 -0.190 -6.563 791 HB3 GLU 102 1HB GLU 102 -14.017 -1.219 -5.204 792 HG2 GLU 102 2HG GLU 102 -15.372 0.213 -3.692 793 HG3 GLU 102 1HG GLU 102 -15.868 1.179 -5.081 794 H ILE 103 H ILE 103 -11.352 -0.854 -4.381 795 HA ILE 103 HA ILE 103 -9.690 -0.466 -6.842 796 HB ILE 103 HB ILE 103 -8.788 -1.257 -4.058 797 HG12 ILE 103 2HG1 ILE 103 -8.380 1.370 -5.516 798 HG13 ILE 103 1HG1 ILE 103 -9.606 1.118 -4.271 799 HG21 ILE 103 1HG2 ILE 103 -7.358 -0.704 -6.658 800 HG22 ILE 103 2HG2 ILE 103 -7.279 -2.157 -5.662 801 HG23 ILE 103 3HG2 ILE 103 -6.532 -0.661 -5.101 802 HD11 ILE 103 1HD1 ILE 103 -7.672 0.287 -2.784 803 HD12 ILE 103 2HD1 ILE 103 -7.752 2.022 -3.097 804 HD13 ILE 103 3HD1 ILE 103 -6.601 1.018 -3.982 805 H GLU 104 H GLU 104 -9.005 -2.339 -7.919 806 HA GLU 104 HA GLU 104 -10.003 -4.920 -6.770 807 HB2 GLU 104 2HB GLU 104 -11.016 -4.226 -8.959 808 HB3 GLU 104 1HB GLU 104 -9.403 -4.282 -9.673 809 HG2 GLU 104 2HG GLU 104 -9.216 -6.672 -8.980 810 HG3 GLU 104 1HG GLU 104 -10.874 -6.601 -8.384 811 H VAL 105 H VAL 105 -8.415 -6.244 -6.074 812 HA VAL 105 HA VAL 105 -5.731 -6.032 -7.365 813 HB VAL 105 HB VAL 105 -6.289 -6.606 -4.440 814 HG11 VAL 105 1HG1 VAL 105 -3.763 -6.136 -4.352 815 HG12 VAL 105 2HG1 VAL 105 -3.780 -6.336 -6.104 816 HG13 VAL 105 3HG1 VAL 105 -4.256 -7.674 -5.059 817 HG21 VAL 105 1HG2 VAL 105 -6.735 -4.313 -4.642 818 HG22 VAL 105 2HG2 VAL 105 -5.566 -4.102 -5.947 819 HG23 VAL 105 3HG2 VAL 105 -5.007 -4.322 -4.288 820 H ASP 106 H ASP 106 -4.889 -7.969 -8.031 821 HA ASP 106 HA ASP 106 -6.292 -10.446 -7.121 822 HB2 ASP 106 2HB ASP 106 -6.864 -9.862 -9.465 823 HB3 ASP 106 1HB ASP 106 -5.147 -9.880 -9.870 824 H PHE 107 H PHE 107 -4.952 -12.002 -6.304 825 HA PHE 107 HA PHE 107 -2.021 -11.683 -6.808 826 HB2 PHE 107 2HB PHE 107 -3.546 -12.105 -4.296 827 HB3 PHE 107 1HB PHE 107 -2.050 -13.025 -4.471 828 HD1 PHE 107 1HD PHE 107 -3.516 -9.664 -4.182 829 HD2 PHE 107 2HD PHE 107 0.105 -11.910 -4.693 830 HE1 PHE 107 1HE PHE 107 -2.185 -7.640 -3.646 831 HE2 PHE 107 2HE PHE 107 1.439 -9.891 -4.156 832 HZ PHE 107 HZ PHE 107 0.297 -7.756 -3.633 833 H VAL 108 H VAL 108 -1.188 -13.352 -7.895 834 HA VAL 108 HA VAL 108 -2.332 -16.065 -7.461 835 HB VAL 108 HB VAL 108 -1.769 -14.677 -10.100 836 HG11 VAL 108 1HG1 VAL 108 -2.706 -17.530 -9.945 837 HG12 VAL 108 2HG1 VAL 108 -0.977 -17.192 -9.908 838 HG13 VAL 108 3HG1 VAL 108 -1.943 -16.683 -11.284 839 HG21 VAL 108 1HG2 VAL 108 -4.112 -15.187 -10.529 840 HG22 VAL 108 2HG2 VAL 108 -3.970 -14.341 -8.987 841 HG23 VAL 108 3HG2 VAL 108 -4.215 -16.088 -9.015 842 HA PRO 109 HA PRO 109 1.956 -17.043 -6.763 843 HB2 PRO 109 2HB PRO 109 1.944 -19.672 -7.712 844 HB3 PRO 109 1HB PRO 109 1.514 -19.169 -6.069 845 HG2 PRO 109 2HG PRO 109 -0.232 -19.869 -8.350 846 HG3 PRO 109 1HG PRO 109 -0.483 -20.108 -6.612 847 HD2 PRO 109 2HD PRO 109 -1.760 -18.158 -8.015 848 HD3 PRO 109 1HD PRO 109 -1.330 -17.975 -6.301 849 H ASN 110 H ASN 110 3.658 -16.453 -8.009 850 HA ASN 110 HA ASN 110 3.615 -17.173 -10.906 851 HB2 ASN 110 2HB ASN 110 3.354 -14.733 -10.437 852 HB3 ASN 110 1HB ASN 110 4.924 -14.764 -9.639 853 HD21 ASN 110 1HD2 ASN 110 3.388 -15.517 -12.806 854 HD22 ASN 110 2HD2 ASN 110 4.772 -15.175 -13.727 855 H GLY 111 H GLY 111 5.135 -18.695 -11.312 856 HA2 GLY 111 2HA GLY 111 7.155 -19.885 -11.218 857 HA3 GLY 111 1HA GLY 111 7.894 -18.370 -10.694 858 H SER 112 H SER 112 9.097 -18.987 -8.930 859 HA SER 112 HA SER 112 7.588 -20.251 -6.680 860 HB2 SER 112 2HB SER 112 9.572 -21.548 -6.095 861 HB3 SER 112 1HB SER 112 9.121 -21.900 -7.760 862 HG SER 112 HG SER 112 11.188 -21.424 -8.011 863 H GLY 113 H GLY 113 8.107 -19.429 -4.628 864 HA2 GLY 113 2HA GLY 113 8.900 -17.857 -3.081 865 HA3 GLY 113 1HA GLY 113 10.363 -17.772 -4.063 866 H GLY 114 H GLY 114 7.719 -17.103 -6.029 867 HA2 GLY 114 2HA GLY 114 7.774 -14.201 -5.386 868 HA3 GLY 114 1HA GLY 114 8.194 -14.711 -7.020 869 H THR 115 H THR 115 5.863 -13.113 -5.947 870 HA THR 115 HA THR 115 3.705 -14.791 -7.160 871 HB THR 115 HB THR 115 3.329 -12.772 -4.932 872 HG1 THR 115 1HG THR 115 3.196 -14.547 -3.588 873 HG21 THR 115 1HG2 THR 115 1.127 -13.934 -4.742 874 HG22 THR 115 2HG2 THR 115 1.537 -14.871 -6.176 875 HG23 THR 115 3HG2 THR 115 1.341 -13.122 -6.293 876 H ARG 116 H ARG 116 2.392 -13.728 -8.641 877 HA ARG 116 HA ARG 116 3.202 -10.923 -9.292 878 HB2 ARG 116 2HB ARG 116 3.602 -12.576 -11.097 879 HB3 ARG 116 1HB ARG 116 1.890 -13.004 -11.070 880 HG2 ARG 116 2HG ARG 116 1.290 -10.695 -11.669 881 HG3 ARG 116 1HG ARG 116 2.995 -10.241 -11.661 882 HD2 ARG 116 2HD ARG 116 2.372 -10.658 -13.955 883 HD3 ARG 116 1HD ARG 116 3.383 -12.004 -13.429 884 HE ARG 116 HE ARG 116 0.744 -12.792 -12.901 885 HH11 ARG 116 1HH1 ARG 116 -0.416 -14.029 -14.397 886 HH12 ARG 116 2HH1 ARG 116 0.041 -13.996 -16.067 887 HH21 ARG 116 1HH2 ARG 116 2.666 -11.782 -15.580 888 HH22 ARG 116 2HH2 ARG 116 1.786 -12.725 -16.736 889 H VAL 117 H VAL 117 1.678 -9.363 -9.056 890 HA VAL 117 HA VAL 117 -1.152 -10.248 -8.750 891 HB VAL 117 HB VAL 117 -0.778 -9.635 -6.577 892 HG11 VAL 117 1HG1 VAL 117 1.557 -9.249 -6.655 893 HG12 VAL 117 2HG1 VAL 117 0.881 -7.745 -6.030 894 HG13 VAL 117 3HG1 VAL 117 1.374 -7.855 -7.720 895 HG21 VAL 117 1HG2 VAL 117 -1.639 -7.451 -6.160 896 HG22 VAL 117 2HG2 VAL 117 -2.354 -7.936 -7.696 897 HG23 VAL 117 3HG2 VAL 117 -0.986 -6.821 -7.672 898 H GLU 118 H GLU 118 -2.713 -9.021 -9.734 899 HA GLU 118 HA GLU 118 -1.736 -6.822 -11.501 900 HB2 GLU 118 2HB GLU 118 -2.833 -8.690 -12.670 901 HB3 GLU 118 1HB GLU 118 -4.251 -8.523 -11.638 902 HG2 GLU 118 2HG GLU 118 -4.592 -6.219 -12.511 903 HG3 GLU 118 1HG GLU 118 -3.213 -6.437 -13.584 904 H LEU 119 H LEU 119 -2.229 -4.803 -10.824 905 HA LEU 119 HA LEU 119 -4.608 -4.452 -9.055 906 HB2 LEU 119 2HB LEU 119 -2.316 -3.963 -8.059 907 HB3 LEU 119 1HB LEU 119 -2.186 -2.639 -9.215 908 HG LEU 119 HG LEU 119 -4.688 -2.738 -7.600 909 HD11 LEU 119 1HD1 LEU 119 -3.616 -1.718 -5.654 910 HD12 LEU 119 2HD1 LEU 119 -2.036 -1.847 -6.428 911 HD13 LEU 119 3HD1 LEU 119 -2.906 -3.306 -5.952 912 HD21 LEU 119 1HD2 LEU 119 -2.749 -0.564 -8.459 913 HD22 LEU 119 2HD2 LEU 119 -4.243 -0.275 -7.570 914 HD23 LEU 119 3HD2 LEU 119 -4.304 -0.932 -9.205 915 H ALA 120 H ALA 120 -6.244 -3.342 -10.016 916 HA ALA 120 HA ALA 120 -5.522 -1.306 -12.079 917 HB1 ALA 120 1HB ALA 120 -7.318 -3.666 -12.323 918 HB2 ALA 120 2HB ALA 120 -6.352 -2.855 -13.556 919 HB3 ALA 120 3HB ALA 120 -7.889 -2.160 -13.040 920 H HIS 121 H HIS 121 -6.642 0.596 -11.871 921 HA HIS 121 HA HIS 121 -8.873 0.649 -9.876 922 HB2 HIS 121 2HB HIS 121 -7.852 2.322 -8.753 923 HB3 HIS 121 1HB HIS 121 -6.409 1.966 -9.699 924 HD1 HIS 121 1HD HIS 121 -9.668 3.813 -10.541 925 HD2 HIS 121 2HD HIS 121 -5.536 4.338 -10.784 926 HE1 HIS 121 1HE HIS 121 -9.294 6.052 -11.663 927 HE2 HIS 121 2HE HIS 121 -6.785 6.386 -11.807 928 H VAL 122 H VAL 122 -10.696 1.828 -10.466 929 HA VAL 122 HA VAL 122 -10.591 3.275 -13.065 930 HB VAL 122 HB VAL 122 -12.723 2.219 -13.744 931 HG11 VAL 122 1HG1 VAL 122 -11.717 0.320 -14.609 932 HG12 VAL 122 2HG1 VAL 122 -10.935 -0.087 -13.081 933 HG13 VAL 122 3HG1 VAL 122 -10.284 1.207 -14.086 934 HG21 VAL 122 1HG2 VAL 122 -12.352 0.888 -11.076 935 HG22 VAL 122 2HG2 VAL 122 -13.206 0.032 -12.362 936 HG23 VAL 122 3HG2 VAL 122 -13.814 1.582 -11.779 937 H LYS 123 H LYS 123 -12.020 5.016 -13.186 938 HA LYS 123 HA LYS 123 -13.330 6.770 -12.360 939 HB2 LYS 123 2HB LYS 123 -14.610 4.522 -10.781 940 HB3 LYS 123 1HB LYS 123 -15.321 6.104 -11.097 941 HG2 LYS 123 2HG LYS 123 -15.200 5.646 -13.538 942 HG3 LYS 123 1HG LYS 123 -14.575 4.035 -13.183 943 HD2 LYS 123 2HD LYS 123 -16.648 3.613 -11.817 944 HD3 LYS 123 1HD LYS 123 -17.282 5.149 -12.408 945 HE2 LYS 123 2HE LYS 123 -16.980 4.316 -14.750 946 HE3 LYS 123 1HE LYS 123 -16.502 2.751 -14.090 947 HZ1 LYS 123 1HZ LYS 123 -18.928 3.696 -12.929 948 HZ2 LYS 123 2HZ LYS 123 -18.608 2.221 -13.709 949 HZ3 LYS 123 3HZ LYS 123 -19.057 3.585 -14.617 950 H LEU 124 H LEU 124 -10.832 6.031 -10.823 951 HA LEU 124 HA LEU 124 -11.387 6.334 -8.010 952 HB2 LEU 124 2HB LEU 124 -9.205 5.504 -8.875 953 HB3 LEU 124 1HB LEU 124 -8.871 7.112 -9.518 954 HG LEU 124 HG LEU 124 -9.124 8.019 -7.183 955 HD11 LEU 124 1HD1 LEU 124 -10.180 6.623 -5.744 956 HD12 LEU 124 2HD1 LEU 124 -8.615 5.825 -5.591 957 HD13 LEU 124 3HD1 LEU 124 -9.816 5.199 -6.719 958 HD21 LEU 124 1HD2 LEU 124 -7.001 6.211 -8.164 959 HD22 LEU 124 2HD2 LEU 124 -6.974 6.512 -6.427 960 HD23 LEU 124 3HD2 LEU 124 -6.881 7.862 -7.558 961 H HIS 125 H HIS 125 -10.898 8.600 -10.656 962 HA HIS 125 HA HIS 125 -10.448 10.966 -9.228 963 HB2 HIS 125 2HB HIS 125 -10.383 10.920 -11.664 964 HB3 HIS 125 1HB HIS 125 -12.118 10.606 -11.719 965 HD1 HIS 125 1HD HIS 125 -11.245 12.851 -9.005 966 HD2 HIS 125 2HD HIS 125 -12.151 13.300 -13.051 967 HE1 HIS 125 1HE HIS 125 -11.832 15.284 -9.334 968 HE2 HIS 125 2HE HIS 125 -12.377 15.580 -11.799 969 H ARG 126 H ARG 126 -13.516 9.234 -9.679 970 HA ARG 126 HA ARG 126 -15.320 11.219 -8.912 971 HB2 ARG 126 2HB ARG 126 -16.785 9.465 -8.230 972 HB3 ARG 126 1HB ARG 126 -15.799 8.765 -9.512 973 HG2 ARG 126 2HG ARG 126 -14.234 7.951 -7.656 974 HG3 ARG 126 1HG ARG 126 -15.520 8.377 -6.535 975 HD2 ARG 126 2HD ARG 126 -15.760 6.437 -8.848 976 HD3 ARG 126 1HD ARG 126 -15.704 6.010 -7.137 977 HE ARG 126 HE ARG 126 -17.870 7.853 -7.884 978 HH11 ARG 126 1HH1 ARG 126 -19.949 7.034 -7.538 979 HH12 ARG 126 2HH1 ARG 126 -20.156 5.347 -7.203 980 HH21 ARG 126 1HH2 ARG 126 -16.770 4.624 -7.381 981 HH22 ARG 126 2HH2 ARG 126 -18.357 3.983 -7.114 982 H HIS 127 H HIS 127 -13.162 9.251 -6.923 983 HA HIS 127 HA HIS 127 -14.044 10.584 -4.456 984 HB2 HIS 127 2HB HIS 127 -13.288 8.166 -4.516 985 HB3 HIS 127 1HB HIS 127 -11.664 8.746 -4.859 986 HD1 HIS 127 1HD HIS 127 -13.428 11.048 -2.663 987 HD2 HIS 127 2HD HIS 127 -11.181 7.573 -2.137 988 HE1 HIS 127 1HE HIS 127 -12.786 10.972 -0.213 989 HE2 HIS 127 2HE HIS 127 -11.420 8.862 0.118 990 H GLY 128 H GLY 128 -11.968 11.272 -7.006 991 HA2 GLY 128 2HA GLY 128 -9.652 12.372 -6.001 992 HA3 GLY 128 1HA GLY 128 -10.569 13.154 -7.291 993 H ASP 129 H ASP 129 -12.881 13.351 -5.252 994 HA ASP 129 HA ASP 129 -12.608 16.042 -4.530 995 HB2 ASP 129 2HB ASP 129 -14.706 14.650 -4.332 996 HB3 ASP 129 1HB ASP 129 -14.033 13.953 -2.857 997 H GLY 130 H GLY 130 -11.508 13.151 -2.822 998 HA2 GLY 130 2HA GLY 130 -9.727 14.881 -1.199 999 HA3 GLY 130 1HA GLY 130 -10.793 13.769 -0.341 1000 H ALA 131 H ALA 131 -10.407 11.865 -2.770 1001 HA ALA 131 HA ALA 131 -8.396 10.228 -1.585 1002 HB1 ALA 131 1HB ALA 131 -10.177 10.106 -3.840 1003 HB2 ALA 131 2HB ALA 131 -9.394 8.778 -2.982 1004 HB3 ALA 131 3HB ALA 131 -8.573 9.565 -4.330 1005 H TRP 132 H TRP 132 -8.270 12.268 -4.530 1006 HA TRP 132 HA TRP 132 -5.544 11.742 -5.131 1007 HB2 TRP 132 2HB TRP 132 -7.182 12.902 -6.650 1008 HB3 TRP 132 1HB TRP 132 -7.016 14.340 -5.644 1009 HD1 TRP 132 HD TRP 132 -5.328 15.978 -6.544 1010 HE1 TRP 132 1HE TRP 132 -3.141 15.847 -7.903 1011 HE3 TRP 132 3HE TRP 132 -4.963 10.917 -7.159 1012 HZ2 TRP 132 2HZ TRP 132 -1.462 13.860 -9.088 1013 HZ3 TRP 132 3HZ TRP 132 -3.065 9.938 -8.400 1014 HH2 TRP 132 HH TRP 132 -1.318 11.398 -9.365 1015 H ASN 133 H ASN 133 -7.018 14.165 -2.992 1016 HA ASN 133 HA ASN 133 -4.640 15.609 -2.395 1017 HB2 ASN 133 2HB ASN 133 -7.069 15.012 -0.680 1018 HB3 ASN 133 1HB ASN 133 -5.822 16.181 -0.259 1019 HD21 ASN 133 1HD2 ASN 133 -8.529 17.012 -0.677 1020 HD22 ASN 133 2HD2 ASN 133 -8.589 17.958 -2.084 1021 H ILE 134 H ILE 134 -6.064 12.702 -0.958 1022 HA ILE 134 HA ILE 134 -4.122 12.345 1.111 1023 HB ILE 134 HB ILE 134 -6.208 10.703 -0.202 1024 HG12 ILE 134 2HG1 ILE 134 -6.640 10.114 2.196 1025 HG13 ILE 134 1HG1 ILE 134 -5.260 11.107 2.650 1026 HG21 ILE 134 1HG2 ILE 134 -4.458 9.099 -0.467 1027 HG22 ILE 134 2HG2 ILE 134 -5.306 8.642 1.009 1028 HG23 ILE 134 3HG2 ILE 134 -3.766 9.492 1.109 1029 HD11 ILE 134 1HD1 ILE 134 -6.939 12.672 2.876 1030 HD12 ILE 134 2HD1 ILE 134 -7.942 11.933 1.628 1031 HD13 ILE 134 3HD1 ILE 134 -6.556 12.921 1.176 1032 H HIS 135 H HIS 135 -4.268 11.296 -2.268 1033 HA HIS 135 HA HIS 135 -2.003 9.599 -2.276 1034 HB2 HIS 135 2HB HIS 135 -3.272 9.570 -4.255 1035 HB3 HIS 135 1HB HIS 135 -3.276 11.327 -4.384 1036 HD1 HIS 135 1HD HIS 135 -0.503 8.699 -4.147 1037 HD2 HIS 135 2HD HIS 135 -1.528 12.077 -6.370 1038 HE1 HIS 135 1HE HIS 135 1.381 9.070 -5.800 1039 HE2 HIS 135 2HE HIS 135 0.766 11.119 -7.161 1040 H LYS 136 H LYS 136 -2.199 13.153 -2.657 1041 HA LYS 136 HA LYS 136 0.525 13.597 -3.284 1042 HB2 LYS 136 2HB LYS 136 -1.285 15.300 -1.564 1043 HB3 LYS 136 1HB LYS 136 0.231 15.838 -2.272 1044 HG2 LYS 136 2HG LYS 136 -0.809 15.091 -4.522 1045 HG3 LYS 136 1HG LYS 136 -2.340 15.127 -3.653 1046 HD2 LYS 136 2HD LYS 136 -0.402 17.449 -3.851 1047 HD3 LYS 136 1HD LYS 136 -1.884 17.284 -4.791 1048 HE2 LYS 136 2HE LYS 136 -2.777 16.892 -2.211 1049 HE3 LYS 136 1HE LYS 136 -1.526 18.113 -1.996 1050 HZ1 LYS 136 1HZ LYS 136 -4.105 18.465 -2.978 1051 HZ2 LYS 136 2HZ LYS 136 -3.045 18.734 -4.278 1052 HZ3 LYS 136 3HZ LYS 136 -2.877 19.626 -2.842 1053 H ALA 137 H ALA 137 -1.075 13.120 -0.163 1054 HA ALA 137 HA ALA 137 1.284 13.539 1.439 1055 HB1 ALA 137 1HB ALA 137 -1.435 12.433 1.836 1056 HB2 ALA 137 2HB ALA 137 -0.526 13.563 2.839 1057 HB3 ALA 137 3HB ALA 137 -0.203 11.832 2.944 1058 H LEU 138 H LEU 138 -0.139 10.718 -0.140 1059 HA LEU 138 HA LEU 138 1.973 8.949 0.899 1060 HB2 LEU 138 2HB LEU 138 -0.233 8.338 -1.081 1061 HB3 LEU 138 1HB LEU 138 0.730 7.176 -0.187 1062 HG LEU 138 HG LEU 138 -1.316 9.110 0.921 1063 HD11 LEU 138 1HD1 LEU 138 -1.146 6.111 1.261 1064 HD12 LEU 138 2HD1 LEU 138 -1.966 6.840 -0.121 1065 HD13 LEU 138 3HD1 LEU 138 -2.538 7.164 1.517 1066 HD21 LEU 138 1HD2 LEU 138 0.390 9.159 2.539 1067 HD22 LEU 138 2HD2 LEU 138 0.844 7.483 2.243 1068 HD23 LEU 138 3HD2 LEU 138 -0.651 7.853 3.103 1069 H ASP 139 H ASP 139 1.660 11.150 -1.568 1070 HA ASP 139 HA ASP 139 2.875 9.655 -3.735 1071 HB2 ASP 139 2HB ASP 139 1.468 11.677 -4.093 1072 HB3 ASP 139 1HB ASP 139 2.727 12.656 -3.337 1073 H GLY 140 H GLY 140 4.904 8.948 -3.616 1074 HA2 GLY 140 2HA GLY 140 7.026 10.819 -2.704 1075 HA3 GLY 140 1HA GLY 140 7.000 9.171 -2.067 1076 HA PRO 141 HA PRO 141 9.424 9.572 -6.191 1077 HB2 PRO 141 2HB PRO 141 11.362 8.032 -4.533 1078 HB3 PRO 141 1HB PRO 141 11.656 9.365 -5.665 1079 HG2 PRO 141 2HG PRO 141 11.766 9.694 -3.008 1080 HG3 PRO 141 1HG PRO 141 11.214 10.971 -4.104 1081 HD2 PRO 141 2HD PRO 141 9.620 9.273 -2.249 1082 HD3 PRO 141 1HD PRO 141 9.293 10.916 -2.842 1083 H SER 142 H SER 142 9.080 7.931 -7.656 1084 HA SER 142 HA SER 142 9.514 5.187 -7.325 1085 HB2 SER 142 2HB SER 142 7.875 4.507 -5.924 1086 HB3 SER 142 1HB SER 142 7.119 6.098 -5.942 1087 HG SER 142 HG SER 142 5.702 4.644 -6.858 1088 HA PRO 143 HA PRO 143 8.405 5.180 -11.586 1089 HB2 PRO 143 2HB PRO 143 7.045 2.772 -11.841 1090 HB3 PRO 143 1HB PRO 143 8.805 2.946 -11.829 1091 HG2 PRO 143 2HG PRO 143 6.974 2.114 -9.654 1092 HG3 PRO 143 1HG PRO 143 8.614 1.558 -10.028 1093 HD2 PRO 143 2HD PRO 143 8.097 3.278 -7.986 1094 HD3 PRO 143 1HD PRO 143 9.617 3.324 -8.906 1095 H GLY 144 H GLY 144 5.623 3.483 -10.144 1096 HA2 GLY 144 2HA GLY 144 3.794 5.685 -10.512 1097 HA3 GLY 144 1HA GLY 144 3.658 4.542 -11.846 1098 H GLU 145 H GLU 145 3.040 2.329 -11.334 1099 HA GLU 145 HA GLU 145 0.841 2.035 -9.664 1100 HB2 GLU 145 2HB GLU 145 1.185 -0.379 -9.827 1101 HB3 GLU 145 1HB GLU 145 1.570 0.381 -11.373 1102 HG2 GLU 145 2HG GLU 145 3.980 0.419 -10.696 1103 HG3 GLU 145 1HG GLU 145 3.546 -0.486 -9.246 1104 H THR 146 H THR 146 0.504 1.182 -7.576 1105 HA THR 146 HA THR 146 2.418 1.978 -5.578 1106 HB THR 146 HB THR 146 -0.245 0.652 -5.620 1107 HG1 THR 146 1HG THR 146 -0.208 2.294 -3.735 1108 HG21 THR 146 1HG2 THR 146 0.813 -0.875 -4.116 1109 HG22 THR 146 2HG2 THR 146 -0.019 0.302 -3.102 1110 HG23 THR 146 3HG2 THR 146 1.723 0.421 -3.336 1111 H LEU 147 H LEU 147 1.939 -0.933 -7.379 1112 HA LEU 147 HA LEU 147 2.913 -2.893 -5.629 1113 HB2 LEU 147 2HB LEU 147 3.527 -2.669 -8.588 1114 HB3 LEU 147 1HB LEU 147 3.546 -4.141 -7.616 1115 HG LEU 147 HG LEU 147 1.127 -2.412 -8.197 1116 HD11 LEU 147 1HD1 LEU 147 1.600 -3.754 -10.106 1117 HD12 LEU 147 2HD1 LEU 147 0.356 -4.635 -9.219 1118 HD13 LEU 147 3HD1 LEU 147 2.042 -5.143 -9.114 1119 HD21 LEU 147 1HD2 LEU 147 0.050 -4.546 -7.056 1120 HD22 LEU 147 2HD2 LEU 147 0.658 -3.222 -6.063 1121 HD23 LEU 147 3HD2 LEU 147 1.634 -4.674 -6.289 1122 H ALA 148 H ALA 148 4.689 -0.419 -7.417 1123 HA ALA 148 HA ALA 148 7.307 -1.490 -7.079 1124 HB1 ALA 148 1HB ALA 148 7.616 0.335 -8.376 1125 HB2 ALA 148 2HB ALA 148 7.614 1.270 -6.881 1126 HB3 ALA 148 3HB ALA 148 6.123 1.079 -7.805 1127 H ARG 149 H ARG 149 5.580 0.907 -5.061 1128 HA ARG 149 HA ARG 149 7.566 0.959 -2.996 1129 HB2 ARG 149 2HB ARG 149 4.617 1.612 -2.926 1130 HB3 ARG 149 1HB ARG 149 5.744 1.979 -1.627 1131 HG2 ARG 149 2HG ARG 149 6.102 2.957 -4.472 1132 HG3 ARG 149 1HG ARG 149 5.307 3.902 -3.214 1133 HD2 ARG 149 2HD ARG 149 7.483 3.433 -1.836 1134 HD3 ARG 149 1HD ARG 149 8.193 3.073 -3.409 1135 HE ARG 149 HE ARG 149 7.059 5.490 -3.892 1136 HH11 ARG 149 1HH1 ARG 149 7.984 7.494 -3.395 1137 HH12 ARG 149 2HH1 ARG 149 9.119 7.607 -2.091 1138 HH21 ARG 149 1HH2 ARG 149 8.949 4.241 -1.293 1139 HH22 ARG 149 2HH2 ARG 149 9.665 5.768 -0.902 1140 H PHE 150 H PHE 150 4.630 -0.970 -3.458 1141 HA PHE 150 HA PHE 150 4.759 -2.243 -0.880 1142 HB2 PHE 150 2HB PHE 150 2.688 -2.231 -2.190 1143 HB3 PHE 150 1HB PHE 150 3.468 -3.180 -3.454 1144 HD1 PHE 150 1HD PHE 150 2.441 -3.238 0.126 1145 HD2 PHE 150 2HD PHE 150 3.691 -5.533 -3.283 1146 HE1 PHE 150 1HE PHE 150 1.903 -5.335 1.337 1147 HE2 PHE 150 2HE PHE 150 3.153 -7.628 -2.073 1148 HZ PHE 150 HZ PHE 150 2.264 -7.528 0.237 1149 H ALA 151 H ALA 151 5.979 -3.189 -4.101 1150 HA ALA 151 HA ALA 151 6.932 -5.763 -3.230 1151 HB1 ALA 151 1HB ALA 151 6.512 -4.817 -5.642 1152 HB2 ALA 151 2HB ALA 151 7.788 -6.004 -5.377 1153 HB3 ALA 151 3HB ALA 151 8.190 -4.293 -5.519 1154 H ASN 152 H ASN 152 8.743 -2.730 -3.880 1155 HA ASN 152 HA ASN 152 11.266 -3.762 -3.099 1156 HB2 ASN 152 2HB ASN 152 11.918 -1.378 -2.749 1157 HB3 ASN 152 1HB ASN 152 11.096 -1.646 -4.286 1158 HD21 ASN 152 1HD2 ASN 152 11.115 0.941 -3.032 1159 HD22 ASN 152 2HD2 ASN 152 9.530 1.304 -2.549 1160 H VAL 153 H VAL 153 8.840 -2.038 -1.115 1161 HA VAL 153 HA VAL 153 10.421 -2.216 1.292 1162 HB VAL 153 HB VAL 153 8.444 -1.469 2.443 1163 HG11 VAL 153 1HG1 VAL 153 7.669 0.392 0.833 1164 HG12 VAL 153 2HG1 VAL 153 8.822 -0.296 -0.309 1165 HG13 VAL 153 3HG1 VAL 153 9.382 0.332 1.240 1166 HG21 VAL 153 1HG2 VAL 153 6.311 -1.291 0.870 1167 HG22 VAL 153 2HG2 VAL 153 6.651 -2.771 1.770 1168 HG23 VAL 153 3HG2 VAL 153 7.083 -2.655 0.065 1169 H ILE 154 H ILE 154 8.244 -4.393 -0.355 1170 HA ILE 154 HA ILE 154 7.894 -6.143 1.962 1171 HB ILE 154 HB ILE 154 7.137 -6.298 -0.945 1172 HG12 ILE 154 2HG1 ILE 154 5.894 -4.977 0.992 1173 HG13 ILE 154 1HG1 ILE 154 4.969 -5.891 -0.197 1174 HG21 ILE 154 1HG2 ILE 154 7.579 -8.547 -0.551 1175 HG22 ILE 154 2HG2 ILE 154 5.874 -8.416 -0.118 1176 HG23 ILE 154 3HG2 ILE 154 7.107 -8.445 1.145 1177 HD11 ILE 154 1HD1 ILE 154 4.636 -7.709 1.288 1178 HD12 ILE 154 2HD1 ILE 154 4.375 -6.270 2.273 1179 HD13 ILE 154 3HD1 ILE 154 5.898 -7.149 2.385 Start of MODEL 8 1 H1 MET 1 1HT MET 1 2.401 3.357 -5.495 2 H2 MET 1 2HT MET 1 2.943 3.891 -7.013 3 H3 MET 1 3HT MET 1 1.455 3.081 -6.876 4 HA MET 1 HA MET 1 0.348 4.903 -6.249 5 HB2 MET 1 2HB MET 1 2.712 5.137 -4.491 6 HB3 MET 1 1HB MET 1 1.936 6.668 -4.894 7 HG2 MET 1 2HG MET 1 0.913 5.749 -2.873 8 HG3 MET 1 1HG MET 1 -0.254 5.705 -4.194 9 HE1 MET 1 1HE MET 1 -1.809 3.884 -4.070 10 HE2 MET 1 2HE MET 1 -1.438 4.079 -2.359 11 HE3 MET 1 3HE MET 1 -1.562 2.462 -3.048 12 HA PRO 2 HA PRO 2 2.587 6.634 -9.947 13 HB2 PRO 2 2HB PRO 2 -0.236 7.114 -10.710 14 HB3 PRO 2 1HB PRO 2 1.074 6.377 -11.647 15 HG2 PRO 2 2HG PRO 2 -0.930 4.933 -10.610 16 HG3 PRO 2 1HG PRO 2 0.715 4.299 -10.773 17 HD2 PRO 2 2HD PRO 2 -0.716 5.208 -8.316 18 HD3 PRO 2 1HD PRO 2 0.534 3.958 -8.499 19 H GLU 3 H GLU 3 2.822 8.852 -10.525 20 HA GLU 3 HA GLU 3 2.136 10.766 -8.492 21 HB2 GLU 3 2HB GLU 3 3.114 11.183 -11.321 22 HB3 GLU 3 1HB GLU 3 3.076 12.426 -10.074 23 HG2 GLU 3 2HG GLU 3 4.560 11.012 -8.660 24 HG3 GLU 3 1HG GLU 3 4.650 9.833 -9.968 25 H GLU 4 H GLU 4 0.662 9.840 -11.534 26 HA GLU 4 HA GLU 4 -1.424 11.934 -11.170 27 HB2 GLU 4 2HB GLU 4 -0.826 10.276 -13.628 28 HB3 GLU 4 1HB GLU 4 -1.940 11.639 -13.518 29 HG2 GLU 4 2HG GLU 4 -0.010 13.096 -12.861 30 HG3 GLU 4 1HG GLU 4 1.067 11.732 -13.152 31 H ILE 5 H ILE 5 -3.652 11.101 -12.093 32 HA ILE 5 HA ILE 5 -4.155 8.438 -10.831 33 HB ILE 5 HB ILE 5 -6.342 10.374 -11.527 34 HG12 ILE 5 2HG1 ILE 5 -4.398 10.589 -9.224 35 HG13 ILE 5 1HG1 ILE 5 -4.858 11.842 -10.372 36 HG21 ILE 5 1HG2 ILE 5 -6.682 8.007 -10.631 37 HG22 ILE 5 2HG2 ILE 5 -7.475 9.297 -9.728 38 HG23 ILE 5 3HG2 ILE 5 -5.982 8.583 -9.119 39 HD11 ILE 5 1HD1 ILE 5 -6.061 12.311 -8.348 40 HD12 ILE 5 2HD1 ILE 5 -6.573 10.631 -8.189 41 HD13 ILE 5 3HD1 ILE 5 -7.231 11.634 -9.480 42 HA PRO 6 HA PRO 6 -4.941 7.786 -15.371 43 HB2 PRO 6 2HB PRO 6 -3.658 5.415 -15.619 44 HB3 PRO 6 1HB PRO 6 -2.793 6.965 -15.678 45 HG2 PRO 6 2HG PRO 6 -3.047 5.023 -13.435 46 HG3 PRO 6 1HG PRO 6 -1.640 5.962 -13.963 47 HD2 PRO 6 2HD PRO 6 -3.224 6.670 -11.826 48 HD3 PRO 6 1HD PRO 6 -2.274 7.826 -12.785 49 H ASP 7 H ASP 7 -6.220 6.007 -16.403 50 HA ASP 7 HA ASP 7 -8.296 5.039 -14.670 51 HB2 ASP 7 2HB ASP 7 -7.536 4.273 -17.507 52 HB3 ASP 7 1HB ASP 7 -9.009 3.745 -16.698 53 H VAL 8 H VAL 8 -7.953 2.347 -16.397 54 HA VAL 8 HA VAL 8 -7.324 0.625 -14.299 55 HB VAL 8 HB VAL 8 -6.553 0.183 -17.200 56 HG11 VAL 8 1HG1 VAL 8 -6.111 -1.387 -14.932 57 HG12 VAL 8 2HG1 VAL 8 -6.079 -1.943 -16.606 58 HG13 VAL 8 3HG1 VAL 8 -7.561 -2.078 -15.660 59 HG21 VAL 8 1HG2 VAL 8 -8.747 -0.048 -17.704 60 HG22 VAL 8 2HG2 VAL 8 -9.080 0.761 -16.174 61 HG23 VAL 8 3HG2 VAL 8 -9.053 -0.999 -16.251 62 H ARG 9 H ARG 9 -5.450 -0.045 -13.315 63 HA ARG 9 HA ARG 9 -2.999 1.427 -13.998 64 HB2 ARG 9 2HB ARG 9 -3.767 -0.313 -11.659 65 HB3 ARG 9 1HB ARG 9 -2.142 0.326 -11.871 66 HG2 ARG 9 2HG ARG 9 -4.437 2.222 -12.106 67 HG3 ARG 9 1HG ARG 9 -3.976 1.671 -10.500 68 HD2 ARG 9 2HD ARG 9 -1.993 2.807 -12.481 69 HD3 ARG 9 1HD ARG 9 -2.814 3.790 -11.268 70 HE ARG 9 HE ARG 9 -0.593 2.012 -10.765 71 HH11 ARG 9 1HH1 ARG 9 0.006 1.717 -8.603 72 HH12 ARG 9 2HH1 ARG 9 -1.098 2.160 -7.345 73 HH21 ARG 9 1HH2 ARG 9 -3.567 3.241 -9.527 74 HH22 ARG 9 2HH2 ARG 9 -3.120 3.022 -7.868 75 H LYS 10 H LYS 10 -1.107 -0.508 -13.031 76 HA LYS 10 HA LYS 10 -1.215 -2.480 -15.268 77 HB2 LYS 10 2HB LYS 10 1.121 -1.048 -14.005 78 HB3 LYS 10 1HB LYS 10 1.290 -2.374 -15.146 79 HG2 LYS 10 2HG LYS 10 -0.064 -1.076 -16.786 80 HG3 LYS 10 1HG LYS 10 -0.078 0.275 -15.650 81 HD2 LYS 10 2HD LYS 10 2.418 0.281 -15.687 82 HD3 LYS 10 1HD LYS 10 2.373 -0.983 -16.916 83 HE2 LYS 10 2HE LYS 10 2.422 0.800 -18.349 84 HE3 LYS 10 1HE LYS 10 0.685 0.814 -18.040 85 HZ1 LYS 10 1HZ LYS 10 2.520 2.819 -17.483 86 HZ2 LYS 10 2HZ LYS 10 2.030 2.192 -15.982 87 HZ3 LYS 10 3HZ LYS 10 0.873 2.781 -17.078 88 H SER 11 H SER 11 0.631 -4.221 -14.748 89 HA SER 11 HA SER 11 0.095 -5.263 -11.988 90 HB2 SER 11 2HB SER 11 -1.007 -6.555 -13.860 91 HB3 SER 11 1HB SER 11 0.598 -6.922 -14.472 92 HG SER 11 HG SER 11 -0.212 -8.555 -13.074 93 H VAL 12 H VAL 12 1.877 -6.196 -10.913 94 HA VAL 12 HA VAL 12 4.487 -6.125 -12.347 95 HB VAL 12 HB VAL 12 3.859 -4.845 -9.695 96 HG11 VAL 12 1HG1 VAL 12 6.469 -5.730 -10.908 97 HG12 VAL 12 2HG1 VAL 12 5.901 -5.934 -9.251 98 HG13 VAL 12 3HG1 VAL 12 6.411 -4.345 -9.819 99 HG21 VAL 12 1HG2 VAL 12 3.472 -3.445 -11.664 100 HG22 VAL 12 2HG2 VAL 12 5.070 -3.855 -12.288 101 HG23 VAL 12 3HG2 VAL 12 4.918 -2.886 -10.823 102 H VAL 13 H VAL 13 6.072 -7.546 -11.484 103 HA VAL 13 HA VAL 13 4.892 -9.759 -9.867 104 HB VAL 13 HB VAL 13 7.466 -9.710 -11.477 105 HG11 VAL 13 1HG1 VAL 13 7.569 -11.397 -9.770 106 HG12 VAL 13 2HG1 VAL 13 7.163 -12.223 -11.274 107 HG13 VAL 13 3HG1 VAL 13 5.906 -11.897 -10.081 108 HG21 VAL 13 1HG2 VAL 13 5.138 -11.326 -12.355 109 HG22 VAL 13 2HG2 VAL 13 6.309 -10.426 -13.317 110 HG23 VAL 13 3HG2 VAL 13 4.967 -9.581 -12.544 111 H VAL 14 H VAL 14 5.648 -10.128 -7.812 112 HA VAL 14 HA VAL 14 8.138 -8.697 -6.976 113 HB VAL 14 HB VAL 14 7.091 -8.196 -4.825 114 HG11 VAL 14 1HG1 VAL 14 5.574 -6.493 -5.560 115 HG12 VAL 14 2HG1 VAL 14 5.166 -7.397 -7.019 116 HG13 VAL 14 3HG1 VAL 14 6.767 -6.679 -6.846 117 HG21 VAL 14 1HG2 VAL 14 4.528 -8.618 -4.745 118 HG22 VAL 14 2HG2 VAL 14 5.599 -9.986 -4.443 119 HG23 VAL 14 3HG2 VAL 14 4.832 -9.798 -6.020 120 H ALA 15 H ALA 15 9.266 -9.736 -5.172 121 HA ALA 15 HA ALA 15 8.956 -12.671 -5.282 122 HB1 ALA 15 1HB ALA 15 11.026 -11.008 -3.817 123 HB2 ALA 15 2HB ALA 15 11.211 -11.596 -5.470 124 HB3 ALA 15 3HB ALA 15 11.102 -12.742 -4.132 125 H ALA 16 H ALA 16 7.113 -13.074 -4.025 126 HA ALA 16 HA ALA 16 7.524 -13.119 -1.154 127 HB1 ALA 16 1HB ALA 16 6.810 -10.772 -1.406 128 HB2 ALA 16 2HB ALA 16 5.569 -11.712 -0.575 129 HB3 ALA 16 3HB ALA 16 5.370 -11.298 -2.278 130 H SER 17 H SER 17 6.138 -14.662 -0.214 131 HA SER 17 HA SER 17 4.820 -16.483 -2.011 132 HB2 SER 17 2HB SER 17 4.510 -16.230 0.994 133 HB3 SER 17 1HB SER 17 4.056 -17.625 0.021 134 HG SER 17 HG SER 17 6.528 -17.086 -0.618 135 H VAL 18 H VAL 18 2.559 -16.836 -2.290 136 HA VAL 18 HA VAL 18 0.932 -14.519 -2.466 137 HB VAL 18 HB VAL 18 -0.561 -17.025 -2.063 138 HG11 VAL 18 1HG1 VAL 18 -1.696 -16.307 -3.981 139 HG12 VAL 18 2HG1 VAL 18 -0.284 -15.467 -4.620 140 HG13 VAL 18 3HG1 VAL 18 -1.178 -14.782 -3.265 141 HG21 VAL 18 1HG2 VAL 18 1.763 -16.873 -3.987 142 HG22 VAL 18 2HG2 VAL 18 0.366 -17.895 -4.318 143 HG23 VAL 18 3HG2 VAL 18 1.342 -18.180 -2.877 144 H GLU 19 H GLU 19 1.076 -17.051 0.030 145 HA GLU 19 HA GLU 19 -1.033 -16.082 1.674 146 HB2 GLU 19 2HB GLU 19 1.545 -17.479 2.462 147 HB3 GLU 19 1HB GLU 19 0.152 -17.268 3.522 148 HG2 GLU 19 2HG GLU 19 0.099 -18.722 0.861 149 HG3 GLU 19 1HG GLU 19 0.168 -19.506 2.440 150 H HIS 20 H HIS 20 2.364 -15.167 1.406 151 HA HIS 20 HA HIS 20 2.519 -13.455 3.668 152 HB2 HIS 20 2HB HIS 20 4.418 -14.283 2.180 153 HB3 HIS 20 1HB HIS 20 3.938 -13.039 1.028 154 HD1 HIS 20 1HD HIS 20 4.602 -13.157 4.788 155 HD2 HIS 20 2HD HIS 20 5.365 -10.731 1.483 156 HE1 HIS 20 1HE HIS 20 5.955 -11.198 5.636 157 HE2 HIS 20 2HE HIS 20 6.427 -9.714 3.634 158 H CYS 21 H CYS 21 1.437 -12.889 0.335 159 HA CYS 21 HA CYS 21 1.199 -10.096 0.348 160 HB2 CYS 21 2HB CYS 21 -0.829 -11.992 -0.872 161 HB3 CYS 21 1HB CYS 21 -0.409 -10.372 -1.422 162 HG CYS 21 HG CYS 21 2.128 -11.650 -1.653 163 H PHE 22 H PHE 22 -1.455 -12.392 1.111 164 HA PHE 22 HA PHE 22 -3.131 -10.275 2.152 165 HB2 PHE 22 2HB PHE 22 -3.502 -13.163 2.883 166 HB3 PHE 22 1HB PHE 22 -4.724 -11.941 2.518 167 HD1 PHE 22 1HD PHE 22 -5.262 -11.338 0.197 168 HD2 PHE 22 2HD PHE 22 -2.243 -14.249 1.111 169 HE1 PHE 22 1HE PHE 22 -5.231 -12.054 -2.176 170 HE2 PHE 22 2HE PHE 22 -2.215 -14.968 -1.255 171 HZ PHE 22 HZ PHE 22 -3.706 -13.869 -2.898 172 H GLU 23 H GLU 23 -0.947 -12.632 3.624 173 HA GLU 23 HA GLU 23 -1.707 -12.037 6.340 174 HB2 GLU 23 2HB GLU 23 0.807 -13.250 5.166 175 HB3 GLU 23 1HB GLU 23 0.506 -13.119 6.898 176 HG2 GLU 23 2HG GLU 23 -1.318 -14.543 4.936 177 HG3 GLU 23 1HG GLU 23 -0.150 -15.346 5.986 178 H VAL 24 H VAL 24 0.660 -10.646 4.112 179 HA VAL 24 HA VAL 24 2.143 -9.133 6.000 180 HB VAL 24 HB VAL 24 1.601 -8.922 3.071 181 HG11 VAL 24 1HG1 VAL 24 2.653 -6.712 4.836 182 HG12 VAL 24 2HG1 VAL 24 1.429 -6.616 3.572 183 HG13 VAL 24 3HG1 VAL 24 3.123 -6.841 3.143 184 HG21 VAL 24 1HG2 VAL 24 3.413 -10.340 3.955 185 HG22 VAL 24 2HG2 VAL 24 4.099 -8.949 4.795 186 HG23 VAL 24 3HG2 VAL 24 4.077 -8.991 3.032 187 H PHE 25 H PHE 25 -0.791 -8.224 4.150 188 HA PHE 25 HA PHE 25 -0.984 -5.583 5.234 189 HB2 PHE 25 2HB PHE 25 -3.437 -7.213 4.639 190 HB3 PHE 25 1HB PHE 25 -3.135 -5.507 4.318 191 HD1 PHE 25 1HD PHE 25 -3.890 -8.178 2.576 192 HD2 PHE 25 2HD PHE 25 -0.512 -5.566 2.986 193 HE1 PHE 25 1HE PHE 25 -3.166 -8.755 0.270 194 HE2 PHE 25 2HE PHE 25 0.219 -6.139 0.684 195 HZ PHE 25 HZ PHE 25 -1.110 -7.735 -0.674 196 H THR 26 H THR 26 -2.243 -8.699 6.356 197 HA THR 26 HA THR 26 -3.420 -7.396 8.733 198 HB THR 26 HB THR 26 -4.481 -9.534 9.132 199 HG1 THR 26 1HG THR 26 -3.207 -11.137 8.646 200 HG21 THR 26 1HG2 THR 26 -5.542 -9.916 6.841 201 HG22 THR 26 2HG2 THR 26 -4.448 -8.673 6.235 202 HG23 THR 26 3HG2 THR 26 -5.638 -8.272 7.473 203 H SER 27 H SER 27 -0.400 -8.661 7.955 204 HA SER 27 HA SER 27 0.035 -9.591 10.766 205 HB2 SER 27 2HB SER 27 0.514 -11.245 8.955 206 HB3 SER 27 1HB SER 27 1.757 -10.154 8.353 207 HG SER 27 HG SER 27 2.931 -11.247 9.737 208 H ARG 28 H ARG 28 1.823 -7.874 8.159 209 HA ARG 28 HA ARG 28 3.100 -6.249 10.333 210 HB2 ARG 28 2HB ARG 28 5.131 -6.182 8.880 211 HB3 ARG 28 1HB ARG 28 4.734 -7.812 9.427 212 HG2 ARG 28 2HG ARG 28 4.425 -8.523 7.311 213 HG3 ARG 28 1HG ARG 28 3.333 -7.180 6.967 214 HD2 ARG 28 2HD ARG 28 5.326 -7.124 5.498 215 HD3 ARG 28 1HD ARG 28 5.253 -5.705 6.544 216 HE ARG 28 HE ARG 28 6.818 -7.379 8.016 217 HH11 ARG 28 1HH1 ARG 28 9.048 -7.640 7.757 218 HH12 ARG 28 2HH1 ARG 28 9.769 -7.338 6.211 219 HH21 ARG 28 1HH2 ARG 28 6.771 -6.494 4.684 220 HH22 ARG 28 2HH2 ARG 28 8.479 -6.689 4.471 221 HA PRO 29 HA PRO 29 1.064 -3.676 6.884 222 HB2 PRO 29 2HB PRO 29 -0.764 -2.438 8.557 223 HB3 PRO 29 1HB PRO 29 -1.119 -3.837 7.532 224 HG2 PRO 29 2HG PRO 29 -0.582 -3.707 10.439 225 HG3 PRO 29 1HG PRO 29 -1.634 -4.803 9.528 226 HD2 PRO 29 2HD PRO 29 0.825 -5.535 10.512 227 HD3 PRO 29 1HD PRO 29 0.072 -6.287 9.089 228 H ALA 30 H ALA 30 1.689 -2.875 10.294 229 HA ALA 30 HA ALA 30 2.222 -0.078 9.819 230 HB1 ALA 30 1HB ALA 30 2.842 -1.960 12.096 231 HB2 ALA 30 2HB ALA 30 1.611 -0.699 12.032 232 HB3 ALA 30 3HB ALA 30 3.317 -0.262 12.124 233 H ASP 31 H ASP 31 4.146 -2.968 9.591 234 HA ASP 31 HA ASP 31 6.737 -1.908 9.946 235 HB2 ASP 31 2HB ASP 31 6.169 -4.329 9.703 236 HB3 ASP 31 1HB ASP 31 5.948 -4.062 7.973 237 H TRP 32 H TRP 32 4.614 -1.669 7.114 238 HA TRP 32 HA TRP 32 6.775 -0.052 5.811 239 HB2 TRP 32 2HB TRP 32 6.630 -1.264 3.920 240 HB3 TRP 32 1HB TRP 32 5.746 -2.451 4.877 241 HD1 TRP 32 HD TRP 32 5.141 0.555 2.566 242 HE1 TRP 32 1HE TRP 32 2.778 0.360 1.566 243 HE3 TRP 32 3HE TRP 32 3.450 -3.511 5.124 244 HZ2 TRP 32 2HZ TRP 32 0.477 -1.304 1.817 245 HZ3 TRP 32 3HZ TRP 32 1.164 -4.390 4.723 246 HH2 TRP 32 HH TRP 32 -0.325 -3.290 3.073 247 H TRP 33 H TRP 33 3.619 0.029 7.039 248 HA TRP 33 HA TRP 33 2.206 1.627 5.221 249 HB2 TRP 33 2HB TRP 33 1.767 0.834 7.808 250 HB3 TRP 33 1HB TRP 33 1.978 2.574 7.999 251 HD1 TRP 33 HD TRP 33 0.066 4.113 7.223 252 HE1 TRP 33 1HE TRP 33 -2.227 3.720 6.109 253 HE3 TRP 33 3HE TRP 33 0.499 -0.834 6.025 254 HZ2 TRP 33 2HZ TRP 33 -3.682 1.590 4.875 255 HZ3 TRP 33 3HZ TRP 33 -1.353 -2.018 4.880 256 HH2 TRP 33 HH TRP 33 -3.442 -0.813 4.303 257 HA PRO 34 HA PRO 34 4.579 5.457 6.662 258 HB2 PRO 34 2HB PRO 34 6.374 5.262 8.686 259 HB3 PRO 34 1HB PRO 34 4.625 5.344 8.968 260 HG2 PRO 34 2HG PRO 34 6.451 3.096 9.317 261 HG3 PRO 34 1HG PRO 34 4.810 3.320 9.940 262 HD2 PRO 34 2HD PRO 34 5.677 1.810 7.590 263 HD3 PRO 34 1HD PRO 34 4.076 1.844 8.360 264 HA PRO 35 HA PRO 35 8.382 4.213 4.406 265 HB2 PRO 35 2HB PRO 35 8.085 5.773 2.248 266 HB3 PRO 35 1HB PRO 35 7.064 4.341 2.481 267 HG2 PRO 35 2HG PRO 35 6.409 7.210 2.891 268 HG3 PRO 35 1HG PRO 35 5.394 5.894 2.279 269 HD2 PRO 35 2HD PRO 35 5.401 6.881 4.927 270 HD3 PRO 35 1HD PRO 35 4.658 5.365 4.376 271 H SER 36 H SER 36 8.400 7.284 2.982 272 HA SER 36 HA SER 36 10.113 8.424 5.149 273 HB2 SER 36 2HB SER 36 10.681 8.516 2.171 274 HB3 SER 36 1HB SER 36 11.648 9.282 3.427 275 HG SER 36 HG SER 36 11.360 6.798 4.168 276 H HIS 37 H HIS 37 9.984 10.714 5.340 277 HA HIS 37 HA HIS 37 8.702 12.701 5.341 278 HB2 HIS 37 2HB HIS 37 8.867 12.203 2.353 279 HB3 HIS 37 1HB HIS 37 8.605 13.758 3.141 280 HD1 HIS 37 1HD HIS 37 10.644 14.415 4.914 281 HD2 HIS 37 2HD HIS 37 11.540 11.688 1.887 282 HE1 HIS 37 1HE HIS 37 13.172 14.362 4.721 283 HE2 HIS 37 2HE HIS 37 13.727 12.706 2.881 284 H VAL 38 H VAL 38 6.714 12.019 6.241 285 HA VAL 38 HA VAL 38 4.624 11.146 4.289 286 HB VAL 38 HB VAL 38 4.590 10.941 7.314 287 HG11 VAL 38 1HG1 VAL 38 2.950 9.119 5.707 288 HG12 VAL 38 2HG1 VAL 38 2.511 10.811 5.485 289 HG13 VAL 38 3HG1 VAL 38 2.499 10.102 7.100 290 HG21 VAL 38 1HG2 VAL 38 4.810 8.401 6.530 291 HG22 VAL 38 2HG2 VAL 38 6.239 9.400 6.796 292 HG23 VAL 38 3HG2 VAL 38 5.633 9.145 5.159 293 H LEU 39 H LEU 39 2.861 12.448 3.962 294 HA LEU 39 HA LEU 39 2.898 15.182 4.749 295 HB2 LEU 39 2HB LEU 39 0.523 13.501 3.886 296 HB3 LEU 39 1HB LEU 39 0.588 15.265 3.893 297 HG LEU 39 HG LEU 39 2.399 13.445 2.277 298 HD11 LEU 39 1HD1 LEU 39 -0.210 14.044 1.745 299 HD12 LEU 39 2HD1 LEU 39 1.002 13.745 0.500 300 HD13 LEU 39 3HD1 LEU 39 0.605 15.399 0.966 301 HD21 LEU 39 1HD2 LEU 39 2.322 16.388 2.820 302 HD22 LEU 39 2HD2 LEU 39 2.766 15.855 1.199 303 HD23 LEU 39 3HD2 LEU 39 3.713 15.327 2.590 304 H VAL 40 H VAL 40 1.474 12.339 6.263 305 HA VAL 40 HA VAL 40 -0.285 13.610 8.090 306 HB VAL 40 HB VAL 40 1.442 11.234 8.785 307 HG11 VAL 40 1HG1 VAL 40 -0.139 12.353 10.462 308 HG12 VAL 40 2HG1 VAL 40 -0.353 10.619 10.216 309 HG13 VAL 40 3HG1 VAL 40 -1.455 11.762 9.448 310 HG21 VAL 40 1HG2 VAL 40 0.464 10.950 6.497 311 HG22 VAL 40 2HG2 VAL 40 -1.137 11.228 7.180 312 HG23 VAL 40 3HG2 VAL 40 -0.206 9.810 7.663 313 H LYS 41 H LYS 41 0.123 14.864 9.896 314 HA LYS 41 HA LYS 41 2.698 15.949 10.379 315 HB2 LYS 41 2HB LYS 41 0.499 16.912 11.167 316 HB3 LYS 41 1HB LYS 41 0.492 15.681 12.428 317 HG2 LYS 41 2HG LYS 41 2.684 16.519 13.236 318 HG3 LYS 41 1HG LYS 41 2.632 17.785 12.011 319 HD2 LYS 41 2HD LYS 41 0.464 18.571 13.000 320 HD3 LYS 41 1HD LYS 41 0.679 17.393 14.295 321 HE2 LYS 41 2HE LYS 41 3.006 18.499 14.621 322 HE3 LYS 41 1HE LYS 41 2.338 19.832 13.679 323 HZ1 LYS 41 1HZ LYS 41 2.074 19.982 16.163 324 HZ2 LYS 41 2HZ LYS 41 0.958 18.706 16.044 325 HZ3 LYS 41 3HZ LYS 41 0.655 20.181 15.257 326 H LYS 42 H LYS 42 1.001 13.233 11.897 327 HA LYS 42 HA LYS 42 3.484 12.563 13.405 328 HB2 LYS 42 2HB LYS 42 0.676 11.476 13.693 329 HB3 LYS 42 1HB LYS 42 2.039 11.073 14.731 330 HG2 LYS 42 2HG LYS 42 1.018 13.898 14.340 331 HG3 LYS 42 1HG LYS 42 0.489 12.853 15.656 332 HD2 LYS 42 2HD LYS 42 2.282 13.545 16.832 333 HD3 LYS 42 1HD LYS 42 3.302 12.695 15.674 334 HE2 LYS 42 2HE LYS 42 3.484 14.667 14.289 335 HE3 LYS 42 1HE LYS 42 2.301 15.526 15.273 336 HZ1 LYS 42 1HZ LYS 42 5.073 14.784 15.931 337 HZ2 LYS 42 2HZ LYS 42 3.939 15.018 17.176 338 HZ3 LYS 42 3HZ LYS 42 4.298 16.283 16.100 339 H GLU 43 H GLU 43 4.339 10.402 13.232 340 HA GLU 43 HA GLU 43 3.856 9.196 10.590 341 HB2 GLU 43 2HB GLU 43 6.166 9.436 11.549 342 HB3 GLU 43 1HB GLU 43 5.718 8.279 12.804 343 HG2 GLU 43 2HG GLU 43 5.178 6.614 11.028 344 HG3 GLU 43 1HG GLU 43 5.745 7.764 9.816 345 H ARG 44 H ARG 44 2.547 7.445 10.276 346 HA ARG 44 HA ARG 44 0.921 6.447 12.415 347 HB2 ARG 44 2HB ARG 44 1.414 5.422 9.615 348 HB3 ARG 44 1HB ARG 44 0.254 4.688 10.724 349 HG2 ARG 44 2HG ARG 44 -0.750 7.027 10.992 350 HG3 ARG 44 1HG ARG 44 0.229 7.494 9.601 351 HD2 ARG 44 2HD ARG 44 -0.890 5.961 8.170 352 HD3 ARG 44 1HD ARG 44 -1.619 5.110 9.529 353 HE ARG 44 HE ARG 44 -3.186 6.909 9.784 354 HH11 ARG 44 1HH1 ARG 44 -4.351 8.578 8.812 355 HH12 ARG 44 2HH1 ARG 44 -3.719 9.351 7.397 356 HH21 ARG 44 1HH2 ARG 44 -0.851 7.416 7.282 357 HH22 ARG 44 2HH2 ARG 44 -1.744 8.693 6.534 358 H ALA 45 H ALA 45 1.022 4.549 13.571 359 HA ALA 45 HA ALA 45 3.454 2.859 13.176 360 HB1 ALA 45 1HB ALA 45 2.654 3.063 15.963 361 HB2 ALA 45 2HB ALA 45 3.069 4.640 15.294 362 HB3 ALA 45 3HB ALA 45 4.239 3.322 15.234 363 H GLY 46 H GLY 46 0.258 3.086 14.785 364 HA2 GLY 46 2HA GLY 46 0.144 0.123 14.861 365 HA3 GLY 46 1HA GLY 46 -1.013 1.217 15.620 366 H LEU 47 H LEU 47 -1.542 -1.059 13.797 367 HA LEU 47 HA LEU 47 -3.372 0.368 12.007 368 HB2 LEU 47 2HB LEU 47 -1.250 0.259 10.723 369 HB3 LEU 47 1HB LEU 47 -1.284 -1.494 10.851 370 HG LEU 47 HG LEU 47 -3.649 0.012 9.749 371 HD11 LEU 47 1HD1 LEU 47 -1.013 -0.184 8.537 372 HD12 LEU 47 2HD1 LEU 47 -2.433 0.701 7.987 373 HD13 LEU 47 3HD1 LEU 47 -2.231 -0.995 7.554 374 HD21 LEU 47 1HD2 LEU 47 -3.492 -2.297 8.354 375 HD22 LEU 47 2HD2 LEU 47 -4.343 -2.168 9.890 376 HD23 LEU 47 3HD2 LEU 47 -2.706 -2.813 9.842 377 H ALA 48 H ALA 48 -5.212 -0.776 11.878 378 HA ALA 48 HA ALA 48 -5.188 -3.715 11.945 379 HB1 ALA 48 1HB ALA 48 -6.760 -3.826 13.872 380 HB2 ALA 48 2HB ALA 48 -6.548 -2.092 14.116 381 HB3 ALA 48 3HB ALA 48 -5.183 -3.186 14.338 382 H PHE 49 H PHE 49 -6.908 -4.488 10.737 383 HA PHE 49 HA PHE 49 -9.289 -2.765 10.409 384 HB2 PHE 49 2HB PHE 49 -9.215 -2.769 7.997 385 HB3 PHE 49 1HB PHE 49 -7.685 -2.123 8.589 386 HD1 PHE 49 1HD PHE 49 -5.654 -3.617 8.647 387 HD2 PHE 49 2HD PHE 49 -9.315 -4.765 6.717 388 HE1 PHE 49 1HE PHE 49 -4.435 -5.349 7.360 389 HE2 PHE 49 2HE PHE 49 -8.095 -6.500 5.434 390 HZ PHE 49 HZ PHE 49 -5.654 -6.788 5.751 391 H GLU 50 H GLU 50 -11.146 -3.915 9.764 392 HA GLU 50 HA GLU 50 -10.964 -6.825 10.204 393 HB2 GLU 50 2HB GLU 50 -13.576 -5.608 9.535 394 HB3 GLU 50 1HB GLU 50 -13.147 -6.690 10.861 395 HG2 GLU 50 2HG GLU 50 -11.872 -4.679 11.851 396 HG3 GLU 50 1HG GLU 50 -12.776 -3.700 10.695 397 HA PRO 51 HA PRO 51 -11.012 -7.086 5.661 398 HB2 PRO 51 2HB PRO 51 -10.391 -9.724 5.451 399 HB3 PRO 51 1HB PRO 51 -9.183 -8.473 5.794 400 HG2 PRO 51 2HG PRO 51 -10.463 -10.419 7.627 401 HG3 PRO 51 1HG PRO 51 -8.817 -9.765 7.638 402 HD2 PRO 51 2HD PRO 51 -10.875 -8.909 9.304 403 HD3 PRO 51 1HD PRO 51 -9.414 -7.969 8.931 404 H PHE 52 H PHE 52 -13.296 -6.805 5.422 405 HA PHE 52 HA PHE 52 -14.727 -9.237 4.664 406 HB2 PHE 52 2HB PHE 52 -15.904 -7.517 6.870 407 HB3 PHE 52 1HB PHE 52 -16.576 -9.007 6.207 408 HD1 PHE 52 1HD PHE 52 -15.311 -11.183 6.528 409 HD2 PHE 52 2HD PHE 52 -14.271 -7.561 8.584 410 HE1 PHE 52 1HE PHE 52 -14.000 -12.495 8.176 411 HE2 PHE 52 2HE PHE 52 -12.964 -8.868 10.231 412 HZ PHE 52 HZ PHE 52 -12.822 -11.336 10.027 413 H VAL 53 H VAL 53 -17.132 -8.421 4.035 414 HA VAL 53 HA VAL 53 -16.676 -6.143 2.250 415 HB VAL 53 HB VAL 53 -19.297 -7.565 2.812 416 HG11 VAL 53 1HG1 VAL 53 -19.725 -5.602 1.570 417 HG12 VAL 53 2HG1 VAL 53 -19.596 -6.855 0.336 418 HG13 VAL 53 3HG1 VAL 53 -18.240 -5.764 0.632 419 HG21 VAL 53 1HG2 VAL 53 -17.909 -8.338 0.369 420 HG22 VAL 53 2HG2 VAL 53 -18.596 -9.360 1.631 421 HG23 VAL 53 3HG2 VAL 53 -16.959 -8.730 1.801 422 H GLY 54 H GLY 54 -17.034 -4.059 2.859 423 HA2 GLY 54 2HA GLY 54 -18.135 -2.244 3.928 424 HA3 GLY 54 1HA GLY 54 -19.216 -3.402 4.712 425 H GLY 55 H GLY 55 -15.856 -4.119 4.885 426 HA2 GLY 55 2HA GLY 55 -15.861 -3.956 7.778 427 HA3 GLY 55 1HA GLY 55 -14.461 -4.320 6.768 428 H ARG 56 H ARG 56 -13.775 -2.734 8.755 429 HA ARG 56 HA ARG 56 -13.645 -0.015 7.519 430 HB2 ARG 56 2HB ARG 56 -14.135 -0.706 10.428 431 HB3 ARG 56 1HB ARG 56 -13.724 0.915 9.859 432 HG2 ARG 56 2HG ARG 56 -15.700 0.872 8.358 433 HG3 ARG 56 1HG ARG 56 -16.127 -0.719 8.985 434 HD2 ARG 56 2HD ARG 56 -15.875 1.787 10.673 435 HD3 ARG 56 1HD ARG 56 -17.400 1.115 10.096 436 HE ARG 56 HE ARG 56 -15.744 -0.768 11.619 437 HH11 ARG 56 1HH1 ARG 56 -16.669 -1.478 13.555 438 HH12 ARG 56 2HH1 ARG 56 -18.054 -0.655 14.190 439 HH21 ARG 56 1HH2 ARG 56 -18.205 1.646 11.600 440 HH22 ARG 56 2HH2 ARG 56 -18.925 1.113 13.083 441 H TYR 57 H TYR 57 -11.664 1.077 7.802 442 HA TYR 57 HA TYR 57 -9.430 -0.661 8.762 443 HB2 TYR 57 2HB TYR 57 -9.753 0.589 6.333 444 HB3 TYR 57 1HB TYR 57 -8.772 1.760 7.212 445 HD1 TYR 57 1HD TYR 57 -6.532 1.160 8.046 446 HD2 TYR 57 2HD TYR 57 -8.893 -1.611 5.766 447 HE1 TYR 57 1HE TYR 57 -4.521 -0.237 7.656 448 HE2 TYR 57 2HE TYR 57 -6.881 -3.010 5.382 449 HH TYR 57 HH TYR 57 -3.681 -1.977 6.532 450 H TYR 58 H TYR 58 -8.322 -0.003 10.552 451 HA TYR 58 HA TYR 58 -8.718 2.826 11.464 452 HB2 TYR 58 2HB TYR 58 -8.243 0.398 13.212 453 HB3 TYR 58 1HB TYR 58 -8.636 2.031 13.749 454 HD1 TYR 58 1HD TYR 58 -10.893 2.977 13.361 455 HD2 TYR 58 2HD TYR 58 -9.930 -1.081 12.338 456 HE1 TYR 58 1HE TYR 58 -13.310 2.445 13.193 457 HE2 TYR 58 2HE TYR 58 -12.345 -1.614 12.167 458 HH TYR 58 HH TYR 58 -14.797 0.901 12.395 459 H GLU 59 H GLU 59 -6.886 3.954 12.031 460 HA GLU 59 HA GLU 59 -4.315 2.441 12.195 461 HB2 GLU 59 2HB GLU 59 -4.791 5.030 10.680 462 HB3 GLU 59 1HB GLU 59 -3.214 4.284 10.940 463 HG2 GLU 59 2HG GLU 59 -4.007 2.245 9.770 464 HG3 GLU 59 1HG GLU 59 -5.550 3.039 9.460 465 H TRP 60 H TRP 60 -2.918 3.246 13.812 466 HA TRP 60 HA TRP 60 -4.098 5.409 15.501 467 HB2 TRP 60 2HB TRP 60 -2.158 3.175 16.123 468 HB3 TRP 60 1HB TRP 60 -2.449 4.519 17.228 469 HD1 TRP 60 HD TRP 60 -4.897 4.754 18.274 470 HE1 TRP 60 1HE TRP 60 -6.750 3.007 18.668 471 HE3 TRP 60 3HE TRP 60 -3.250 1.015 15.211 472 HZ2 TRP 60 2HZ TRP 60 -7.442 0.371 17.800 473 HZ3 TRP 60 3HZ TRP 60 -4.524 -1.102 15.015 474 HH2 TRP 60 HH TRP 60 -6.616 -1.428 16.304 475 H ASP 61 H ASP 61 -3.042 7.315 15.704 476 HA ASP 61 HA ASP 61 -0.413 7.583 14.334 477 HB2 ASP 61 2HB ASP 61 -2.412 9.631 15.320 478 HB3 ASP 61 1HB ASP 61 -0.866 10.043 14.580 479 H ILE 62 H ILE 62 1.323 8.758 15.457 480 HA ILE 62 HA ILE 62 1.870 7.832 18.053 481 HB ILE 62 HB ILE 62 2.882 10.355 16.734 482 HG12 ILE 62 2HG1 ILE 62 4.116 7.604 16.884 483 HG13 ILE 62 1HG1 ILE 62 3.234 8.209 15.491 484 HG21 ILE 62 1HG2 ILE 62 4.814 10.050 18.261 485 HG22 ILE 62 2HG2 ILE 62 3.953 8.726 19.044 486 HG23 ILE 62 3HG2 ILE 62 3.317 10.369 19.138 487 HD11 ILE 62 1HD1 ILE 62 5.950 8.539 15.940 488 HD12 ILE 62 2HD1 ILE 62 5.265 10.089 16.426 489 HD13 ILE 62 3HD1 ILE 62 4.978 9.470 14.800 490 H ASP 63 H ASP 63 0.387 10.901 17.053 491 HA ASP 63 HA ASP 63 -0.398 11.326 19.914 492 HB2 ASP 63 2HB ASP 63 1.234 13.014 19.016 493 HB3 ASP 63 1HB ASP 63 0.029 13.466 17.810 494 H GLY 64 H GLY 64 -1.406 11.199 16.576 495 HA2 GLY 64 2HA GLY 64 -4.053 12.320 17.102 496 HA3 GLY 64 1HA GLY 64 -3.532 11.567 15.594 497 H THR 65 H THR 65 -6.004 11.122 17.149 498 HA THR 65 HA THR 65 -5.844 8.547 18.445 499 HB THR 65 HB THR 65 -7.636 10.309 18.812 500 HG1 THR 65 1HG THR 65 -9.282 8.362 18.398 501 HG21 THR 65 1HG2 THR 65 -7.856 10.231 16.109 502 HG22 THR 65 2HG2 THR 65 -9.133 10.812 17.176 503 HG23 THR 65 3HG2 THR 65 -9.174 9.157 16.571 504 H GLU 66 H GLU 66 -8.278 7.538 17.049 505 HA GLU 66 HA GLU 66 -6.858 6.090 14.915 506 HB2 GLU 66 2HB GLU 66 -9.603 5.733 16.143 507 HB3 GLU 66 1HB GLU 66 -8.923 4.687 14.902 508 HG2 GLU 66 2HG GLU 66 -7.026 4.156 16.394 509 HG3 GLU 66 1HG GLU 66 -7.738 5.174 17.647 510 H ILE 67 H ILE 67 -7.253 6.386 12.760 511 HA ILE 67 HA ILE 67 -9.586 8.090 11.982 512 HB ILE 67 HB ILE 67 -6.817 8.151 10.742 513 HG12 ILE 67 2HG1 ILE 67 -8.294 10.187 12.443 514 HG13 ILE 67 1HG1 ILE 67 -6.875 9.261 12.938 515 HG21 ILE 67 1HG2 ILE 67 -8.674 8.537 9.140 516 HG22 ILE 67 2HG2 ILE 67 -7.730 10.001 9.400 517 HG23 ILE 67 3HG2 ILE 67 -9.297 9.812 10.187 518 HD11 ILE 67 1HD1 ILE 67 -7.077 11.483 10.927 519 HD12 ILE 67 2HD1 ILE 67 -5.798 10.278 10.769 520 HD13 ILE 67 3HD1 ILE 67 -5.905 11.266 12.228 521 H VAL 68 H VAL 68 -10.522 7.539 9.926 522 HA VAL 68 HA VAL 68 -10.197 4.714 9.229 523 HB VAL 68 HB VAL 68 -11.855 6.860 7.864 524 HG11 VAL 68 1HG1 VAL 68 -12.890 4.163 7.781 525 HG12 VAL 68 2HG1 VAL 68 -11.250 4.200 7.134 526 HG13 VAL 68 3HG1 VAL 68 -12.495 5.238 6.439 527 HG21 VAL 68 1HG2 VAL 68 -13.720 5.957 9.218 528 HG22 VAL 68 2HG2 VAL 68 -12.448 6.614 10.248 529 HG23 VAL 68 3HG2 VAL 68 -12.596 4.870 10.035 530 H TRP 69 H TRP 69 -8.864 3.962 7.644 531 HA TRP 69 HA TRP 69 -7.483 5.981 5.947 532 HB2 TRP 69 2HB TRP 69 -5.845 4.705 6.983 533 HB3 TRP 69 1HB TRP 69 -6.806 3.229 6.920 534 HD1 TRP 69 HD TRP 69 -4.302 5.256 4.972 535 HE1 TRP 69 1HE TRP 69 -3.669 3.996 2.813 536 HE3 TRP 69 3HE TRP 69 -7.820 1.556 5.044 537 HZ2 TRP 69 2HZ TRP 69 -4.538 1.716 1.318 538 HZ3 TRP 69 3HZ TRP 69 -7.895 -0.146 3.246 539 HH2 TRP 69 HH TRP 69 -6.260 -0.074 1.383 540 H GLY 70 H GLY 70 -10.055 3.860 5.722 541 HA2 GLY 70 2HA GLY 70 -10.669 4.219 3.064 542 HA3 GLY 70 1HA GLY 70 -9.540 2.863 3.028 543 H ARG 71 H ARG 71 -10.935 1.168 2.584 544 HA ARG 71 HA ARG 71 -12.640 0.273 4.773 545 HB2 ARG 71 2HB ARG 71 -13.923 1.956 3.106 546 HB3 ARG 71 1HB ARG 71 -14.136 0.463 2.201 547 HG2 ARG 71 2HG ARG 71 -15.101 -0.621 4.189 548 HG3 ARG 71 1HG ARG 71 -14.883 0.866 5.109 549 HD2 ARG 71 2HD ARG 71 -16.355 2.045 3.482 550 HD3 ARG 71 1HD ARG 71 -16.626 0.513 2.654 551 HE ARG 71 HE ARG 71 -17.372 -0.114 5.195 552 HH11 ARG 71 1HH1 ARG 71 -19.407 0.290 6.092 553 HH12 ARG 71 2HH1 ARG 71 -20.360 1.604 5.488 554 HH21 ARG 71 1HH2 ARG 71 -18.005 2.579 3.138 555 HH22 ARG 71 2HH2 ARG 71 -19.566 2.900 3.816 556 H ILE 72 H ILE 72 -14.097 -1.638 3.214 557 HA ILE 72 HA ILE 72 -11.965 -3.133 1.781 558 HB ILE 72 HB ILE 72 -13.720 -4.262 3.985 559 HG12 ILE 72 2HG1 ILE 72 -11.214 -4.818 4.744 560 HG13 ILE 72 1HG1 ILE 72 -10.868 -3.382 3.779 561 HG21 ILE 72 1HG2 ILE 72 -13.470 -5.947 2.295 562 HG22 ILE 72 2HG2 ILE 72 -12.286 -6.322 3.547 563 HG23 ILE 72 3HG2 ILE 72 -11.773 -5.541 2.052 564 HD11 ILE 72 1HD1 ILE 72 -12.996 -2.478 5.187 565 HD12 ILE 72 2HD1 ILE 72 -11.332 -2.306 5.744 566 HD13 ILE 72 3HD1 ILE 72 -12.332 -3.625 6.351 567 H LEU 73 H LEU 73 -12.932 -4.952 0.472 568 HA LEU 73 HA LEU 73 -15.750 -4.313 -0.316 569 HB2 LEU 73 2HB LEU 73 -13.973 -3.652 -2.002 570 HB3 LEU 73 1HB LEU 73 -13.584 -5.366 -2.153 571 HG LEU 73 HG LEU 73 -16.193 -5.598 -2.515 572 HD11 LEU 73 1HD1 LEU 73 -16.734 -3.258 -2.082 573 HD12 LEU 73 2HD1 LEU 73 -17.058 -3.621 -3.776 574 HD13 LEU 73 3HD1 LEU 73 -15.600 -2.736 -3.327 575 HD21 LEU 73 1HD2 LEU 73 -15.788 -5.231 -4.985 576 HD22 LEU 73 2HD2 LEU 73 -14.600 -6.267 -4.197 577 HD23 LEU 73 3HD2 LEU 73 -14.201 -4.587 -4.564 578 H GLU 74 H GLU 74 -13.267 -6.866 -0.483 579 HA GLU 74 HA GLU 74 -14.947 -8.843 0.740 580 HB2 GLU 74 2HB GLU 74 -16.115 -8.624 -1.466 581 HB3 GLU 74 1HB GLU 74 -14.620 -9.124 -2.252 582 HG2 GLU 74 2HG GLU 74 -14.663 -11.234 -0.928 583 HG3 GLU 74 1HG GLU 74 -16.215 -10.743 -0.249 584 H TRP 75 H TRP 75 -13.674 -10.584 1.347 585 HA TRP 75 HA TRP 75 -10.861 -10.529 0.373 586 HB2 TRP 75 2HB TRP 75 -10.610 -10.459 2.651 587 HB3 TRP 75 1HB TRP 75 -12.172 -11.225 2.947 588 HD1 TRP 75 HD TRP 75 -8.513 -12.010 2.311 589 HE1 TRP 75 1HE TRP 75 -8.104 -14.521 2.738 590 HE3 TRP 75 3HE TRP 75 -13.329 -13.598 2.898 591 HZ2 TRP 75 2HZ TRP 75 -9.623 -16.889 3.258 592 HZ3 TRP 75 3HZ TRP 75 -13.821 -15.982 3.358 593 HH2 TRP 75 HH TRP 75 -11.975 -17.629 3.539 594 H ASP 76 H ASP 76 -10.342 -12.066 -1.094 595 HA ASP 76 HA ASP 76 -11.941 -14.583 -1.114 596 HB2 ASP 76 2HB ASP 76 -11.453 -12.820 -3.175 597 HB3 ASP 76 1HB ASP 76 -10.233 -14.068 -3.440 598 HA PRO 77 HA PRO 77 -8.392 -16.652 0.766 599 HB2 PRO 77 2HB PRO 77 -9.247 -18.672 -1.302 600 HB3 PRO 77 1HB PRO 77 -8.745 -18.942 0.379 601 HG2 PRO 77 2HG PRO 77 -11.318 -18.897 -0.317 602 HG3 PRO 77 1HG PRO 77 -10.757 -18.261 1.238 603 HD2 PRO 77 2HD PRO 77 -11.822 -16.799 -1.084 604 HD3 PRO 77 1HD PRO 77 -11.641 -16.249 0.597 605 HA PRO 78 HA PRO 78 -4.680 -15.857 -1.462 606 HB2 PRO 78 2HB PRO 78 -4.502 -18.845 -1.713 607 HB3 PRO 78 1HB PRO 78 -3.232 -17.680 -1.291 608 HG2 PRO 78 2HG PRO 78 -4.637 -19.137 0.545 609 HG3 PRO 78 1HG PRO 78 -3.865 -17.581 0.884 610 HD2 PRO 78 2HD PRO 78 -6.689 -18.179 0.869 611 HD3 PRO 78 1HD PRO 78 -5.909 -16.621 1.211 612 H HIS 79 H HIS 79 -6.108 -15.039 -3.223 613 HA HIS 79 HA HIS 79 -5.460 -16.149 -5.765 614 HB2 HIS 79 2HB HIS 79 -7.095 -17.903 -5.074 615 HB3 HIS 79 1HB HIS 79 -8.319 -16.653 -4.880 616 HD1 HIS 79 1HD HIS 79 -5.913 -17.808 -7.621 617 HD2 HIS 79 2HD HIS 79 -9.769 -16.275 -7.193 618 HE1 HIS 79 1HE HIS 79 -6.917 -17.729 -9.947 619 HE2 HIS 79 2HE HIS 79 -9.263 -16.798 -9.697 620 H ARG 80 H ARG 80 -8.106 -14.380 -4.057 621 HA ARG 80 HA ARG 80 -7.655 -12.166 -6.004 622 HB2 ARG 80 2HB ARG 80 -9.754 -13.841 -6.329 623 HB3 ARG 80 1HB ARG 80 -10.467 -12.669 -5.222 624 HG2 ARG 80 2HG ARG 80 -9.045 -11.943 -7.797 625 HG3 ARG 80 1HG ARG 80 -10.795 -12.054 -7.619 626 HD2 ARG 80 2HD ARG 80 -10.466 -10.394 -5.638 627 HD3 ARG 80 1HD ARG 80 -8.898 -10.071 -6.381 628 HE ARG 80 HE ARG 80 -10.017 -8.998 -8.182 629 HH11 ARG 80 1HH1 ARG 80 -11.892 -8.176 -9.154 630 HH12 ARG 80 2HH1 ARG 80 -13.443 -8.662 -8.557 631 HH21 ARG 80 1HH2 ARG 80 -12.145 -10.740 -6.103 632 HH22 ARG 80 2HH2 ARG 80 -13.587 -10.114 -6.832 633 H LEU 81 H LEU 81 -7.659 -10.176 -5.071 634 HA LEU 81 HA LEU 81 -8.748 -9.935 -2.293 635 HB2 LEU 81 2HB LEU 81 -6.237 -10.007 -2.338 636 HB3 LEU 81 1HB LEU 81 -6.255 -8.580 -3.369 637 HG LEU 81 HG LEU 81 -7.643 -7.447 -1.537 638 HD11 LEU 81 1HD1 LEU 81 -6.557 -8.975 0.622 639 HD12 LEU 81 2HD1 LEU 81 -7.447 -10.076 -0.429 640 HD13 LEU 81 3HD1 LEU 81 -8.252 -8.663 0.253 641 HD21 LEU 81 1HD2 LEU 81 -5.619 -6.490 -1.273 642 HD22 LEU 81 2HD2 LEU 81 -4.795 -7.987 -1.713 643 HD23 LEU 81 3HD2 LEU 81 -5.279 -7.707 -0.041 644 H ALA 82 H ALA 82 -10.264 -8.336 -2.156 645 HA ALA 82 HA ALA 82 -10.082 -6.054 -4.078 646 HB1 ALA 82 1HB ALA 82 -11.876 -7.881 -4.611 647 HB2 ALA 82 2HB ALA 82 -12.361 -6.186 -4.634 648 HB3 ALA 82 3HB ALA 82 -12.741 -7.193 -3.237 649 H MET 83 H MET 83 -10.542 -4.047 -3.121 650 HA MET 83 HA MET 83 -11.660 -4.079 -0.368 651 HB2 MET 83 2HB MET 83 -9.083 -2.669 -1.102 652 HB3 MET 83 1HB MET 83 -9.854 -2.682 0.485 653 HG2 MET 83 2HG MET 83 -9.625 -5.193 0.484 654 HG3 MET 83 1HG MET 83 -8.663 -5.042 -0.987 655 HE1 MET 83 1HE MET 83 -5.587 -3.208 -0.156 656 HE2 MET 83 2HE MET 83 -6.963 -2.109 -0.166 657 HE3 MET 83 3HE MET 83 -6.918 -3.461 -1.293 658 H THR 84 H THR 84 -12.841 -2.228 0.138 659 HA THR 84 HA THR 84 -13.119 -0.238 -2.070 660 HB THR 84 HB THR 84 -14.850 -0.676 0.389 661 HG1 THR 84 1HG THR 84 -15.607 -2.240 -0.753 662 HG21 THR 84 1HG2 THR 84 -15.469 1.447 -0.164 663 HG22 THR 84 2HG2 THR 84 -16.383 0.635 -1.435 664 HG23 THR 84 3HG2 THR 84 -14.798 1.322 -1.790 665 H TRP 85 H TRP 85 -12.433 1.896 -1.695 666 HA TRP 85 HA TRP 85 -11.046 2.321 0.901 667 HB2 TRP 85 2HB TRP 85 -10.792 3.563 -1.830 668 HB3 TRP 85 1HB TRP 85 -10.112 4.355 -0.410 669 HD1 TRP 85 HD TRP 85 -10.168 0.554 -1.031 670 HE1 TRP 85 1HE TRP 85 -7.738 -0.292 -1.094 671 HE3 TRP 85 3HE TRP 85 -7.682 5.002 -0.734 672 HZ2 TRP 85 2HZ TRP 85 -5.085 0.775 -1.034 673 HZ3 TRP 85 3HZ TRP 85 -5.205 5.059 -0.742 674 HH2 TRP 85 HH TRP 85 -3.904 2.954 -0.891 675 H ARG 86 H ARG 86 -12.132 3.474 2.423 676 HA ARG 86 HA ARG 86 -13.989 5.627 1.474 677 HB2 ARG 86 2HB ARG 86 -15.158 3.809 2.666 678 HB3 ARG 86 1HB ARG 86 -14.093 4.032 4.054 679 HG2 ARG 86 2HG ARG 86 -14.911 6.319 4.351 680 HG3 ARG 86 1HG ARG 86 -15.921 6.165 2.913 681 HD2 ARG 86 2HD ARG 86 -17.331 5.776 4.834 682 HD3 ARG 86 1HD ARG 86 -17.079 4.224 4.036 683 HE ARG 86 HE ARG 86 -15.077 4.211 5.883 684 HH11 ARG 86 1HH1 ARG 86 -15.305 3.574 8.040 685 HH12 ARG 86 2HH1 ARG 86 -16.848 3.721 8.813 686 HH21 ARG 86 1HH2 ARG 86 -18.424 5.028 6.015 687 HH22 ARG 86 2HH2 ARG 86 -18.613 4.544 7.667 688 H ILE 87 H ILE 87 -12.487 7.338 1.504 689 HA ILE 87 HA ILE 87 -11.673 8.202 4.217 690 HB ILE 87 HB ILE 87 -9.734 6.949 3.235 691 HG12 ILE 87 2HG1 ILE 87 -9.099 9.898 3.367 692 HG13 ILE 87 1HG1 ILE 87 -9.632 9.027 4.802 693 HG21 ILE 87 1HG2 ILE 87 -8.704 7.619 1.248 694 HG22 ILE 87 2HG2 ILE 87 -9.388 9.243 1.326 695 HG23 ILE 87 3HG2 ILE 87 -10.406 7.879 0.862 696 HD11 ILE 87 1HD1 ILE 87 -7.618 8.059 5.066 697 HD12 ILE 87 2HD1 ILE 87 -7.017 9.171 3.842 698 HD13 ILE 87 3HD1 ILE 87 -7.558 7.560 3.377 699 H ASP 88 H ASP 88 -11.017 10.527 4.225 700 HA ASP 88 HA ASP 88 -12.510 12.003 2.102 701 HB2 ASP 88 2HB ASP 88 -13.178 12.311 4.512 702 HB3 ASP 88 1HB ASP 88 -11.591 13.019 4.806 703 H GLY 89 H GLY 89 -11.547 13.786 1.064 704 HA2 GLY 89 2HA GLY 89 -8.780 13.589 0.458 705 HA3 GLY 89 1HA GLY 89 -9.790 14.981 0.082 706 H HIS 90 H HIS 90 -10.430 15.271 3.037 707 HA HIS 90 HA HIS 90 -8.089 16.935 3.654 708 HB2 HIS 90 2HB HIS 90 -10.738 16.538 5.046 709 HB3 HIS 90 1HB HIS 90 -9.503 17.664 5.587 710 HD1 HIS 90 1HD HIS 90 -8.588 18.860 2.927 711 HD2 HIS 90 2HD HIS 90 -12.596 18.236 3.889 712 HE1 HIS 90 1HE HIS 90 -9.929 20.441 1.469 713 HE2 HIS 90 2HE HIS 90 -12.372 20.068 2.044 714 H TRP 91 H TRP 91 -8.281 13.817 3.881 715 HA TRP 91 HA TRP 91 -7.411 12.185 5.328 716 HB2 TRP 91 2HB TRP 91 -5.866 14.655 5.799 717 HB3 TRP 91 1HB TRP 91 -5.794 13.488 7.118 718 HD1 TRP 91 HD TRP 91 -4.041 14.299 4.082 719 HE1 TRP 91 1HE TRP 91 -2.732 12.280 3.158 720 HE3 TRP 91 3HE TRP 91 -6.206 10.537 6.773 721 HZ2 TRP 91 2HZ TRP 91 -2.620 9.442 3.512 722 HZ3 TRP 91 3HZ TRP 91 -5.480 8.189 6.458 723 HH2 TRP 91 HH TRP 91 -3.692 7.637 4.834 724 H GLN 92 H GLN 92 -9.873 13.820 6.112 725 HA GLN 92 HA GLN 92 -9.709 13.697 9.062 726 HB2 GLN 92 2HB GLN 92 -11.967 14.555 7.233 727 HB3 GLN 92 1HB GLN 92 -11.981 14.671 8.994 728 HG2 GLN 92 2HG GLN 92 -10.003 16.042 7.150 729 HG3 GLN 92 1HG GLN 92 -11.342 16.819 7.986 730 HE21 GLN 92 1HE2 GLN 92 -8.119 16.664 8.233 731 HE22 GLN 92 2HE2 GLN 92 -7.923 16.662 9.919 732 H SER 93 H SER 93 -12.815 13.023 7.870 733 HA SER 93 HA SER 93 -12.453 10.097 7.900 734 HB2 SER 93 2HB SER 93 -13.815 9.672 9.789 735 HB3 SER 93 1HB SER 93 -12.755 10.975 10.310 736 HG SER 93 HG SER 93 -15.471 11.055 9.562 737 H VAL 94 H VAL 94 -14.437 8.987 7.183 738 HA VAL 94 HA VAL 94 -16.411 10.810 5.871 739 HB VAL 94 HB VAL 94 -16.240 8.528 4.259 740 HG11 VAL 94 1HG1 VAL 94 -16.680 10.682 3.338 741 HG12 VAL 94 2HG1 VAL 94 -15.116 10.205 2.678 742 HG13 VAL 94 3HG1 VAL 94 -15.195 11.355 4.011 743 HG21 VAL 94 1HG2 VAL 94 -13.462 9.620 4.780 744 HG22 VAL 94 2HG2 VAL 94 -13.911 8.277 3.730 745 HG23 VAL 94 3HG2 VAL 94 -14.050 8.112 5.479 746 HA PRO 95 HA PRO 95 -18.693 7.923 8.678 747 HB2 PRO 95 2HB PRO 95 -20.840 9.802 7.796 748 HB3 PRO 95 1HB PRO 95 -20.455 9.211 9.424 749 HG2 PRO 95 2HG PRO 95 -19.825 11.682 8.647 750 HG3 PRO 95 1HG PRO 95 -18.785 10.749 9.737 751 HD2 PRO 95 2HD PRO 95 -18.378 11.409 6.859 752 HD3 PRO 95 1HD PRO 95 -17.174 11.124 8.134 753 H ASP 96 H ASP 96 -19.101 8.790 5.339 754 HA ASP 96 HA ASP 96 -20.361 6.185 4.823 755 HB2 ASP 96 2HB ASP 96 -22.266 7.122 3.598 756 HB3 ASP 96 1HB ASP 96 -22.294 7.692 5.267 757 H ASP 97 H ASP 97 -20.428 5.765 2.430 758 HA ASP 97 HA ASP 97 -18.076 7.038 1.169 759 HB2 ASP 97 2HB ASP 97 -18.394 5.240 -0.555 760 HB3 ASP 97 1HB ASP 97 -18.161 4.616 1.078 761 H ASP 98 H ASP 98 -18.687 9.008 0.303 762 HA ASP 98 HA ASP 98 -21.235 9.265 -1.137 763 HB2 ASP 98 2HB ASP 98 -20.163 11.102 0.289 764 HB3 ASP 98 1HB ASP 98 -19.002 11.290 -1.022 765 H ARG 99 H ARG 99 -17.791 9.673 -1.917 766 HA ARG 99 HA ARG 99 -18.411 8.808 -4.704 767 HB2 ARG 99 2HB ARG 99 -16.502 10.992 -3.821 768 HB3 ARG 99 1HB ARG 99 -16.675 10.413 -5.479 769 HG2 ARG 99 2HG ARG 99 -19.094 11.035 -5.398 770 HG3 ARG 99 1HG ARG 99 -18.833 11.716 -3.793 771 HD2 ARG 99 2HD ARG 99 -18.673 13.550 -5.321 772 HD3 ARG 99 1HD ARG 99 -17.019 13.169 -4.842 773 HE ARG 99 HE ARG 99 -17.292 11.669 -7.102 774 HH11 ARG 99 1HH1 ARG 99 -16.979 12.431 -9.207 775 HH12 ARG 99 2HH1 ARG 99 -17.227 14.110 -9.552 776 HH21 ARG 99 1HH2 ARG 99 -18.093 14.924 -6.295 777 HH22 ARG 99 2HH2 ARG 99 -17.858 15.521 -7.903 778 H ALA 100 H ALA 100 -17.485 7.184 -2.468 779 HA ALA 100 HA ALA 100 -14.643 6.839 -2.529 780 HB1 ALA 100 1HB ALA 100 -16.699 4.688 -1.982 781 HB2 ALA 100 2HB ALA 100 -16.219 5.899 -0.794 782 HB3 ALA 100 3HB ALA 100 -15.035 4.746 -1.404 783 H SER 101 H SER 101 -13.386 5.257 -3.634 784 HA SER 101 HA SER 101 -14.606 4.347 -6.205 785 HB2 SER 101 2HB SER 101 -11.693 4.827 -5.515 786 HB3 SER 101 1HB SER 101 -12.314 4.352 -7.094 787 HG SER 101 HG SER 101 -12.600 6.779 -5.694 788 H GLU 102 H GLU 102 -13.800 2.249 -7.032 789 HA GLU 102 HA GLU 102 -13.307 0.347 -4.780 790 HB2 GLU 102 2HB GLU 102 -15.408 0.022 -6.078 791 HB3 GLU 102 1HB GLU 102 -14.445 -0.189 -7.541 792 HG2 GLU 102 2HG GLU 102 -13.278 -2.107 -6.446 793 HG3 GLU 102 1HG GLU 102 -14.358 -1.933 -5.063 794 H ILE 103 H ILE 103 -11.573 -1.023 -4.865 795 HA ILE 103 HA ILE 103 -9.727 -0.718 -7.204 796 HB ILE 103 HB ILE 103 -9.018 -1.395 -4.336 797 HG12 ILE 103 2HG1 ILE 103 -8.632 1.207 -5.851 798 HG13 ILE 103 1HG1 ILE 103 -9.846 0.945 -4.598 799 HG21 ILE 103 1HG2 ILE 103 -6.880 -0.337 -5.925 800 HG22 ILE 103 2HG2 ILE 103 -7.630 -1.671 -6.800 801 HG23 ILE 103 3HG2 ILE 103 -7.004 -1.927 -5.172 802 HD11 ILE 103 1HD1 ILE 103 -8.192 1.759 -3.236 803 HD12 ILE 103 2HD1 ILE 103 -6.904 1.276 -4.341 804 HD13 ILE 103 3HD1 ILE 103 -7.649 0.080 -3.278 805 H GLU 104 H GLU 104 -9.125 -2.610 -8.223 806 HA GLU 104 HA GLU 104 -10.036 -5.162 -6.946 807 HB2 GLU 104 2HB GLU 104 -11.107 -4.585 -9.141 808 HB3 GLU 104 1HB GLU 104 -9.508 -4.637 -9.885 809 HG2 GLU 104 2HG GLU 104 -9.248 -6.987 -9.101 810 HG3 GLU 104 1HG GLU 104 -10.888 -6.927 -8.456 811 H VAL 105 H VAL 105 -8.393 -6.379 -6.188 812 HA VAL 105 HA VAL 105 -5.763 -6.236 -7.593 813 HB VAL 105 HB VAL 105 -6.144 -6.576 -4.607 814 HG11 VAL 105 1HG1 VAL 105 -4.067 -7.519 -5.317 815 HG12 VAL 105 2HG1 VAL 105 -3.675 -5.921 -4.684 816 HG13 VAL 105 3HG1 VAL 105 -3.759 -6.183 -6.425 817 HG21 VAL 105 1HG2 VAL 105 -6.770 -4.352 -4.865 818 HG22 VAL 105 2HG2 VAL 105 -5.804 -4.142 -6.325 819 HG23 VAL 105 3HG2 VAL 105 -5.019 -4.179 -4.746 820 H ASP 106 H ASP 106 -5.021 -8.227 -8.200 821 HA ASP 106 HA ASP 106 -6.326 -10.611 -6.945 822 HB2 ASP 106 2HB ASP 106 -6.950 -10.306 -9.318 823 HB3 ASP 106 1HB ASP 106 -5.243 -10.304 -9.762 824 H PHE 107 H PHE 107 -4.970 -12.057 -5.991 825 HA PHE 107 HA PHE 107 -2.047 -11.787 -6.569 826 HB2 PHE 107 2HB PHE 107 -3.542 -11.904 -4.010 827 HB3 PHE 107 1HB PHE 107 -2.056 -12.851 -4.086 828 HD1 PHE 107 1HD PHE 107 0.111 -11.772 -4.512 829 HD2 PHE 107 2HD PHE 107 -3.503 -9.483 -4.126 830 HE1 PHE 107 1HE PHE 107 1.451 -9.707 -4.227 831 HE2 PHE 107 2HE PHE 107 -2.164 -7.418 -3.843 832 HZ PHE 107 HZ PHE 107 0.318 -7.532 -3.893 833 H VAL 108 H VAL 108 -1.275 -13.566 -7.529 834 HA VAL 108 HA VAL 108 -2.352 -16.222 -6.707 835 HB VAL 108 HB VAL 108 -2.844 -16.863 -8.865 836 HG11 VAL 108 1HG1 VAL 108 -3.845 -15.037 -10.117 837 HG12 VAL 108 2HG1 VAL 108 -2.868 -13.856 -9.245 838 HG13 VAL 108 3HG1 VAL 108 -4.122 -14.761 -8.397 839 HG21 VAL 108 1HG2 VAL 108 -0.640 -16.776 -9.790 840 HG22 VAL 108 2HG2 VAL 108 -0.586 -15.016 -9.676 841 HG23 VAL 108 3HG2 VAL 108 -1.639 -15.789 -10.858 842 HA PRO 109 HA PRO 109 1.909 -17.280 -6.234 843 HB2 PRO 109 2HB PRO 109 1.902 -19.873 -7.261 844 HB3 PRO 109 1HB PRO 109 1.465 -19.426 -5.604 845 HG2 PRO 109 2HG PRO 109 -0.273 -20.058 -7.911 846 HG3 PRO 109 1HG PRO 109 -0.525 -20.362 -6.184 847 HD2 PRO 109 2HD PRO 109 -1.802 -18.360 -7.529 848 HD3 PRO 109 1HD PRO 109 -1.394 -18.249 -5.803 849 H ASN 110 H ASN 110 3.606 -16.661 -7.493 850 HA ASN 110 HA ASN 110 3.483 -17.249 -10.418 851 HB2 ASN 110 2HB ASN 110 3.295 -14.806 -9.710 852 HB3 ASN 110 1HB ASN 110 4.960 -14.946 -9.152 853 HD21 ASN 110 1HD2 ASN 110 6.463 -14.327 -10.704 854 HD22 ASN 110 2HD2 ASN 110 6.238 -14.442 -12.382 855 H GLY 111 H GLY 111 4.975 -18.777 -10.936 856 HA2 GLY 111 2HA GLY 111 6.987 -19.988 -10.932 857 HA3 GLY 111 1HA GLY 111 7.751 -18.501 -10.369 858 H SER 112 H SER 112 8.833 -18.864 -8.504 859 HA SER 112 HA SER 112 7.486 -20.516 -6.408 860 HB2 SER 112 2HB SER 112 9.632 -21.496 -5.805 861 HB3 SER 112 1HB SER 112 9.335 -21.787 -7.517 862 HG SER 112 HG SER 112 10.899 -20.436 -8.027 863 H GLY 113 H GLY 113 7.960 -19.854 -4.237 864 HA2 GLY 113 2HA GLY 113 8.114 -18.105 -2.658 865 HA3 GLY 113 1HA GLY 113 9.761 -18.008 -3.279 866 H GLY 114 H GLY 114 7.221 -17.362 -5.539 867 HA2 GLY 114 2HA GLY 114 7.506 -14.434 -5.105 868 HA3 GLY 114 1HA GLY 114 7.867 -15.096 -6.698 869 H THR 115 H THR 115 5.728 -13.203 -5.969 870 HA THR 115 HA THR 115 3.426 -14.819 -6.962 871 HB THR 115 HB THR 115 3.276 -14.292 -4.473 872 HG1 THR 115 1HG THR 115 1.100 -13.194 -4.925 873 HG21 THR 115 1HG2 THR 115 2.463 -11.526 -5.167 874 HG22 THR 115 2HG2 THR 115 4.197 -11.848 -5.172 875 HG23 THR 115 3HG2 THR 115 3.252 -12.138 -3.713 876 H ARG 116 H ARG 116 2.129 -13.760 -8.457 877 HA ARG 116 HA ARG 116 3.082 -11.051 -9.314 878 HB2 ARG 116 2HB ARG 116 3.475 -12.878 -10.978 879 HB3 ARG 116 1HB ARG 116 1.738 -13.190 -10.999 880 HG2 ARG 116 2HG ARG 116 1.332 -10.867 -11.740 881 HG3 ARG 116 1HG ARG 116 3.070 -10.568 -11.742 882 HD2 ARG 116 2HD ARG 116 3.338 -12.429 -13.395 883 HD3 ARG 116 1HD ARG 116 1.581 -12.574 -13.461 884 HE ARG 116 HE ARG 116 1.996 -9.912 -14.025 885 HH11 ARG 116 1HH1 ARG 116 2.368 -9.119 -16.109 886 HH12 ARG 116 2HH1 ARG 116 3.056 -10.163 -17.308 887 HH21 ARG 116 1HH2 ARG 116 3.283 -12.894 -15.182 888 HH22 ARG 116 2HH2 ARG 116 3.574 -12.300 -16.784 889 H VAL 117 H VAL 117 1.569 -9.455 -9.151 890 HA VAL 117 HA VAL 117 -1.286 -10.294 -8.911 891 HB VAL 117 HB VAL 117 -0.866 -9.654 -6.730 892 HG11 VAL 117 1HG1 VAL 117 1.202 -7.899 -8.002 893 HG12 VAL 117 2HG1 VAL 117 1.370 -9.040 -6.667 894 HG13 VAL 117 3HG1 VAL 117 0.605 -7.474 -6.398 895 HG21 VAL 117 1HG2 VAL 117 -1.952 -7.577 -6.386 896 HG22 VAL 117 2HG2 VAL 117 -2.561 -8.112 -7.952 897 HG23 VAL 117 3HG2 VAL 117 -1.293 -6.889 -7.869 898 H GLU 118 H GLU 118 -2.796 -9.105 -9.967 899 HA GLU 118 HA GLU 118 -1.805 -6.922 -11.746 900 HB2 GLU 118 2HB GLU 118 -2.846 -8.828 -12.911 901 HB3 GLU 118 1HB GLU 118 -4.289 -8.665 -11.913 902 HG2 GLU 118 2HG GLU 118 -4.633 -6.375 -12.831 903 HG3 GLU 118 1HG GLU 118 -3.238 -6.608 -13.880 904 H LEU 119 H LEU 119 -2.280 -4.918 -10.965 905 HA LEU 119 HA LEU 119 -4.741 -4.615 -9.303 906 HB2 LEU 119 2HB LEU 119 -2.535 -4.102 -8.193 907 HB3 LEU 119 1HB LEU 119 -2.315 -2.799 -9.360 908 HG LEU 119 HG LEU 119 -4.929 -2.807 -7.961 909 HD11 LEU 119 1HD1 LEU 119 -4.016 -1.867 -5.898 910 HD12 LEU 119 2HD1 LEU 119 -2.373 -2.061 -6.508 911 HD13 LEU 119 3HD1 LEU 119 -3.353 -3.482 -6.150 912 HD21 LEU 119 1HD2 LEU 119 -2.812 -0.715 -8.557 913 HD22 LEU 119 2HD2 LEU 119 -4.396 -0.374 -7.861 914 HD23 LEU 119 3HD2 LEU 119 -4.272 -1.013 -9.500 915 H ALA 120 H ALA 120 -6.349 -3.434 -10.197 916 HA ALA 120 HA ALA 120 -5.626 -1.426 -12.275 917 HB1 ALA 120 1HB ALA 120 -6.488 -3.194 -13.580 918 HB2 ALA 120 2HB ALA 120 -7.852 -2.096 -13.376 919 HB3 ALA 120 3HB ALA 120 -7.747 -3.562 -12.399 920 H HIS 121 H HIS 121 -6.486 0.545 -11.850 921 HA HIS 121 HA HIS 121 -8.810 0.684 -9.965 922 HB2 HIS 121 2HB HIS 121 -7.686 2.154 -8.671 923 HB3 HIS 121 1HB HIS 121 -6.237 1.727 -9.581 924 HD1 HIS 121 1HD HIS 121 -9.256 3.988 -10.288 925 HD2 HIS 121 2HD HIS 121 -5.095 4.023 -10.574 926 HE1 HIS 121 1HE HIS 121 -8.626 6.237 -11.269 927 HE2 HIS 121 2HE HIS 121 -6.094 6.273 -11.437 928 H VAL 122 H VAL 122 -10.492 2.049 -10.576 929 HA VAL 122 HA VAL 122 -10.084 3.688 -13.028 930 HB VAL 122 HB VAL 122 -12.247 2.878 -13.927 931 HG11 VAL 122 1HG1 VAL 122 -11.237 1.119 -14.976 932 HG12 VAL 122 2HG1 VAL 122 -10.804 0.335 -13.457 933 HG13 VAL 122 3HG1 VAL 122 -9.816 1.656 -14.079 934 HG21 VAL 122 1HG2 VAL 122 -12.169 1.342 -11.356 935 HG22 VAL 122 2HG2 VAL 122 -12.917 0.583 -12.762 936 HG23 VAL 122 3HG2 VAL 122 -13.539 2.118 -12.155 937 H LYS 123 H LYS 123 -11.361 5.540 -13.118 938 HA LYS 123 HA LYS 123 -12.601 7.333 -12.280 939 HB2 LYS 123 2HB LYS 123 -14.144 5.100 -10.932 940 HB3 LYS 123 1HB LYS 123 -14.713 6.751 -11.177 941 HG2 LYS 123 2HG LYS 123 -14.467 6.451 -13.630 942 HG3 LYS 123 1HG LYS 123 -13.982 4.776 -13.358 943 HD2 LYS 123 2HD LYS 123 -16.158 4.410 -12.161 944 HD3 LYS 123 1HD LYS 123 -16.645 6.033 -12.653 945 HE2 LYS 123 2HE LYS 123 -16.214 5.347 -15.045 946 HE3 LYS 123 1HE LYS 123 -15.977 3.697 -14.464 947 HZ1 LYS 123 1HZ LYS 123 -18.433 5.337 -14.146 948 HZ2 LYS 123 2HZ LYS 123 -18.209 3.783 -13.496 949 HZ3 LYS 123 3HZ LYS 123 -18.241 4.006 -15.180 950 H LEU 124 H LEU 124 -10.268 6.370 -10.645 951 HA LEU 124 HA LEU 124 -10.971 6.538 -7.859 952 HB2 LEU 124 2HB LEU 124 -8.796 5.651 -8.633 953 HB3 LEU 124 1HB LEU 124 -8.351 7.258 -9.212 954 HG LEU 124 HG LEU 124 -8.647 8.105 -6.862 955 HD11 LEU 124 1HD1 LEU 124 -8.339 5.809 -5.341 956 HD12 LEU 124 2HD1 LEU 124 -9.556 5.334 -6.526 957 HD13 LEU 124 3HD1 LEU 124 -9.830 6.738 -5.495 958 HD21 LEU 124 1HD2 LEU 124 -6.663 6.119 -6.285 959 HD22 LEU 124 2HD2 LEU 124 -6.419 7.798 -6.766 960 HD23 LEU 124 3HD2 LEU 124 -6.550 6.538 -7.995 961 H HIS 125 H HIS 125 -10.083 8.929 -10.294 962 HA HIS 125 HA HIS 125 -9.877 11.196 -8.583 963 HB2 HIS 125 2HB HIS 125 -9.073 11.421 -10.812 964 HB3 HIS 125 1HB HIS 125 -10.615 10.909 -11.491 965 HD1 HIS 125 1HD HIS 125 -10.080 13.476 -8.742 966 HD2 HIS 125 2HD HIS 125 -11.476 13.289 -12.668 967 HE1 HIS 125 1HE HIS 125 -11.047 15.758 -9.270 968 HE2 HIS 125 2HE HIS 125 -11.891 15.658 -11.659 969 H ARG 126 H ARG 126 -12.613 9.325 -9.395 970 HA ARG 126 HA ARG 126 -14.701 11.134 -9.627 971 HB2 ARG 126 2HB ARG 126 -16.134 9.443 -8.676 972 HB3 ARG 126 1HB ARG 126 -14.888 8.624 -9.615 973 HG2 ARG 126 2HG ARG 126 -13.571 8.344 -7.492 974 HG3 ARG 126 1HG ARG 126 -14.955 8.987 -6.610 975 HD2 ARG 126 2HD ARG 126 -14.928 6.497 -8.337 976 HD3 ARG 126 1HD ARG 126 -15.056 6.552 -6.578 977 HE ARG 126 HE ARG 126 -17.198 8.078 -7.422 978 HH11 ARG 126 1HH1 ARG 126 -19.235 7.200 -7.859 979 HH12 ARG 126 2HH1 ARG 126 -19.366 5.535 -8.317 980 HH21 ARG 126 1HH2 ARG 126 -15.954 4.941 -8.131 981 HH22 ARG 126 2HH2 ARG 126 -17.508 4.256 -8.471 982 H HIS 127 H HIS 127 -12.815 10.382 -6.739 983 HA HIS 127 HA HIS 127 -14.538 11.541 -4.807 984 HB2 HIS 127 2HB HIS 127 -11.658 10.904 -4.980 985 HB3 HIS 127 1HB HIS 127 -12.065 12.187 -3.844 986 HD1 HIS 127 1HD HIS 127 -14.893 11.003 -3.027 987 HD2 HIS 127 2HD HIS 127 -11.297 8.887 -3.039 988 HE1 HIS 127 1HE HIS 127 -15.189 9.076 -1.408 989 HE2 HIS 127 2HE HIS 127 -13.008 7.781 -1.410 990 H GLY 128 H GLY 128 -12.039 13.037 -6.838 991 HA2 GLY 128 2HA GLY 128 -11.472 15.323 -7.076 992 HA3 GLY 128 1HA GLY 128 -13.205 15.449 -7.385 993 H ASP 129 H ASP 129 -12.235 14.369 -4.250 994 HA ASP 129 HA ASP 129 -13.026 17.026 -3.128 995 HB2 ASP 129 2HB ASP 129 -14.507 15.080 -2.576 996 HB3 ASP 129 1HB ASP 129 -13.130 14.310 -1.786 997 H GLY 130 H GLY 130 -10.294 15.782 -3.955 998 HA2 GLY 130 2HA GLY 130 -8.167 16.545 -3.079 999 HA3 GLY 130 1HA GLY 130 -8.899 16.644 -1.476 1000 H ALA 131 H ALA 131 -9.865 13.838 -3.061 1001 HA ALA 131 HA ALA 131 -8.727 12.050 -1.208 1002 HB1 ALA 131 1HB ALA 131 -9.064 10.341 -3.133 1003 HB2 ALA 131 2HB ALA 131 -9.730 11.706 -4.030 1004 HB3 ALA 131 3HB ALA 131 -10.486 11.187 -2.522 1005 H TRP 132 H TRP 132 -7.399 13.267 -4.272 1006 HA TRP 132 HA TRP 132 -5.230 11.450 -4.469 1007 HB2 TRP 132 2HB TRP 132 -5.891 13.146 -6.226 1008 HB3 TRP 132 1HB TRP 132 -5.088 14.374 -5.240 1009 HD1 TRP 132 HD TRP 132 -2.639 14.729 -5.832 1010 HE1 TRP 132 1HE TRP 132 -0.754 13.287 -6.847 1011 HE3 TRP 132 3HE TRP 132 -5.132 10.323 -6.451 1012 HZ2 TRP 132 2HZ TRP 132 -0.365 10.609 -7.783 1013 HZ3 TRP 132 3HZ TRP 132 -3.991 8.344 -7.395 1014 HH2 TRP 132 HH TRP 132 -1.616 8.479 -8.068 1015 H ASN 133 H ASN 133 -5.582 14.405 -2.538 1016 HA ASN 133 HA ASN 133 -2.892 14.720 -1.731 1017 HB2 ASN 133 2HB ASN 133 -5.455 15.135 -0.155 1018 HB3 ASN 133 1HB ASN 133 -3.870 15.701 0.361 1019 HD21 ASN 133 1HD2 ASN 133 -5.993 17.549 -0.163 1020 HD22 ASN 133 2HD2 ASN 133 -5.588 18.455 -1.540 1021 H ILE 134 H ILE 134 -5.444 12.609 -0.463 1022 HA ILE 134 HA ILE 134 -3.905 11.458 1.664 1023 HB ILE 134 HB ILE 134 -6.292 10.566 0.068 1024 HG12 ILE 134 2HG1 ILE 134 -7.462 10.902 2.135 1025 HG13 ILE 134 1HG1 ILE 134 -5.954 11.011 3.040 1026 HG21 ILE 134 1HG2 ILE 134 -6.420 8.632 1.714 1027 HG22 ILE 134 2HG2 ILE 134 -4.736 8.971 2.111 1028 HG23 ILE 134 3HG2 ILE 134 -5.178 8.488 0.473 1029 HD11 ILE 134 1HD1 ILE 134 -6.632 12.952 0.829 1030 HD12 ILE 134 2HD1 ILE 134 -5.410 13.121 2.088 1031 HD13 ILE 134 3HD1 ILE 134 -7.121 13.229 2.499 1032 H HIS 135 H HIS 135 -4.413 10.589 -1.724 1033 HA HIS 135 HA HIS 135 -2.821 8.217 -1.764 1034 HB2 HIS 135 2HB HIS 135 -4.364 8.840 -3.587 1035 HB3 HIS 135 1HB HIS 135 -3.366 10.244 -3.956 1036 HD1 HIS 135 1HD HIS 135 -0.697 9.512 -4.450 1037 HD2 HIS 135 2HD HIS 135 -3.679 6.677 -5.132 1038 HE1 HIS 135 1HE HIS 135 0.299 7.784 -6.016 1039 HE2 HIS 135 2HE HIS 135 -1.503 6.048 -6.427 1040 H LYS 136 H LYS 136 -2.048 11.644 -2.198 1041 HA LYS 136 HA LYS 136 0.639 11.376 -3.049 1042 HB2 LYS 136 2HB LYS 136 -0.674 13.510 -2.984 1043 HB3 LYS 136 1HB LYS 136 -0.465 13.526 -1.240 1044 HG2 LYS 136 2HG LYS 136 1.986 13.510 -1.549 1045 HG3 LYS 136 1HG LYS 136 1.747 13.563 -3.291 1046 HD2 LYS 136 2HD LYS 136 0.467 15.696 -2.999 1047 HD3 LYS 136 1HD LYS 136 0.891 15.666 -1.288 1048 HE2 LYS 136 2HE LYS 136 2.682 16.069 -3.668 1049 HE3 LYS 136 1HE LYS 136 2.584 17.011 -2.181 1050 HZ1 LYS 136 1HZ LYS 136 3.289 14.686 -1.172 1051 HZ2 LYS 136 2HZ LYS 136 4.431 15.816 -1.722 1052 HZ3 LYS 136 3HZ LYS 136 3.985 14.507 -2.708 1053 H ALA 137 H ALA 137 -0.728 11.454 0.236 1054 HA ALA 137 HA ALA 137 1.804 11.358 1.591 1055 HB1 ALA 137 1HB ALA 137 -0.760 11.686 2.426 1056 HB2 ALA 137 2HB ALA 137 0.559 11.248 3.510 1057 HB3 ALA 137 3HB ALA 137 -0.503 9.998 2.865 1058 H LEU 138 H LEU 138 -0.456 8.844 0.521 1059 HA LEU 138 HA LEU 138 1.078 6.632 1.534 1060 HB2 LEU 138 2HB LEU 138 -0.869 6.710 -0.789 1061 HB3 LEU 138 1HB LEU 138 -0.345 5.272 0.073 1062 HG LEU 138 HG LEU 138 -1.902 7.590 1.249 1063 HD11 LEU 138 1HD1 LEU 138 -2.630 4.720 0.589 1064 HD12 LEU 138 2HD1 LEU 138 -3.314 6.179 -0.129 1065 HD13 LEU 138 3HD1 LEU 138 -3.638 5.792 1.561 1066 HD21 LEU 138 1HD2 LEU 138 -0.496 5.220 2.404 1067 HD22 LEU 138 2HD2 LEU 138 -2.023 5.716 3.134 1068 HD23 LEU 138 3HD2 LEU 138 -0.670 6.845 3.061 1069 H ASP 139 H ASP 139 1.244 8.661 -1.273 1070 HA ASP 139 HA ASP 139 2.911 6.860 -2.840 1071 HB2 ASP 139 2HB ASP 139 1.470 8.644 -3.850 1072 HB3 ASP 139 1HB ASP 139 2.533 9.856 -3.132 1073 H GLY 140 H GLY 140 4.877 6.364 -2.021 1074 HA2 GLY 140 2HA GLY 140 6.466 8.489 -0.684 1075 HA3 GLY 140 1HA GLY 140 6.791 6.759 -0.576 1076 HA PRO 141 HA PRO 141 9.828 8.706 -3.570 1077 HB2 PRO 141 2HB PRO 141 11.376 6.397 -2.503 1078 HB3 PRO 141 1HB PRO 141 11.880 8.080 -2.741 1079 HG2 PRO 141 2HG PRO 141 11.365 7.086 -0.314 1080 HG3 PRO 141 1HG PRO 141 11.009 8.768 -0.741 1081 HD2 PRO 141 2HD PRO 141 9.127 6.480 -0.383 1082 HD3 PRO 141 1HD PRO 141 8.864 8.216 -0.102 1083 H SER 142 H SER 142 10.341 7.907 -5.642 1084 HA SER 142 HA SER 142 10.192 6.498 -7.511 1085 HB2 SER 142 2HB SER 142 11.469 5.009 -5.754 1086 HB3 SER 142 1HB SER 142 9.949 4.125 -5.686 1087 HG SER 142 HG SER 142 11.774 4.431 -7.781 1088 HA PRO 143 HA PRO 143 5.569 6.393 -6.495 1089 HB2 PRO 143 2HB PRO 143 5.603 7.770 -9.137 1090 HB3 PRO 143 1HB PRO 143 4.683 8.160 -7.672 1091 HG2 PRO 143 2HG PRO 143 6.796 9.602 -8.439 1092 HG3 PRO 143 1HG PRO 143 6.412 9.326 -6.731 1093 HD2 PRO 143 2HD PRO 143 8.575 8.113 -8.393 1094 HD3 PRO 143 1HD PRO 143 8.551 8.469 -6.653 1095 H GLY 144 H GLY 144 4.381 6.410 -9.337 1096 HA2 GLY 144 2HA GLY 144 4.113 4.889 -11.149 1097 HA3 GLY 144 1HA GLY 144 5.401 3.895 -10.469 1098 H GLU 145 H GLU 145 3.832 2.105 -10.945 1099 HA GLU 145 HA GLU 145 1.305 1.774 -9.790 1100 HB2 GLU 145 2HB GLU 145 3.464 -0.339 -10.064 1101 HB3 GLU 145 1HB GLU 145 1.731 -0.638 -9.926 1102 HG2 GLU 145 2HG GLU 145 3.029 0.956 -12.152 1103 HG3 GLU 145 1HG GLU 145 2.533 -0.731 -12.282 1104 H THR 146 H THR 146 0.580 0.912 -7.788 1105 HA THR 146 HA THR 146 1.995 1.644 -5.431 1106 HB THR 146 HB THR 146 -0.195 -0.393 -5.855 1107 HG1 THR 146 1HG THR 146 -1.512 1.257 -5.225 1108 HG21 THR 146 1HG2 THR 146 0.675 -1.062 -3.804 1109 HG22 THR 146 2HG2 THR 146 -0.511 0.146 -3.306 1110 HG23 THR 146 3HG2 THR 146 1.199 0.570 -3.384 1111 H LEU 147 H LEU 147 1.886 -1.324 -7.290 1112 HA LEU 147 HA LEU 147 3.183 -3.060 -5.479 1113 HB2 LEU 147 2HB LEU 147 3.407 -2.985 -8.497 1114 HB3 LEU 147 1HB LEU 147 3.744 -4.378 -7.463 1115 HG LEU 147 HG LEU 147 1.066 -2.982 -7.753 1116 HD11 LEU 147 1HD1 LEU 147 2.038 -5.718 -8.624 1117 HD12 LEU 147 2HD1 LEU 147 1.624 -4.373 -9.687 1118 HD13 LEU 147 3HD1 LEU 147 0.370 -5.157 -8.727 1119 HD21 LEU 147 1HD2 LEU 147 0.440 -5.190 -6.432 1120 HD22 LEU 147 2HD2 LEU 147 1.006 -3.766 -5.562 1121 HD23 LEU 147 3HD2 LEU 147 2.118 -5.093 -5.897 1122 H ALA 148 H ALA 148 4.451 -0.510 -7.534 1123 HA ALA 148 HA ALA 148 7.188 -1.268 -7.568 1124 HB1 ALA 148 1HB ALA 148 7.633 0.906 -8.313 1125 HB2 ALA 148 2HB ALA 148 6.366 1.612 -7.309 1126 HB3 ALA 148 3HB ALA 148 5.939 0.707 -8.759 1127 H ARG 149 H ARG 149 5.609 1.052 -5.337 1128 HA ARG 149 HA ARG 149 7.881 1.227 -3.596 1129 HB2 ARG 149 2HB ARG 149 4.958 1.817 -3.116 1130 HB3 ARG 149 1HB ARG 149 6.248 2.233 -1.997 1131 HG2 ARG 149 2HG ARG 149 7.336 3.581 -3.772 1132 HG3 ARG 149 1HG ARG 149 6.001 3.198 -4.859 1133 HD2 ARG 149 2HD ARG 149 5.555 5.366 -3.898 1134 HD3 ARG 149 1HD ARG 149 4.436 4.222 -3.163 1135 HE ARG 149 HE ARG 149 6.744 5.501 -1.816 1136 HH11 ARG 149 1HH1 ARG 149 6.700 5.317 0.430 1137 HH12 ARG 149 2HH1 ARG 149 5.550 4.261 1.180 1138 HH21 ARG 149 1HH2 ARG 149 4.150 3.214 -1.810 1139 HH22 ARG 149 2HH2 ARG 149 4.110 3.076 -0.085 1140 H PHE 150 H PHE 150 4.942 -0.756 -3.520 1141 HA PHE 150 HA PHE 150 5.401 -1.949 -0.963 1142 HB2 PHE 150 2HB PHE 150 3.234 -2.048 -2.124 1143 HB3 PHE 150 1HB PHE 150 3.950 -3.051 -3.380 1144 HD1 PHE 150 1HD PHE 150 4.144 -5.385 -3.121 1145 HD2 PHE 150 2HD PHE 150 3.234 -2.925 0.281 1146 HE1 PHE 150 1HE PHE 150 3.696 -7.418 -1.774 1147 HE2 PHE 150 2HE PHE 150 2.787 -4.959 1.629 1148 HZ PHE 150 HZ PHE 150 3.019 -7.203 0.598 1149 H ALA 151 H ALA 151 6.367 -2.970 -4.245 1150 HA ALA 151 HA ALA 151 7.537 -5.456 -3.397 1151 HB1 ALA 151 1HB ALA 151 8.501 -3.890 -5.782 1152 HB2 ALA 151 2HB ALA 151 6.918 -4.664 -5.789 1153 HB3 ALA 151 3HB ALA 151 8.373 -5.639 -5.589 1154 H ASN 152 H ASN 152 8.887 -2.193 -3.819 1155 HA ASN 152 HA ASN 152 11.617 -2.895 -3.430 1156 HB2 ASN 152 2HB ASN 152 10.161 -0.346 -2.721 1157 HB3 ASN 152 1HB ASN 152 11.914 -0.517 -2.770 1158 HD21 ASN 152 1HD2 ASN 152 10.511 1.310 -4.497 1159 HD22 ASN 152 2HD2 ASN 152 10.683 0.761 -6.094 1160 H VAL 153 H VAL 153 9.226 -1.730 -1.045 1161 HA VAL 153 HA VAL 153 11.018 -2.089 1.184 1162 HB VAL 153 HB VAL 153 8.970 -1.757 2.555 1163 HG11 VAL 153 1HG1 VAL 153 10.037 0.017 0.522 1164 HG12 VAL 153 2HG1 VAL 153 9.519 0.395 2.165 1165 HG13 VAL 153 3HG1 VAL 153 8.343 0.385 0.851 1166 HG21 VAL 153 1HG2 VAL 153 7.189 -2.770 1.456 1167 HG22 VAL 153 2HG2 VAL 153 7.704 -2.187 -0.125 1168 HG23 VAL 153 3HG2 VAL 153 6.929 -1.085 1.011 1169 H ILE 154 H ILE 154 8.736 -4.168 -0.479 1170 HA ILE 154 HA ILE 154 8.809 -6.220 1.611 1171 HB ILE 154 HB ILE 154 7.617 -6.081 -1.152 1172 HG12 ILE 154 2HG1 ILE 154 6.736 -4.966 1.132 1173 HG13 ILE 154 1HG1 ILE 154 5.640 -5.606 -0.085 1174 HG21 ILE 154 1HG2 ILE 154 7.765 -8.372 0.796 1175 HG22 ILE 154 2HG2 ILE 154 8.167 -8.365 -0.919 1176 HG23 ILE 154 3HG2 ILE 154 6.482 -8.257 -0.410 1177 HD11 ILE 154 1HD1 ILE 154 5.326 -7.638 1.118 1178 HD12 ILE 154 2HD1 ILE 154 5.238 -6.364 2.334 1179 HD13 ILE 154 3HD1 ILE 154 6.711 -7.317 2.162 Start of MODEL 9 1 H1 MET 1 1HT MET 1 -1.205 8.121 -4.549 2 H2 MET 1 2HT MET 1 -1.429 6.724 -5.489 3 H3 MET 1 3HT MET 1 -0.971 8.183 -6.227 4 HA MET 1 HA MET 1 0.992 7.857 -4.417 5 HB2 MET 1 2HB MET 1 -0.310 5.362 -4.617 6 HB3 MET 1 1HB MET 1 1.167 5.210 -5.570 7 HG2 MET 1 2HG MET 1 2.506 6.000 -3.682 8 HG3 MET 1 1HG MET 1 1.047 6.258 -2.727 9 HE1 MET 1 1HE MET 1 0.470 4.603 -0.929 10 HE2 MET 1 2HE MET 1 -0.097 3.024 -1.465 11 HE3 MET 1 3HE MET 1 -0.681 4.480 -2.266 12 HA PRO 2 HA PRO 2 2.309 6.672 -8.986 13 HB2 PRO 2 2HB PRO 2 -0.153 7.367 -10.446 14 HB3 PRO 2 1HB PRO 2 0.893 5.950 -10.619 15 HG2 PRO 2 2HG PRO 2 -1.552 5.814 -9.512 16 HG3 PRO 2 1HG PRO 2 -0.213 4.767 -9.012 17 HD2 PRO 2 2HD PRO 2 -1.357 7.158 -7.623 18 HD3 PRO 2 1HD PRO 2 -0.672 5.669 -6.932 19 H GLU 3 H GLU 3 3.137 8.219 -10.495 20 HA GLU 3 HA GLU 3 3.496 10.824 -9.760 21 HB2 GLU 3 2HB GLU 3 3.068 9.910 -12.608 22 HB3 GLU 3 1HB GLU 3 3.929 11.365 -12.112 23 HG2 GLU 3 2HG GLU 3 5.541 9.944 -10.848 24 HG3 GLU 3 1HG GLU 3 4.712 8.508 -11.451 25 H GLU 4 H GLU 4 1.244 10.325 -12.467 26 HA GLU 4 HA GLU 4 -0.457 12.483 -11.311 27 HB2 GLU 4 2HB GLU 4 -0.340 11.478 -14.170 28 HB3 GLU 4 1HB GLU 4 -1.220 12.893 -13.588 29 HG2 GLU 4 2HG GLU 4 0.957 13.871 -12.833 30 HG3 GLU 4 1HG GLU 4 1.785 12.505 -13.576 31 H ILE 5 H ILE 5 -2.701 12.114 -11.091 32 HA ILE 5 HA ILE 5 -3.681 9.615 -10.394 33 HB ILE 5 HB ILE 5 -4.847 11.813 -10.098 34 HG12 ILE 5 2HG1 ILE 5 -6.922 10.204 -11.447 35 HG13 ILE 5 1HG1 ILE 5 -5.936 9.300 -10.297 36 HG21 ILE 5 1HG2 ILE 5 -5.793 12.969 -11.833 37 HG22 ILE 5 2HG2 ILE 5 -6.134 11.509 -12.762 38 HG23 ILE 5 3HG2 ILE 5 -4.502 12.177 -12.736 39 HD11 ILE 5 1HD1 ILE 5 -7.029 11.991 -9.506 40 HD12 ILE 5 2HD1 ILE 5 -6.604 10.616 -8.484 41 HD13 ILE 5 3HD1 ILE 5 -8.079 10.574 -9.449 42 HA PRO 6 HA PRO 6 -3.653 7.975 -14.672 43 HB2 PRO 6 2HB PRO 6 -2.803 5.496 -14.132 44 HB3 PRO 6 1HB PRO 6 -1.696 6.880 -14.042 45 HG2 PRO 6 2HG PRO 6 -2.972 5.336 -11.861 46 HG3 PRO 6 1HG PRO 6 -1.394 6.134 -11.910 47 HD2 PRO 6 2HD PRO 6 -3.781 7.159 -10.747 48 HD3 PRO 6 1HD PRO 6 -2.255 8.026 -10.984 49 H ASP 7 H ASP 7 -4.882 6.215 -15.762 50 HA ASP 7 HA ASP 7 -7.449 5.682 -14.430 51 HB2 ASP 7 2HB ASP 7 -6.349 4.934 -17.162 52 HB3 ASP 7 1HB ASP 7 -7.979 4.555 -16.615 53 H VAL 8 H VAL 8 -7.199 3.013 -16.196 54 HA VAL 8 HA VAL 8 -6.917 1.207 -14.044 55 HB VAL 8 HB VAL 8 -7.773 0.132 -15.903 56 HG11 VAL 8 1HG1 VAL 8 -5.903 1.941 -17.382 57 HG12 VAL 8 2HG1 VAL 8 -7.629 1.674 -17.627 58 HG13 VAL 8 3HG1 VAL 8 -6.463 0.476 -18.190 59 HG21 VAL 8 1HG2 VAL 8 -5.632 -1.028 -15.041 60 HG22 VAL 8 2HG2 VAL 8 -4.863 -0.412 -16.504 61 HG23 VAL 8 3HG2 VAL 8 -6.229 -1.519 -16.626 62 H ARG 9 H ARG 9 -5.111 0.287 -13.044 63 HA ARG 9 HA ARG 9 -2.521 1.509 -13.751 64 HB2 ARG 9 2HB ARG 9 -3.391 -0.179 -11.400 65 HB3 ARG 9 1HB ARG 9 -1.736 0.380 -11.632 66 HG2 ARG 9 2HG ARG 9 -2.591 2.725 -11.738 67 HG3 ARG 9 1HG ARG 9 -4.206 2.120 -11.370 68 HD2 ARG 9 2HD ARG 9 -3.286 1.115 -9.266 69 HD3 ARG 9 1HD ARG 9 -1.746 1.900 -9.614 70 HE ARG 9 HE ARG 9 -3.522 3.994 -9.703 71 HH11 ARG 9 1HH1 ARG 9 -4.147 5.190 -7.889 72 HH12 ARG 9 2HH1 ARG 9 -4.079 4.458 -6.321 73 HH21 ARG 9 1HH2 ARG 9 -2.896 1.418 -7.499 74 HH22 ARG 9 2HH2 ARG 9 -3.370 2.322 -6.099 75 H LYS 10 H LYS 10 -0.804 -0.577 -12.832 76 HA LYS 10 HA LYS 10 -1.173 -2.564 -15.027 77 HB2 LYS 10 2HB LYS 10 1.322 -1.262 -13.955 78 HB3 LYS 10 1HB LYS 10 1.336 -2.621 -15.067 79 HG2 LYS 10 2HG LYS 10 -0.044 -1.272 -16.652 80 HG3 LYS 10 1HG LYS 10 0.119 0.102 -15.558 81 HD2 LYS 10 2HD LYS 10 2.599 -0.074 -15.765 82 HD3 LYS 10 1HD LYS 10 2.378 -1.360 -16.952 83 HE2 LYS 10 2HE LYS 10 0.705 0.697 -17.839 84 HE3 LYS 10 1HE LYS 10 2.169 1.522 -17.303 85 HZ1 LYS 10 1HZ LYS 10 1.787 -0.345 -19.496 86 HZ2 LYS 10 2HZ LYS 10 3.223 -0.533 -18.607 87 HZ3 LYS 10 3HZ LYS 10 2.868 0.954 -19.350 88 H SER 11 H SER 11 0.731 -4.334 -14.538 89 HA SER 11 HA SER 11 0.240 -5.323 -11.752 90 HB2 SER 11 2HB SER 11 0.081 -7.573 -12.611 91 HB3 SER 11 1HB SER 11 -1.011 -6.573 -13.560 92 HG SER 11 HG SER 11 1.298 -6.402 -14.748 93 H VAL 12 H VAL 12 2.010 -6.516 -10.820 94 HA VAL 12 HA VAL 12 4.532 -6.647 -12.350 95 HB VAL 12 HB VAL 12 3.945 -4.585 -10.390 96 HG11 VAL 12 1HG1 VAL 12 6.119 -4.760 -9.172 97 HG12 VAL 12 2HG1 VAL 12 6.351 -6.360 -9.868 98 HG13 VAL 12 3HG1 VAL 12 5.007 -6.064 -8.761 99 HG21 VAL 12 1HG2 VAL 12 5.020 -4.430 -12.698 100 HG22 VAL 12 2HG2 VAL 12 6.482 -5.077 -11.957 101 HG23 VAL 12 3HG2 VAL 12 5.828 -3.532 -11.413 102 H VAL 13 H VAL 13 6.120 -8.043 -11.288 103 HA VAL 13 HA VAL 13 4.798 -9.993 -9.478 104 HB VAL 13 HB VAL 13 7.448 -10.224 -10.936 105 HG11 VAL 13 1HG1 VAL 13 6.089 -11.829 -8.938 106 HG12 VAL 13 2HG1 VAL 13 7.699 -12.041 -9.625 107 HG13 VAL 13 3HG1 VAL 13 6.296 -12.742 -10.433 108 HG21 VAL 13 1HG2 VAL 13 4.984 -10.115 -12.128 109 HG22 VAL 13 2HG2 VAL 13 5.127 -11.840 -11.799 110 HG23 VAL 13 3HG2 VAL 13 6.351 -11.024 -12.771 111 H VAL 14 H VAL 14 5.486 -10.267 -7.374 112 HA VAL 14 HA VAL 14 7.912 -8.732 -6.538 113 HB VAL 14 HB VAL 14 6.780 -8.128 -4.469 114 HG11 VAL 14 1HG1 VAL 14 4.810 -7.569 -6.687 115 HG12 VAL 14 2HG1 VAL 14 6.410 -6.827 -6.669 116 HG13 VAL 14 3HG1 VAL 14 5.280 -6.519 -5.350 117 HG21 VAL 14 1HG2 VAL 14 4.494 -9.754 -5.624 118 HG22 VAL 14 2HG2 VAL 14 4.341 -8.697 -4.220 119 HG23 VAL 14 3HG2 VAL 14 5.402 -10.105 -4.153 120 H ALA 15 H ALA 15 9.042 -9.630 -4.678 121 HA ALA 15 HA ALA 15 8.880 -12.565 -4.616 122 HB1 ALA 15 1HB ALA 15 11.024 -12.527 -3.820 123 HB2 ALA 15 2HB ALA 15 10.729 -11.121 -2.796 124 HB3 ALA 15 3HB ALA 15 11.001 -10.911 -4.526 125 H ALA 16 H ALA 16 6.994 -13.052 -3.465 126 HA ALA 16 HA ALA 16 7.202 -12.981 -0.584 127 HB1 ALA 16 1HB ALA 16 4.891 -11.705 -0.464 128 HB2 ALA 16 2HB ALA 16 5.431 -11.006 -1.990 129 HB3 ALA 16 3HB ALA 16 6.399 -10.792 -0.532 130 H SER 17 H SER 17 6.019 -14.687 0.204 131 HA SER 17 HA SER 17 4.686 -16.475 -1.599 132 HB2 SER 17 2HB SER 17 4.495 -16.335 1.425 133 HB3 SER 17 1HB SER 17 4.037 -17.711 0.426 134 HG SER 17 HG SER 17 6.533 -16.849 -0.160 135 H VAL 18 H VAL 18 2.379 -17.043 -1.575 136 HA VAL 18 HA VAL 18 0.649 -14.803 -1.809 137 HB VAL 18 HB VAL 18 -0.735 -17.281 -1.072 138 HG11 VAL 18 1HG1 VAL 18 -1.987 -16.800 -3.001 139 HG12 VAL 18 2HG1 VAL 18 -0.640 -15.972 -3.782 140 HG13 VAL 18 3HG1 VAL 18 -1.494 -15.201 -2.447 141 HG21 VAL 18 1HG2 VAL 18 0.055 -18.423 -3.223 142 HG22 VAL 18 2HG2 VAL 18 1.188 -18.450 -1.874 143 HG23 VAL 18 3HG2 VAL 18 1.419 -17.307 -3.199 144 H GLU 19 H GLU 19 1.079 -17.101 0.873 145 HA GLU 19 HA GLU 19 -0.928 -16.003 2.575 146 HB2 GLU 19 2HB GLU 19 1.683 -17.379 3.279 147 HB3 GLU 19 1HB GLU 19 0.378 -17.061 4.422 148 HG2 GLU 19 2HG GLU 19 -1.163 -18.393 2.997 149 HG3 GLU 19 1HG GLU 19 0.184 -18.763 1.920 150 H HIS 20 H HIS 20 2.433 -15.111 1.987 151 HA HIS 20 HA HIS 20 2.769 -13.282 4.130 152 HB2 HIS 20 2HB HIS 20 4.550 -14.176 2.561 153 HB3 HIS 20 1HB HIS 20 3.961 -13.027 1.360 154 HD1 HIS 20 1HD HIS 20 4.896 -12.837 5.059 155 HD2 HIS 20 2HD HIS 20 5.397 -10.685 1.522 156 HE1 HIS 20 1HE HIS 20 6.270 -10.799 5.649 157 HE2 HIS 20 2HE HIS 20 6.582 -9.481 3.505 158 H CYS 21 H CYS 21 1.427 -12.839 0.858 159 HA CYS 21 HA CYS 21 1.190 -10.020 0.897 160 HB2 CYS 21 2HB CYS 21 -0.527 -12.139 -0.424 161 HB3 CYS 21 1HB CYS 21 -0.696 -10.413 -0.736 162 HG CYS 21 HG CYS 21 1.765 -10.401 -1.667 163 H PHE 22 H PHE 22 -1.404 -12.390 1.645 164 HA PHE 22 HA PHE 22 -3.123 -10.336 2.739 165 HB2 PHE 22 2HB PHE 22 -3.435 -13.221 3.479 166 HB3 PHE 22 1HB PHE 22 -4.672 -12.036 3.051 167 HD1 PHE 22 1HD PHE 22 -4.610 -11.119 0.592 168 HD2 PHE 22 2HD PHE 22 -2.668 -14.726 1.877 169 HE1 PHE 22 1HE PHE 22 -4.514 -11.904 -1.756 170 HE2 PHE 22 2HE PHE 22 -2.572 -15.512 -0.467 171 HZ PHE 22 HZ PHE 22 -3.493 -14.101 -2.285 172 H GLU 23 H GLU 23 -0.839 -12.641 4.108 173 HA GLU 23 HA GLU 23 -1.522 -12.223 6.860 174 HB2 GLU 23 2HB GLU 23 -0.168 -14.133 6.070 175 HB3 GLU 23 1HB GLU 23 1.125 -13.023 5.630 176 HG2 GLU 23 2HG GLU 23 1.302 -12.302 7.986 177 HG3 GLU 23 1HG GLU 23 0.040 -13.455 8.419 178 H VAL 24 H VAL 24 0.764 -10.587 4.690 179 HA VAL 24 HA VAL 24 2.068 -8.998 6.639 180 HB VAL 24 HB VAL 24 1.490 -8.547 3.708 181 HG11 VAL 24 1HG1 VAL 24 2.672 -6.762 5.760 182 HG12 VAL 24 2HG1 VAL 24 1.870 -6.359 4.243 183 HG13 VAL 24 3HG1 VAL 24 3.552 -6.887 4.238 184 HG21 VAL 24 1HG2 VAL 24 3.207 -10.279 4.941 185 HG22 VAL 24 2HG2 VAL 24 4.233 -8.854 4.777 186 HG23 VAL 24 3HG2 VAL 24 3.495 -9.577 3.349 187 H PHE 25 H PHE 25 -0.876 -8.286 4.720 188 HA PHE 25 HA PHE 25 -1.233 -5.635 5.740 189 HB2 PHE 25 2HB PHE 25 -3.567 -7.413 5.082 190 HB3 PHE 25 1HB PHE 25 -3.370 -5.689 4.778 191 HD1 PHE 25 1HD PHE 25 -0.610 -5.712 3.573 192 HD2 PHE 25 2HD PHE 25 -4.007 -8.250 2.941 193 HE1 PHE 25 1HE PHE 25 0.203 -6.218 1.287 194 HE2 PHE 25 2HE PHE 25 -3.196 -8.763 0.648 195 HZ PHE 25 HZ PHE 25 -1.089 -7.747 -0.177 196 H THR 26 H THR 26 -2.484 -8.763 6.881 197 HA THR 26 HA THR 26 -3.723 -7.385 9.189 198 HB THR 26 HB THR 26 -4.928 -9.433 9.537 199 HG1 THR 26 1HG THR 26 -3.160 -10.835 9.137 200 HG21 THR 26 1HG2 THR 26 -4.636 -8.883 6.573 201 HG22 THR 26 2HG2 THR 26 -5.725 -8.043 7.679 202 HG23 THR 26 3HG2 THR 26 -5.977 -9.751 7.321 203 H SER 27 H SER 27 -0.716 -8.793 8.583 204 HA SER 27 HA SER 27 -0.500 -9.702 11.428 205 HB2 SER 27 2HB SER 27 -0.005 -11.354 9.565 206 HB3 SER 27 1HB SER 27 1.427 -10.385 9.224 207 HG SER 27 HG SER 27 0.930 -11.123 11.868 208 H ARG 28 H ARG 28 1.798 -8.381 8.988 209 HA ARG 28 HA ARG 28 2.834 -6.622 11.186 210 HB2 ARG 28 2HB ARG 28 5.049 -6.805 10.012 211 HB3 ARG 28 1HB ARG 28 4.473 -8.321 10.703 212 HG2 ARG 28 2HG ARG 28 3.692 -9.084 8.546 213 HG3 ARG 28 1HG ARG 28 4.033 -7.516 7.816 214 HD2 ARG 28 2HD ARG 28 5.836 -9.050 7.253 215 HD3 ARG 28 1HD ARG 28 6.453 -7.835 8.373 216 HE ARG 28 HE ARG 28 6.021 -10.693 8.977 217 HH11 ARG 28 1HH1 ARG 28 6.910 -11.363 10.940 218 HH12 ARG 28 2HH1 ARG 28 7.491 -10.180 12.064 219 HH21 ARG 28 1HH2 ARG 28 6.672 -7.476 10.057 220 HH22 ARG 28 2HH2 ARG 28 7.355 -7.984 11.564 221 HA PRO 29 HA PRO 29 1.483 -4.129 7.371 222 HB2 PRO 29 2HB PRO 29 -0.314 -2.564 8.760 223 HB3 PRO 29 1HB PRO 29 -0.757 -4.046 7.891 224 HG2 PRO 29 2HG PRO 29 -0.264 -3.634 10.800 225 HG3 PRO 29 1HG PRO 29 -1.493 -4.623 9.991 226 HD2 PRO 29 2HD PRO 29 0.744 -5.704 11.083 227 HD3 PRO 29 1HD PRO 29 -0.025 -6.388 9.632 228 H ALA 30 H ALA 30 2.210 -3.338 10.736 229 HA ALA 30 HA ALA 30 2.927 -0.580 10.274 230 HB1 ALA 30 1HB ALA 30 4.170 -2.207 12.469 231 HB2 ALA 30 2HB ALA 30 2.437 -1.887 12.515 232 HB3 ALA 30 3HB ALA 30 3.581 -0.545 12.510 233 H ASP 31 H ASP 31 4.552 -3.582 9.682 234 HA ASP 31 HA ASP 31 7.260 -2.812 9.890 235 HB2 ASP 31 2HB ASP 31 6.399 -5.114 9.277 236 HB3 ASP 31 1HB ASP 31 6.099 -4.498 7.652 237 H TRP 32 H TRP 32 4.823 -2.010 7.499 238 HA TRP 32 HA TRP 32 6.666 0.035 6.408 239 HB2 TRP 32 2HB TRP 32 6.068 -0.586 4.077 240 HB3 TRP 32 1HB TRP 32 6.943 -1.876 4.897 241 HD1 TRP 32 HD TRP 32 5.679 -4.103 5.392 242 HE1 TRP 32 1HE TRP 32 3.408 -5.054 4.647 243 HE3 TRP 32 3HE TRP 32 3.557 0.110 3.484 244 HZ2 TRP 32 2HZ TRP 32 1.010 -4.141 3.401 245 HZ3 TRP 32 3HZ TRP 32 1.275 0.047 2.519 246 HH2 TRP 32 HH TRP 32 -0.004 -2.069 2.475 247 H TRP 33 H TRP 33 5.527 1.895 6.663 248 HA TRP 33 HA TRP 33 2.623 1.882 6.848 249 HB2 TRP 33 2HB TRP 33 3.265 4.520 6.629 250 HB3 TRP 33 1HB TRP 33 3.352 3.623 8.144 251 HD1 TRP 33 HD TRP 33 5.457 5.436 5.654 252 HE1 TRP 33 1HE TRP 33 7.943 5.277 6.319 253 HE3 TRP 33 3HE TRP 33 5.167 1.893 9.320 254 HZ2 TRP 33 2HZ TRP 33 9.591 3.838 8.162 255 HZ3 TRP 33 3HZ TRP 33 7.206 1.148 10.514 256 HH2 TRP 33 HH TRP 33 9.417 2.115 9.940 257 HA PRO 34 HA PRO 34 1.493 2.301 2.623 258 HB2 PRO 34 2HB PRO 34 -0.190 4.597 2.912 259 HB3 PRO 34 1HB PRO 34 -0.662 2.899 2.802 260 HG2 PRO 34 2HG PRO 34 -0.487 4.611 5.151 261 HG3 PRO 34 1HG PRO 34 -1.317 3.067 4.935 262 HD2 PRO 34 2HD PRO 34 0.976 3.407 6.445 263 HD3 PRO 34 1HD PRO 34 0.454 1.859 5.746 264 HA PRO 35 HA PRO 35 2.704 6.896 1.520 265 HB2 PRO 35 2HB PRO 35 3.960 8.235 3.611 266 HB3 PRO 35 1HB PRO 35 2.276 8.475 3.116 267 HG2 PRO 35 2HG PRO 35 3.383 6.815 5.328 268 HG3 PRO 35 1HG PRO 35 1.927 7.828 5.293 269 HD2 PRO 35 2HD PRO 35 1.734 5.165 5.078 270 HD3 PRO 35 1HD PRO 35 0.681 6.238 4.131 271 H SER 36 H SER 36 4.560 6.716 0.349 272 HA SER 36 HA SER 36 6.745 5.032 1.134 273 HB2 SER 36 2HB SER 36 6.744 7.228 -0.956 274 HB3 SER 36 1HB SER 36 7.870 5.875 -0.859 275 HG SER 36 HG SER 36 6.198 4.481 -1.305 276 H HIS 37 H HIS 37 6.178 8.505 1.390 277 HA HIS 37 HA HIS 37 8.778 8.756 2.857 278 HB2 HIS 37 2HB HIS 37 8.659 10.076 0.743 279 HB3 HIS 37 1HB HIS 37 7.245 10.916 1.376 280 HD1 HIS 37 1HD HIS 37 10.810 10.193 2.567 281 HD2 HIS 37 2HD HIS 37 7.953 13.230 2.694 282 HE1 HIS 37 1HE HIS 37 11.891 12.146 3.769 283 HE2 HIS 37 2HE HIS 37 10.160 13.999 3.851 284 H VAL 38 H VAL 38 8.614 10.710 4.481 285 HA VAL 38 HA VAL 38 6.304 10.134 6.194 286 HB VAL 38 HB VAL 38 7.425 11.610 7.812 287 HG11 VAL 38 1HG1 VAL 38 9.400 9.792 6.398 288 HG12 VAL 38 2HG1 VAL 38 8.176 9.246 7.546 289 HG13 VAL 38 3HG1 VAL 38 9.477 10.309 8.082 290 HG21 VAL 38 1HG2 VAL 38 9.875 12.230 6.726 291 HG22 VAL 38 2HG2 VAL 38 8.526 13.358 6.860 292 HG23 VAL 38 3HG2 VAL 38 8.797 12.483 5.354 293 H LEU 39 H LEU 39 4.427 11.196 5.933 294 HA LEU 39 HA LEU 39 4.468 14.114 5.412 295 HB2 LEU 39 2HB LEU 39 2.952 12.084 3.742 296 HB3 LEU 39 1HB LEU 39 2.625 13.816 3.709 297 HG LEU 39 HG LEU 39 5.327 12.572 3.105 298 HD11 LEU 39 1HD1 LEU 39 4.632 13.560 0.759 299 HD12 LEU 39 2HD1 LEU 39 2.997 13.346 1.381 300 HD13 LEU 39 3HD1 LEU 39 4.076 11.958 1.240 301 HD21 LEU 39 1HD2 LEU 39 5.230 15.087 1.987 302 HD22 LEU 39 2HD2 LEU 39 5.974 14.712 3.541 303 HD23 LEU 39 3HD2 LEU 39 4.320 15.320 3.479 304 H VAL 40 H VAL 40 3.694 11.899 7.473 305 HA VAL 40 HA VAL 40 0.890 12.783 7.983 306 HB VAL 40 HB VAL 40 2.424 10.513 9.265 307 HG11 VAL 40 1HG1 VAL 40 -0.550 11.073 9.150 308 HG12 VAL 40 2HG1 VAL 40 0.477 11.493 10.521 309 HG13 VAL 40 3HG1 VAL 40 0.254 9.802 10.071 310 HG21 VAL 40 1HG2 VAL 40 0.303 9.634 7.558 311 HG22 VAL 40 2HG2 VAL 40 2.028 9.302 7.406 312 HG23 VAL 40 3HG2 VAL 40 1.333 10.726 6.631 313 H LYS 41 H LYS 41 0.377 13.603 10.122 314 HA LYS 41 HA LYS 41 2.301 15.336 11.250 315 HB2 LYS 41 2HB LYS 41 -0.174 15.457 11.646 316 HB3 LYS 41 1HB LYS 41 -0.018 14.068 12.718 317 HG2 LYS 41 2HG LYS 41 1.595 15.340 14.110 318 HG3 LYS 41 1HG LYS 41 1.371 16.740 13.061 319 HD2 LYS 41 2HD LYS 41 -1.083 16.668 13.592 320 HD3 LYS 41 1HD LYS 41 -0.744 15.394 14.764 321 HE2 LYS 41 2HE LYS 41 -0.214 18.296 14.930 322 HE3 LYS 41 1HE LYS 41 -0.490 17.126 16.221 323 HZ1 LYS 41 1HZ LYS 41 1.741 17.807 16.404 324 HZ2 LYS 41 2HZ LYS 41 2.022 17.638 14.737 325 HZ3 LYS 41 3HZ LYS 41 1.794 16.262 15.707 326 H LYS 42 H LYS 42 1.391 12.022 12.196 327 HA LYS 42 HA LYS 42 3.971 11.878 13.680 328 HB2 LYS 42 2HB LYS 42 1.876 12.086 15.178 329 HB3 LYS 42 1HB LYS 42 1.475 10.463 14.619 330 HG2 LYS 42 2HG LYS 42 2.710 10.150 16.631 331 HG3 LYS 42 1HG LYS 42 3.834 9.783 15.324 332 HD2 LYS 42 2HD LYS 42 3.990 12.589 15.827 333 HD3 LYS 42 1HD LYS 42 4.087 11.761 17.379 334 HE2 LYS 42 2HE LYS 42 5.855 10.278 16.447 335 HE3 LYS 42 1HE LYS 42 5.800 11.197 14.943 336 HZ1 LYS 42 1HZ LYS 42 7.244 11.783 17.247 337 HZ2 LYS 42 2HZ LYS 42 6.037 12.973 17.112 338 HZ3 LYS 42 3HZ LYS 42 7.124 12.711 15.832 339 H GLU 43 H GLU 43 5.087 9.938 13.360 340 HA GLU 43 HA GLU 43 4.526 8.439 11.012 341 HB2 GLU 43 2HB GLU 43 6.762 8.594 12.135 342 HB3 GLU 43 1HB GLU 43 6.156 7.522 13.399 343 HG2 GLU 43 2HG GLU 43 5.650 5.810 11.657 344 HG3 GLU 43 1HG GLU 43 6.373 6.870 10.445 345 H ARG 44 H ARG 44 3.315 6.620 10.651 346 HA ARG 44 HA ARG 44 1.403 5.788 12.657 347 HB2 ARG 44 2HB ARG 44 2.105 4.692 9.929 348 HB3 ARG 44 1HB ARG 44 0.836 4.005 10.945 349 HG2 ARG 44 2HG ARG 44 -0.149 6.347 11.085 350 HG3 ARG 44 1HG ARG 44 0.980 6.802 9.808 351 HD2 ARG 44 2HD ARG 44 0.026 5.207 8.288 352 HD3 ARG 44 1HD ARG 44 -0.947 4.485 9.571 353 HE ARG 44 HE ARG 44 -1.886 7.001 9.638 354 HH11 ARG 44 1HH1 ARG 44 -3.403 7.938 8.250 355 HH12 ARG 44 2HH1 ARG 44 -3.562 7.341 6.631 356 HH21 ARG 44 1HH2 ARG 44 -1.101 4.929 6.990 357 HH22 ARG 44 2HH2 ARG 44 -2.260 5.641 5.920 358 H ALA 45 H ALA 45 1.335 3.875 13.834 359 HA ALA 45 HA ALA 45 3.788 2.168 13.711 360 HB1 ALA 45 1HB ALA 45 4.309 3.277 15.648 361 HB2 ALA 45 2HB ALA 45 3.252 2.041 16.332 362 HB3 ALA 45 3HB ALA 45 2.624 3.658 16.006 363 H GLY 46 H GLY 46 0.323 2.365 14.162 364 HA2 GLY 46 2HA GLY 46 0.275 -0.625 14.279 365 HA3 GLY 46 1HA GLY 46 -0.756 0.323 15.338 366 H LEU 47 H LEU 47 -1.509 -1.609 13.249 367 HA LEU 47 HA LEU 47 -3.416 0.143 11.804 368 HB2 LEU 47 2HB LEU 47 -1.777 -2.006 10.426 369 HB3 LEU 47 1HB LEU 47 -3.045 -1.039 9.684 370 HG LEU 47 HG LEU 47 -1.550 0.976 10.565 371 HD11 LEU 47 1HD1 LEU 47 0.660 0.522 10.975 372 HD12 LEU 47 2HD1 LEU 47 0.699 -0.824 9.838 373 HD13 LEU 47 3HD1 LEU 47 0.020 -1.051 11.448 374 HD21 LEU 47 1HD2 LEU 47 -1.447 -0.695 8.095 375 HD22 LEU 47 2HD2 LEU 47 -0.164 0.499 8.300 376 HD23 LEU 47 3HD2 LEU 47 -1.851 1.011 8.281 377 H ALA 48 H ALA 48 -5.451 -0.784 11.808 378 HA ALA 48 HA ALA 48 -5.696 -3.716 12.057 379 HB1 ALA 48 1HB ALA 48 -5.583 -3.006 14.389 380 HB2 ALA 48 2HB ALA 48 -7.229 -3.510 14.011 381 HB3 ALA 48 3HB ALA 48 -6.833 -1.794 14.108 382 H PHE 49 H PHE 49 -7.349 -4.359 10.765 383 HA PHE 49 HA PHE 49 -9.692 -2.587 10.420 384 HB2 PHE 49 2HB PHE 49 -9.537 -2.758 7.942 385 HB3 PHE 49 1HB PHE 49 -8.181 -1.871 8.643 386 HD1 PHE 49 1HD PHE 49 -5.968 -2.964 8.905 387 HD2 PHE 49 2HD PHE 49 -9.216 -4.866 6.839 388 HE1 PHE 49 1HE PHE 49 -4.375 -4.549 7.865 389 HE2 PHE 49 2HE PHE 49 -7.625 -6.456 5.798 390 HZ PHE 49 HZ PHE 49 -5.196 -6.292 6.311 391 H GLU 50 H GLU 50 -11.561 -3.717 9.732 392 HA GLU 50 HA GLU 50 -11.442 -6.622 10.186 393 HB2 GLU 50 2HB GLU 50 -13.996 -5.398 9.345 394 HB3 GLU 50 1HB GLU 50 -13.653 -6.449 10.718 395 HG2 GLU 50 2HG GLU 50 -12.460 -4.453 11.775 396 HG3 GLU 50 1HG GLU 50 -13.189 -3.469 10.504 397 HA PRO 51 HA PRO 51 -11.220 -6.942 5.653 398 HB2 PRO 51 2HB PRO 51 -10.573 -9.576 5.513 399 HB3 PRO 51 1HB PRO 51 -9.395 -8.315 5.922 400 HG2 PRO 51 2HG PRO 51 -10.790 -10.246 7.687 401 HG3 PRO 51 1HG PRO 51 -9.147 -9.593 7.796 402 HD2 PRO 51 2HD PRO 51 -11.304 -8.717 9.320 403 HD3 PRO 51 1HD PRO 51 -9.823 -7.783 9.028 404 H PHE 52 H PHE 52 -13.478 -6.673 5.261 405 HA PHE 52 HA PHE 52 -14.861 -9.123 4.468 406 HB2 PHE 52 2HB PHE 52 -16.165 -7.330 6.539 407 HB3 PHE 52 1HB PHE 52 -16.813 -8.830 5.872 408 HD1 PHE 52 1HD PHE 52 -14.649 -7.352 8.360 409 HD2 PHE 52 2HD PHE 52 -15.584 -11.008 6.314 410 HE1 PHE 52 1HE PHE 52 -13.448 -8.633 10.107 411 HE2 PHE 52 2HE PHE 52 -14.383 -12.294 8.062 412 HZ PHE 52 HZ PHE 52 -13.310 -11.106 9.958 413 H VAL 53 H VAL 53 -17.194 -8.314 3.587 414 HA VAL 53 HA VAL 53 -16.543 -6.081 1.807 415 HB VAL 53 HB VAL 53 -19.221 -7.471 2.146 416 HG11 VAL 53 1HG1 VAL 53 -18.177 -5.356 0.422 417 HG12 VAL 53 2HG1 VAL 53 -19.842 -5.890 0.657 418 HG13 VAL 53 3HG1 VAL 53 -18.810 -6.715 -0.511 419 HG21 VAL 53 1HG2 VAL 53 -16.987 -8.832 1.514 420 HG22 VAL 53 2HG2 VAL 53 -17.361 -8.172 -0.078 421 HG23 VAL 53 3HG2 VAL 53 -18.540 -9.179 0.758 422 H GLY 54 H GLY 54 -16.946 -3.972 2.317 423 HA2 GLY 54 2HA GLY 54 -18.075 -2.119 3.266 424 HA3 GLY 54 1HA GLY 54 -19.300 -3.231 3.887 425 H GLY 55 H GLY 55 -15.994 -4.015 4.492 426 HA2 GLY 55 2HA GLY 55 -16.385 -3.923 7.359 427 HA3 GLY 55 1HA GLY 55 -14.860 -4.269 6.536 428 H ARG 56 H ARG 56 -14.453 -2.745 8.633 429 HA ARG 56 HA ARG 56 -14.354 0.068 7.599 430 HB2 ARG 56 2HB ARG 56 -14.464 -0.937 10.460 431 HB3 ARG 56 1HB ARG 56 -14.267 0.753 9.993 432 HG2 ARG 56 2HG ARG 56 -16.424 0.628 8.751 433 HG3 ARG 56 1HG ARG 56 -16.633 -1.026 9.331 434 HD2 ARG 56 2HD ARG 56 -16.456 -0.138 11.685 435 HD3 ARG 56 1HD ARG 56 -16.485 1.491 11.011 436 HE ARG 56 HE ARG 56 -18.778 -0.253 11.313 437 HH11 ARG 56 1HH1 ARG 56 -20.738 0.518 10.492 438 HH12 ARG 56 2HH1 ARG 56 -20.733 1.836 9.369 439 HH21 ARG 56 1HH2 ARG 56 -17.282 2.171 9.371 440 HH22 ARG 56 2HH2 ARG 56 -18.776 2.771 8.733 441 H TYR 57 H TYR 57 -12.333 1.022 7.518 442 HA TYR 57 HA TYR 57 -10.059 -0.629 8.540 443 HB2 TYR 57 2HB TYR 57 -10.371 -0.261 5.981 444 HB3 TYR 57 1HB TYR 57 -9.803 1.376 6.310 445 HD1 TYR 57 1HD TYR 57 -8.827 -2.008 5.701 446 HD2 TYR 57 2HD TYR 57 -7.599 1.604 7.675 447 HE1 TYR 57 1HE TYR 57 -6.488 -2.834 5.755 448 HE2 TYR 57 2HE TYR 57 -5.260 0.782 7.723 449 HH TYR 57 HH TYR 57 -3.857 -0.809 7.045 450 H TYR 58 H TYR 58 -8.797 0.331 10.040 451 HA TYR 58 HA TYR 58 -8.674 3.292 10.149 452 HB2 TYR 58 2HB TYR 58 -8.961 3.075 12.696 453 HB3 TYR 58 1HB TYR 58 -10.418 2.891 11.717 454 HD1 TYR 58 1HD TYR 58 -8.358 1.376 14.206 455 HD2 TYR 58 2HD TYR 58 -11.011 0.476 10.952 456 HE1 TYR 58 1HE TYR 58 -8.694 -0.910 15.111 457 HE2 TYR 58 2HE TYR 58 -11.348 -1.809 11.854 458 HH TYR 58 HH TYR 58 -9.739 -3.392 13.492 459 H GLU 59 H GLU 59 -6.795 4.054 11.326 460 HA GLU 59 HA GLU 59 -4.789 1.938 11.963 461 HB2 GLU 59 2HB GLU 59 -4.288 4.472 10.371 462 HB3 GLU 59 1HB GLU 59 -3.049 3.319 10.873 463 HG2 GLU 59 2HG GLU 59 -4.201 1.537 9.598 464 HG3 GLU 59 1HG GLU 59 -5.411 2.707 9.070 465 H TRP 60 H TRP 60 -3.242 2.577 13.586 466 HA TRP 60 HA TRP 60 -4.210 4.869 15.236 467 HB2 TRP 60 2HB TRP 60 -2.452 2.513 15.976 468 HB3 TRP 60 1HB TRP 60 -2.925 3.808 17.075 469 HD1 TRP 60 HD TRP 60 -5.767 4.159 17.112 470 HE1 TRP 60 1HE TRP 60 -7.516 2.292 17.426 471 HE3 TRP 60 3HE TRP 60 -2.979 0.103 15.735 472 HZ2 TRP 60 2HZ TRP 60 -7.705 -0.546 17.139 473 HZ3 TRP 60 3HZ TRP 60 -3.970 -2.168 15.771 474 HH2 TRP 60 HH TRP 60 -6.328 -2.496 16.470 475 H ASP 61 H ASP 61 -2.881 6.590 15.618 476 HA ASP 61 HA ASP 61 -0.223 6.565 14.286 477 HB2 ASP 61 2HB ASP 61 -1.918 8.794 15.430 478 HB3 ASP 61 1HB ASP 61 -0.307 9.042 14.762 479 H ILE 62 H ILE 62 1.685 7.122 15.512 480 HA ILE 62 HA ILE 62 1.841 6.005 18.085 481 HB ILE 62 HB ILE 62 3.620 8.090 16.832 482 HG12 ILE 62 2HG1 ILE 62 4.010 5.114 17.111 483 HG13 ILE 62 1HG1 ILE 62 3.338 5.865 15.673 484 HG21 ILE 62 1HG2 ILE 62 3.596 6.898 19.479 485 HG22 ILE 62 2HG2 ILE 62 4.608 8.202 18.853 486 HG23 ILE 62 3HG2 ILE 62 5.082 6.521 18.608 487 HD11 ILE 62 1HD1 ILE 62 5.413 7.306 15.565 488 HD12 ILE 62 2HD1 ILE 62 5.700 5.589 15.286 489 HD13 ILE 62 3HD1 ILE 62 6.089 6.304 16.850 490 H ASP 63 H ASP 63 1.240 9.377 17.167 491 HA ASP 63 HA ASP 63 0.571 9.900 20.040 492 HB2 ASP 63 2HB ASP 63 1.892 11.751 18.040 493 HB3 ASP 63 1HB ASP 63 1.271 12.276 19.604 494 H GLY 64 H GLY 64 -0.742 9.511 17.058 495 HA2 GLY 64 2HA GLY 64 -2.829 11.598 17.514 496 HA3 GLY 64 1HA GLY 64 -2.459 10.909 15.935 497 H THR 65 H THR 65 -5.030 10.950 17.389 498 HA THR 65 HA THR 65 -5.672 8.432 18.526 499 HB THR 65 HB THR 65 -7.061 10.620 18.416 500 HG1 THR 65 1HG THR 65 -7.913 7.970 18.292 501 HG21 THR 65 1HG2 THR 65 -6.975 10.291 15.782 502 HG22 THR 65 2HG2 THR 65 -8.372 11.022 16.570 503 HG23 THR 65 3HG2 THR 65 -8.415 9.324 16.100 504 H GLU 66 H GLU 66 -7.845 7.516 16.952 505 HA GLU 66 HA GLU 66 -6.330 6.190 14.764 506 HB2 GLU 66 2HB GLU 66 -8.922 5.049 15.079 507 HB3 GLU 66 1HB GLU 66 -7.368 4.329 15.488 508 HG2 GLU 66 2HG GLU 66 -8.713 4.335 17.490 509 HG3 GLU 66 1HG GLU 66 -7.466 5.563 17.691 510 H ILE 67 H ILE 67 -6.901 6.521 12.653 511 HA ILE 67 HA ILE 67 -9.436 8.000 12.113 512 HB ILE 67 HB ILE 67 -8.250 9.250 10.334 513 HG12 ILE 67 2HG1 ILE 67 -5.716 8.118 11.540 514 HG13 ILE 67 1HG1 ILE 67 -6.459 7.455 10.084 515 HG21 ILE 67 1HG2 ILE 67 -8.352 9.853 12.931 516 HG22 ILE 67 2HG2 ILE 67 -7.462 10.861 11.790 517 HG23 ILE 67 3HG2 ILE 67 -6.602 9.689 12.788 518 HD11 ILE 67 1HD1 ILE 67 -6.392 9.835 9.140 519 HD12 ILE 67 2HD1 ILE 67 -4.834 9.024 9.307 520 HD13 ILE 67 3HD1 ILE 67 -5.331 10.231 10.493 521 H VAL 68 H VAL 68 -10.115 7.752 9.760 522 HA VAL 68 HA VAL 68 -9.870 4.902 9.050 523 HB VAL 68 HB VAL 68 -11.481 7.116 7.744 524 HG11 VAL 68 1HG1 VAL 68 -11.066 5.167 6.282 525 HG12 VAL 68 2HG1 VAL 68 -12.760 5.249 6.767 526 HG13 VAL 68 3HG1 VAL 68 -11.675 4.095 7.544 527 HG21 VAL 68 1HG2 VAL 68 -12.395 4.970 9.680 528 HG22 VAL 68 2HG2 VAL 68 -13.346 6.316 9.052 529 HG23 VAL 68 3HG2 VAL 68 -12.016 6.622 10.168 530 H TRP 69 H TRP 69 -8.653 4.130 7.386 531 HA TRP 69 HA TRP 69 -7.179 6.127 5.727 532 HB2 TRP 69 2HB TRP 69 -5.521 4.828 6.673 533 HB3 TRP 69 1HB TRP 69 -6.546 3.398 6.762 534 HD1 TRP 69 HD TRP 69 -4.029 5.124 4.587 535 HE1 TRP 69 1HE TRP 69 -3.612 3.727 2.461 536 HE3 TRP 69 3HE TRP 69 -7.818 1.726 5.004 537 HZ2 TRP 69 2HZ TRP 69 -4.734 1.465 1.116 538 HZ3 TRP 69 3HZ TRP 69 -8.121 -0.038 3.291 539 HH2 TRP 69 HH TRP 69 -6.584 -0.174 1.348 540 H GLY 70 H GLY 70 -9.806 4.078 5.554 541 HA2 GLY 70 2HA GLY 70 -10.451 4.458 2.898 542 HA3 GLY 70 1HA GLY 70 -9.403 3.040 2.863 543 H ARG 71 H ARG 71 -10.929 1.431 2.445 544 HA ARG 71 HA ARG 71 -12.668 0.704 4.683 545 HB2 ARG 71 2HB ARG 71 -13.845 2.372 2.914 546 HB3 ARG 71 1HB ARG 71 -14.138 0.839 2.098 547 HG2 ARG 71 2HG ARG 71 -15.128 -0.068 4.183 548 HG3 ARG 71 1HG ARG 71 -14.883 1.495 4.960 549 HD2 ARG 71 2HD ARG 71 -16.309 2.551 3.213 550 HD3 ARG 71 1HD ARG 71 -16.608 0.955 2.525 551 HE ARG 71 HE ARG 71 -17.309 0.779 5.243 552 HH11 ARG 71 1HH1 ARG 71 -19.459 1.043 5.886 553 HH12 ARG 71 2HH1 ARG 71 -20.553 1.914 4.865 554 HH21 ARG 71 1HH2 ARG 71 -18.178 2.562 2.423 555 HH22 ARG 71 2HH2 ARG 71 -19.828 2.774 2.903 556 H ILE 72 H ILE 72 -14.233 -1.163 3.151 557 HA ILE 72 HA ILE 72 -12.123 -2.909 1.960 558 HB ILE 72 HB ILE 72 -14.379 -3.959 3.668 559 HG12 ILE 72 2HG1 ILE 72 -13.000 -2.442 5.046 560 HG13 ILE 72 1HG1 ILE 72 -12.810 -4.113 5.541 561 HG21 ILE 72 1HG2 ILE 72 -12.764 -5.878 3.876 562 HG22 ILE 72 2HG2 ILE 72 -11.741 -5.064 2.697 563 HG23 ILE 72 3HG2 ILE 72 -13.355 -5.603 2.237 564 HD11 ILE 72 1HD1 ILE 72 -10.806 -2.250 4.576 565 HD12 ILE 72 2HD1 ILE 72 -10.821 -3.711 3.594 566 HD13 ILE 72 3HD1 ILE 72 -10.589 -3.823 5.334 567 H LEU 73 H LEU 73 -13.008 -4.527 0.455 568 HA LEU 73 HA LEU 73 -15.692 -3.759 -0.630 569 HB2 LEU 73 2HB LEU 73 -13.774 -3.040 -2.089 570 HB3 LEU 73 1HB LEU 73 -13.303 -4.732 -2.227 571 HG LEU 73 HG LEU 73 -15.812 -5.063 -2.976 572 HD11 LEU 73 1HD1 LEU 73 -16.652 -3.099 -4.223 573 HD12 LEU 73 2HD1 LEU 73 -15.288 -2.151 -3.634 574 HD13 LEU 73 3HD1 LEU 73 -16.502 -2.748 -2.502 575 HD21 LEU 73 1HD2 LEU 73 -14.942 -4.160 -5.353 576 HD22 LEU 73 2HD2 LEU 73 -14.317 -5.640 -4.628 577 HD23 LEU 73 3HD2 LEU 73 -13.411 -4.133 -4.477 578 H GLU 74 H GLU 74 -13.262 -6.374 -0.627 579 HA GLU 74 HA GLU 74 -15.122 -8.351 0.298 580 HB2 GLU 74 2HB GLU 74 -16.016 -8.005 -2.015 581 HB3 GLU 74 1HB GLU 74 -14.451 -8.513 -2.645 582 HG2 GLU 74 2HG GLU 74 -14.700 -10.677 -1.433 583 HG3 GLU 74 1HG GLU 74 -16.310 -10.171 -0.919 584 H TRP 75 H TRP 75 -14.030 -10.275 0.813 585 HA TRP 75 HA TRP 75 -11.122 -10.310 0.126 586 HB2 TRP 75 2HB TRP 75 -10.610 -11.063 2.281 587 HB3 TRP 75 1HB TRP 75 -11.923 -9.929 2.596 588 HD1 TRP 75 HD TRP 75 -10.941 -13.472 3.055 589 HE1 TRP 75 1HE TRP 75 -12.915 -14.840 3.991 590 HE3 TRP 75 3HE TRP 75 -14.731 -10.110 2.409 591 HZ2 TRP 75 2HZ TRP 75 -15.728 -14.548 4.410 592 HZ3 TRP 75 3HZ TRP 75 -17.046 -10.681 3.084 593 HH2 TRP 75 HH TRP 75 -17.549 -12.894 4.083 594 H ASP 76 H ASP 76 -10.535 -12.035 -1.086 595 HA ASP 76 HA ASP 76 -12.267 -14.465 -0.986 596 HB2 ASP 76 2HB ASP 76 -11.783 -12.870 -3.179 597 HB3 ASP 76 1HB ASP 76 -10.594 -14.160 -3.372 598 HA PRO 77 HA PRO 77 -8.808 -16.591 0.942 599 HB2 PRO 77 2HB PRO 77 -9.606 -18.593 -1.165 600 HB3 PRO 77 1HB PRO 77 -9.160 -18.878 0.529 601 HG2 PRO 77 2HG PRO 77 -11.711 -18.800 -0.255 602 HG3 PRO 77 1HG PRO 77 -11.194 -18.196 1.328 603 HD2 PRO 77 2HD PRO 77 -12.187 -16.687 -0.990 604 HD3 PRO 77 1HD PRO 77 -12.016 -16.156 0.699 605 HA PRO 78 HA PRO 78 -5.012 -15.813 -1.134 606 HB2 PRO 78 2HB PRO 78 -4.841 -18.800 -1.413 607 HB3 PRO 78 1HB PRO 78 -3.584 -17.647 -0.921 608 HG2 PRO 78 2HG PRO 78 -5.088 -19.125 0.828 609 HG3 PRO 78 1HG PRO 78 -4.297 -17.594 1.228 610 HD2 PRO 78 2HD PRO 78 -7.126 -18.125 1.108 611 HD3 PRO 78 1HD PRO 78 -6.328 -16.583 1.480 612 H HIS 79 H HIS 79 -5.952 -14.883 -3.020 613 HA HIS 79 HA HIS 79 -5.343 -15.932 -5.500 614 HB2 HIS 79 2HB HIS 79 -7.763 -17.182 -4.375 615 HB3 HIS 79 1HB HIS 79 -7.981 -16.521 -5.994 616 HD1 HIS 79 1HD HIS 79 -7.057 -19.565 -4.474 617 HD2 HIS 79 2HD HIS 79 -5.464 -17.375 -7.648 618 HE1 HIS 79 1HE HIS 79 -5.651 -21.182 -5.828 619 HE2 HIS 79 2HE HIS 79 -4.679 -19.859 -7.762 620 H ARG 80 H ARG 80 -8.160 -14.355 -3.867 621 HA ARG 80 HA ARG 80 -7.769 -12.105 -5.787 622 HB2 ARG 80 2HB ARG 80 -9.809 -13.876 -6.131 623 HB3 ARG 80 1HB ARG 80 -10.576 -12.682 -5.087 624 HG2 ARG 80 2HG ARG 80 -9.078 -11.981 -7.623 625 HG3 ARG 80 1HG ARG 80 -10.827 -12.179 -7.534 626 HD2 ARG 80 2HD ARG 80 -10.816 -10.424 -5.695 627 HD3 ARG 80 1HD ARG 80 -9.127 -10.121 -6.110 628 HE ARG 80 HE ARG 80 -9.856 -9.032 -8.077 629 HH11 ARG 80 1HH1 ARG 80 -11.471 -8.269 -9.467 630 HH12 ARG 80 2HH1 ARG 80 -13.095 -8.840 -9.281 631 HH21 ARG 80 1HH2 ARG 80 -12.339 -10.916 -6.607 632 HH22 ARG 80 2HH2 ARG 80 -13.588 -10.340 -7.661 633 H LEU 81 H LEU 81 -7.770 -10.164 -4.815 634 HA LEU 81 HA LEU 81 -9.070 -9.909 -2.137 635 HB2 LEU 81 2HB LEU 81 -6.593 -10.154 -1.887 636 HB3 LEU 81 1HB LEU 81 -6.383 -8.730 -2.905 637 HG LEU 81 HG LEU 81 -7.826 -7.451 -1.262 638 HD11 LEU 81 1HD1 LEU 81 -7.644 -10.111 0.123 639 HD12 LEU 81 2HD1 LEU 81 -9.025 -9.026 -0.031 640 HD13 LEU 81 3HD1 LEU 81 -7.719 -8.637 1.088 641 HD21 LEU 81 1HD2 LEU 81 -6.005 -6.979 0.174 642 HD22 LEU 81 2HD2 LEU 81 -5.242 -7.577 -1.299 643 HD23 LEU 81 3HD2 LEU 81 -5.408 -8.637 0.100 644 H ALA 82 H ALA 82 -10.397 -8.146 -2.033 645 HA ALA 82 HA ALA 82 -9.911 -5.899 -3.941 646 HB1 ALA 82 1HB ALA 82 -11.859 -7.666 -4.469 647 HB2 ALA 82 2HB ALA 82 -12.056 -5.944 -4.790 648 HB3 ALA 82 3HB ALA 82 -12.734 -6.652 -3.324 649 H MET 83 H MET 83 -10.384 -3.845 -3.045 650 HA MET 83 HA MET 83 -11.642 -3.801 -0.357 651 HB2 MET 83 2HB MET 83 -8.950 -2.548 -0.943 652 HB3 MET 83 1HB MET 83 -9.815 -2.490 0.593 653 HG2 MET 83 2HG MET 83 -9.737 -5.006 0.645 654 HG3 MET 83 1HG MET 83 -8.694 -4.945 -0.775 655 HE1 MET 83 1HE MET 83 -6.822 -3.494 -1.014 656 HE2 MET 83 2HE MET 83 -5.560 -3.268 0.193 657 HE3 MET 83 3HE MET 83 -6.877 -2.104 0.079 658 H THR 84 H THR 84 -12.788 -1.901 0.046 659 HA THR 84 HA THR 84 -12.792 0.099 -2.172 660 HB THR 84 HB THR 84 -14.724 -0.173 0.156 661 HG1 THR 84 1HG THR 84 -15.587 -0.826 -2.346 662 HG21 THR 84 1HG2 THR 84 -15.819 1.021 -2.200 663 HG22 THR 84 2HG2 THR 84 -14.307 1.842 -1.813 664 HG23 THR 84 3HG2 THR 84 -15.594 1.750 -0.610 665 H TRP 85 H TRP 85 -11.963 2.164 -1.754 666 HA TRP 85 HA TRP 85 -10.847 2.559 0.976 667 HB2 TRP 85 2HB TRP 85 -10.258 3.836 -1.697 668 HB3 TRP 85 1HB TRP 85 -9.623 4.485 -0.188 669 HD1 TRP 85 HD TRP 85 -9.834 0.793 0.007 670 HE1 TRP 85 1HE TRP 85 -7.513 -0.259 -0.341 671 HE3 TRP 85 3HE TRP 85 -7.274 4.854 -1.737 672 HZ2 TRP 85 2HZ TRP 85 -4.912 0.511 -1.238 673 HZ3 TRP 85 3HZ TRP 85 -4.876 4.665 -2.330 674 HH2 TRP 85 HH TRP 85 -3.691 2.500 -2.082 675 H ARG 86 H ARG 86 -12.071 3.734 2.349 676 HA ARG 86 HA ARG 86 -13.659 6.010 1.218 677 HB2 ARG 86 2HB ARG 86 -15.040 4.199 2.254 678 HB3 ARG 86 1HB ARG 86 -14.185 4.461 3.774 679 HG2 ARG 86 2HG ARG 86 -14.965 6.787 3.834 680 HG3 ARG 86 1HG ARG 86 -15.785 6.566 2.288 681 HD2 ARG 86 2HD ARG 86 -17.440 6.309 4.028 682 HD3 ARG 86 1HD ARG 86 -17.120 4.709 3.359 683 HE ARG 86 HE ARG 86 -15.363 5.084 5.555 684 HH11 ARG 86 1HH1 ARG 86 -15.894 4.179 7.557 685 HH12 ARG 86 2HH1 ARG 86 -17.542 3.767 7.897 686 HH21 ARG 86 1HH2 ARG 86 -18.721 4.832 4.815 687 HH22 ARG 86 2HH2 ARG 86 -19.142 4.138 6.345 688 H ILE 87 H ILE 87 -12.407 7.812 1.585 689 HA ILE 87 HA ILE 87 -11.561 8.310 4.383 690 HB ILE 87 HB ILE 87 -9.594 7.303 3.298 691 HG12 ILE 87 2HG1 ILE 87 -9.047 10.261 3.465 692 HG13 ILE 87 1HG1 ILE 87 -9.543 9.372 4.906 693 HG21 ILE 87 1HG2 ILE 87 -9.524 9.664 1.427 694 HG22 ILE 87 2HG2 ILE 87 -10.385 8.192 0.982 695 HG23 ILE 87 3HG2 ILE 87 -8.653 8.135 1.308 696 HD11 ILE 87 1HD1 ILE 87 -7.415 8.079 3.312 697 HD12 ILE 87 2HD1 ILE 87 -7.563 8.263 5.060 698 HD13 ILE 87 3HD1 ILE 87 -6.955 9.596 4.083 699 H ASP 88 H ASP 88 -10.897 10.629 4.681 700 HA ASP 88 HA ASP 88 -12.524 12.363 2.878 701 HB2 ASP 88 2HB ASP 88 -13.065 12.335 5.335 702 HB3 ASP 88 1HB ASP 88 -11.459 12.993 5.647 703 H GLY 89 H GLY 89 -11.593 14.278 2.025 704 HA2 GLY 89 2HA GLY 89 -8.902 14.168 1.201 705 HA3 GLY 89 1HA GLY 89 -9.866 15.644 1.213 706 H HIS 90 H HIS 90 -10.283 15.496 4.155 707 HA HIS 90 HA HIS 90 -7.737 16.761 4.904 708 HB2 HIS 90 2HB HIS 90 -10.402 16.507 6.301 709 HB3 HIS 90 1HB HIS 90 -9.009 17.305 7.017 710 HD1 HIS 90 1HD HIS 90 -7.901 18.798 4.574 711 HD2 HIS 90 2HD HIS 90 -11.953 18.680 5.550 712 HE1 HIS 90 1HE HIS 90 -8.964 20.817 3.470 713 HE2 HIS 90 2HE HIS 90 -11.430 20.754 4.055 714 H TRP 91 H TRP 91 -8.206 13.702 4.630 715 HA TRP 91 HA TRP 91 -7.523 11.773 5.790 716 HB2 TRP 91 2HB TRP 91 -5.810 13.946 6.996 717 HB3 TRP 91 1HB TRP 91 -5.680 12.275 7.544 718 HD1 TRP 91 HD TRP 91 -4.706 14.572 4.752 719 HE1 TRP 91 1HE TRP 91 -3.367 13.266 2.978 720 HE3 TRP 91 3HE TRP 91 -5.490 9.806 6.396 721 HZ2 TRP 91 2HZ TRP 91 -2.714 10.549 2.342 722 HZ3 TRP 91 3HZ TRP 91 -4.501 7.879 5.193 723 HH2 TRP 91 HH TRP 91 -3.117 8.244 3.170 724 H GLN 92 H GLN 92 -9.788 13.509 6.859 725 HA GLN 92 HA GLN 92 -9.658 13.049 9.762 726 HB2 GLN 92 2HB GLN 92 -11.890 14.065 7.975 727 HB3 GLN 92 1HB GLN 92 -11.938 14.039 9.739 728 HG2 GLN 92 2HG GLN 92 -10.080 15.572 9.878 729 HG3 GLN 92 1HG GLN 92 -9.799 15.471 8.151 730 HE21 GLN 92 1HE2 GLN 92 -10.345 17.974 9.490 731 HE22 GLN 92 2HE2 GLN 92 -11.841 18.549 8.930 732 H SER 93 H SER 93 -12.231 12.249 7.446 733 HA SER 93 HA SER 93 -12.266 9.531 7.337 734 HB2 SER 93 2HB SER 93 -12.171 8.941 9.557 735 HB3 SER 93 1HB SER 93 -12.926 10.436 10.097 736 HG SER 93 HG SER 93 -14.151 8.177 8.894 737 H VAL 94 H VAL 94 -14.120 8.886 6.265 738 HA VAL 94 HA VAL 94 -16.241 10.951 6.016 739 HB VAL 94 HB VAL 94 -16.290 8.607 4.225 740 HG11 VAL 94 1HG1 VAL 94 -17.743 10.538 3.865 741 HG12 VAL 94 2HG1 VAL 94 -16.579 10.432 2.544 742 HG13 VAL 94 3HG1 VAL 94 -16.347 11.614 3.831 743 HG21 VAL 94 1HG2 VAL 94 -13.871 8.861 4.444 744 HG22 VAL 94 2HG2 VAL 94 -14.004 10.600 4.186 745 HG23 VAL 94 3HG2 VAL 94 -14.380 9.484 2.874 746 HA PRO 95 HA PRO 95 -18.780 8.122 8.435 747 HB2 PRO 95 2HB PRO 95 -21.206 9.354 8.046 748 HB3 PRO 95 1HB PRO 95 -19.995 9.907 9.219 749 HG2 PRO 95 2HG PRO 95 -20.651 10.972 6.531 750 HG3 PRO 95 1HG PRO 95 -20.152 11.827 7.999 751 HD2 PRO 95 2HD PRO 95 -18.465 11.307 5.891 752 HD3 PRO 95 1HD PRO 95 -17.909 11.536 7.564 753 H ASP 96 H ASP 96 -19.397 8.960 5.102 754 HA ASP 96 HA ASP 96 -20.435 6.242 4.617 755 HB2 ASP 96 2HB ASP 96 -22.427 7.729 5.086 756 HB3 ASP 96 1HB ASP 96 -21.968 8.665 3.667 757 H ASP 97 H ASP 97 -20.172 5.629 2.376 758 HA ASP 97 HA ASP 97 -18.036 7.114 1.045 759 HB2 ASP 97 2HB ASP 97 -18.274 5.305 -0.690 760 HB3 ASP 97 1HB ASP 97 -17.980 4.696 0.939 761 H ASP 98 H ASP 98 -18.765 9.057 0.196 762 HA ASP 98 HA ASP 98 -21.329 9.213 -1.209 763 HB2 ASP 98 2HB ASP 98 -20.246 11.105 0.133 764 HB3 ASP 98 1HB ASP 98 -19.133 11.279 -1.221 765 H ARG 99 H ARG 99 -17.922 9.678 -2.121 766 HA ARG 99 HA ARG 99 -18.617 8.706 -4.858 767 HB2 ARG 99 2HB ARG 99 -16.730 10.967 -4.131 768 HB3 ARG 99 1HB ARG 99 -16.959 10.320 -5.756 769 HG2 ARG 99 2HG ARG 99 -19.374 10.904 -5.620 770 HG3 ARG 99 1HG ARG 99 -19.087 11.627 -4.036 771 HD2 ARG 99 2HD ARG 99 -19.023 13.414 -5.649 772 HD3 ARG 99 1HD ARG 99 -17.362 13.117 -5.136 773 HE ARG 99 HE ARG 99 -16.879 12.278 -7.308 774 HH11 ARG 99 1HH1 ARG 99 -17.432 12.002 -9.483 775 HH12 ARG 99 2HH1 ARG 99 -19.092 12.129 -9.962 776 HH21 ARG 99 1HH2 ARG 99 -20.245 12.780 -6.758 777 HH22 ARG 99 2HH2 ARG 99 -20.684 12.569 -8.420 778 H ALA 100 H ALA 100 -17.495 7.250 -2.535 779 HA ALA 100 HA ALA 100 -14.652 6.988 -2.833 780 HB1 ALA 100 1HB ALA 100 -16.167 6.147 -0.915 781 HB2 ALA 100 2HB ALA 100 -14.817 5.122 -1.402 782 HB3 ALA 100 3HB ALA 100 -16.452 4.742 -1.942 783 H SER 101 H SER 101 -13.448 5.390 -3.949 784 HA SER 101 HA SER 101 -14.894 4.166 -6.260 785 HB2 SER 101 2HB SER 101 -13.095 5.830 -6.782 786 HB3 SER 101 1HB SER 101 -11.935 4.772 -5.984 787 HG SER 101 HG SER 101 -12.295 3.232 -7.526 788 H GLU 102 H GLU 102 -13.991 2.022 -6.976 789 HA GLU 102 HA GLU 102 -13.210 0.413 -4.581 790 HB2 GLU 102 2HB GLU 102 -14.531 -0.481 -7.159 791 HB3 GLU 102 1HB GLU 102 -14.196 -1.502 -5.760 792 HG2 GLU 102 2HG GLU 102 -15.640 -0.022 -4.371 793 HG3 GLU 102 1HG GLU 102 -16.030 0.909 -5.816 794 H ILE 103 H ILE 103 -11.540 -1.094 -4.756 795 HA ILE 103 HA ILE 103 -9.769 -0.762 -7.148 796 HB ILE 103 HB ILE 103 -8.974 -1.409 -4.294 797 HG12 ILE 103 2HG1 ILE 103 -8.583 1.165 -5.852 798 HG13 ILE 103 1HG1 ILE 103 -9.838 0.930 -4.633 799 HG21 ILE 103 1HG2 ILE 103 -6.823 -0.408 -5.806 800 HG22 ILE 103 2HG2 ILE 103 -7.630 -1.581 -6.847 801 HG23 ILE 103 3HG2 ILE 103 -7.053 -2.067 -5.253 802 HD11 ILE 103 1HD1 ILE 103 -6.839 0.868 -4.237 803 HD12 ILE 103 2HD1 ILE 103 -7.971 0.261 -3.027 804 HD13 ILE 103 3HD1 ILE 103 -8.005 1.963 -3.494 805 H GLU 104 H GLU 104 -9.010 -2.657 -8.113 806 HA GLU 104 HA GLU 104 -10.009 -5.213 -6.908 807 HB2 GLU 104 2HB GLU 104 -10.919 -4.614 -9.169 808 HB3 GLU 104 1HB GLU 104 -9.272 -4.674 -9.800 809 HG2 GLU 104 2HG GLU 104 -9.092 -7.034 -9.005 810 HG3 GLU 104 1HG GLU 104 -10.781 -6.962 -8.500 811 H VAL 105 H VAL 105 -8.443 -6.509 -6.104 812 HA VAL 105 HA VAL 105 -5.718 -6.357 -7.306 813 HB VAL 105 HB VAL 105 -6.305 -6.634 -4.346 814 HG11 VAL 105 1HG1 VAL 105 -4.222 -7.660 -4.815 815 HG12 VAL 105 2HG1 VAL 105 -3.796 -6.027 -4.304 816 HG13 VAL 105 3HG1 VAL 105 -3.799 -6.442 -6.018 817 HG21 VAL 105 1HG2 VAL 105 -6.737 -4.396 -4.542 818 HG22 VAL 105 2HG2 VAL 105 -5.929 -4.276 -6.105 819 HG23 VAL 105 3HG2 VAL 105 -4.980 -4.273 -4.619 820 H ASP 106 H ASP 106 -4.777 -8.359 -7.650 821 HA ASP 106 HA ASP 106 -6.152 -10.728 -6.451 822 HB2 ASP 106 2HB ASP 106 -6.847 -10.395 -8.831 823 HB3 ASP 106 1HB ASP 106 -5.153 -10.519 -9.306 824 H PHE 107 H PHE 107 -4.738 -12.177 -5.546 825 HA PHE 107 HA PHE 107 -1.841 -11.869 -6.238 826 HB2 PHE 107 2HB PHE 107 -3.227 -12.272 -3.612 827 HB3 PHE 107 1HB PHE 107 -1.602 -12.920 -3.833 828 HD1 PHE 107 1HD PHE 107 0.291 -11.421 -4.354 829 HD2 PHE 107 2HD PHE 107 -3.629 -9.889 -3.499 830 HE1 PHE 107 1HE PHE 107 1.254 -9.167 -3.990 831 HE2 PHE 107 2HE PHE 107 -2.667 -7.633 -3.134 832 HZ PHE 107 HZ PHE 107 -0.222 -7.274 -3.381 833 H VAL 108 H VAL 108 -0.914 -13.658 -7.092 834 HA VAL 108 HA VAL 108 -2.079 -16.318 -6.427 835 HB VAL 108 HB VAL 108 -2.335 -16.949 -8.637 836 HG11 VAL 108 1HG1 VAL 108 -3.473 -15.216 -9.812 837 HG12 VAL 108 2HG1 VAL 108 -2.494 -13.958 -9.057 838 HG13 VAL 108 3HG1 VAL 108 -3.690 -14.837 -8.103 839 HG21 VAL 108 1HG2 VAL 108 -1.064 -15.677 -10.492 840 HG22 VAL 108 2HG2 VAL 108 -0.108 -16.711 -9.430 841 HG23 VAL 108 3HG2 VAL 108 -0.121 -14.965 -9.183 842 HA PRO 109 HA PRO 109 2.197 -17.327 -5.801 843 HB2 PRO 109 2HB PRO 109 2.167 -20.025 -6.235 844 HB3 PRO 109 1HB PRO 109 1.493 -19.267 -4.780 845 HG2 PRO 109 2HG PRO 109 0.103 -20.290 -7.195 846 HG3 PRO 109 1HG PRO 109 -0.384 -20.364 -5.493 847 HD2 PRO 109 2HD PRO 109 -1.416 -18.550 -7.287 848 HD3 PRO 109 1HD PRO 109 -1.327 -18.262 -5.535 849 H ASN 110 H ASN 110 4.009 -17.211 -7.082 850 HA ASN 110 HA ASN 110 3.760 -18.107 -9.920 851 HB2 ASN 110 2HB ASN 110 4.171 -15.594 -9.316 852 HB3 ASN 110 1HB ASN 110 5.818 -16.135 -8.996 853 HD21 ASN 110 1HD2 ASN 110 5.929 -14.480 -11.027 854 HD22 ASN 110 2HD2 ASN 110 5.936 -15.250 -12.540 855 H GLY 111 H GLY 111 5.429 -19.383 -10.773 856 HA2 GLY 111 2HA GLY 111 6.823 -21.127 -9.034 857 HA3 GLY 111 1HA GLY 111 7.240 -20.878 -10.730 858 H SER 112 H SER 112 7.696 -17.971 -10.265 859 HA SER 112 HA SER 112 10.483 -17.962 -9.877 860 HB2 SER 112 2HB SER 112 8.576 -15.705 -9.247 861 HB3 SER 112 1HB SER 112 10.291 -15.548 -9.602 862 HG SER 112 HG SER 112 9.845 -16.435 -11.671 863 H GLY 113 H GLY 113 7.936 -18.076 -7.527 864 HA2 GLY 113 2HA GLY 113 8.440 -18.783 -5.229 865 HA3 GLY 113 1HA GLY 113 9.991 -17.942 -5.361 866 H GLY 114 H GLY 114 7.721 -16.132 -6.903 867 HA2 GLY 114 2HA GLY 114 7.089 -14.530 -4.470 868 HA3 GLY 114 1HA GLY 114 7.600 -13.774 -5.981 869 H THR 115 H THR 115 5.080 -13.175 -4.799 870 HA THR 115 HA THR 115 3.129 -14.751 -6.361 871 HB THR 115 HB THR 115 1.465 -13.307 -5.180 872 HG1 THR 115 1HG THR 115 3.764 -11.974 -4.603 873 HG21 THR 115 1HG2 THR 115 2.566 -14.077 -2.784 874 HG22 THR 115 2HG2 THR 115 3.388 -15.136 -3.929 875 HG23 THR 115 3HG2 THR 115 1.628 -15.127 -3.846 876 H ARG 116 H ARG 116 2.022 -13.925 -8.116 877 HA ARG 116 HA ARG 116 3.000 -11.305 -9.155 878 HB2 ARG 116 2HB ARG 116 3.211 -13.312 -10.651 879 HB3 ARG 116 1HB ARG 116 1.458 -13.495 -10.596 880 HG2 ARG 116 2HG ARG 116 1.213 -11.201 -11.525 881 HG3 ARG 116 1HG ARG 116 2.969 -11.086 -11.649 882 HD2 ARG 116 2HD ARG 116 2.960 -13.099 -13.124 883 HD3 ARG 116 1HD ARG 116 1.198 -13.101 -13.062 884 HE ARG 116 HE ARG 116 1.180 -11.184 -14.480 885 HH11 ARG 116 1HH1 ARG 116 2.231 -9.808 -15.928 886 HH12 ARG 116 2HH1 ARG 116 3.962 -9.725 -15.923 887 HH21 ARG 116 1HH2 ARG 116 4.333 -12.038 -13.368 888 HH22 ARG 116 2HH2 ARG 116 5.150 -10.987 -14.476 889 H VAL 117 H VAL 117 1.589 -9.605 -8.937 890 HA VAL 117 HA VAL 117 -1.289 -10.300 -8.625 891 HB VAL 117 HB VAL 117 -0.649 -9.691 -6.451 892 HG11 VAL 117 1HG1 VAL 117 0.597 -7.218 -6.526 893 HG12 VAL 117 2HG1 VAL 117 1.297 -8.057 -7.910 894 HG13 VAL 117 3HG1 VAL 117 1.410 -8.766 -6.300 895 HG21 VAL 117 1HG2 VAL 117 -1.994 -7.842 -6.042 896 HG22 VAL 117 2HG2 VAL 117 -2.514 -8.236 -7.680 897 HG23 VAL 117 3HG2 VAL 117 -1.349 -6.940 -7.413 898 H GLU 118 H GLU 118 -2.782 -9.082 -9.605 899 HA GLU 118 HA GLU 118 -1.790 -6.956 -11.448 900 HB2 GLU 118 2HB GLU 118 -2.946 -8.853 -12.538 901 HB3 GLU 118 1HB GLU 118 -4.351 -8.593 -11.505 902 HG2 GLU 118 2HG GLU 118 -4.584 -6.298 -12.458 903 HG3 GLU 118 1HG GLU 118 -3.250 -6.647 -13.553 904 H LEU 119 H LEU 119 -2.203 -4.925 -10.719 905 HA LEU 119 HA LEU 119 -4.600 -4.526 -8.984 906 HB2 LEU 119 2HB LEU 119 -2.314 -4.182 -7.909 907 HB3 LEU 119 1HB LEU 119 -2.097 -2.820 -9.004 908 HG LEU 119 HG LEU 119 -4.646 -2.873 -7.464 909 HD11 LEU 119 1HD1 LEU 119 -3.583 -1.976 -5.450 910 HD12 LEU 119 2HD1 LEU 119 -1.989 -2.162 -6.184 911 HD13 LEU 119 3HD1 LEU 119 -2.951 -3.587 -5.788 912 HD21 LEU 119 1HD2 LEU 119 -4.117 -1.028 -8.987 913 HD22 LEU 119 2HD2 LEU 119 -2.585 -0.755 -8.157 914 HD23 LEU 119 3HD2 LEU 119 -4.107 -0.441 -7.325 915 H ALA 120 H ALA 120 -6.155 -3.393 -10.015 916 HA ALA 120 HA ALA 120 -5.308 -1.270 -11.934 917 HB1 ALA 120 1HB ALA 120 -7.061 -3.613 -12.388 918 HB2 ALA 120 2HB ALA 120 -6.092 -2.689 -13.537 919 HB3 ALA 120 3HB ALA 120 -7.663 -2.077 -13.013 920 H HIS 121 H HIS 121 -6.324 0.645 -11.610 921 HA HIS 121 HA HIS 121 -8.744 0.668 -9.847 922 HB2 HIS 121 2HB HIS 121 -7.773 2.207 -8.503 923 HB3 HIS 121 1HB HIS 121 -6.254 1.849 -9.323 924 HD1 HIS 121 1HD HIS 121 -9.345 3.935 -10.234 925 HD2 HIS 121 2HD HIS 121 -5.181 4.193 -10.281 926 HE1 HIS 121 1HE HIS 121 -8.779 6.188 -11.239 927 HE2 HIS 121 2HE HIS 121 -6.248 6.363 -11.252 928 H VAL 122 H VAL 122 -10.455 1.954 -10.580 929 HA VAL 122 HA VAL 122 -9.964 3.582 -13.025 930 HB VAL 122 HB VAL 122 -12.013 2.648 -14.057 931 HG11 VAL 122 1HG1 VAL 122 -9.694 1.670 -14.436 932 HG12 VAL 122 2HG1 VAL 122 -11.034 0.571 -14.761 933 HG13 VAL 122 3HG1 VAL 122 -10.117 0.424 -13.262 934 HG21 VAL 122 1HG2 VAL 122 -13.361 1.879 -12.314 935 HG22 VAL 122 2HG2 VAL 122 -12.012 1.111 -11.476 936 HG23 VAL 122 3HG2 VAL 122 -12.692 0.366 -12.925 937 H LYS 123 H LYS 123 -11.378 5.325 -13.275 938 HA LYS 123 HA LYS 123 -12.772 7.059 -12.569 939 HB2 LYS 123 2HB LYS 123 -14.226 4.773 -11.213 940 HB3 LYS 123 1HB LYS 123 -14.890 6.375 -11.529 941 HG2 LYS 123 2HG LYS 123 -14.522 6.027 -13.961 942 HG3 LYS 123 1HG LYS 123 -13.936 4.398 -13.620 943 HD2 LYS 123 2HD LYS 123 -16.128 3.907 -12.508 944 HD3 LYS 123 1HD LYS 123 -16.704 5.484 -13.050 945 HE2 LYS 123 2HE LYS 123 -16.101 4.773 -15.411 946 HE3 LYS 123 1HE LYS 123 -15.841 3.149 -14.772 947 HZ1 LYS 123 1HZ LYS 123 -18.022 2.998 -15.327 948 HZ2 LYS 123 2HZ LYS 123 -18.330 4.651 -15.084 949 HZ3 LYS 123 3HZ LYS 123 -18.206 3.603 -13.753 950 H LEU 124 H LEU 124 -10.467 6.286 -10.774 951 HA LEU 124 HA LEU 124 -11.354 6.569 -8.044 952 HB2 LEU 124 2HB LEU 124 -9.105 5.703 -8.621 953 HB3 LEU 124 1HB LEU 124 -8.663 7.294 -9.246 954 HG LEU 124 HG LEU 124 -9.200 8.231 -6.951 955 HD11 LEU 124 1HD1 LEU 124 -8.992 6.351 -5.148 956 HD12 LEU 124 2HD1 LEU 124 -9.549 5.284 -6.436 957 HD13 LEU 124 3HD1 LEU 124 -10.558 6.629 -5.905 958 HD21 LEU 124 1HD2 LEU 124 -6.896 7.933 -7.511 959 HD22 LEU 124 2HD2 LEU 124 -7.010 6.181 -7.344 960 HD23 LEU 124 3HD2 LEU 124 -7.097 7.211 -5.915 961 H HIS 125 H HIS 125 -10.551 8.829 -10.609 962 HA HIS 125 HA HIS 125 -10.271 11.204 -9.143 963 HB2 HIS 125 2HB HIS 125 -9.890 11.205 -11.529 964 HB3 HIS 125 1HB HIS 125 -11.575 10.779 -11.833 965 HD1 HIS 125 1HD HIS 125 -11.023 13.161 -9.082 966 HD2 HIS 125 2HD HIS 125 -11.815 13.390 -13.170 967 HE1 HIS 125 1HE HIS 125 -11.782 15.530 -9.527 968 HE2 HIS 125 2HE HIS 125 -12.252 15.692 -12.018 969 H ARG 126 H ARG 126 -13.214 9.390 -9.855 970 HA ARG 126 HA ARG 126 -15.132 11.389 -9.360 971 HB2 ARG 126 2HB ARG 126 -16.661 9.632 -8.908 972 HB3 ARG 126 1HB ARG 126 -15.490 8.914 -10.012 973 HG2 ARG 126 2HG ARG 126 -14.228 8.111 -7.948 974 HG3 ARG 126 1HG ARG 126 -15.641 8.591 -7.016 975 HD2 ARG 126 2HD ARG 126 -15.622 6.598 -9.298 976 HD3 ARG 126 1HD ARG 126 -15.788 6.211 -7.584 977 HE ARG 126 HE ARG 126 -17.834 8.065 -8.258 978 HH11 ARG 126 1HH1 ARG 126 -19.922 7.296 -8.653 979 HH12 ARG 126 2HH1 ARG 126 -20.151 5.633 -9.081 980 HH21 ARG 126 1HH2 ARG 126 -16.776 4.854 -8.934 981 HH22 ARG 126 2HH2 ARG 126 -18.370 4.250 -9.239 982 H HIS 127 H HIS 127 -13.042 9.610 -7.181 983 HA HIS 127 HA HIS 127 -14.303 10.836 -4.804 984 HB2 HIS 127 2HB HIS 127 -13.456 8.425 -4.848 985 HB3 HIS 127 1HB HIS 127 -11.828 9.092 -4.900 986 HD1 HIS 127 1HD HIS 127 -14.086 11.192 -2.946 987 HD2 HIS 127 2HD HIS 127 -11.684 7.868 -2.182 988 HE1 HIS 127 1HE HIS 127 -13.825 11.059 -0.429 989 HE2 HIS 127 2HE HIS 127 -12.364 9.040 0.047 990 H GLY 128 H GLY 128 -12.186 11.804 -7.110 991 HA2 GLY 128 2HA GLY 128 -9.891 12.830 -6.012 992 HA3 GLY 128 1HA GLY 128 -10.848 13.752 -7.172 993 H ASP 129 H ASP 129 -13.133 13.677 -5.116 994 HA ASP 129 HA ASP 129 -12.812 16.247 -4.029 995 HB2 ASP 129 2HB ASP 129 -14.409 13.890 -2.992 996 HB3 ASP 129 1HB ASP 129 -14.543 15.521 -2.332 997 H GLY 130 H GLY 130 -11.813 13.112 -2.739 998 HA2 GLY 130 2HA GLY 130 -10.100 14.565 -0.792 999 HA3 GLY 130 1HA GLY 130 -11.162 13.291 -0.191 1000 H ALA 131 H ALA 131 -10.697 11.780 -2.819 1001 HA ALA 131 HA ALA 131 -8.597 10.091 -1.876 1002 HB1 ALA 131 1HB ALA 131 -10.138 9.085 -3.357 1003 HB2 ALA 131 2HB ALA 131 -8.665 9.234 -4.316 1004 HB3 ALA 131 3HB ALA 131 -9.983 10.385 -4.538 1005 H TRP 132 H TRP 132 -8.593 12.422 -4.610 1006 HA TRP 132 HA TRP 132 -5.835 12.099 -5.218 1007 HB2 TRP 132 2HB TRP 132 -7.475 13.254 -6.696 1008 HB3 TRP 132 1HB TRP 132 -7.515 14.598 -5.556 1009 HD1 TRP 132 HD TRP 132 -6.033 16.494 -6.263 1010 HE1 TRP 132 1HE TRP 132 -3.797 16.757 -7.514 1011 HE3 TRP 132 3HE TRP 132 -4.971 11.587 -7.230 1012 HZ2 TRP 132 2HZ TRP 132 -1.823 15.112 -8.759 1013 HZ3 TRP 132 3HZ TRP 132 -2.907 10.969 -8.448 1014 HH2 TRP 132 HH TRP 132 -1.333 12.723 -9.214 1015 H ASN 133 H ASN 133 -7.469 14.285 -2.942 1016 HA ASN 133 HA ASN 133 -5.135 15.754 -2.173 1017 HB2 ASN 133 2HB ASN 133 -7.569 16.269 -1.558 1018 HB3 ASN 133 1HB ASN 133 -7.416 15.023 -0.319 1019 HD21 ASN 133 1HD2 ASN 133 -7.781 16.986 1.178 1020 HD22 ASN 133 2HD2 ASN 133 -6.418 17.896 1.621 1021 H ILE 134 H ILE 134 -6.550 12.715 -1.036 1022 HA ILE 134 HA ILE 134 -4.732 12.242 1.116 1023 HB ILE 134 HB ILE 134 -6.700 10.700 -0.442 1024 HG12 ILE 134 2HG1 ILE 134 -7.183 9.804 1.828 1025 HG13 ILE 134 1HG1 ILE 134 -5.798 10.696 2.450 1026 HG21 ILE 134 1HG2 ILE 134 -4.874 9.200 -0.885 1027 HG22 ILE 134 2HG2 ILE 134 -5.780 8.508 0.457 1028 HG23 ILE 134 3HG2 ILE 134 -4.267 9.356 0.764 1029 HD11 ILE 134 1HD1 ILE 134 -8.480 11.662 1.751 1030 HD12 ILE 134 2HD1 ILE 134 -7.191 12.643 1.068 1031 HD13 ILE 134 3HD1 ILE 134 -7.268 12.382 2.807 1032 H HIS 135 H HIS 135 -4.631 11.445 -2.337 1033 HA HIS 135 HA HIS 135 -2.247 9.912 -2.335 1034 HB2 HIS 135 2HB HIS 135 -3.421 9.929 -4.375 1035 HB3 HIS 135 1HB HIS 135 -3.559 11.687 -4.382 1036 HD1 HIS 135 1HD HIS 135 -0.609 9.253 -4.214 1037 HD2 HIS 135 2HD HIS 135 -1.784 12.724 -6.204 1038 HE1 HIS 135 1HE HIS 135 1.311 9.891 -5.740 1039 HE2 HIS 135 2HE HIS 135 0.602 11.994 -6.965 1040 H LYS 136 H LYS 136 -2.750 13.429 -2.374 1041 HA LYS 136 HA LYS 136 -0.106 14.248 -2.902 1042 HB2 LYS 136 2HB LYS 136 -2.105 15.482 -1.004 1043 HB3 LYS 136 1HB LYS 136 -0.650 16.279 -1.579 1044 HG2 LYS 136 2HG LYS 136 -1.464 15.981 -3.912 1045 HG3 LYS 136 1HG LYS 136 -2.962 15.318 -3.269 1046 HD2 LYS 136 2HD LYS 136 -3.310 17.438 -1.997 1047 HD3 LYS 136 1HD LYS 136 -1.872 18.101 -2.774 1048 HE2 LYS 136 2HE LYS 136 -2.953 17.649 -5.001 1049 HE3 LYS 136 1HE LYS 136 -4.423 17.197 -4.139 1050 HZ1 LYS 136 1HZ LYS 136 -3.215 19.823 -4.505 1051 HZ2 LYS 136 2HZ LYS 136 -3.935 19.522 -2.996 1052 HZ3 LYS 136 3HZ LYS 136 -4.850 19.383 -4.421 1053 H ALA 137 H ALA 137 -1.621 13.239 0.139 1054 HA ALA 137 HA ALA 137 0.759 13.644 1.742 1055 HB1 ALA 137 1HB ALA 137 -0.829 13.366 3.318 1056 HB2 ALA 137 2HB ALA 137 -0.794 11.639 2.960 1057 HB3 ALA 137 3HB ALA 137 -1.948 12.689 2.137 1058 H LEU 138 H LEU 138 -0.568 10.957 -0.114 1059 HA LEU 138 HA LEU 138 1.552 9.129 0.791 1060 HB2 LEU 138 2HB LEU 138 -0.597 8.717 -1.302 1061 HB3 LEU 138 1HB LEU 138 0.397 7.471 -0.572 1062 HG LEU 138 HG LEU 138 -1.681 9.185 0.815 1063 HD11 LEU 138 1HD1 LEU 138 -1.561 6.177 0.736 1064 HD12 LEU 138 2HD1 LEU 138 -2.247 7.065 -0.626 1065 HD13 LEU 138 3HD1 LEU 138 -2.958 7.227 0.979 1066 HD21 LEU 138 1HD2 LEU 138 0.500 7.388 1.829 1067 HD22 LEU 138 2HD2 LEU 138 -1.010 7.511 2.728 1068 HD23 LEU 138 3HD2 LEU 138 -0.026 8.948 2.453 1069 H ASP 139 H ASP 139 1.308 11.585 -1.415 1070 HA ASP 139 HA ASP 139 2.321 10.650 -3.837 1071 HB2 ASP 139 2HB ASP 139 1.687 12.997 -3.417 1072 HB3 ASP 139 1HB ASP 139 3.129 13.205 -2.426 1073 H GLY 140 H GLY 140 4.032 9.429 -4.242 1074 HA2 GLY 140 2HA GLY 140 6.649 10.088 -3.053 1075 HA3 GLY 140 1HA GLY 140 6.047 8.454 -2.757 1076 HA PRO 141 HA PRO 141 6.099 8.621 -7.594 1077 HB2 PRO 141 2HB PRO 141 7.107 11.011 -8.625 1078 HB3 PRO 141 1HB PRO 141 5.393 10.581 -8.507 1079 HG2 PRO 141 2HG PRO 141 7.035 12.304 -6.739 1080 HG3 PRO 141 1HG PRO 141 5.334 12.455 -7.208 1081 HD2 PRO 141 2HD PRO 141 6.067 11.541 -4.763 1082 HD3 PRO 141 1HD PRO 141 4.611 10.947 -5.594 1083 H SER 142 H SER 142 7.776 7.649 -8.616 1084 HA SER 142 HA SER 142 10.373 8.577 -9.019 1085 HB2 SER 142 2HB SER 142 10.028 7.844 -6.277 1086 HB3 SER 142 1HB SER 142 11.050 6.628 -7.031 1087 HG SER 142 HG SER 142 12.476 8.161 -6.578 1088 HA PRO 143 HA PRO 143 10.061 3.931 -9.900 1089 HB2 PRO 143 2HB PRO 143 8.221 2.419 -8.633 1090 HB3 PRO 143 1HB PRO 143 9.739 2.898 -7.854 1091 HG2 PRO 143 2HG PRO 143 7.004 3.828 -7.347 1092 HG3 PRO 143 1HG PRO 143 8.427 3.877 -6.299 1093 HD2 PRO 143 2HD PRO 143 7.335 6.019 -7.910 1094 HD3 PRO 143 1HD PRO 143 8.734 6.068 -6.819 1095 H GLY 144 H GLY 144 6.612 4.010 -9.070 1096 HA2 GLY 144 2HA GLY 144 5.254 4.926 -11.196 1097 HA3 GLY 144 1HA GLY 144 5.933 3.452 -11.887 1098 H GLU 145 H GLU 145 4.860 1.557 -11.520 1099 HA GLU 145 HA GLU 145 2.254 1.423 -10.525 1100 HB2 GLU 145 2HB GLU 145 4.310 -0.801 -10.399 1101 HB3 GLU 145 1HB GLU 145 2.558 -0.989 -10.470 1102 HG2 GLU 145 2HG GLU 145 2.551 0.141 -12.683 1103 HG3 GLU 145 1HG GLU 145 4.310 0.239 -12.617 1104 H THR 146 H THR 146 1.344 0.874 -8.511 1105 HA THR 146 HA THR 146 2.663 1.726 -6.139 1106 HB THR 146 HB THR 146 0.278 -0.066 -6.578 1107 HG1 THR 146 1HG THR 146 0.518 2.576 -5.594 1108 HG21 THR 146 1HG2 THR 146 1.616 0.820 -4.037 1109 HG22 THR 146 2HG2 THR 146 0.987 -0.773 -4.460 1110 HG23 THR 146 3HG2 THR 146 -0.125 0.542 -4.077 1111 H LEU 147 H LEU 147 2.385 -1.435 -7.654 1112 HA LEU 147 HA LEU 147 3.286 -3.078 -5.567 1113 HB2 LEU 147 2HB LEU 147 3.952 -3.339 -8.506 1114 HB3 LEU 147 1HB LEU 147 3.960 -4.638 -7.313 1115 HG LEU 147 HG LEU 147 1.545 -3.026 -8.187 1116 HD11 LEU 147 1HD1 LEU 147 1.721 -4.590 -9.861 1117 HD12 LEU 147 2HD1 LEU 147 0.911 -5.594 -8.660 1118 HD13 LEU 147 3HD1 LEU 147 2.658 -5.704 -8.866 1119 HD21 LEU 147 1HD2 LEU 147 2.021 -4.983 -5.958 1120 HD22 LEU 147 2HD2 LEU 147 0.443 -4.942 -6.746 1121 HD23 LEU 147 3HD2 LEU 147 1.070 -3.498 -5.951 1122 H ALA 148 H ALA 148 5.088 -0.857 -7.593 1123 HA ALA 148 HA ALA 148 7.702 -1.885 -7.194 1124 HB1 ALA 148 1HB ALA 148 6.921 1.034 -7.388 1125 HB2 ALA 148 2HB ALA 148 7.085 -0.042 -8.777 1126 HB3 ALA 148 3HB ALA 148 8.492 0.331 -7.778 1127 H ARG 149 H ARG 149 6.118 0.761 -5.356 1128 HA ARG 149 HA ARG 149 8.160 0.868 -3.352 1129 HB2 ARG 149 2HB ARG 149 5.256 1.693 -3.217 1130 HB3 ARG 149 1HB ARG 149 6.485 2.145 -2.045 1131 HG2 ARG 149 2HG ARG 149 6.761 2.762 -4.991 1132 HG3 ARG 149 1HG ARG 149 5.979 3.872 -3.865 1133 HD2 ARG 149 2HD ARG 149 8.117 3.691 -2.451 1134 HD3 ARG 149 1HD ARG 149 8.855 2.938 -3.863 1135 HE ARG 149 HE ARG 149 7.736 5.267 -4.863 1136 HH11 ARG 149 1HH1 ARG 149 8.877 7.219 -4.949 1137 HH12 ARG 149 2HH1 ARG 149 10.197 7.483 -3.859 1138 HH21 ARG 149 1HH2 ARG 149 9.883 4.398 -2.308 1139 HH22 ARG 149 2HH2 ARG 149 10.766 5.887 -2.364 1140 H PHE 150 H PHE 150 5.077 -0.849 -3.536 1141 HA PHE 150 HA PHE 150 5.117 -1.924 -0.885 1142 HB2 PHE 150 2HB PHE 150 3.093 -1.903 -2.257 1143 HB3 PHE 150 1HB PHE 150 3.855 -2.973 -3.425 1144 HD1 PHE 150 1HD PHE 150 3.648 -5.284 -3.218 1145 HD2 PHE 150 2HD PHE 150 2.939 -2.782 0.200 1146 HE1 PHE 150 1HE PHE 150 2.890 -7.262 -1.932 1147 HE2 PHE 150 2HE PHE 150 2.180 -4.762 1.489 1148 HZ PHE 150 HZ PHE 150 2.158 -6.998 0.418 1149 H ALA 151 H ALA 151 6.405 -3.157 -3.965 1150 HA ALA 151 HA ALA 151 7.180 -5.725 -2.957 1151 HB1 ALA 151 1HB ALA 151 7.004 -5.022 -5.393 1152 HB2 ALA 151 2HB ALA 151 8.440 -5.957 -4.979 1153 HB3 ALA 151 3HB ALA 151 8.554 -4.209 -5.182 1154 H ASN 152 H ASN 152 8.970 -2.648 -3.183 1155 HA ASN 152 HA ASN 152 11.469 -3.745 -2.298 1156 HB2 ASN 152 2HB ASN 152 12.258 -1.611 -2.456 1157 HB3 ASN 152 1HB ASN 152 10.734 -1.342 -3.302 1158 HD21 ASN 152 1HD2 ASN 152 9.081 -0.125 -2.215 1159 HD22 ASN 152 2HD2 ASN 152 9.350 0.658 -0.736 1160 H VAL 153 H VAL 153 8.929 -1.995 -0.479 1161 HA VAL 153 HA VAL 153 10.267 -2.316 2.053 1162 HB VAL 153 HB VAL 153 8.216 -1.516 3.035 1163 HG11 VAL 153 1HG1 VAL 153 7.921 0.001 0.547 1164 HG12 VAL 153 2HG1 VAL 153 9.601 -0.176 1.054 1165 HG13 VAL 153 3HG1 VAL 153 8.424 0.553 2.146 1166 HG21 VAL 153 1HG2 VAL 153 7.018 -2.399 0.412 1167 HG22 VAL 153 2HG2 VAL 153 6.198 -1.235 1.451 1168 HG23 VAL 153 3HG2 VAL 153 6.536 -2.862 2.044 1169 H ILE 154 H ILE 154 8.251 -4.369 0.120 1170 HA ILE 154 HA ILE 154 7.550 -6.156 2.329 1171 HB ILE 154 HB ILE 154 7.156 -6.220 -0.654 1172 HG12 ILE 154 2HG1 ILE 154 5.793 -4.830 1.157 1173 HG13 ILE 154 1HG1 ILE 154 4.972 -5.621 -0.185 1174 HG21 ILE 154 1HG2 ILE 154 6.674 -8.353 1.407 1175 HG22 ILE 154 2HG2 ILE 154 7.404 -8.503 -0.191 1176 HG23 ILE 154 3HG2 ILE 154 5.666 -8.250 -0.037 1177 HD11 ILE 154 1HD1 ILE 154 4.276 -7.443 1.170 1178 HD12 ILE 154 2HD1 ILE 154 4.004 -6.016 2.170 1179 HD13 ILE 154 3HD1 ILE 154 5.418 -7.031 2.447 Start of MODEL 10 1 H1 MET 1 1HT MET 1 2.093 12.384 -4.326 2 H2 MET 1 2HT MET 1 3.275 13.565 -4.020 3 H3 MET 1 3HT MET 1 3.697 12.120 -4.809 4 HA MET 1 HA MET 1 1.621 13.756 -6.048 5 HB2 MET 1 2HB MET 1 4.577 14.437 -6.098 6 HB3 MET 1 1HB MET 1 3.356 15.151 -7.151 7 HG2 MET 1 2HG MET 1 2.520 16.478 -5.497 8 HG3 MET 1 1HG MET 1 2.719 15.233 -4.265 9 HE1 MET 1 1HE MET 1 4.747 18.817 -3.769 10 HE2 MET 1 2HE MET 1 3.202 18.044 -3.420 11 HE3 MET 1 3HE MET 1 3.562 18.578 -5.060 12 HA PRO 2 HA PRO 2 3.263 10.224 -8.496 13 HB2 PRO 2 2HB PRO 2 0.888 8.826 -8.611 14 HB3 PRO 2 1HB PRO 2 2.117 8.601 -7.356 15 HG2 PRO 2 2HG PRO 2 -0.517 9.754 -7.131 16 HG3 PRO 2 1HG PRO 2 0.633 9.336 -5.854 17 HD2 PRO 2 2HD PRO 2 0.054 11.964 -7.010 18 HD3 PRO 2 1HD PRO 2 0.987 11.567 -5.547 19 H GLU 3 H GLU 3 2.467 9.471 -10.707 20 HA GLU 3 HA GLU 3 1.868 11.543 -12.448 21 HB2 GLU 3 2HB GLU 3 0.819 8.716 -12.721 22 HB3 GLU 3 1HB GLU 3 1.089 9.859 -14.034 23 HG2 GLU 3 2HG GLU 3 3.516 9.912 -13.425 24 HG3 GLU 3 1HG GLU 3 3.204 8.659 -12.223 25 H GLU 4 H GLU 4 -0.164 12.311 -13.384 26 HA GLU 4 HA GLU 4 -2.214 12.890 -11.576 27 HB2 GLU 4 2HB GLU 4 -2.496 12.487 -14.574 28 HB3 GLU 4 1HB GLU 4 -3.650 13.338 -13.546 29 HG2 GLU 4 2HG GLU 4 -1.859 14.941 -12.904 30 HG3 GLU 4 1HG GLU 4 -0.756 14.119 -14.009 31 H ILE 5 H ILE 5 -4.298 11.911 -11.188 32 HA ILE 5 HA ILE 5 -4.370 9.214 -10.666 33 HB ILE 5 HB ILE 5 -6.927 10.214 -11.774 34 HG12 ILE 5 2HG1 ILE 5 -5.465 11.638 -9.533 35 HG13 ILE 5 1HG1 ILE 5 -6.065 12.343 -11.031 36 HG21 ILE 5 1HG2 ILE 5 -7.798 9.286 -9.760 37 HG22 ILE 5 2HG2 ILE 5 -6.222 9.325 -8.973 38 HG23 ILE 5 3HG2 ILE 5 -6.526 8.181 -10.280 39 HD11 ILE 5 1HD1 ILE 5 -7.508 11.735 -8.546 40 HD12 ILE 5 2HD1 ILE 5 -8.328 11.152 -9.994 41 HD13 ILE 5 3HD1 ILE 5 -7.922 12.861 -9.839 42 HA PRO 6 HA PRO 6 -4.449 7.848 -15.034 43 HB2 PRO 6 2HB PRO 6 -3.004 5.598 -14.746 44 HB3 PRO 6 1HB PRO 6 -2.233 7.196 -14.710 45 HG2 PRO 6 2HG PRO 6 -2.846 5.344 -12.481 46 HG3 PRO 6 1HG PRO 6 -1.498 6.475 -12.677 47 HD2 PRO 6 2HD PRO 6 -3.845 6.917 -11.153 48 HD3 PRO 6 1HD PRO 6 -2.626 8.130 -11.589 49 H ASP 7 H ASP 7 -5.651 6.123 -16.094 50 HA ASP 7 HA ASP 7 -7.800 5.012 -14.537 51 HB2 ASP 7 2HB ASP 7 -6.775 4.323 -17.312 52 HB3 ASP 7 1HB ASP 7 -8.276 3.707 -16.625 53 H VAL 8 H VAL 8 -7.209 2.346 -16.207 54 HA VAL 8 HA VAL 8 -6.557 0.674 -14.081 55 HB VAL 8 HB VAL 8 -7.207 -0.134 -16.344 56 HG11 VAL 8 1HG1 VAL 8 -4.360 0.109 -17.231 57 HG12 VAL 8 2HG1 VAL 8 -5.387 1.538 -17.343 58 HG13 VAL 8 3HG1 VAL 8 -5.835 0.062 -18.198 59 HG21 VAL 8 1HG2 VAL 8 -5.209 -1.232 -14.593 60 HG22 VAL 8 2HG2 VAL 8 -4.809 -1.667 -16.255 61 HG23 VAL 8 3HG2 VAL 8 -6.385 -2.091 -15.588 62 H ARG 9 H ARG 9 -4.681 0.188 -12.971 63 HA ARG 9 HA ARG 9 -2.329 1.861 -13.567 64 HB2 ARG 9 2HB ARG 9 -2.960 0.042 -11.234 65 HB3 ARG 9 1HB ARG 9 -1.477 0.976 -11.381 66 HG2 ARG 9 2HG ARG 9 -2.877 3.049 -11.577 67 HG3 ARG 9 1HG ARG 9 -4.299 2.064 -11.233 68 HD2 ARG 9 2HD ARG 9 -3.182 1.323 -9.104 69 HD3 ARG 9 1HD ARG 9 -1.902 2.490 -9.428 70 HE ARG 9 HE ARG 9 -4.348 3.898 -9.551 71 HH11 ARG 9 1HH1 ARG 9 -5.072 5.053 -7.747 72 HH12 ARG 9 2HH1 ARG 9 -4.474 4.639 -6.175 73 HH21 ARG 9 1HH2 ARG 9 -2.437 2.082 -7.331 74 HH22 ARG 9 2HH2 ARG 9 -2.982 2.957 -5.939 75 H LYS 10 H LYS 10 -0.452 -0.060 -12.329 76 HA LYS 10 HA LYS 10 -0.164 -1.900 -14.660 77 HB2 LYS 10 2HB LYS 10 1.896 -0.480 -12.968 78 HB3 LYS 10 1HB LYS 10 2.294 -1.756 -14.112 79 HG2 LYS 10 2HG LYS 10 1.203 -0.442 -15.918 80 HG3 LYS 10 1HG LYS 10 0.921 0.861 -14.762 81 HD2 LYS 10 2HD LYS 10 3.381 0.977 -14.352 82 HD3 LYS 10 1HD LYS 10 3.617 -0.238 -15.609 83 HE2 LYS 10 2HE LYS 10 1.919 1.841 -16.631 84 HE3 LYS 10 1HE LYS 10 3.369 2.572 -15.942 85 HZ1 LYS 10 1HZ LYS 10 3.980 0.221 -17.427 86 HZ2 LYS 10 2HZ LYS 10 4.596 1.795 -17.599 87 HZ3 LYS 10 3HZ LYS 10 3.157 1.351 -18.387 88 H SER 11 H SER 11 1.687 -3.599 -13.921 89 HA SER 11 HA SER 11 0.841 -4.776 -11.307 90 HB2 SER 11 2HB SER 11 0.746 -6.975 -12.319 91 HB3 SER 11 1HB SER 11 -0.282 -5.894 -13.253 92 HG SER 11 HG SER 11 0.942 -6.286 -14.901 93 H VAL 12 H VAL 12 2.485 -6.150 -10.333 94 HA VAL 12 HA VAL 12 5.162 -6.055 -11.611 95 HB VAL 12 HB VAL 12 4.522 -5.002 -8.863 96 HG11 VAL 12 1HG1 VAL 12 6.478 -6.252 -8.479 97 HG12 VAL 12 2HG1 VAL 12 7.104 -4.653 -8.882 98 HG13 VAL 12 3HG1 VAL 12 7.104 -5.933 -10.095 99 HG21 VAL 12 1HG2 VAL 12 5.716 -3.005 -9.753 100 HG22 VAL 12 2HG2 VAL 12 4.281 -3.397 -10.702 101 HG23 VAL 12 3HG2 VAL 12 5.882 -3.831 -11.303 102 H VAL 13 H VAL 13 6.615 -7.654 -10.819 103 HA VAL 13 HA VAL 13 5.226 -9.905 -9.429 104 HB VAL 13 HB VAL 13 7.805 -9.944 -11.031 105 HG11 VAL 13 1HG1 VAL 13 6.732 -11.778 -9.197 106 HG12 VAL 13 2HG1 VAL 13 8.003 -12.095 -10.377 107 HG13 VAL 13 3HG1 VAL 13 6.321 -12.430 -10.783 108 HG21 VAL 13 1HG2 VAL 13 5.447 -11.319 -12.110 109 HG22 VAL 13 2HG2 VAL 13 6.594 -10.255 -12.923 110 HG23 VAL 13 3HG2 VAL 13 5.246 -9.570 -12.015 111 H VAL 14 H VAL 14 5.935 -10.500 -7.413 112 HA VAL 14 HA VAL 14 8.538 -9.370 -6.474 113 HB VAL 14 HB VAL 14 7.535 -8.958 -4.282 114 HG11 VAL 14 1HG1 VAL 14 6.007 -7.815 -6.635 115 HG12 VAL 14 2HG1 VAL 14 7.393 -7.104 -5.810 116 HG13 VAL 14 3HG1 VAL 14 5.837 -7.212 -4.987 117 HG21 VAL 14 1HG2 VAL 14 4.962 -9.162 -4.191 118 HG22 VAL 14 2HG2 VAL 14 5.888 -10.659 -4.083 119 HG23 VAL 14 3HG2 VAL 14 5.120 -10.205 -5.604 120 H ALA 15 H ALA 15 9.589 -10.667 -4.798 121 HA ALA 15 HA ALA 15 8.947 -13.535 -5.123 122 HB1 ALA 15 1HB ALA 15 11.242 -12.378 -3.537 123 HB2 ALA 15 2HB ALA 15 11.315 -12.551 -5.291 124 HB3 ALA 15 3HB ALA 15 11.121 -13.977 -4.271 125 H ALA 16 H ALA 16 7.116 -13.802 -3.802 126 HA ALA 16 HA ALA 16 7.668 -14.071 -0.954 127 HB1 ALA 16 1HB ALA 16 5.803 -11.927 -1.989 128 HB2 ALA 16 2HB ALA 16 7.111 -11.762 -0.815 129 HB3 ALA 16 3HB ALA 16 5.632 -12.611 -0.373 130 H SER 17 H SER 17 6.044 -15.399 0.066 131 HA SER 17 HA SER 17 4.634 -17.140 -1.768 132 HB2 SER 17 2HB SER 17 3.956 -18.352 0.173 133 HB3 SER 17 1HB SER 17 5.575 -17.757 0.532 134 HG SER 17 HG SER 17 4.764 -16.553 2.053 135 H VAL 18 H VAL 18 2.352 -17.343 -2.015 136 HA VAL 18 HA VAL 18 0.881 -14.925 -2.189 137 HB VAL 18 HB VAL 18 -0.800 -17.297 -1.776 138 HG11 VAL 18 1HG1 VAL 18 -0.379 -15.870 -4.385 139 HG12 VAL 18 2HG1 VAL 18 -1.190 -15.030 -3.064 140 HG13 VAL 18 3HG1 VAL 18 -1.864 -16.529 -3.701 141 HG21 VAL 18 1HG2 VAL 18 1.026 -18.619 -2.523 142 HG22 VAL 18 2HG2 VAL 18 1.545 -17.396 -3.683 143 HG23 VAL 18 3HG2 VAL 18 0.075 -18.322 -3.976 144 H GLU 19 H GLU 19 0.912 -17.417 0.341 145 HA GLU 19 HA GLU 19 -1.183 -16.423 1.954 146 HB2 GLU 19 2HB GLU 19 0.045 -18.574 2.334 147 HB3 GLU 19 1HB GLU 19 1.414 -17.640 2.938 148 HG2 GLU 19 2HG GLU 19 -0.079 -16.637 4.667 149 HG3 GLU 19 1HG GLU 19 -1.387 -17.677 4.100 150 H HIS 20 H HIS 20 2.191 -15.388 1.706 151 HA HIS 20 HA HIS 20 2.218 -13.635 3.957 152 HB2 HIS 20 2HB HIS 20 4.316 -13.160 3.246 153 HB3 HIS 20 1HB HIS 20 4.035 -14.374 1.998 154 HD1 HIS 20 1HD HIS 20 2.586 -13.239 -0.172 155 HD2 HIS 20 2HD HIS 20 5.027 -10.747 2.116 156 HE1 HIS 20 1HE HIS 20 3.049 -11.190 -1.588 157 HE2 HIS 20 2HE HIS 20 4.525 -9.665 -0.200 158 H CYS 21 H CYS 21 1.202 -13.148 0.593 159 HA CYS 21 HA CYS 21 0.848 -10.357 0.608 160 HB2 CYS 21 2HB CYS 21 0.578 -11.856 -1.383 161 HB3 CYS 21 1HB CYS 21 -0.974 -12.382 -0.728 162 HG CYS 21 HG CYS 21 -1.349 -10.341 -2.378 163 H PHE 22 H PHE 22 -1.735 -12.771 1.207 164 HA PHE 22 HA PHE 22 -3.535 -10.741 2.226 165 HB2 PHE 22 2HB PHE 22 -3.867 -13.657 2.841 166 HB3 PHE 22 1HB PHE 22 -5.092 -12.462 2.400 167 HD1 PHE 22 1HD PHE 22 -2.634 -14.848 1.179 168 HD2 PHE 22 2HD PHE 22 -5.258 -11.649 0.029 169 HE1 PHE 22 1HE PHE 22 -2.385 -15.501 -1.194 170 HE2 PHE 22 2HE PHE 22 -5.012 -12.304 -2.349 171 HZ PHE 22 HZ PHE 22 -3.571 -14.228 -2.961 172 H GLU 23 H GLU 23 -1.349 -13.081 3.690 173 HA GLU 23 HA GLU 23 -2.222 -12.684 6.402 174 HB2 GLU 23 2HB GLU 23 -0.889 -14.639 5.652 175 HB3 GLU 23 1HB GLU 23 0.480 -13.572 5.366 176 HG2 GLU 23 2HG GLU 23 0.437 -12.909 7.758 177 HG3 GLU 23 1HG GLU 23 -0.871 -14.059 8.025 178 H VAL 24 H VAL 24 0.185 -11.077 4.368 179 HA VAL 24 HA VAL 24 1.480 -9.590 6.416 180 HB VAL 24 HB VAL 24 1.119 -9.161 3.457 181 HG11 VAL 24 1HG1 VAL 24 2.219 -7.338 5.543 182 HG12 VAL 24 2HG1 VAL 24 1.433 -6.954 4.011 183 HG13 VAL 24 3HG1 VAL 24 3.116 -7.478 4.031 184 HG21 VAL 24 1HG2 VAL 24 2.723 -10.860 4.869 185 HG22 VAL 24 2HG2 VAL 24 3.769 -9.445 4.747 186 HG23 VAL 24 3HG2 VAL 24 3.141 -10.207 3.286 187 H PHE 25 H PHE 25 -1.292 -8.662 4.323 188 HA PHE 25 HA PHE 25 -1.537 -6.018 5.404 189 HB2 PHE 25 2HB PHE 25 -3.901 -7.638 4.476 190 HB3 PHE 25 1HB PHE 25 -3.633 -5.904 4.326 191 HD1 PHE 25 1HD PHE 25 -0.950 -5.679 3.231 192 HD2 PHE 25 2HD PHE 25 -4.033 -8.537 2.370 193 HE1 PHE 25 1HE PHE 25 0.025 -6.043 0.979 194 HE2 PHE 25 2HE PHE 25 -3.059 -8.906 0.109 195 HZ PHE 25 HZ PHE 25 -1.030 -7.654 -0.582 196 H THR 26 H THR 26 -3.029 -9.094 6.346 197 HA THR 26 HA THR 26 -4.478 -7.752 8.530 198 HB THR 26 HB THR 26 -5.576 -9.892 8.829 199 HG1 THR 26 1HG THR 26 -4.749 -11.485 7.085 200 HG21 THR 26 1HG2 THR 26 -6.467 -8.594 7.017 201 HG22 THR 26 2HG2 THR 26 -6.380 -10.265 6.459 202 HG23 THR 26 3HG2 THR 26 -5.163 -9.098 5.940 203 H SER 27 H SER 27 -1.374 -9.023 8.225 204 HA SER 27 HA SER 27 -1.359 -10.072 11.010 205 HB2 SER 27 2HB SER 27 0.974 -10.771 10.474 206 HB3 SER 27 1HB SER 27 -0.220 -11.463 9.383 207 HG SER 27 HG SER 27 1.806 -10.353 8.533 208 H ARG 28 H ARG 28 0.895 -7.974 9.139 209 HA ARG 28 HA ARG 28 0.756 -5.921 11.223 210 HB2 ARG 28 2HB ARG 28 3.385 -6.192 11.460 211 HB3 ARG 28 1HB ARG 28 2.286 -7.120 12.481 212 HG2 ARG 28 2HG ARG 28 2.709 -9.097 11.381 213 HG3 ARG 28 1HG ARG 28 2.988 -8.299 9.837 214 HD2 ARG 28 2HD ARG 28 5.202 -7.920 10.272 215 HD3 ARG 28 1HD ARG 28 4.942 -7.741 12.008 216 HE ARG 28 HE ARG 28 4.490 -10.466 11.103 217 HH11 ARG 28 1HH1 ARG 28 6.014 -11.992 11.778 218 HH12 ARG 28 2HH1 ARG 28 7.537 -11.457 12.404 219 HH21 ARG 28 1HH2 ARG 28 6.812 -8.088 12.019 220 HH22 ARG 28 2HH2 ARG 28 7.989 -9.246 12.540 221 HA PRO 29 HA PRO 29 1.831 -4.467 6.927 222 HB2 PRO 29 2HB PRO 29 0.140 -2.210 7.817 223 HB3 PRO 29 1HB PRO 29 0.043 -3.171 6.332 224 HG2 PRO 29 2HG PRO 29 -1.755 -3.411 8.305 225 HG3 PRO 29 1HG PRO 29 -1.266 -4.777 7.292 226 HD2 PRO 29 2HD PRO 29 -0.477 -4.145 10.110 227 HD3 PRO 29 1HD PRO 29 -0.745 -5.725 9.338 228 H ALA 30 H ALA 30 2.054 -3.107 10.124 229 HA ALA 30 HA ALA 30 3.449 -0.685 9.495 230 HB1 ALA 30 1HB ALA 30 2.770 -2.210 11.869 231 HB2 ALA 30 2HB ALA 30 3.050 -0.476 11.702 232 HB3 ALA 30 3HB ALA 30 4.409 -1.567 11.978 233 H ASP 31 H ASP 31 4.417 -3.969 9.358 234 HA ASP 31 HA ASP 31 7.168 -3.834 9.972 235 HB2 ASP 31 2HB ASP 31 5.849 -5.911 9.398 236 HB3 ASP 31 1HB ASP 31 5.963 -5.439 7.702 237 H TRP 32 H TRP 32 5.439 -2.704 7.115 238 HA TRP 32 HA TRP 32 8.024 -1.572 6.125 239 HB2 TRP 32 2HB TRP 32 6.943 -1.983 3.775 240 HB3 TRP 32 1HB TRP 32 7.742 -3.324 4.598 241 HD1 TRP 32 HD TRP 32 6.316 -5.368 5.206 242 HE1 TRP 32 1HE TRP 32 3.823 -5.976 4.995 243 HE3 TRP 32 3HE TRP 32 4.440 -0.844 3.824 244 HZ2 TRP 32 2HZ TRP 32 1.359 -4.703 4.327 245 HZ3 TRP 32 3HZ TRP 32 2.014 -0.561 3.400 246 HH2 TRP 32 HH TRP 32 0.469 -2.485 3.649 247 H TRP 33 H TRP 33 5.352 -0.628 7.496 248 HA TRP 33 HA TRP 33 4.222 1.185 5.530 249 HB2 TRP 33 2HB TRP 33 2.958 0.297 7.507 250 HB3 TRP 33 1HB TRP 33 3.944 1.331 8.541 251 HD1 TRP 33 HD TRP 33 3.704 3.992 8.206 252 HE1 TRP 33 1HE TRP 33 1.737 5.407 7.322 253 HE3 TRP 33 3HE TRP 33 0.979 0.356 5.875 254 HZ2 TRP 33 2HZ TRP 33 -0.672 5.043 5.823 255 HZ3 TRP 33 3HZ TRP 33 -1.145 0.916 4.729 256 HH2 TRP 33 HH TRP 33 -1.973 3.253 4.699 257 HA PRO 34 HA PRO 34 7.002 4.240 8.335 258 HB2 PRO 34 2HB PRO 34 9.428 2.530 7.985 259 HB3 PRO 34 1HB PRO 34 8.981 3.592 9.335 260 HG2 PRO 34 2HG PRO 34 8.734 0.976 9.561 261 HG3 PRO 34 1HG PRO 34 7.495 2.059 10.222 262 HD2 PRO 34 2HD PRO 34 7.409 0.385 7.746 263 HD3 PRO 34 1HD PRO 34 6.103 0.771 8.886 264 HA PRO 35 HA PRO 35 8.248 5.124 4.018 265 HB2 PRO 35 2HB PRO 35 7.362 7.679 3.926 266 HB3 PRO 35 1HB PRO 35 6.264 6.293 3.785 267 HG2 PRO 35 2HG PRO 35 6.735 8.104 6.078 268 HG3 PRO 35 1HG PRO 35 5.259 7.266 5.580 269 HD2 PRO 35 2HD PRO 35 7.010 6.456 7.636 270 HD3 PRO 35 1HD PRO 35 5.725 5.473 6.907 271 H SER 36 H SER 36 9.976 6.399 3.124 272 HA SER 36 HA SER 36 12.085 7.106 4.916 273 HB2 SER 36 2HB SER 36 13.226 7.973 2.960 274 HB3 SER 36 1HB SER 36 12.364 6.513 2.485 275 HG SER 36 HG SER 36 11.904 9.175 1.831 276 H HIS 37 H HIS 37 9.414 8.923 3.581 277 HA HIS 37 HA HIS 37 10.386 11.345 5.054 278 HB2 HIS 37 2HB HIS 37 8.672 11.233 2.550 279 HB3 HIS 37 1HB HIS 37 9.157 12.702 3.397 280 HD1 HIS 37 1HD HIS 37 11.906 12.954 3.639 281 HD2 HIS 37 2HD HIS 37 10.482 10.471 0.603 282 HE1 HIS 37 1HE HIS 37 13.815 12.657 1.999 283 HE2 HIS 37 2HE HIS 37 12.960 11.146 0.149 284 H VAL 38 H VAL 38 8.749 12.489 6.248 285 HA VAL 38 HA VAL 38 6.538 10.761 7.103 286 HB VAL 38 HB VAL 38 7.184 13.605 7.937 287 HG11 VAL 38 1HG1 VAL 38 5.946 11.781 9.864 288 HG12 VAL 38 2HG1 VAL 38 4.938 12.050 8.443 289 HG13 VAL 38 3HG1 VAL 38 5.479 13.420 9.412 290 HG21 VAL 38 1HG2 VAL 38 8.493 12.682 9.712 291 HG22 VAL 38 2HG2 VAL 38 9.031 11.857 8.249 292 HG23 VAL 38 3HG2 VAL 38 7.935 11.045 9.368 293 H LEU 39 H LEU 39 4.616 10.766 6.086 294 HA LEU 39 HA LEU 39 3.850 13.155 4.476 295 HB2 LEU 39 2HB LEU 39 2.716 10.340 4.422 296 HB3 LEU 39 1HB LEU 39 2.326 11.645 3.303 297 HG LEU 39 HG LEU 39 5.084 10.444 3.687 298 HD11 LEU 39 1HD1 LEU 39 4.748 9.529 1.419 299 HD12 LEU 39 2HD1 LEU 39 3.114 10.188 1.390 300 HD13 LEU 39 3HD1 LEU 39 3.530 8.910 2.532 301 HD21 LEU 39 1HD2 LEU 39 5.612 12.537 2.906 302 HD22 LEU 39 2HD2 LEU 39 4.009 12.798 2.221 303 HD23 LEU 39 3HD2 LEU 39 5.187 11.810 1.358 304 H VAL 40 H VAL 40 3.348 11.882 7.479 305 HA VAL 40 HA VAL 40 0.665 13.178 7.697 306 HB VAL 40 HB VAL 40 0.302 11.377 9.551 307 HG11 VAL 40 1HG1 VAL 40 -1.183 11.228 7.756 308 HG12 VAL 40 2HG1 VAL 40 -0.312 9.704 7.585 309 HG13 VAL 40 3HG1 VAL 40 0.110 11.081 6.566 310 HG21 VAL 40 1HG2 VAL 40 2.691 10.592 9.333 311 HG22 VAL 40 2HG2 VAL 40 2.274 9.960 7.742 312 HG23 VAL 40 3HG2 VAL 40 1.493 9.306 9.183 313 H LYS 41 H LYS 41 0.230 13.946 9.953 314 HA LYS 41 HA LYS 41 2.408 15.397 11.041 315 HB2 LYS 41 2HB LYS 41 -0.009 15.883 11.488 316 HB3 LYS 41 1HB LYS 41 -0.061 14.456 12.518 317 HG2 LYS 41 2HG LYS 41 0.332 16.197 14.050 318 HG3 LYS 41 1HG LYS 41 1.946 15.550 13.762 319 HD2 LYS 41 2HD LYS 41 2.460 17.325 12.208 320 HD3 LYS 41 1HD LYS 41 0.791 17.896 12.230 321 HE2 LYS 41 2HE LYS 41 2.452 19.199 13.681 322 HE3 LYS 41 1HE LYS 41 0.977 18.656 14.481 323 HZ1 LYS 41 1HZ LYS 41 3.543 17.165 14.524 324 HZ2 LYS 41 2HZ LYS 41 2.136 16.804 15.407 325 HZ3 LYS 41 3HZ LYS 41 3.027 18.207 15.759 326 H LYS 42 H LYS 42 1.109 12.208 11.803 327 HA LYS 42 HA LYS 42 3.550 11.690 13.443 328 HB2 LYS 42 2HB LYS 42 0.781 10.578 13.938 329 HB3 LYS 42 1HB LYS 42 2.212 10.272 14.914 330 HG2 LYS 42 2HG LYS 42 1.226 13.082 14.447 331 HG3 LYS 42 1HG LYS 42 0.550 12.086 15.735 332 HD2 LYS 42 2HD LYS 42 2.405 12.287 17.021 333 HD3 LYS 42 1HD LYS 42 3.491 12.056 15.652 334 HE2 LYS 42 2HE LYS 42 3.409 14.333 15.048 335 HE3 LYS 42 1HE LYS 42 1.943 14.619 15.984 336 HZ1 LYS 42 1HZ LYS 42 4.716 14.444 16.879 337 HZ2 LYS 42 2HZ LYS 42 3.524 13.833 17.924 338 HZ3 LYS 42 3HZ LYS 42 3.466 15.454 17.418 339 H GLU 43 H GLU 43 4.472 9.612 13.132 340 HA GLU 43 HA GLU 43 3.879 8.383 10.567 341 HB2 GLU 43 2HB GLU 43 6.174 8.481 11.566 342 HB3 GLU 43 1HB GLU 43 5.640 7.349 12.809 343 HG2 GLU 43 2HG GLU 43 5.037 5.720 11.017 344 HG3 GLU 43 1HG GLU 43 5.699 6.838 9.822 345 H ARG 44 H ARG 44 2.572 6.633 10.180 346 HA ARG 44 HA ARG 44 0.809 5.688 12.261 347 HB2 ARG 44 2HB ARG 44 1.372 4.523 9.516 348 HB3 ARG 44 1HB ARG 44 0.012 4.090 10.550 349 HG2 ARG 44 2HG ARG 44 0.568 6.854 9.432 350 HG3 ARG 44 1HG ARG 44 -0.675 5.743 8.856 351 HD2 ARG 44 2HD ARG 44 -1.432 5.753 11.382 352 HD3 ARG 44 1HD ARG 44 -0.554 7.283 11.427 353 HE ARG 44 HE ARG 44 -3.081 6.802 10.056 354 HH11 ARG 44 1HH1 ARG 44 -3.971 8.605 9.020 355 HH12 ARG 44 2HH1 ARG 44 -2.988 10.005 8.749 356 HH21 ARG 44 1HH2 ARG 44 -0.165 8.632 10.222 357 HH22 ARG 44 2HH2 ARG 44 -0.833 10.021 9.429 358 H ALA 45 H ALA 45 0.922 3.815 13.478 359 HA ALA 45 HA ALA 45 3.256 2.019 12.984 360 HB1 ALA 45 1HB ALA 45 2.518 2.420 15.813 361 HB2 ALA 45 2HB ALA 45 3.241 3.825 15.030 362 HB3 ALA 45 3HB ALA 45 4.112 2.292 15.070 363 H GLY 46 H GLY 46 0.167 2.391 14.779 364 HA2 GLY 46 2HA GLY 46 -0.066 -0.572 14.810 365 HA3 GLY 46 1HA GLY 46 -1.094 0.546 15.700 366 H LEU 47 H LEU 47 -1.870 -1.648 13.850 367 HA LEU 47 HA LEU 47 -3.686 -0.027 12.165 368 HB2 LEU 47 2HB LEU 47 -1.924 -2.237 11.065 369 HB3 LEU 47 1HB LEU 47 -3.253 -1.478 10.192 370 HG LEU 47 HG LEU 47 -1.973 0.754 10.829 371 HD11 LEU 47 1HD1 LEU 47 0.214 0.578 11.437 372 HD12 LEU 47 2HD1 LEU 47 0.489 -0.821 10.400 373 HD13 LEU 47 3HD1 LEU 47 -0.248 -1.032 11.987 374 HD21 LEU 47 1HD2 LEU 47 -1.717 -1.156 8.589 375 HD22 LEU 47 2HD2 LEU 47 -0.405 0.014 8.706 376 HD23 LEU 47 3HD2 LEU 47 -2.072 0.570 8.563 377 H ALA 48 H ALA 48 -5.715 -0.918 12.115 378 HA ALA 48 HA ALA 48 -6.071 -3.811 12.540 379 HB1 ALA 48 1HB ALA 48 -6.092 -3.180 14.836 380 HB2 ALA 48 2HB ALA 48 -7.793 -3.289 14.381 381 HB3 ALA 48 3HB ALA 48 -7.012 -1.713 14.504 382 H PHE 49 H PHE 49 -7.684 -4.431 11.172 383 HA PHE 49 HA PHE 49 -9.956 -2.601 10.700 384 HB2 PHE 49 2HB PHE 49 -9.706 -2.765 8.244 385 HB3 PHE 49 1HB PHE 49 -8.329 -1.950 8.989 386 HD1 PHE 49 1HD PHE 49 -9.460 -4.838 7.098 387 HD2 PHE 49 2HD PHE 49 -6.191 -3.207 9.356 388 HE1 PHE 49 1HE PHE 49 -7.935 -6.516 6.100 389 HE2 PHE 49 2HE PHE 49 -4.663 -4.885 8.360 390 HZ PHE 49 HZ PHE 49 -5.530 -6.536 6.730 391 H GLU 50 H GLU 50 -11.819 -3.673 9.928 392 HA GLU 50 HA GLU 50 -11.794 -6.592 10.355 393 HB2 GLU 50 2HB GLU 50 -14.302 -5.311 9.483 394 HB3 GLU 50 1HB GLU 50 -13.997 -6.349 10.877 395 HG2 GLU 50 2HG GLU 50 -12.779 -4.350 11.913 396 HG3 GLU 50 1HG GLU 50 -13.496 -3.379 10.627 397 HA PRO 51 HA PRO 51 -11.452 -6.777 5.815 398 HB2 PRO 51 2HB PRO 51 -10.834 -9.412 5.610 399 HB3 PRO 51 1HB PRO 51 -9.653 -8.180 6.090 400 HG2 PRO 51 2HG PRO 51 -11.120 -10.145 7.758 401 HG3 PRO 51 1HG PRO 51 -9.471 -9.523 7.927 402 HD2 PRO 51 2HD PRO 51 -11.649 -8.659 9.425 403 HD3 PRO 51 1HD PRO 51 -10.149 -7.737 9.194 404 H PHE 52 H PHE 52 -13.694 -6.471 5.353 405 HA PHE 52 HA PHE 52 -15.074 -8.888 4.459 406 HB2 PHE 52 2HB PHE 52 -16.439 -7.142 6.531 407 HB3 PHE 52 1HB PHE 52 -17.060 -8.629 5.813 408 HD1 PHE 52 1HD PHE 52 -15.868 -10.816 6.268 409 HD2 PHE 52 2HD PHE 52 -14.959 -7.190 8.380 410 HE1 PHE 52 1HE PHE 52 -14.721 -12.130 8.034 411 HE2 PHE 52 2HE PHE 52 -13.816 -8.498 10.142 412 HZ PHE 52 HZ PHE 52 -13.690 -10.971 9.970 413 H VAL 53 H VAL 53 -17.386 -8.055 3.576 414 HA VAL 53 HA VAL 53 -16.727 -5.802 1.826 415 HB VAL 53 HB VAL 53 -19.407 -7.189 2.131 416 HG11 VAL 53 1HG1 VAL 53 -19.431 -6.528 -0.376 417 HG12 VAL 53 2HG1 VAL 53 -18.105 -5.441 0.044 418 HG13 VAL 53 3HG1 VAL 53 -19.682 -5.250 0.815 419 HG21 VAL 53 1HG2 VAL 53 -18.578 -9.026 1.117 420 HG22 VAL 53 2HG2 VAL 53 -16.963 -8.364 1.358 421 HG23 VAL 53 3HG2 VAL 53 -17.831 -8.048 -0.144 422 H GLY 54 H GLY 54 -17.100 -3.707 2.394 423 HA2 GLY 54 2HA GLY 54 -18.269 -1.863 3.324 424 HA3 GLY 54 1HA GLY 54 -19.483 -2.988 3.943 425 H GLY 55 H GLY 55 -16.219 -3.834 4.577 426 HA2 GLY 55 2HA GLY 55 -16.612 -3.654 7.443 427 HA3 GLY 55 1HA GLY 55 -15.105 -4.088 6.633 428 H ARG 56 H ARG 56 -14.632 -2.524 8.691 429 HA ARG 56 HA ARG 56 -14.364 0.239 7.556 430 HB2 ARG 56 2HB ARG 56 -14.664 -0.626 10.448 431 HB3 ARG 56 1HB ARG 56 -14.328 1.025 9.926 432 HG2 ARG 56 2HG ARG 56 -16.429 1.002 8.592 433 HG3 ARG 56 1HG ARG 56 -16.778 -0.613 9.211 434 HD2 ARG 56 2HD ARG 56 -17.987 0.955 10.588 435 HD3 ARG 56 1HD ARG 56 -16.635 0.349 11.544 436 HE ARG 56 HE ARG 56 -15.723 2.685 10.254 437 HH11 ARG 56 1HH1 ARG 56 -15.746 4.662 11.350 438 HH12 ARG 56 2HH1 ARG 56 -16.812 4.878 12.697 439 HH21 ARG 56 1HH2 ARG 56 -18.137 1.680 12.500 440 HH22 ARG 56 2HH2 ARG 56 -18.166 3.190 13.349 441 H TYR 57 H TYR 57 -12.298 1.105 7.562 442 HA TYR 57 HA TYR 57 -10.156 -0.619 8.746 443 HB2 TYR 57 2HB TYR 57 -10.324 -0.374 6.169 444 HB3 TYR 57 1HB TYR 57 -9.744 1.270 6.431 445 HD1 TYR 57 1HD TYR 57 -7.580 1.561 7.821 446 HD2 TYR 57 2HD TYR 57 -8.810 -2.170 6.087 447 HE1 TYR 57 1HE TYR 57 -5.255 0.715 7.994 448 HE2 TYR 57 2HE TYR 57 -6.486 -3.021 6.263 449 HH TYR 57 HH TYR 57 -4.464 -2.634 7.308 450 H TYR 58 H TYR 58 -8.938 0.351 10.282 451 HA TYR 58 HA TYR 58 -8.621 3.292 10.232 452 HB2 TYR 58 2HB TYR 58 -9.237 3.471 12.621 453 HB3 TYR 58 1HB TYR 58 -10.592 2.910 11.642 454 HD1 TYR 58 1HD TYR 58 -8.590 2.236 14.505 455 HD2 TYR 58 2HD TYR 58 -10.840 0.328 11.389 456 HE1 TYR 58 1HE TYR 58 -8.754 0.180 15.883 457 HE2 TYR 58 2HE TYR 58 -11.005 -1.733 12.764 458 HH TYR 58 HH TYR 58 -9.554 -1.880 16.023 459 H GLU 59 H GLU 59 -6.821 4.007 11.595 460 HA GLU 59 HA GLU 59 -4.999 1.803 12.459 461 HB2 GLU 59 2HB GLU 59 -4.165 4.261 10.885 462 HB3 GLU 59 1HB GLU 59 -3.106 2.957 11.425 463 HG2 GLU 59 2HG GLU 59 -4.397 1.353 10.044 464 HG3 GLU 59 1HG GLU 59 -5.413 2.678 9.475 465 H TRP 60 H TRP 60 -3.350 2.580 14.046 466 HA TRP 60 HA TRP 60 -4.436 4.870 15.628 467 HB2 TRP 60 2HB TRP 60 -2.578 2.608 16.406 468 HB3 TRP 60 1HB TRP 60 -2.976 3.963 17.460 469 HD1 TRP 60 HD TRP 60 -5.648 4.252 18.050 470 HE1 TRP 60 1HE TRP 60 -7.418 2.423 18.465 471 HE3 TRP 60 3HE TRP 60 -3.340 0.269 15.840 472 HZ2 TRP 60 2HZ TRP 60 -7.799 -0.360 17.935 473 HZ3 TRP 60 3HZ TRP 60 -4.425 -1.956 15.813 474 HH2 TRP 60 HH TRP 60 -6.651 -2.275 16.857 475 H ASP 61 H ASP 61 -3.244 6.700 15.822 476 HA ASP 61 HA ASP 61 -0.616 6.794 14.452 477 HB2 ASP 61 2HB ASP 61 -2.418 8.957 15.561 478 HB3 ASP 61 1HB ASP 61 -0.877 9.268 14.769 479 H ILE 62 H ILE 62 1.214 7.869 15.566 480 HA ILE 62 HA ILE 62 1.785 6.794 18.099 481 HB ILE 62 HB ILE 62 2.895 9.311 16.855 482 HG12 ILE 62 2HG1 ILE 62 3.971 6.491 16.850 483 HG13 ILE 62 1HG1 ILE 62 3.096 7.213 15.508 484 HG21 ILE 62 1HG2 ILE 62 4.067 9.543 18.752 485 HG22 ILE 62 2HG2 ILE 62 4.800 7.970 18.436 486 HG23 ILE 62 3HG2 ILE 62 3.337 8.079 19.413 487 HD11 ILE 62 1HD1 ILE 62 4.802 9.044 15.442 488 HD12 ILE 62 2HD1 ILE 62 5.478 7.453 15.091 489 HD13 ILE 62 3HD1 ILE 62 5.714 8.179 16.680 490 H ASP 63 H ASP 63 0.560 10.049 17.313 491 HA ASP 63 HA ASP 63 -0.312 10.272 20.168 492 HB2 ASP 63 2HB ASP 63 1.660 11.745 19.617 493 HB3 ASP 63 1HB ASP 63 0.638 12.571 18.439 494 H GLY 64 H GLY 64 -1.374 9.917 17.098 495 HA2 GLY 64 2HA GLY 64 -3.675 11.778 17.431 496 HA3 GLY 64 1HA GLY 64 -3.190 11.047 15.902 497 H THR 65 H THR 65 -5.805 10.963 17.257 498 HA THR 65 HA THR 65 -6.289 8.417 18.455 499 HB THR 65 HB THR 65 -8.496 9.048 18.459 500 HG1 THR 65 1HG THR 65 -8.422 10.492 16.082 501 HG21 THR 65 1HG2 THR 65 -6.905 11.093 18.930 502 HG22 THR 65 2HG2 THR 65 -8.645 11.344 18.795 503 HG23 THR 65 3HG2 THR 65 -7.593 11.714 17.428 504 H GLU 66 H GLU 66 -8.527 7.705 16.625 505 HA GLU 66 HA GLU 66 -6.907 6.120 14.723 506 HB2 GLU 66 2HB GLU 66 -9.812 5.887 15.553 507 HB3 GLU 66 1HB GLU 66 -8.967 4.777 14.481 508 HG2 GLU 66 2HG GLU 66 -8.746 3.685 16.527 509 HG3 GLU 66 1HG GLU 66 -7.249 4.613 16.454 510 H ILE 67 H ILE 67 -6.991 6.484 12.548 511 HA ILE 67 HA ILE 67 -9.108 8.351 11.536 512 HB ILE 67 HB ILE 67 -6.260 8.092 10.522 513 HG12 ILE 67 2HG1 ILE 67 -7.607 10.287 12.128 514 HG13 ILE 67 1HG1 ILE 67 -6.337 9.210 12.711 515 HG21 ILE 67 1HG2 ILE 67 -7.968 8.690 8.807 516 HG22 ILE 67 2HG2 ILE 67 -6.842 10.009 9.114 517 HG23 ILE 67 3HG2 ILE 67 -8.462 10.054 9.809 518 HD11 ILE 67 1HD1 ILE 67 -6.149 11.544 10.889 519 HD12 ILE 67 2HD1 ILE 67 -5.148 10.154 10.466 520 HD13 ILE 67 3HD1 ILE 67 -4.970 10.923 12.045 521 H VAL 68 H VAL 68 -10.211 7.647 9.721 522 HA VAL 68 HA VAL 68 -9.925 4.878 8.938 523 HB VAL 68 HB VAL 68 -11.414 7.103 7.507 524 HG11 VAL 68 1HG1 VAL 68 -11.720 4.084 7.483 525 HG12 VAL 68 2HG1 VAL 68 -11.108 5.073 6.158 526 HG13 VAL 68 3HG1 VAL 68 -12.792 5.218 6.661 527 HG21 VAL 68 1HG2 VAL 68 -12.607 5.119 9.442 528 HG22 VAL 68 2HG2 VAL 68 -13.282 6.648 8.878 529 HG23 VAL 68 3HG2 VAL 68 -11.933 6.645 10.014 530 H TRP 69 H TRP 69 -8.658 4.045 7.323 531 HA TRP 69 HA TRP 69 -7.110 6.002 5.676 532 HB2 TRP 69 2HB TRP 69 -5.503 4.742 6.770 533 HB3 TRP 69 1HB TRP 69 -6.513 3.300 6.815 534 HD1 TRP 69 HD TRP 69 -3.958 5.101 4.715 535 HE1 TRP 69 1HE TRP 69 -3.360 3.658 2.662 536 HE3 TRP 69 3HE TRP 69 -7.547 1.488 5.100 537 HZ2 TRP 69 2HZ TRP 69 -4.283 1.284 1.358 538 HZ3 TRP 69 3HZ TRP 69 -7.665 -0.351 3.441 539 HH2 TRP 69 HH TRP 69 -6.039 -0.459 1.572 540 H GLY 70 H GLY 70 -9.731 3.956 5.443 541 HA2 GLY 70 2HA GLY 70 -10.243 4.215 2.754 542 HA3 GLY 70 1HA GLY 70 -9.175 2.813 2.817 543 H ARG 71 H ARG 71 -10.641 1.159 2.395 544 HA ARG 71 HA ARG 71 -12.437 0.427 4.571 545 HB2 ARG 71 2HB ARG 71 -13.620 2.088 2.796 546 HB3 ARG 71 1HB ARG 71 -13.875 0.556 1.964 547 HG2 ARG 71 2HG ARG 71 -14.873 -0.387 4.028 548 HG3 ARG 71 1HG ARG 71 -14.665 1.171 4.823 549 HD2 ARG 71 2HD ARG 71 -16.084 2.218 3.057 550 HD3 ARG 71 1HD ARG 71 -16.361 0.617 2.373 551 HE ARG 71 HE ARG 71 -17.052 0.565 5.144 552 HH11 ARG 71 1HH1 ARG 71 -19.241 0.647 5.700 553 HH12 ARG 71 2HH1 ARG 71 -20.390 1.248 4.552 554 HH21 ARG 71 1HH2 ARG 71 -18.016 1.873 2.103 555 HH22 ARG 71 2HH2 ARG 71 -19.697 1.942 2.516 556 H ILE 72 H ILE 72 -13.954 -1.452 2.979 557 HA ILE 72 HA ILE 72 -11.820 -3.116 1.736 558 HB ILE 72 HB ILE 72 -13.816 -4.050 3.822 559 HG12 ILE 72 2HG1 ILE 72 -11.350 -4.794 4.689 560 HG13 ILE 72 1HG1 ILE 72 -10.938 -3.313 3.826 561 HG21 ILE 72 1HG2 ILE 72 -13.575 -5.780 2.156 562 HG22 ILE 72 2HG2 ILE 72 -12.576 -6.239 3.536 563 HG23 ILE 72 3HG2 ILE 72 -11.827 -5.551 2.095 564 HD11 ILE 72 1HD1 ILE 72 -12.774 -2.150 5.104 565 HD12 ILE 72 2HD1 ILE 72 -11.440 -2.712 6.112 566 HD13 ILE 72 3HD1 ILE 72 -12.952 -3.616 6.066 567 H LEU 73 H LEU 73 -12.766 -4.855 0.341 568 HA LEU 73 HA LEU 73 -15.486 -4.095 -0.654 569 HB2 LEU 73 2HB LEU 73 -13.587 -3.476 -2.200 570 HB3 LEU 73 1HB LEU 73 -13.205 -5.193 -2.320 571 HG LEU 73 HG LEU 73 -15.769 -5.406 -2.924 572 HD11 LEU 73 1HD1 LEU 73 -16.285 -3.030 -2.493 573 HD12 LEU 73 2HD1 LEU 73 -16.563 -3.436 -4.185 574 HD13 LEU 73 3HD1 LEU 73 -15.109 -2.555 -3.718 575 HD21 LEU 73 1HD2 LEU 73 -13.460 -4.544 -4.645 576 HD22 LEU 73 2HD2 LEU 73 -15.052 -4.762 -5.372 577 HD23 LEU 73 3HD2 LEU 73 -14.260 -6.114 -4.564 578 H GLU 74 H GLU 74 -13.101 -6.747 -0.679 579 HA GLU 74 HA GLU 74 -14.913 -8.671 0.419 580 HB2 GLU 74 2HB GLU 74 -15.976 -8.380 -1.834 581 HB3 GLU 74 1HB GLU 74 -14.469 -8.934 -2.558 582 HG2 GLU 74 2HG GLU 74 -14.657 -11.052 -1.263 583 HG3 GLU 74 1HG GLU 74 -16.215 -10.504 -0.644 584 H TRP 75 H TRP 75 -13.767 -10.516 1.000 585 HA TRP 75 HA TRP 75 -10.904 -10.553 0.185 586 HB2 TRP 75 2HB TRP 75 -10.831 -10.548 2.490 587 HB3 TRP 75 1HB TRP 75 -12.392 -11.355 2.644 588 HD1 TRP 75 HD TRP 75 -8.684 -12.033 2.261 589 HE1 TRP 75 1HE TRP 75 -8.252 -14.559 2.559 590 HE3 TRP 75 3HE TRP 75 -13.492 -13.747 2.315 591 HZ2 TRP 75 2HZ TRP 75 -9.753 -16.986 2.789 592 HZ3 TRP 75 3HZ TRP 75 -13.965 -16.163 2.573 593 HH2 TRP 75 HH TRP 75 -12.103 -17.786 2.811 594 H ASP 76 H ASP 76 -10.332 -12.093 -1.265 595 HA ASP 76 HA ASP 76 -12.068 -14.508 -1.498 596 HB2 ASP 76 2HB ASP 76 -11.253 -12.655 -3.446 597 HB3 ASP 76 1HB ASP 76 -10.311 -14.117 -3.752 598 HA PRO 77 HA PRO 77 -8.684 -16.814 0.426 599 HB2 PRO 77 2HB PRO 77 -9.605 -18.714 -1.727 600 HB3 PRO 77 1HB PRO 77 -9.152 -19.069 -0.047 601 HG2 PRO 77 2HG PRO 77 -11.702 -18.857 -0.777 602 HG3 PRO 77 1HG PRO 77 -11.133 -18.291 0.801 603 HD2 PRO 77 2HD PRO 77 -12.068 -16.718 -1.505 604 HD3 PRO 77 1HD PRO 77 -11.900 -16.221 0.194 605 HA PRO 78 HA PRO 78 -4.879 -16.175 -1.689 606 HB2 PRO 78 2HB PRO 78 -4.845 -19.159 -2.020 607 HB3 PRO 78 1HB PRO 78 -3.536 -18.073 -1.514 608 HG2 PRO 78 2HG PRO 78 -5.091 -19.522 0.214 609 HG3 PRO 78 1HG PRO 78 -4.230 -18.036 0.642 610 HD2 PRO 78 2HD PRO 78 -7.081 -18.442 0.529 611 HD3 PRO 78 1HD PRO 78 -6.213 -16.948 0.936 612 H HIS 79 H HIS 79 -5.988 -15.195 -3.514 613 HA HIS 79 HA HIS 79 -5.386 -16.252 -6.030 614 HB2 HIS 79 2HB HIS 79 -7.856 -17.358 -4.862 615 HB3 HIS 79 1HB HIS 79 -8.060 -16.691 -6.482 616 HD1 HIS 79 1HD HIS 79 -7.171 -19.747 -4.881 617 HD2 HIS 79 2HD HIS 79 -5.743 -17.730 -8.242 618 HE1 HIS 79 1HE HIS 79 -5.916 -21.459 -6.267 619 HE2 HIS 79 2HE HIS 79 -5.044 -20.242 -8.315 620 H ARG 80 H ARG 80 -8.048 -14.511 -4.319 621 HA ARG 80 HA ARG 80 -7.550 -12.273 -6.211 622 HB2 ARG 80 2HB ARG 80 -9.670 -13.924 -6.613 623 HB3 ARG 80 1HB ARG 80 -10.390 -12.726 -5.540 624 HG2 ARG 80 2HG ARG 80 -8.842 -12.031 -8.048 625 HG3 ARG 80 1HG ARG 80 -10.599 -12.138 -7.968 626 HD2 ARG 80 2HD ARG 80 -10.457 -10.453 -6.038 627 HD3 ARG 80 1HD ARG 80 -8.784 -10.191 -6.536 628 HE ARG 80 HE ARG 80 -9.611 -8.946 -8.355 629 HH11 ARG 80 1HH1 ARG 80 -11.238 -8.241 -9.765 630 HH12 ARG 80 2HH1 ARG 80 -12.816 -8.947 -9.668 631 HH21 ARG 80 1HH2 ARG 80 -11.981 -11.105 -7.087 632 HH22 ARG 80 2HH2 ARG 80 -13.235 -10.569 -8.153 633 H LEU 81 H LEU 81 -7.479 -10.343 -5.214 634 HA LEU 81 HA LEU 81 -8.666 -10.124 -2.475 635 HB2 LEU 81 2HB LEU 81 -6.166 -10.254 -2.426 636 HB3 LEU 81 1HB LEU 81 -6.106 -8.819 -3.447 637 HG LEU 81 HG LEU 81 -7.474 -7.619 -1.685 638 HD11 LEU 81 1HD1 LEU 81 -7.116 -8.804 0.640 639 HD12 LEU 81 2HD1 LEU 81 -7.047 -10.269 -0.337 640 HD13 LEU 81 3HD1 LEU 81 -8.489 -9.254 -0.372 641 HD21 LEU 81 1HD2 LEU 81 -4.691 -8.324 -1.708 642 HD22 LEU 81 2HD2 LEU 81 -5.232 -8.202 -0.034 643 HD23 LEU 81 3HD2 LEU 81 -5.440 -6.836 -1.129 644 H ALA 82 H ALA 82 -10.050 -8.411 -2.254 645 HA ALA 82 HA ALA 82 -9.803 -6.144 -4.177 646 HB1 ALA 82 1HB ALA 82 -12.539 -7.083 -3.417 647 HB2 ALA 82 2HB ALA 82 -11.668 -7.995 -4.648 648 HB3 ALA 82 3HB ALA 82 -12.000 -6.280 -4.891 649 H MET 83 H MET 83 -10.163 -4.148 -3.198 650 HA MET 83 HA MET 83 -11.430 -4.120 -0.516 651 HB2 MET 83 2HB MET 83 -8.702 -2.925 -1.067 652 HB3 MET 83 1HB MET 83 -9.575 -2.869 0.464 653 HG2 MET 83 2HG MET 83 -9.561 -5.390 0.472 654 HG3 MET 83 1HG MET 83 -8.503 -5.329 -0.938 655 HE1 MET 83 1HE MET 83 -7.701 -4.263 3.393 656 HE2 MET 83 2HE MET 83 -9.227 -4.552 2.566 657 HE3 MET 83 3HE MET 83 -8.464 -2.969 2.459 658 H THR 84 H THR 84 -12.545 -2.201 -0.109 659 HA THR 84 HA THR 84 -12.474 -0.183 -2.310 660 HB THR 84 HB THR 84 -14.448 -0.426 -0.016 661 HG1 THR 84 1HG THR 84 -15.748 -1.189 -1.933 662 HG21 THR 84 1HG2 THR 84 -15.824 1.060 -1.351 663 HG22 THR 84 2HG2 THR 84 -14.658 1.011 -2.673 664 HG23 THR 84 3HG2 THR 84 -14.234 1.799 -1.152 665 H TRP 85 H TRP 85 -11.619 1.862 -1.867 666 HA TRP 85 HA TRP 85 -10.639 2.266 0.925 667 HB2 TRP 85 2HB TRP 85 -9.787 3.427 -1.733 668 HB3 TRP 85 1HB TRP 85 -9.241 4.095 -0.199 669 HD1 TRP 85 HD TRP 85 -9.593 0.437 0.155 670 HE1 TRP 85 1HE TRP 85 -7.304 -0.717 -0.022 671 HE3 TRP 85 3HE TRP 85 -6.799 4.299 -1.680 672 HZ2 TRP 85 2HZ TRP 85 -4.636 -0.093 -0.832 673 HZ3 TRP 85 3HZ TRP 85 -4.385 3.988 -2.143 674 HH2 TRP 85 HH TRP 85 -3.300 1.799 -1.722 675 H ARG 86 H ARG 86 -11.822 3.621 2.174 676 HA ARG 86 HA ARG 86 -13.304 5.823 0.794 677 HB2 ARG 86 2HB ARG 86 -14.861 4.275 1.845 678 HB3 ARG 86 1HB ARG 86 -13.965 4.349 3.361 679 HG2 ARG 86 2HG ARG 86 -15.963 5.779 3.472 680 HG3 ARG 86 1HG ARG 86 -14.505 6.760 3.558 681 HD2 ARG 86 2HD ARG 86 -14.730 7.453 1.276 682 HD3 ARG 86 1HD ARG 86 -15.964 6.237 0.960 683 HE ARG 86 HE ARG 86 -16.986 7.861 3.005 684 HH11 ARG 86 1HH1 ARG 86 -18.341 9.606 2.524 685 HH12 ARG 86 2HH1 ARG 86 -18.287 10.317 0.945 686 HH21 ARG 86 1HH2 ARG 86 -15.839 8.161 -0.232 687 HH22 ARG 86 2HH2 ARG 86 -16.870 9.499 -0.614 688 H ILE 87 H ILE 87 -12.222 7.707 1.095 689 HA ILE 87 HA ILE 87 -11.352 8.413 3.832 690 HB ILE 87 HB ILE 87 -9.396 7.333 2.634 691 HG12 ILE 87 2HG1 ILE 87 -7.831 9.209 3.222 692 HG13 ILE 87 1HG1 ILE 87 -9.229 10.265 3.412 693 HG21 ILE 87 1HG2 ILE 87 -8.376 8.485 0.794 694 HG22 ILE 87 2HG2 ILE 87 -9.451 9.870 0.982 695 HG23 ILE 87 3HG2 ILE 87 -10.086 8.335 0.396 696 HD11 ILE 87 1HD1 ILE 87 -8.126 8.748 5.424 697 HD12 ILE 87 2HD1 ILE 87 -9.450 7.721 4.875 698 HD13 ILE 87 3HD1 ILE 87 -9.778 9.366 5.421 699 H ASP 88 H ASP 88 -11.161 10.704 4.133 700 HA ASP 88 HA ASP 88 -12.734 12.260 2.191 701 HB2 ASP 88 2HB ASP 88 -13.036 12.488 4.683 702 HB3 ASP 88 1HB ASP 88 -11.424 13.200 4.760 703 H GLY 89 H GLY 89 -11.906 14.063 1.039 704 HA2 GLY 89 2HA GLY 89 -9.235 13.861 0.083 705 HA3 GLY 89 1HA GLY 89 -10.276 15.263 -0.147 706 H HIS 90 H HIS 90 -10.574 15.640 2.804 707 HA HIS 90 HA HIS 90 -8.103 17.186 3.166 708 HB2 HIS 90 2HB HIS 90 -10.689 17.010 4.705 709 HB3 HIS 90 1HB HIS 90 -9.326 17.977 5.249 710 HD1 HIS 90 1HD HIS 90 -8.363 19.138 2.574 711 HD2 HIS 90 2HD HIS 90 -12.377 18.957 3.684 712 HE1 HIS 90 1HE HIS 90 -9.563 20.906 1.211 713 HE2 HIS 90 2HE HIS 90 -12.009 20.803 1.877 714 H TRP 91 H TRP 91 -8.343 14.110 3.469 715 HA TRP 91 HA TRP 91 -7.397 12.481 4.872 716 HB2 TRP 91 2HB TRP 91 -5.824 14.938 5.249 717 HB3 TRP 91 1HB TRP 91 -5.731 13.822 6.611 718 HD1 TRP 91 HD TRP 91 -3.893 14.517 3.666 719 HE1 TRP 91 1HE TRP 91 -2.692 12.441 2.723 720 HE3 TRP 91 3HE TRP 91 -6.400 10.840 6.167 721 HZ2 TRP 91 2HZ TRP 91 -2.788 9.588 2.994 722 HZ3 TRP 91 3HZ TRP 91 -5.827 8.458 5.804 723 HH2 TRP 91 HH TRP 91 -4.026 7.828 4.224 724 H GLN 92 H GLN 92 -9.823 14.103 5.726 725 HA GLN 92 HA GLN 92 -9.606 14.130 8.659 726 HB2 GLN 92 2HB GLN 92 -11.973 14.579 6.810 727 HB3 GLN 92 1HB GLN 92 -11.972 14.862 8.553 728 HG2 GLN 92 2HG GLN 92 -10.296 16.583 8.341 729 HG3 GLN 92 1HG GLN 92 -10.039 16.200 6.649 730 HE21 GLN 92 1HE2 GLN 92 -10.813 18.835 7.498 731 HE22 GLN 92 2HE2 GLN 92 -12.379 19.141 6.922 732 H SER 93 H SER 93 -12.635 13.028 7.584 733 HA SER 93 HA SER 93 -11.996 10.173 7.707 734 HB2 SER 93 2HB SER 93 -12.998 9.656 9.763 735 HB3 SER 93 1HB SER 93 -12.141 11.149 10.129 736 HG SER 93 HG SER 93 -14.482 10.933 10.729 737 H VAL 94 H VAL 94 -13.822 8.880 7.047 738 HA VAL 94 HA VAL 94 -16.230 10.425 6.192 739 HB VAL 94 HB VAL 94 -15.873 8.472 4.233 740 HG11 VAL 94 1HG1 VAL 94 -15.490 10.407 2.768 741 HG12 VAL 94 2HG1 VAL 94 -15.111 11.407 4.170 742 HG13 VAL 94 3HG1 VAL 94 -16.743 10.776 3.951 743 HG21 VAL 94 1HG2 VAL 94 -13.536 8.200 5.056 744 HG22 VAL 94 2HG2 VAL 94 -13.260 9.919 4.763 745 HG23 VAL 94 3HG2 VAL 94 -13.602 8.837 3.414 746 HA PRO 95 HA PRO 95 -17.393 6.715 8.724 747 HB2 PRO 95 2HB PRO 95 -19.847 8.376 8.951 748 HB3 PRO 95 1HB PRO 95 -18.915 7.558 10.218 749 HG2 PRO 95 2HG PRO 95 -18.827 10.206 9.888 750 HG3 PRO 95 1HG PRO 95 -17.414 9.275 10.412 751 HD2 PRO 95 2HD PRO 95 -17.982 10.488 7.742 752 HD3 PRO 95 1HD PRO 95 -16.425 10.244 8.564 753 H ASP 96 H ASP 96 -18.632 8.121 5.828 754 HA ASP 96 HA ASP 96 -20.199 5.629 5.352 755 HB2 ASP 96 2HB ASP 96 -21.148 8.451 4.833 756 HB3 ASP 96 1HB ASP 96 -21.955 7.010 4.222 757 H ASP 97 H ASP 97 -20.400 5.099 3.077 758 HA ASP 97 HA ASP 97 -18.182 6.253 1.481 759 HB2 ASP 97 2HB ASP 97 -18.625 4.293 -0.027 760 HB3 ASP 97 1HB ASP 97 -18.201 3.831 1.621 761 H ASP 98 H ASP 98 -18.928 8.110 0.497 762 HA ASP 98 HA ASP 98 -21.606 8.084 -0.761 763 HB2 ASP 98 2HB ASP 98 -20.746 10.037 0.635 764 HB3 ASP 98 1HB ASP 98 -19.640 10.366 -0.694 765 H ARG 99 H ARG 99 -18.264 8.920 -1.666 766 HA ARG 99 HA ARG 99 -18.895 8.010 -4.439 767 HB2 ARG 99 2HB ARG 99 -17.213 10.379 -3.577 768 HB3 ARG 99 1HB ARG 99 -17.337 9.790 -5.236 769 HG2 ARG 99 2HG ARG 99 -19.807 10.143 -5.132 770 HG3 ARG 99 1HG ARG 99 -19.608 10.841 -3.523 771 HD2 ARG 99 2HD ARG 99 -18.019 12.517 -4.534 772 HD3 ARG 99 1HD ARG 99 -18.462 11.893 -6.123 773 HE ARG 99 HE ARG 99 -20.894 12.508 -4.933 774 HH11 ARG 99 1HH1 ARG 99 -21.870 14.533 -5.161 775 HH12 ARG 99 2HH1 ARG 99 -20.889 15.917 -5.515 776 HH21 ARG 99 1HH2 ARG 99 -17.918 14.128 -5.570 777 HH22 ARG 99 2HH2 ARG 99 -18.652 15.687 -5.747 778 H ALA 100 H ALA 100 -17.625 6.584 -2.136 779 HA ALA 100 HA ALA 100 -14.782 6.509 -2.504 780 HB1 ALA 100 1HB ALA 100 -16.705 5.168 -0.901 781 HB2 ALA 100 2HB ALA 100 -14.948 5.125 -0.743 782 HB3 ALA 100 3HB ALA 100 -15.774 3.928 -1.737 783 H SER 101 H SER 101 -13.503 5.074 -3.725 784 HA SER 101 HA SER 101 -14.916 3.831 -6.040 785 HB2 SER 101 2HB SER 101 -13.204 5.575 -6.540 786 HB3 SER 101 1HB SER 101 -11.988 4.570 -5.755 787 HG SER 101 HG SER 101 -11.877 4.002 -7.853 788 H GLU 102 H GLU 102 -13.935 1.755 -6.831 789 HA GLU 102 HA GLU 102 -13.082 0.098 -4.495 790 HB2 GLU 102 2HB GLU 102 -14.364 -0.770 -7.102 791 HB3 GLU 102 1HB GLU 102 -14.011 -1.808 -5.719 792 HG2 GLU 102 2HG GLU 102 -15.513 -0.396 -4.318 793 HG3 GLU 102 1HG GLU 102 -15.916 0.549 -5.749 794 H ILE 103 H ILE 103 -11.361 -1.343 -4.733 795 HA ILE 103 HA ILE 103 -9.600 -0.841 -7.101 796 HB ILE 103 HB ILE 103 -8.809 -1.623 -4.279 797 HG12 ILE 103 2HG1 ILE 103 -8.449 1.035 -5.694 798 HG13 ILE 103 1HG1 ILE 103 -9.733 0.711 -4.529 799 HG21 ILE 103 1HG2 ILE 103 -6.867 -2.191 -5.257 800 HG22 ILE 103 2HG2 ILE 103 -6.665 -0.498 -5.709 801 HG23 ILE 103 3HG2 ILE 103 -7.436 -1.624 -6.826 802 HD11 ILE 103 1HD1 ILE 103 -7.968 0.067 -2.860 803 HD12 ILE 103 2HD1 ILE 103 -7.896 1.761 -3.349 804 HD13 ILE 103 3HD1 ILE 103 -6.748 0.600 -4.018 805 H GLU 104 H GLU 104 -8.865 -2.660 -8.209 806 HA GLU 104 HA GLU 104 -9.770 -5.299 -7.115 807 HB2 GLU 104 2HB GLU 104 -10.786 -4.603 -9.294 808 HB3 GLU 104 1HB GLU 104 -9.168 -4.583 -9.997 809 HG2 GLU 104 2HG GLU 104 -8.892 -6.977 -9.347 810 HG3 GLU 104 1HG GLU 104 -10.556 -6.981 -8.763 811 H VAL 105 H VAL 105 -8.162 -6.588 -6.426 812 HA VAL 105 HA VAL 105 -5.516 -6.417 -7.780 813 HB VAL 105 HB VAL 105 -5.894 -6.722 -4.788 814 HG11 VAL 105 1HG1 VAL 105 -3.839 -7.723 -5.589 815 HG12 VAL 105 2HG1 VAL 105 -3.434 -6.193 -4.812 816 HG13 VAL 105 3HG1 VAL 105 -3.479 -6.303 -6.571 817 HG21 VAL 105 1HG2 VAL 105 -5.752 -4.338 -6.525 818 HG22 VAL 105 2HG2 VAL 105 -4.617 -4.325 -5.175 819 HG23 VAL 105 3HG2 VAL 105 -6.346 -4.490 -4.872 820 H ASP 106 H ASP 106 -4.786 -8.434 -8.363 821 HA ASP 106 HA ASP 106 -6.144 -10.781 -7.095 822 HB2 ASP 106 2HB ASP 106 -5.077 -10.457 -9.913 823 HB3 ASP 106 1HB ASP 106 -5.708 -11.965 -9.251 824 H PHE 107 H PHE 107 -4.824 -12.264 -6.130 825 HA PHE 107 HA PHE 107 -1.885 -12.008 -6.631 826 HB2 PHE 107 2HB PHE 107 -3.459 -12.261 -4.126 827 HB3 PHE 107 1HB PHE 107 -1.960 -13.189 -4.209 828 HD1 PHE 107 1HD PHE 107 -3.436 -9.817 -4.198 829 HD2 PHE 107 2HD PHE 107 0.202 -12.085 -4.448 830 HE1 PHE 107 1HE PHE 107 -2.123 -7.756 -3.787 831 HE2 PHE 107 2HE PHE 107 1.518 -10.025 -4.037 832 HZ PHE 107 HZ PHE 107 0.360 -7.861 -3.707 833 H VAL 108 H VAL 108 -1.007 -13.760 -7.550 834 HA VAL 108 HA VAL 108 -2.191 -16.433 -6.958 835 HB VAL 108 HB VAL 108 -2.409 -17.005 -9.189 836 HG11 VAL 108 1HG1 VAL 108 -3.471 -15.223 -10.369 837 HG12 VAL 108 2HG1 VAL 108 -2.506 -14.002 -9.537 838 HG13 VAL 108 3HG1 VAL 108 -3.750 -14.893 -8.659 839 HG21 VAL 108 1HG2 VAL 108 -0.151 -16.787 -9.908 840 HG22 VAL 108 2HG2 VAL 108 -0.153 -15.042 -9.644 841 HG23 VAL 108 3HG2 VAL 108 -1.067 -15.734 -10.985 842 HA PRO 109 HA PRO 109 2.027 -17.476 -6.157 843 HB2 PRO 109 2HB PRO 109 2.068 -20.127 -6.922 844 HB3 PRO 109 1HB PRO 109 1.394 -19.541 -5.392 845 HG2 PRO 109 2HG PRO 109 0.007 -20.325 -7.891 846 HG3 PRO 109 1HG PRO 109 -0.485 -20.548 -6.203 847 HD2 PRO 109 2HD PRO 109 -1.534 -18.600 -7.822 848 HD3 PRO 109 1HD PRO 109 -1.412 -18.435 -6.054 849 H ASN 110 H ASN 110 3.678 -16.764 -7.416 850 HA ASN 110 HA ASN 110 3.864 -17.765 -10.220 851 HB2 ASN 110 2HB ASN 110 3.364 -15.326 -10.036 852 HB3 ASN 110 1HB ASN 110 4.874 -15.128 -9.149 853 HD21 ASN 110 1HD2 ASN 110 3.635 -16.357 -12.298 854 HD22 ASN 110 2HD2 ASN 110 5.039 -15.972 -13.170 855 H GLY 111 H GLY 111 5.540 -19.173 -10.403 856 HA2 GLY 111 2HA GLY 111 7.841 -19.793 -10.352 857 HA3 GLY 111 1HA GLY 111 8.153 -18.443 -9.260 858 H SER 112 H SER 112 9.398 -20.557 -8.404 859 HA SER 112 HA SER 112 7.945 -22.532 -6.954 860 HB2 SER 112 2HB SER 112 10.681 -21.427 -6.315 861 HB3 SER 112 1HB SER 112 10.040 -22.982 -5.804 862 HG SER 112 HG SER 112 11.332 -22.426 -8.021 863 H GLY 113 H GLY 113 9.104 -19.310 -5.993 864 HA2 GLY 113 2HA GLY 113 7.235 -19.420 -3.700 865 HA3 GLY 113 1HA GLY 113 8.936 -19.157 -3.325 866 H GLY 114 H GLY 114 6.942 -17.887 -5.993 867 HA2 GLY 114 2HA GLY 114 7.375 -15.158 -4.892 868 HA3 GLY 114 1HA GLY 114 7.773 -15.485 -6.577 869 H THR 115 H THR 115 5.722 -13.630 -5.534 870 HA THR 115 HA THR 115 3.297 -14.922 -6.699 871 HB THR 115 HB THR 115 2.066 -13.208 -5.289 872 HG1 THR 115 1HG THR 115 3.596 -11.794 -4.718 873 HG21 THR 115 1HG2 THR 115 3.508 -15.616 -4.393 874 HG22 THR 115 2HG2 THR 115 1.798 -15.211 -4.261 875 HG23 THR 115 3HG2 THR 115 2.948 -14.561 -3.096 876 H ARG 116 H ARG 116 2.161 -13.769 -8.224 877 HA ARG 116 HA ARG 116 3.338 -11.155 -9.094 878 HB2 ARG 116 2HB ARG 116 3.622 -12.974 -10.773 879 HB3 ARG 116 1HB ARG 116 1.879 -13.242 -10.760 880 HG2 ARG 116 2HG ARG 116 1.555 -10.867 -11.477 881 HG3 ARG 116 1HG ARG 116 3.305 -10.706 -11.612 882 HD2 ARG 116 2HD ARG 116 3.317 -12.589 -13.246 883 HD3 ARG 116 1HD ARG 116 1.559 -12.648 -13.153 884 HE ARG 116 HE ARG 116 1.453 -10.562 -14.340 885 HH11 ARG 116 1HH1 ARG 116 2.410 -9.130 -15.790 886 HH12 ARG 116 2HH1 ARG 116 4.134 -9.118 -15.970 887 HH21 ARG 116 1HH2 ARG 116 4.670 -11.627 -13.646 888 HH22 ARG 116 2HH2 ARG 116 5.407 -10.528 -14.759 889 H VAL 117 H VAL 117 1.912 -9.463 -8.834 890 HA VAL 117 HA VAL 117 -0.986 -10.153 -8.685 891 HB VAL 117 HB VAL 117 -0.717 -9.614 -6.492 892 HG11 VAL 117 1HG1 VAL 117 1.101 -7.822 -5.870 893 HG12 VAL 117 2HG1 VAL 117 1.722 -8.177 -7.482 894 HG13 VAL 117 3HG1 VAL 117 1.593 -9.464 -6.283 895 HG21 VAL 117 1HG2 VAL 117 -2.046 -7.738 -7.619 896 HG22 VAL 117 2HG2 VAL 117 -0.571 -6.771 -7.531 897 HG23 VAL 117 3HG2 VAL 117 -1.338 -7.343 -6.054 898 H GLU 118 H GLU 118 -2.410 -8.848 -9.705 899 HA GLU 118 HA GLU 118 -1.269 -6.624 -11.337 900 HB2 GLU 118 2HB GLU 118 -2.366 -8.458 -12.606 901 HB3 GLU 118 1HB GLU 118 -3.849 -8.187 -11.693 902 HG2 GLU 118 2HG GLU 118 -3.900 -5.840 -12.549 903 HG3 GLU 118 1HG GLU 118 -2.493 -6.206 -13.544 904 H LEU 119 H LEU 119 -1.716 -4.629 -10.514 905 HA LEU 119 HA LEU 119 -4.193 -4.327 -8.876 906 HB2 LEU 119 2HB LEU 119 -1.947 -3.937 -7.751 907 HB3 LEU 119 1HB LEU 119 -1.747 -2.546 -8.811 908 HG LEU 119 HG LEU 119 -4.317 -2.728 -7.302 909 HD11 LEU 119 1HD1 LEU 119 -2.587 -3.374 -5.630 910 HD12 LEU 119 2HD1 LEU 119 -3.311 -1.807 -5.274 911 HD13 LEU 119 3HD1 LEU 119 -1.707 -1.893 -6.002 912 HD21 LEU 119 1HD2 LEU 119 -3.861 -0.265 -7.114 913 HD22 LEU 119 2HD2 LEU 119 -3.916 -0.833 -8.780 914 HD23 LEU 119 3HD2 LEU 119 -2.362 -0.513 -8.008 915 H ALA 120 H ALA 120 -5.759 -3.112 -9.797 916 HA ALA 120 HA ALA 120 -4.936 -0.995 -11.725 917 HB1 ALA 120 1HB ALA 120 -5.733 -2.881 -13.046 918 HB2 ALA 120 2HB ALA 120 -6.922 -1.581 -13.114 919 HB3 ALA 120 3HB ALA 120 -7.200 -2.977 -12.072 920 H HIS 121 H HIS 121 -6.124 0.899 -11.603 921 HA HIS 121 HA HIS 121 -8.303 0.981 -9.550 922 HB2 HIS 121 2HB HIS 121 -7.203 2.635 -8.481 923 HB3 HIS 121 1HB HIS 121 -5.842 2.389 -9.574 924 HD1 HIS 121 1HD HIS 121 -9.277 4.046 -10.005 925 HD2 HIS 121 2HD HIS 121 -5.243 4.810 -10.744 926 HE1 HIS 121 1HE HIS 121 -9.169 6.304 -11.149 927 HE2 HIS 121 2HE HIS 121 -6.720 6.788 -11.581 928 H VAL 122 H VAL 122 -10.206 1.962 -10.217 929 HA VAL 122 HA VAL 122 -10.142 3.485 -12.773 930 HB VAL 122 HB VAL 122 -12.150 2.253 -13.562 931 HG11 VAL 122 1HG1 VAL 122 -9.602 1.550 -13.888 932 HG12 VAL 122 2HG1 VAL 122 -10.910 0.533 -14.495 933 HG13 VAL 122 3HG1 VAL 122 -10.119 0.136 -12.968 934 HG21 VAL 122 1HG2 VAL 122 -12.444 -0.033 -12.326 935 HG22 VAL 122 2HG2 VAL 122 -13.180 1.408 -11.625 936 HG23 VAL 122 3HG2 VAL 122 -11.662 0.788 -10.975 937 H LYS 123 H LYS 123 -11.723 5.071 -12.933 938 HA LYS 123 HA LYS 123 -13.258 6.660 -12.174 939 HB2 LYS 123 2HB LYS 123 -14.374 4.275 -10.675 940 HB3 LYS 123 1HB LYS 123 -15.237 5.767 -11.053 941 HG2 LYS 123 2HG LYS 123 -14.899 5.335 -13.470 942 HG3 LYS 123 1HG LYS 123 -14.091 3.819 -13.074 943 HD2 LYS 123 2HD LYS 123 -16.182 3.106 -11.871 944 HD3 LYS 123 1HD LYS 123 -16.972 4.553 -12.502 945 HE2 LYS 123 2HE LYS 123 -16.107 3.709 -14.819 946 HE3 LYS 123 1HE LYS 123 -15.954 2.153 -14.004 947 HZ1 LYS 123 1HZ LYS 123 -18.232 2.102 -13.533 948 HZ2 LYS 123 2HZ LYS 123 -18.144 2.634 -15.143 949 HZ3 LYS 123 3HZ LYS 123 -18.446 3.745 -13.894 950 H LEU 124 H LEU 124 -10.787 6.196 -10.534 951 HA LEU 124 HA LEU 124 -11.482 6.433 -7.745 952 HB2 LEU 124 2HB LEU 124 -9.212 5.805 -8.536 953 HB3 LEU 124 1HB LEU 124 -9.002 7.436 -9.177 954 HG LEU 124 HG LEU 124 -9.420 8.308 -6.843 955 HD11 LEU 124 1HD1 LEU 124 -9.477 5.343 -6.334 956 HD12 LEU 124 2HD1 LEU 124 -10.523 6.603 -5.679 957 HD13 LEU 124 3HD1 LEU 124 -8.871 6.433 -5.087 958 HD21 LEU 124 1HD2 LEU 124 -7.171 8.396 -6.848 959 HD22 LEU 124 2HD2 LEU 124 -7.105 7.027 -7.960 960 HD23 LEU 124 3HD2 LEU 124 -7.119 6.751 -6.218 961 H HIS 125 H HIS 125 -11.000 8.750 -10.357 962 HA HIS 125 HA HIS 125 -11.023 11.131 -8.807 963 HB2 HIS 125 2HB HIS 125 -10.359 11.249 -11.109 964 HB3 HIS 125 1HB HIS 125 -11.909 10.601 -11.641 965 HD1 HIS 125 1HD HIS 125 -11.750 13.168 -8.916 966 HD2 HIS 125 2HD HIS 125 -12.629 13.018 -12.991 967 HE1 HIS 125 1HE HIS 125 -12.813 15.391 -9.502 968 HE2 HIS 125 2HE HIS 125 -13.343 15.315 -11.982 969 H ARG 126 H ARG 126 -13.594 8.930 -9.525 970 HA ARG 126 HA ARG 126 -15.851 10.555 -9.601 971 HB2 ARG 126 2HB ARG 126 -17.084 8.704 -8.701 972 HB3 ARG 126 1HB ARG 126 -15.776 8.015 -9.659 973 HG2 ARG 126 2HG ARG 126 -14.423 7.861 -7.528 974 HG3 ARG 126 1HG ARG 126 -15.885 8.309 -6.651 975 HD2 ARG 126 2HD ARG 126 -15.539 5.887 -8.439 976 HD3 ARG 126 1HD ARG 126 -15.686 5.879 -6.681 977 HE ARG 126 HE ARG 126 -17.986 7.174 -7.568 978 HH11 ARG 126 1HH1 ARG 126 -19.905 6.051 -7.977 979 HH12 ARG 126 2HH1 ARG 126 -19.840 4.361 -8.355 980 HH21 ARG 126 1HH2 ARG 126 -16.387 4.170 -8.121 981 HH22 ARG 126 2HH2 ARG 126 -17.848 3.297 -8.436 982 H HIS 127 H HIS 127 -13.698 9.907 -6.917 983 HA HIS 127 HA HIS 127 -15.331 10.790 -4.772 984 HB2 HIS 127 2HB HIS 127 -12.741 9.914 -5.022 985 HB3 HIS 127 1HB HIS 127 -12.507 11.618 -4.640 986 HD1 HIS 127 1HD HIS 127 -15.251 11.686 -2.884 987 HD2 HIS 127 2HD HIS 127 -11.989 9.133 -2.367 988 HE1 HIS 127 1HE HIS 127 -15.334 10.893 -0.478 989 HE2 HIS 127 2HE HIS 127 -13.356 9.338 -0.154 990 H GLY 128 H GLY 128 -13.248 12.598 -6.999 991 HA2 GLY 128 2HA GLY 128 -12.975 14.927 -7.272 992 HA3 GLY 128 1HA GLY 128 -14.739 14.890 -7.286 993 H ASP 129 H ASP 129 -13.330 13.811 -4.354 994 HA ASP 129 HA ASP 129 -14.156 16.367 -3.064 995 HB2 ASP 129 2HB ASP 129 -13.731 13.586 -1.935 996 HB3 ASP 129 1HB ASP 129 -14.145 14.997 -0.962 997 H GLY 130 H GLY 130 -11.429 15.266 -4.338 998 HA2 GLY 130 2HA GLY 130 -9.278 16.294 -3.944 999 HA3 GLY 130 1HA GLY 130 -9.766 16.609 -2.277 1000 H ALA 131 H ALA 131 -10.595 13.489 -3.348 1001 HA ALA 131 HA ALA 131 -9.078 12.127 -1.398 1002 HB1 ALA 131 1HB ALA 131 -9.806 10.143 -2.415 1003 HB2 ALA 131 2HB ALA 131 -9.742 10.839 -4.035 1004 HB3 ALA 131 3HB ALA 131 -11.032 11.302 -2.925 1005 H TRP 132 H TRP 132 -8.205 13.091 -4.683 1006 HA TRP 132 HA TRP 132 -5.926 11.480 -5.058 1007 HB2 TRP 132 2HB TRP 132 -6.872 13.058 -6.760 1008 HB3 TRP 132 1HB TRP 132 -6.180 14.396 -5.842 1009 HD1 TRP 132 HD TRP 132 -3.927 15.137 -6.709 1010 HE1 TRP 132 1HE TRP 132 -1.940 14.022 -7.912 1011 HE3 TRP 132 3HE TRP 132 -5.641 10.328 -6.987 1012 HZ2 TRP 132 2HZ TRP 132 -1.176 11.437 -8.865 1013 HZ3 TRP 132 3HZ TRP 132 -4.261 8.565 -8.043 1014 HH2 TRP 132 HH TRP 132 -2.034 9.112 -8.983 1015 H ASN 133 H ASN 133 -6.317 14.433 -3.148 1016 HA ASN 133 HA ASN 133 -3.590 14.936 -2.566 1017 HB2 ASN 133 2HB ASN 133 -5.533 16.395 -1.891 1018 HB3 ASN 133 1HB ASN 133 -5.905 15.225 -0.624 1019 HD21 ASN 133 1HD2 ASN 133 -3.205 17.302 -1.797 1020 HD22 ASN 133 2HD2 ASN 133 -2.518 17.531 -0.262 1021 H ILE 134 H ILE 134 -5.905 12.709 -1.041 1022 HA ILE 134 HA ILE 134 -4.164 11.776 1.029 1023 HB ILE 134 HB ILE 134 -6.556 10.612 -0.365 1024 HG12 ILE 134 2HG1 ILE 134 -7.614 10.964 1.768 1025 HG13 ILE 134 1HG1 ILE 134 -6.063 11.270 2.547 1026 HG21 ILE 134 1HG2 ILE 134 -5.500 8.598 0.065 1027 HG22 ILE 134 2HG2 ILE 134 -6.291 8.869 1.614 1028 HG23 ILE 134 3HG2 ILE 134 -4.583 9.250 1.423 1029 HD11 ILE 134 1HD1 ILE 134 -7.134 12.987 0.298 1030 HD12 ILE 134 2HD1 ILE 134 -5.778 13.340 1.369 1031 HD13 ILE 134 3HD1 ILE 134 -7.425 13.347 1.999 1032 H HIS 135 H HIS 135 -4.705 10.682 -2.311 1033 HA HIS 135 HA HIS 135 -3.089 8.360 -2.243 1034 HB2 HIS 135 2HB HIS 135 -4.528 9.095 -4.175 1035 HB3 HIS 135 1HB HIS 135 -3.309 10.311 -4.553 1036 HD1 HIS 135 1HD HIS 135 -0.715 9.036 -4.529 1037 HD2 HIS 135 2HD HIS 135 -4.071 6.862 -5.716 1038 HE1 HIS 135 1HE HIS 135 0.144 7.075 -5.888 1039 HE2 HIS 135 2HE HIS 135 -1.892 5.746 -6.616 1040 H LYS 136 H LYS 136 -2.227 11.769 -2.718 1041 HA LYS 136 HA LYS 136 0.524 11.414 -3.320 1042 HB2 LYS 136 2HB LYS 136 -0.825 13.619 -1.747 1043 HB3 LYS 136 1HB LYS 136 0.800 13.710 -2.409 1044 HG2 LYS 136 2HG LYS 136 -0.156 13.328 -4.676 1045 HG3 LYS 136 1HG LYS 136 -1.765 13.390 -3.970 1046 HD2 LYS 136 2HD LYS 136 -1.254 15.675 -3.103 1047 HD3 LYS 136 1HD LYS 136 0.294 15.612 -3.948 1048 HE2 LYS 136 2HE LYS 136 -1.350 14.938 -5.983 1049 HE3 LYS 136 1HE LYS 136 -2.450 15.947 -5.043 1050 HZ1 LYS 136 1HZ LYS 136 0.213 17.022 -5.334 1051 HZ2 LYS 136 2HZ LYS 136 -1.295 17.784 -5.513 1052 HZ3 LYS 136 3HZ LYS 136 -0.639 16.881 -6.793 1053 H ALA 137 H ALA 137 -1.209 11.534 -0.246 1054 HA ALA 137 HA ALA 137 1.182 11.383 1.378 1055 HB1 ALA 137 1HB ALA 137 -0.532 12.244 2.643 1056 HB2 ALA 137 2HB ALA 137 -0.716 10.544 3.075 1057 HB3 ALA 137 3HB ALA 137 -1.755 11.259 1.841 1058 H LEU 138 H LEU 138 -0.937 9.026 -0.127 1059 HA LEU 138 HA LEU 138 0.184 6.808 1.434 1060 HB2 LEU 138 2HB LEU 138 -1.654 6.793 -0.974 1061 HB3 LEU 138 1HB LEU 138 -1.275 5.406 0.035 1062 HG LEU 138 HG LEU 138 -2.656 7.940 0.951 1063 HD11 LEU 138 1HD1 LEU 138 -4.592 6.415 1.276 1064 HD12 LEU 138 2HD1 LEU 138 -3.658 5.103 0.557 1065 HD13 LEU 138 3HD1 LEU 138 -4.104 6.505 -0.417 1066 HD21 LEU 138 1HD2 LEU 138 -1.594 7.237 2.875 1067 HD22 LEU 138 2HD2 LEU 138 -1.508 5.561 2.334 1068 HD23 LEU 138 3HD2 LEU 138 -3.027 6.211 2.951 1069 H ASP 139 H ASP 139 1.234 8.628 -1.158 1070 HA ASP 139 HA ASP 139 3.146 6.504 -1.912 1071 HB2 ASP 139 2HB ASP 139 1.055 6.547 -3.461 1072 HB3 ASP 139 1HB ASP 139 1.751 8.043 -4.085 1073 H GLY 140 H GLY 140 3.807 8.218 -4.308 1074 HA2 GLY 140 2HA GLY 140 4.477 10.853 -3.741 1075 HA3 GLY 140 1HA GLY 140 5.770 9.908 -3.000 1076 HA PRO 141 HA PRO 141 7.830 8.936 -6.782 1077 HB2 PRO 141 2HB PRO 141 6.725 6.190 -7.024 1078 HB3 PRO 141 1HB PRO 141 8.411 6.720 -6.897 1079 HG2 PRO 141 2HG PRO 141 7.137 5.532 -4.867 1080 HG3 PRO 141 1HG PRO 141 8.362 6.786 -4.613 1081 HD2 PRO 141 2HD PRO 141 5.390 6.982 -4.370 1082 HD3 PRO 141 1HD PRO 141 6.657 7.834 -3.460 1083 H SER 142 H SER 142 7.503 9.093 -9.030 1084 HA SER 142 HA SER 142 4.654 9.076 -9.889 1085 HB2 SER 142 2HB SER 142 5.181 10.983 -10.953 1086 HB3 SER 142 1HB SER 142 6.828 10.856 -10.342 1087 HG SER 142 HG SER 142 5.739 10.051 -12.796 1088 HA PRO 143 HA PRO 143 7.235 6.685 -13.384 1089 HB2 PRO 143 2HB PRO 143 9.142 5.433 -11.457 1090 HB3 PRO 143 1HB PRO 143 9.405 5.938 -13.135 1091 HG2 PRO 143 2HG PRO 143 10.347 7.374 -11.116 1092 HG3 PRO 143 1HG PRO 143 9.688 8.153 -12.567 1093 HD2 PRO 143 2HD PRO 143 8.472 7.893 -9.850 1094 HD3 PRO 143 1HD PRO 143 8.312 9.209 -11.036 1095 H GLY 144 H GLY 144 7.514 5.039 -10.225 1096 HA2 GLY 144 2HA GLY 144 6.090 2.709 -11.318 1097 HA3 GLY 144 1HA GLY 144 6.817 2.816 -9.716 1098 H GLU 145 H GLU 145 4.466 1.721 -9.561 1099 HA GLU 145 HA GLU 145 2.531 3.895 -8.863 1100 HB2 GLU 145 2HB GLU 145 1.979 1.015 -9.654 1101 HB3 GLU 145 1HB GLU 145 0.753 2.201 -9.204 1102 HG2 GLU 145 2HG GLU 145 2.676 2.492 -11.531 1103 HG3 GLU 145 1HG GLU 145 0.987 2.005 -11.668 1104 H THR 146 H THR 146 0.807 2.168 -7.351 1105 HA THR 146 HA THR 146 2.024 2.286 -4.783 1106 HB THR 146 HB THR 146 -0.251 0.536 -5.740 1107 HG1 THR 146 1HG THR 146 -1.516 2.196 -5.189 1108 HG21 THR 146 1HG2 THR 146 0.886 1.116 -3.020 1109 HG22 THR 146 2HG2 THR 146 0.386 -0.431 -3.705 1110 HG23 THR 146 3HG2 THR 146 -0.828 0.746 -3.205 1111 H LEU 147 H LEU 147 1.770 -0.319 -7.141 1112 HA LEU 147 HA LEU 147 2.839 -2.411 -5.552 1113 HB2 LEU 147 2HB LEU 147 3.090 -1.973 -8.538 1114 HB3 LEU 147 1HB LEU 147 3.324 -3.501 -7.690 1115 HG LEU 147 HG LEU 147 0.753 -1.901 -7.699 1116 HD11 LEU 147 1HD1 LEU 147 1.710 -4.304 -9.252 1117 HD12 LEU 147 2HD1 LEU 147 0.936 -2.839 -9.859 1118 HD13 LEU 147 3HD1 LEU 147 -0.009 -4.030 -8.964 1119 HD21 LEU 147 1HD2 LEU 147 0.102 -4.396 -6.869 1120 HD22 LEU 147 2HD2 LEU 147 0.533 -3.100 -5.753 1121 HD23 LEU 147 3HD2 LEU 147 1.743 -4.292 -6.231 1122 H ALA 148 H ALA 148 4.372 0.247 -7.249 1123 HA ALA 148 HA ALA 148 7.015 -0.768 -7.414 1124 HB1 ALA 148 1HB ALA 148 6.815 2.088 -6.722 1125 HB2 ALA 148 2HB ALA 148 5.790 1.602 -8.073 1126 HB3 ALA 148 3HB ALA 148 7.531 1.323 -8.139 1127 H ARG 149 H ARG 149 5.681 1.369 -4.859 1128 HA ARG 149 HA ARG 149 7.967 1.052 -3.149 1129 HB2 ARG 149 2HB ARG 149 5.131 1.891 -2.531 1130 HB3 ARG 149 1HB ARG 149 6.474 2.020 -1.401 1131 HG2 ARG 149 2HG ARG 149 7.682 3.436 -3.074 1132 HG3 ARG 149 1HG ARG 149 6.241 3.395 -4.091 1133 HD2 ARG 149 2HD ARG 149 6.150 5.432 -2.803 1134 HD3 ARG 149 1HD ARG 149 4.943 4.334 -2.135 1135 HE ARG 149 HE ARG 149 7.506 4.101 -0.784 1136 HH11 ARG 149 1HH1 ARG 149 7.574 4.869 1.341 1137 HH12 ARG 149 2HH1 ARG 149 6.311 5.906 1.914 1138 HH21 ARG 149 1HH2 ARG 149 4.571 5.884 -1.085 1139 HH22 ARG 149 2HH2 ARG 149 4.611 6.480 0.540 1140 H PHE 150 H PHE 150 4.819 -0.571 -3.296 1141 HA PHE 150 HA PHE 150 5.144 -2.164 -0.939 1142 HB2 PHE 150 2HB PHE 150 2.974 -1.841 -2.069 1143 HB3 PHE 150 1HB PHE 150 3.569 -2.731 -3.464 1144 HD1 PHE 150 1HD PHE 150 2.829 -3.044 0.177 1145 HD2 PHE 150 2HD PHE 150 3.523 -5.088 -3.538 1146 HE1 PHE 150 1HE PHE 150 2.132 -5.184 1.221 1147 HE2 PHE 150 2HE PHE 150 2.829 -7.226 -2.495 1148 HZ PHE 150 HZ PHE 150 2.137 -7.273 -0.118 1149 H ALA 151 H ALA 151 6.008 -2.784 -4.346 1150 HA ALA 151 HA ALA 151 6.868 -5.492 -3.879 1151 HB1 ALA 151 1HB ALA 151 8.249 -4.995 -6.038 1152 HB2 ALA 151 2HB ALA 151 7.371 -3.466 -6.049 1153 HB3 ALA 151 3HB ALA 151 6.488 -4.990 -6.142 1154 H ASN 152 H ASN 152 8.548 -2.368 -3.767 1155 HA ASN 152 HA ASN 152 11.189 -3.422 -3.498 1156 HB2 ASN 152 2HB ASN 152 10.012 -0.828 -2.497 1157 HB3 ASN 152 1HB ASN 152 11.736 -1.193 -2.526 1158 HD21 ASN 152 1HD2 ASN 152 10.663 0.978 -4.057 1159 HD22 ASN 152 2HD2 ASN 152 10.811 0.598 -5.704 1160 H VAL 153 H VAL 153 8.898 -2.337 -0.967 1161 HA VAL 153 HA VAL 153 10.633 -3.155 1.186 1162 HB VAL 153 HB VAL 153 8.796 -2.666 2.634 1163 HG11 VAL 153 1HG1 VAL 153 7.960 -0.483 1.701 1164 HG12 VAL 153 2HG1 VAL 153 8.747 -0.902 0.179 1165 HG13 VAL 153 3HG1 VAL 153 9.712 -0.673 1.637 1166 HG21 VAL 153 1HG2 VAL 153 6.876 -3.708 1.968 1167 HG22 VAL 153 2HG2 VAL 153 7.207 -3.431 0.260 1168 HG23 VAL 153 3HG2 VAL 153 6.539 -2.134 1.245 1169 H ILE 154 H ILE 154 8.189 -4.765 -0.733 1170 HA ILE 154 HA ILE 154 8.065 -7.095 1.035 1171 HB ILE 154 HB ILE 154 6.909 -6.443 -1.671 1172 HG12 ILE 154 2HG1 ILE 154 6.109 -5.497 0.671 1173 HG13 ILE 154 1HG1 ILE 154 4.936 -6.015 -0.536 1174 HG21 ILE 154 1HG2 ILE 154 5.524 -8.570 -1.137 1175 HG22 ILE 154 2HG2 ILE 154 6.887 -8.995 -0.097 1176 HG23 ILE 154 3HG2 ILE 154 7.137 -8.755 -1.826 1177 HD11 ILE 154 1HD1 ILE 154 4.494 -8.038 0.575 1178 HD12 ILE 154 2HD1 ILE 154 4.680 -6.897 1.906 1179 HD13 ILE 154 3HD1 ILE 154 6.006 -7.978 1.480 Start of MODEL 11 1 H1 MET 1 1HT MET 1 3.783 13.474 -5.360 2 H2 MET 1 2HT MET 1 2.158 13.626 -4.891 3 H3 MET 1 3HT MET 1 3.199 14.967 -4.806 4 HA MET 1 HA MET 1 1.537 14.703 -6.786 5 HB2 MET 1 2HB MET 1 3.364 16.453 -6.368 6 HB3 MET 1 1HB MET 1 4.414 15.437 -7.358 7 HG2 MET 1 2HG MET 1 2.821 15.586 -9.226 8 HG3 MET 1 1HG MET 1 1.746 16.579 -8.241 9 HE1 MET 1 1HE MET 1 3.266 16.972 -11.119 10 HE2 MET 1 2HE MET 1 3.594 18.702 -11.126 11 HE3 MET 1 3HE MET 1 2.022 18.113 -10.590 12 HA PRO 2 HA PRO 2 3.248 10.882 -8.661 13 HB2 PRO 2 2HB PRO 2 0.900 9.465 -8.649 14 HB3 PRO 2 1HB PRO 2 2.035 9.492 -7.289 15 HG2 PRO 2 2HG PRO 2 -0.603 10.681 -7.507 16 HG3 PRO 2 1HG PRO 2 0.396 10.418 -6.073 17 HD2 PRO 2 2HD PRO 2 0.007 12.879 -7.579 18 HD3 PRO 2 1HD PRO 2 0.870 12.647 -6.040 19 H GLU 3 H GLU 3 2.523 9.791 -10.759 20 HA GLU 3 HA GLU 3 2.024 11.563 -12.827 21 HB2 GLU 3 2HB GLU 3 0.950 8.736 -12.657 22 HB3 GLU 3 1HB GLU 3 1.207 9.651 -14.139 23 HG2 GLU 3 2HG GLU 3 3.378 8.893 -12.158 24 HG3 GLU 3 1HG GLU 3 3.078 8.080 -13.695 25 H GLU 4 H GLU 4 0.049 12.238 -13.927 26 HA GLU 4 HA GLU 4 -2.027 13.133 -12.294 27 HB2 GLU 4 2HB GLU 4 -2.256 12.302 -15.203 28 HB3 GLU 4 1HB GLU 4 -3.396 13.335 -14.340 29 HG2 GLU 4 2HG GLU 4 -1.561 14.952 -13.897 30 HG3 GLU 4 1HG GLU 4 -0.466 13.938 -14.837 31 H ILE 5 H ILE 5 -4.199 12.329 -11.925 32 HA ILE 5 HA ILE 5 -4.434 9.766 -10.955 33 HB ILE 5 HB ILE 5 -6.784 10.929 -12.416 34 HG12 ILE 5 2HG1 ILE 5 -5.229 12.150 -10.160 35 HG13 ILE 5 1HG1 ILE 5 -6.032 12.937 -11.513 36 HG21 ILE 5 1HG2 ILE 5 -8.016 10.024 -10.608 37 HG22 ILE 5 2HG2 ILE 5 -6.584 9.897 -9.586 38 HG23 ILE 5 3HG2 ILE 5 -6.790 8.804 -10.956 39 HD11 ILE 5 1HD1 ILE 5 -7.461 13.441 -9.725 40 HD12 ILE 5 2HD1 ILE 5 -7.233 11.862 -8.975 41 HD13 ILE 5 3HD1 ILE 5 -8.222 12.014 -10.425 42 HA PRO 6 HA PRO 6 -4.266 7.688 -15.026 43 HB2 PRO 6 2HB PRO 6 -3.047 5.426 -14.241 44 HB3 PRO 6 1HB PRO 6 -2.156 6.956 -14.378 45 HG2 PRO 6 2HG PRO 6 -3.141 5.554 -11.957 46 HG3 PRO 6 1HG PRO 6 -1.671 6.512 -12.191 47 HD2 PRO 6 2HD PRO 6 -4.056 7.421 -10.995 48 HD3 PRO 6 1HD PRO 6 -2.712 8.437 -11.554 49 H ASP 7 H ASP 7 -5.396 5.872 -15.943 50 HA ASP 7 HA ASP 7 -7.758 5.042 -14.448 51 HB2 ASP 7 2HB ASP 7 -8.364 3.880 -16.519 52 HB3 ASP 7 1HB ASP 7 -7.830 5.518 -16.886 53 H VAL 8 H VAL 8 -7.291 2.369 -16.137 54 HA VAL 8 HA VAL 8 -6.771 0.656 -13.961 55 HB VAL 8 HB VAL 8 -6.068 0.156 -16.872 56 HG11 VAL 8 1HG1 VAL 8 -7.062 -2.092 -15.327 57 HG12 VAL 8 2HG1 VAL 8 -5.622 -1.403 -14.580 58 HG13 VAL 8 3HG1 VAL 8 -5.569 -1.953 -16.253 59 HG21 VAL 8 1HG2 VAL 8 -8.643 -0.349 -15.344 60 HG22 VAL 8 2HG2 VAL 8 -8.337 -0.802 -17.021 61 HG23 VAL 8 3HG2 VAL 8 -8.411 0.900 -16.567 62 H ARG 9 H ARG 9 -4.892 -0.037 -12.970 63 HA ARG 9 HA ARG 9 -2.411 1.344 -13.766 64 HB2 ARG 9 2HB ARG 9 -3.097 -0.339 -11.347 65 HB3 ARG 9 1HB ARG 9 -1.524 0.410 -11.614 66 HG2 ARG 9 2HG ARG 9 -2.661 2.629 -11.780 67 HG3 ARG 9 1HG ARG 9 -4.184 1.841 -11.370 68 HD2 ARG 9 2HD ARG 9 -3.098 1.009 -9.256 69 HD3 ARG 9 1HD ARG 9 -1.698 2.007 -9.647 70 HE ARG 9 HE ARG 9 -4.086 3.606 -9.708 71 HH11 ARG 9 1HH1 ARG 9 -4.439 5.010 -7.973 72 HH12 ARG 9 2HH1 ARG 9 -3.592 4.755 -6.483 73 HH21 ARG 9 1HH2 ARG 9 -1.887 1.960 -7.624 74 HH22 ARG 9 2HH2 ARG 9 -2.148 3.028 -6.286 75 H LYS 10 H LYS 10 -0.606 -0.659 -12.684 76 HA LYS 10 HA LYS 10 -0.779 -2.688 -14.870 77 HB2 LYS 10 2HB LYS 10 1.599 -1.268 -13.662 78 HB3 LYS 10 1HB LYS 10 1.740 -2.664 -14.723 79 HG2 LYS 10 2HG LYS 10 0.466 -1.446 -16.466 80 HG3 LYS 10 1HG LYS 10 0.413 -0.033 -15.412 81 HD2 LYS 10 2HD LYS 10 2.909 -0.021 -15.368 82 HD3 LYS 10 1HD LYS 10 2.906 -1.356 -16.521 83 HE2 LYS 10 2HE LYS 10 1.169 0.640 -17.559 84 HE3 LYS 10 1HE LYS 10 2.648 1.454 -17.048 85 HZ1 LYS 10 1HZ LYS 10 2.316 -0.713 -19.017 86 HZ2 LYS 10 2HZ LYS 10 3.810 -0.480 -18.242 87 HZ3 LYS 10 3HZ LYS 10 3.134 0.763 -19.183 88 H SER 11 H SER 11 1.126 -4.410 -14.230 89 HA SER 11 HA SER 11 0.457 -5.371 -11.472 90 HB2 SER 11 2HB SER 11 0.465 -7.637 -12.310 91 HB3 SER 11 1HB SER 11 -0.593 -6.692 -13.350 92 HG SER 11 HG SER 11 1.621 -8.049 -13.984 93 H VAL 12 H VAL 12 2.171 -6.466 -10.364 94 HA VAL 12 HA VAL 12 4.835 -6.425 -11.669 95 HB VAL 12 HB VAL 12 4.108 -5.009 -9.116 96 HG11 VAL 12 1HG1 VAL 12 6.021 -6.194 -8.425 97 HG12 VAL 12 2HG1 VAL 12 6.692 -4.681 -9.033 98 HG13 VAL 12 3HG1 VAL 12 6.746 -6.133 -10.031 99 HG21 VAL 12 1HG2 VAL 12 5.370 -3.175 -10.223 100 HG22 VAL 12 2HG2 VAL 12 4.000 -3.710 -11.196 101 HG23 VAL 12 3HG2 VAL 12 5.634 -4.226 -11.614 102 H VAL 13 H VAL 13 6.357 -7.871 -10.661 103 HA VAL 13 HA VAL 13 4.998 -10.015 -9.100 104 HB VAL 13 HB VAL 13 7.682 -10.073 -10.516 105 HG11 VAL 13 1HG1 VAL 13 7.943 -11.970 -9.321 106 HG12 VAL 13 2HG1 VAL 13 6.611 -12.647 -10.257 107 HG13 VAL 13 3HG1 VAL 13 6.294 -11.879 -8.702 108 HG21 VAL 13 1HG2 VAL 13 6.633 -10.773 -12.424 109 HG22 VAL 13 2HG2 VAL 13 5.261 -9.892 -11.754 110 HG23 VAL 13 3HG2 VAL 13 5.379 -11.637 -11.536 111 H VAL 14 H VAL 14 5.580 -10.391 -6.997 112 HA VAL 14 HA VAL 14 7.976 -8.936 -5.953 113 HB VAL 14 HB VAL 14 5.504 -9.556 -4.360 114 HG11 VAL 14 1HG1 VAL 14 7.564 -9.160 -3.089 115 HG12 VAL 14 2HG1 VAL 14 6.436 -7.823 -2.866 116 HG13 VAL 14 3HG1 VAL 14 7.813 -7.643 -3.953 117 HG21 VAL 14 1HG2 VAL 14 6.132 -7.275 -6.190 118 HG22 VAL 14 2HG2 VAL 14 5.287 -6.921 -4.683 119 HG23 VAL 14 3HG2 VAL 14 4.579 -8.037 -5.850 120 H ALA 15 H ALA 15 9.156 -10.011 -4.302 121 HA ALA 15 HA ALA 15 9.005 -12.940 -4.478 122 HB1 ALA 15 1HB ALA 15 11.045 -11.027 -3.948 123 HB2 ALA 15 2HB ALA 15 11.216 -12.775 -4.104 124 HB3 ALA 15 3HB ALA 15 10.908 -12.057 -2.523 125 H ALA 16 H ALA 16 7.135 -13.521 -3.334 126 HA ALA 16 HA ALA 16 7.390 -13.752 -0.479 127 HB1 ALA 16 1HB ALA 16 5.156 -12.370 -0.144 128 HB2 ALA 16 2HB ALA 16 5.714 -11.523 -1.588 129 HB3 ALA 16 3HB ALA 16 6.717 -11.547 -0.139 130 H SER 17 H SER 17 5.958 -15.338 0.260 131 HA SER 17 HA SER 17 4.624 -16.959 -1.692 132 HB2 SER 17 2HB SER 17 4.220 -16.892 1.313 133 HB3 SER 17 1HB SER 17 3.733 -18.197 0.236 134 HG SER 17 HG SER 17 6.247 -17.461 1.160 135 H VAL 18 H VAL 18 2.308 -17.307 -1.928 136 HA VAL 18 HA VAL 18 0.779 -14.923 -2.126 137 HB VAL 18 HB VAL 18 -0.719 -17.460 -1.740 138 HG11 VAL 18 1HG1 VAL 18 -0.705 -15.901 -4.276 139 HG12 VAL 18 2HG1 VAL 18 -1.337 -15.087 -2.847 140 HG13 VAL 18 3HG1 VAL 18 -2.062 -16.597 -3.393 141 HG21 VAL 18 1HG2 VAL 18 1.548 -17.148 -3.687 142 HG22 VAL 18 2HG2 VAL 18 0.119 -18.064 -4.162 143 HG23 VAL 18 3HG2 VAL 18 1.063 -18.570 -2.761 144 H GLU 19 H GLU 19 0.826 -17.459 0.359 145 HA GLU 19 HA GLU 19 -1.280 -16.493 1.984 146 HB2 GLU 19 2HB GLU 19 -0.061 -18.666 2.305 147 HB3 GLU 19 1HB GLU 19 1.304 -17.753 2.951 148 HG2 GLU 19 2HG GLU 19 -0.203 -16.798 4.689 149 HG3 GLU 19 1HG GLU 19 -1.509 -17.815 4.081 150 H HIS 20 H HIS 20 2.120 -15.539 1.786 151 HA HIS 20 HA HIS 20 2.187 -13.798 4.031 152 HB2 HIS 20 2HB HIS 20 4.153 -14.628 2.658 153 HB3 HIS 20 1HB HIS 20 3.702 -13.441 1.434 154 HD1 HIS 20 1HD HIS 20 4.202 -13.382 5.220 155 HD2 HIS 20 2HD HIS 20 5.083 -11.091 1.846 156 HE1 HIS 20 1HE HIS 20 5.485 -11.364 6.038 157 HE2 HIS 20 2HE HIS 20 6.030 -9.965 3.996 158 H CYS 21 H CYS 21 1.237 -13.254 0.649 159 HA CYS 21 HA CYS 21 1.011 -10.462 0.646 160 HB2 CYS 21 2HB CYS 21 -0.743 -12.541 -0.698 161 HB3 CYS 21 1HB CYS 21 -0.785 -10.821 -1.074 162 HG CYS 21 HG CYS 21 0.929 -12.201 -2.655 163 H PHE 22 H PHE 22 -1.677 -12.743 1.324 164 HA PHE 22 HA PHE 22 -3.416 -10.635 2.242 165 HB2 PHE 22 2HB PHE 22 -3.717 -13.511 3.068 166 HB3 PHE 22 1HB PHE 22 -4.973 -12.335 2.671 167 HD1 PHE 22 1HD PHE 22 -2.606 -14.765 1.377 168 HD2 PHE 22 2HD PHE 22 -5.323 -11.627 0.287 169 HE1 PHE 22 1HE PHE 22 -2.535 -15.528 -0.975 170 HE2 PHE 22 2HE PHE 22 -5.256 -12.389 -2.073 171 HZ PHE 22 HZ PHE 22 -3.857 -14.344 -2.704 172 H GLU 23 H GLU 23 -1.223 -12.866 3.898 173 HA GLU 23 HA GLU 23 -2.080 -12.123 6.555 174 HB2 GLU 23 2HB GLU 23 0.494 -13.366 5.542 175 HB3 GLU 23 1HB GLU 23 0.124 -13.138 7.251 176 HG2 GLU 23 2HG GLU 23 -1.573 -14.728 5.303 177 HG3 GLU 23 1HG GLU 23 -0.457 -15.423 6.479 178 H VAL 24 H VAL 24 0.299 -10.842 4.290 179 HA VAL 24 HA VAL 24 1.776 -9.210 6.054 180 HB VAL 24 HB VAL 24 1.004 -8.899 3.151 181 HG11 VAL 24 1HG1 VAL 24 2.861 -7.132 3.180 182 HG12 VAL 24 2HG1 VAL 24 2.636 -7.087 4.928 183 HG13 VAL 24 3HG1 VAL 24 1.305 -6.655 3.856 184 HG21 VAL 24 1HG2 VAL 24 3.820 -9.096 3.938 185 HG22 VAL 24 2HG2 VAL 24 2.918 -10.037 2.750 186 HG23 VAL 24 3HG2 VAL 24 2.867 -10.487 4.456 187 H PHE 25 H PHE 25 -1.262 -8.498 4.310 188 HA PHE 25 HA PHE 25 -1.456 -5.816 5.386 189 HB2 PHE 25 2HB PHE 25 -3.871 -7.372 4.532 190 HB3 PHE 25 1HB PHE 25 -3.486 -5.674 4.260 191 HD1 PHE 25 1HD PHE 25 -4.046 -8.461 2.500 192 HD2 PHE 25 2HD PHE 25 -0.855 -5.653 3.102 193 HE1 PHE 25 1HE PHE 25 -3.117 -9.040 0.271 194 HE2 PHE 25 2HE PHE 25 0.077 -6.230 0.876 195 HZ PHE 25 HZ PHE 25 -1.055 -7.925 -0.540 196 H THR 26 H THR 26 -2.880 -8.945 6.328 197 HA THR 26 HA THR 26 -4.213 -7.623 8.614 198 HB THR 26 HB THR 26 -5.393 -9.733 8.889 199 HG1 THR 26 1HG THR 26 -3.650 -10.632 6.845 200 HG21 THR 26 1HG2 THR 26 -6.410 -8.354 7.250 201 HG22 THR 26 2HG2 THR 26 -6.304 -9.944 6.496 202 HG23 THR 26 3HG2 THR 26 -5.143 -8.688 6.069 203 H SER 27 H SER 27 -1.194 -9.063 8.139 204 HA SER 27 HA SER 27 -1.165 -10.169 10.910 205 HB2 SER 27 2HB SER 27 -0.307 -11.566 8.980 206 HB3 SER 27 1HB SER 27 1.019 -10.413 8.847 207 HG SER 27 HG SER 27 1.673 -10.950 10.892 208 H ARG 28 H ARG 28 1.231 -8.396 8.901 209 HA ARG 28 HA ARG 28 1.618 -6.541 11.198 210 HB2 ARG 28 2HB ARG 28 4.066 -6.834 11.064 211 HB3 ARG 28 1HB ARG 28 3.261 -8.347 11.487 212 HG2 ARG 28 2HG ARG 28 3.346 -8.181 8.641 213 HG3 ARG 28 1HG ARG 28 4.959 -7.819 9.246 214 HD2 ARG 28 2HD ARG 28 3.297 -10.273 9.817 215 HD3 ARG 28 1HD ARG 28 4.847 -10.200 8.980 216 HE ARG 28 HE ARG 28 5.010 -9.161 11.690 217 HH11 ARG 28 1HH1 ARG 28 6.181 -10.419 13.159 218 HH12 ARG 28 2HH1 ARG 28 6.548 -12.065 12.769 219 HH21 ARG 28 1HH2 ARG 28 4.960 -11.967 9.688 220 HH22 ARG 28 2HH2 ARG 28 5.857 -12.943 10.803 221 HA PRO 29 HA PRO 29 1.730 -4.601 6.889 222 HB2 PRO 29 2HB PRO 29 -0.089 -2.614 7.521 223 HB3 PRO 29 1HB PRO 29 -0.507 -4.145 6.733 224 HG2 PRO 29 2HG PRO 29 -0.800 -3.337 9.574 225 HG3 PRO 29 1HG PRO 29 -1.844 -4.359 8.573 226 HD2 PRO 29 2HD PRO 29 -0.139 -5.377 10.440 227 HD3 PRO 29 1HD PRO 29 -0.586 -6.263 8.965 228 H ALA 30 H ALA 30 1.921 -3.433 10.177 229 HA ALA 30 HA ALA 30 3.003 -0.822 9.563 230 HB1 ALA 30 1HB ALA 30 3.787 -0.978 12.006 231 HB2 ALA 30 2HB ALA 30 2.977 -2.544 12.044 232 HB3 ALA 30 3HB ALA 30 2.049 -1.080 11.725 233 H ASP 31 H ASP 31 4.311 -3.956 9.370 234 HA ASP 31 HA ASP 31 6.987 -3.617 10.183 235 HB2 ASP 31 2HB ASP 31 5.939 -5.758 9.369 236 HB3 ASP 31 1HB ASP 31 6.086 -5.140 7.724 237 H TRP 32 H TRP 32 5.349 -2.441 7.302 238 HA TRP 32 HA TRP 32 7.900 -1.089 6.505 239 HB2 TRP 32 2HB TRP 32 6.621 -1.092 4.169 240 HB3 TRP 32 1HB TRP 32 7.594 -2.472 4.676 241 HD1 TRP 32 HD TRP 32 6.324 -4.641 5.507 242 HE1 TRP 32 1HE TRP 32 3.909 -5.466 5.177 243 HE3 TRP 32 3HE TRP 32 4.148 -0.323 3.920 244 HZ2 TRP 32 2HZ TRP 32 1.386 -4.426 4.345 245 HZ3 TRP 32 3HZ TRP 32 1.734 -0.261 3.358 246 HH2 TRP 32 HH TRP 32 0.349 -2.307 3.569 247 H TRP 33 H TRP 33 5.613 -0.248 8.266 248 HA TRP 33 HA TRP 33 3.921 1.609 6.976 249 HB2 TRP 33 2HB TRP 33 3.198 1.892 9.087 250 HB3 TRP 33 1HB TRP 33 4.528 0.880 9.643 251 HD1 TRP 33 HD TRP 33 4.011 4.596 8.628 252 HE1 TRP 33 1HE TRP 33 5.448 6.054 10.194 253 HE3 TRP 33 3HE TRP 33 6.236 0.955 11.443 254 HZ2 TRP 33 2HZ TRP 33 7.290 5.725 12.357 255 HZ3 TRP 33 3HZ TRP 33 7.820 1.558 13.250 256 HH2 TRP 33 HH TRP 33 8.350 3.935 13.711 257 HA PRO 34 HA PRO 34 7.457 4.864 7.905 258 HB2 PRO 34 2HB PRO 34 9.867 3.189 7.619 259 HB3 PRO 34 1HB PRO 34 9.463 4.386 8.862 260 HG2 PRO 34 2HG PRO 34 9.479 1.767 9.383 261 HG3 PRO 34 1HG PRO 34 8.317 2.870 10.143 262 HD2 PRO 34 2HD PRO 34 7.895 0.974 7.852 263 HD3 PRO 34 1HD PRO 34 6.814 1.339 9.215 264 HA PRO 35 HA PRO 35 8.235 4.579 3.398 265 HB2 PRO 35 2HB PRO 35 7.021 6.832 2.645 266 HB3 PRO 35 1HB PRO 35 6.057 5.446 3.196 267 HG2 PRO 35 2HG PRO 35 6.724 7.966 4.610 268 HG3 PRO 35 1HG PRO 35 5.254 6.982 4.685 269 HD2 PRO 35 2HD PRO 35 7.416 6.934 6.537 270 HD3 PRO 35 1HD PRO 35 6.049 5.806 6.463 271 H SER 36 H SER 36 9.487 6.097 1.894 272 HA SER 36 HA SER 36 11.785 7.194 3.176 273 HB2 SER 36 2HB SER 36 12.366 8.102 1.007 274 HB3 SER 36 1HB SER 36 11.627 6.524 0.748 275 HG SER 36 HG SER 36 9.599 7.834 0.569 276 H HIS 37 H HIS 37 8.697 8.603 2.238 277 HA HIS 37 HA HIS 37 9.374 11.008 3.850 278 HB2 HIS 37 2HB HIS 37 8.237 11.054 1.036 279 HB3 HIS 37 1HB HIS 37 8.318 12.455 2.103 280 HD1 HIS 37 1HD HIS 37 10.450 10.196 0.010 281 HD2 HIS 37 2HD HIS 37 10.959 13.477 2.537 282 HE1 HIS 37 1HE HIS 37 12.822 11.015 -0.346 283 HE2 HIS 37 2HE HIS 37 13.141 13.010 1.187 284 H VAL 38 H VAL 38 7.564 11.808 4.987 285 HA VAL 38 HA VAL 38 4.938 10.513 4.387 286 HB VAL 38 HB VAL 38 6.085 9.354 6.293 287 HG11 VAL 38 1HG1 VAL 38 5.584 11.723 8.026 288 HG12 VAL 38 2HG1 VAL 38 7.011 11.779 6.992 289 HG13 VAL 38 3HG1 VAL 38 6.820 10.473 8.160 290 HG21 VAL 38 1HG2 VAL 38 3.999 10.437 7.880 291 HG22 VAL 38 2HG2 VAL 38 3.952 8.967 6.906 292 HG23 VAL 38 3HG2 VAL 38 3.445 10.505 6.206 293 H LEU 39 H LEU 39 3.229 11.922 4.474 294 HA LEU 39 HA LEU 39 3.827 14.710 5.347 295 HB2 LEU 39 2HB LEU 39 1.512 13.694 3.670 296 HB3 LEU 39 1HB LEU 39 1.928 15.381 3.970 297 HG LEU 39 HG LEU 39 3.590 13.346 2.457 298 HD11 LEU 39 1HD1 LEU 39 2.853 15.955 1.278 299 HD12 LEU 39 2HD1 LEU 39 1.500 14.859 1.559 300 HD13 LEU 39 3HD1 LEU 39 2.852 14.350 0.548 301 HD21 LEU 39 1HD2 LEU 39 5.222 14.641 3.525 302 HD22 LEU 39 2HD2 LEU 39 4.207 16.083 3.541 303 HD23 LEU 39 3HD2 LEU 39 4.960 15.550 2.037 304 H VAL 40 H VAL 40 2.502 11.953 6.562 305 HA VAL 40 HA VAL 40 0.039 12.850 7.719 306 HB VAL 40 HB VAL 40 1.958 10.797 8.833 307 HG11 VAL 40 1HG1 VAL 40 0.112 11.572 10.334 308 HG12 VAL 40 2HG1 VAL 40 -0.023 9.869 9.897 309 HG13 VAL 40 3HG1 VAL 40 -1.047 11.065 9.105 310 HG21 VAL 40 1HG2 VAL 40 -0.412 10.216 7.064 311 HG22 VAL 40 2HG2 VAL 40 0.972 9.183 7.425 312 HG23 VAL 40 3HG2 VAL 40 1.163 10.575 6.359 313 H LYS 41 H LYS 41 -0.370 13.825 9.736 314 HA LYS 41 HA LYS 41 1.533 15.663 10.736 315 HB2 LYS 41 2HB LYS 41 -0.934 15.762 11.160 316 HB3 LYS 41 1HB LYS 41 -0.745 14.424 12.290 317 HG2 LYS 41 2HG LYS 41 0.862 15.780 13.607 318 HG3 LYS 41 1HG LYS 41 0.603 17.129 12.502 319 HD2 LYS 41 2HD LYS 41 -1.841 17.046 13.065 320 HD3 LYS 41 1HD LYS 41 -1.473 15.824 14.282 321 HE2 LYS 41 2HE LYS 41 -0.069 17.360 15.505 322 HE3 LYS 41 1HE LYS 41 -0.179 18.562 14.218 323 HZ1 LYS 41 1HZ LYS 41 -2.504 18.819 14.637 324 HZ2 LYS 41 2HZ LYS 41 -1.677 19.002 16.110 325 HZ3 LYS 41 3HZ LYS 41 -2.501 17.556 15.768 326 H LYS 42 H LYS 42 0.721 12.373 11.844 327 HA LYS 42 HA LYS 42 3.296 12.386 13.347 328 HB2 LYS 42 2HB LYS 42 1.173 12.564 14.806 329 HB3 LYS 42 1HB LYS 42 0.843 10.907 14.301 330 HG2 LYS 42 2HG LYS 42 2.057 10.735 16.350 331 HG3 LYS 42 1HG LYS 42 3.201 10.333 15.069 332 HD2 LYS 42 2HD LYS 42 3.252 13.174 15.469 333 HD3 LYS 42 1HD LYS 42 3.424 12.384 17.034 334 HE2 LYS 42 2HE LYS 42 5.045 11.606 14.601 335 HE3 LYS 42 1HE LYS 42 5.603 12.765 15.807 336 HZ1 LYS 42 1HZ LYS 42 4.889 10.795 17.398 337 HZ2 LYS 42 2HZ LYS 42 6.441 10.886 16.711 338 HZ3 LYS 42 3HZ LYS 42 5.261 9.877 16.022 339 H GLU 43 H GLU 43 4.520 10.541 13.039 340 HA GLU 43 HA GLU 43 4.078 8.922 10.774 341 HB2 GLU 43 2HB GLU 43 5.706 8.309 13.245 342 HB3 GLU 43 1HB GLU 43 5.832 7.441 11.717 343 HG2 GLU 43 2HG GLU 43 6.419 9.576 10.584 344 HG3 GLU 43 1HG GLU 43 6.372 10.395 12.146 345 H ARG 44 H ARG 44 2.991 7.033 10.423 346 HA ARG 44 HA ARG 44 1.108 6.100 12.460 347 HB2 ARG 44 2HB ARG 44 0.509 6.148 10.050 348 HB3 ARG 44 1HB ARG 44 1.778 4.968 9.721 349 HG2 ARG 44 2HG ARG 44 0.652 3.373 11.275 350 HG3 ARG 44 1HG ARG 44 -0.651 4.544 11.487 351 HD2 ARG 44 2HD ARG 44 -1.317 2.938 9.786 352 HD3 ARG 44 1HD ARG 44 -1.026 4.495 9.010 353 HE ARG 44 HE ARG 44 1.388 2.958 8.960 354 HH11 ARG 44 1HH1 ARG 44 1.968 1.958 7.019 355 HH12 ARG 44 2HH1 ARG 44 0.764 1.696 5.800 356 HH21 ARG 44 1HH2 ARG 44 -1.799 3.120 7.654 357 HH22 ARG 44 2HH2 ARG 44 -1.368 2.354 6.160 358 H ALA 45 H ALA 45 1.271 4.137 13.620 359 HA ALA 45 HA ALA 45 3.747 2.532 13.145 360 HB1 ALA 45 1HB ALA 45 2.827 2.766 15.947 361 HB2 ALA 45 2HB ALA 45 3.544 4.220 15.254 362 HB3 ALA 45 3HB ALA 45 4.465 2.716 15.297 363 H GLY 46 H GLY 46 0.371 2.621 14.106 364 HA2 GLY 46 2HA GLY 46 0.357 -0.352 13.858 365 HA3 GLY 46 1HA GLY 46 -0.391 0.385 15.273 366 H LEU 47 H LEU 47 -1.667 -1.206 13.145 367 HA LEU 47 HA LEU 47 -3.892 0.621 12.659 368 HB2 LEU 47 2HB LEU 47 -3.918 0.296 10.210 369 HB3 LEU 47 1HB LEU 47 -2.453 1.128 10.728 370 HG LEU 47 HG LEU 47 -2.025 -1.724 10.812 371 HD11 LEU 47 1HD1 LEU 47 -3.704 -1.985 9.118 372 HD12 LEU 47 2HD1 LEU 47 -2.152 -2.023 8.285 373 HD13 LEU 47 3HD1 LEU 47 -3.135 -0.562 8.245 374 HD21 LEU 47 1HD2 LEU 47 -0.095 -1.150 9.502 375 HD22 LEU 47 2HD2 LEU 47 -0.364 0.204 10.599 376 HD23 LEU 47 3HD2 LEU 47 -0.856 0.326 8.910 377 H ALA 48 H ALA 48 -5.835 -0.499 12.260 378 HA ALA 48 HA ALA 48 -5.685 -3.442 11.914 379 HB1 ALA 48 1HB ALA 48 -7.465 -3.587 13.801 380 HB2 ALA 48 2HB ALA 48 -6.858 -2.007 14.295 381 HB3 ALA 48 3HB ALA 48 -5.777 -3.401 14.273 382 H PHE 49 H PHE 49 -7.481 -4.249 10.808 383 HA PHE 49 HA PHE 49 -9.827 -2.483 10.437 384 HB2 PHE 49 2HB PHE 49 -9.707 -2.705 7.972 385 HB3 PHE 49 1HB PHE 49 -8.311 -1.838 8.616 386 HD1 PHE 49 1HD PHE 49 -9.487 -4.876 6.960 387 HD2 PHE 49 2HD PHE 49 -6.113 -2.973 8.816 388 HE1 PHE 49 1HE PHE 49 -7.979 -6.556 5.937 389 HE2 PHE 49 2HE PHE 49 -4.604 -4.651 7.795 390 HZ PHE 49 HZ PHE 49 -5.534 -6.443 6.354 391 H GLU 50 H GLU 50 -11.704 -3.630 9.798 392 HA GLU 50 HA GLU 50 -11.574 -6.527 10.308 393 HB2 GLU 50 2HB GLU 50 -14.065 -5.039 9.515 394 HB3 GLU 50 1HB GLU 50 -13.902 -6.429 10.586 395 HG2 GLU 50 2HG GLU 50 -12.364 -4.582 11.889 396 HG3 GLU 50 1HG GLU 50 -13.610 -3.552 11.183 397 HA PRO 51 HA PRO 51 -11.359 -6.901 5.777 398 HB2 PRO 51 2HB PRO 51 -10.736 -9.543 5.666 399 HB3 PRO 51 1HB PRO 51 -9.546 -8.284 6.048 400 HG2 PRO 51 2HG PRO 51 -10.938 -10.182 7.851 401 HG3 PRO 51 1HG PRO 51 -9.291 -9.536 7.938 402 HD2 PRO 51 2HD PRO 51 -11.428 -8.629 9.468 403 HD3 PRO 51 1HD PRO 51 -9.948 -7.701 9.146 404 H PHE 52 H PHE 52 -13.618 -6.618 5.383 405 HA PHE 52 HA PHE 52 -15.010 -9.067 4.607 406 HB2 PHE 52 2HB PHE 52 -16.290 -7.272 6.696 407 HB3 PHE 52 1HB PHE 52 -16.965 -8.754 6.015 408 HD1 PHE 52 1HD PHE 52 -15.792 -10.957 6.443 409 HD2 PHE 52 2HD PHE 52 -14.753 -7.335 8.502 410 HE1 PHE 52 1HE PHE 52 -14.617 -12.282 8.180 411 HE2 PHE 52 2HE PHE 52 -13.582 -8.656 10.238 412 HZ PHE 52 HZ PHE 52 -13.508 -11.131 10.078 413 H VAL 53 H VAL 53 -17.341 -8.290 3.761 414 HA VAL 53 HA VAL 53 -16.770 -6.049 1.962 415 HB VAL 53 HB VAL 53 -19.410 -7.496 2.354 416 HG11 VAL 53 1HG1 VAL 53 -18.248 -5.647 0.290 417 HG12 VAL 53 2HG1 VAL 53 -19.860 -5.651 1.007 418 HG13 VAL 53 3HG1 VAL 53 -19.432 -6.858 -0.203 419 HG21 VAL 53 1HG2 VAL 53 -17.821 -8.304 0.044 420 HG22 VAL 53 2HG2 VAL 53 -18.606 -9.305 1.265 421 HG23 VAL 53 3HG2 VAL 53 -16.994 -8.657 1.560 422 H GLY 54 H GLY 54 -17.171 -3.953 2.527 423 HA2 GLY 54 2HA GLY 54 -18.342 -2.128 3.486 424 HA3 GLY 54 1HA GLY 54 -19.542 -3.268 4.103 425 H GLY 55 H GLY 55 -16.250 -4.054 4.708 426 HA2 GLY 55 2HA GLY 55 -16.631 -3.934 7.577 427 HA3 GLY 55 1HA GLY 55 -15.116 -4.305 6.751 428 H ARG 56 H ARG 56 -14.651 -2.765 8.822 429 HA ARG 56 HA ARG 56 -14.575 0.043 7.774 430 HB2 ARG 56 2HB ARG 56 -14.594 -0.959 10.637 431 HB3 ARG 56 1HB ARG 56 -14.405 0.730 10.165 432 HG2 ARG 56 2HG ARG 56 -16.601 0.597 8.977 433 HG3 ARG 56 1HG ARG 56 -16.799 -1.042 9.598 434 HD2 ARG 56 2HD ARG 56 -16.512 1.479 11.260 435 HD3 ARG 56 1HD ARG 56 -17.983 0.530 11.050 436 HE ARG 56 HE ARG 56 -15.698 -0.182 12.754 437 HH11 ARG 56 1HH1 ARG 56 -16.028 -2.011 14.040 438 HH12 ARG 56 2HH1 ARG 56 -17.382 -3.044 13.723 439 HH21 ARG 56 1HH2 ARG 56 -18.538 -1.153 11.055 440 HH22 ARG 56 2HH2 ARG 56 -18.802 -2.558 12.033 441 H TYR 57 H TYR 57 -12.571 0.963 7.549 442 HA TYR 57 HA TYR 57 -10.239 -0.601 8.590 443 HB2 TYR 57 2HB TYR 57 -10.643 -0.405 6.019 444 HB3 TYR 57 1HB TYR 57 -10.085 1.256 6.225 445 HD1 TYR 57 1HD TYR 57 -7.859 1.539 7.622 446 HD2 TYR 57 2HD TYR 57 -9.066 -2.093 5.671 447 HE1 TYR 57 1HE TYR 57 -5.508 0.749 7.639 448 HE2 TYR 57 2HE TYR 57 -6.715 -2.884 5.690 449 HH TYR 57 HH TYR 57 -4.080 -0.788 6.708 450 H TYR 58 H TYR 58 -8.938 0.484 9.970 451 HA TYR 58 HA TYR 58 -8.847 3.439 9.843 452 HB2 TYR 58 2HB TYR 58 -9.186 3.593 12.303 453 HB3 TYR 58 1HB TYR 58 -10.611 2.982 11.462 454 HD1 TYR 58 1HD TYR 58 -8.301 2.375 14.095 455 HD2 TYR 58 2HD TYR 58 -10.778 0.390 11.209 456 HE1 TYR 58 1HE TYR 58 -8.238 0.308 15.462 457 HE2 TYR 58 2HE TYR 58 -10.713 -1.683 12.572 458 HH TYR 58 HH TYR 58 -10.303 -2.376 14.838 459 H GLU 59 H GLU 59 -6.968 4.309 10.993 460 HA GLU 59 HA GLU 59 -4.851 2.246 11.457 461 HB2 GLU 59 2HB GLU 59 -4.559 5.004 10.236 462 HB3 GLU 59 1HB GLU 59 -3.236 3.884 10.554 463 HG2 GLU 59 2HG GLU 59 -4.295 2.224 9.047 464 HG3 GLU 59 1HG GLU 59 -5.582 3.379 8.703 465 H TRP 60 H TRP 60 -3.275 2.785 13.118 466 HA TRP 60 HA TRP 60 -4.333 4.778 15.080 467 HB2 TRP 60 2HB TRP 60 -2.417 2.453 15.411 468 HB3 TRP 60 1HB TRP 60 -2.724 3.647 16.669 469 HD1 TRP 60 HD TRP 60 -5.652 3.984 16.889 470 HE1 TRP 60 1HE TRP 60 -7.276 2.049 17.413 471 HE3 TRP 60 3HE TRP 60 -2.785 0.012 15.451 472 HZ2 TRP 60 2HZ TRP 60 -7.342 -0.808 17.250 473 HZ3 TRP 60 3HZ TRP 60 -3.648 -2.302 15.649 474 HH2 TRP 60 HH TRP 60 -5.921 -2.716 16.546 475 H ASP 61 H ASP 61 -3.165 6.613 15.432 476 HA ASP 61 HA ASP 61 -0.500 6.811 14.109 477 HB2 ASP 61 2HB ASP 61 -2.428 8.896 15.139 478 HB3 ASP 61 1HB ASP 61 -0.821 9.287 14.530 479 H ILE 62 H ILE 62 1.316 7.606 15.355 480 HA ILE 62 HA ILE 62 1.514 6.562 17.961 481 HB ILE 62 HB ILE 62 3.131 8.784 16.724 482 HG12 ILE 62 2HG1 ILE 62 3.762 5.848 16.980 483 HG13 ILE 62 1HG1 ILE 62 3.058 6.559 15.536 484 HG21 ILE 62 1HG2 ILE 62 3.708 8.929 18.967 485 HG22 ILE 62 2HG2 ILE 62 4.835 7.692 18.408 486 HG23 ILE 62 3HG2 ILE 62 3.365 7.224 19.260 487 HD11 ILE 62 1HD1 ILE 62 5.018 8.185 15.526 488 HD12 ILE 62 2HD1 ILE 62 5.422 6.508 15.160 489 HD13 ILE 62 3HD1 ILE 62 5.752 7.164 16.763 490 H ASP 63 H ASP 63 0.671 9.848 16.926 491 HA ASP 63 HA ASP 63 -0.071 10.421 19.772 492 HB2 ASP 63 2HB ASP 63 0.976 12.291 17.634 493 HB3 ASP 63 1HB ASP 63 0.294 12.842 19.165 494 H GLY 64 H GLY 64 -1.334 9.769 16.779 495 HA2 GLY 64 2HA GLY 64 -3.707 11.522 17.244 496 HA3 GLY 64 1HA GLY 64 -3.250 10.895 15.663 497 H THR 65 H THR 65 -5.780 10.557 17.126 498 HA THR 65 HA THR 65 -5.960 7.883 18.167 499 HB THR 65 HB THR 65 -7.560 9.800 18.623 500 HG1 THR 65 1HG THR 65 -9.423 8.180 18.153 501 HG21 THR 65 1HG2 THR 65 -7.691 9.949 15.914 502 HG22 THR 65 2HG2 THR 65 -8.927 10.597 16.993 503 HG23 THR 65 3HG2 THR 65 -9.139 9.006 16.261 504 H GLU 66 H GLU 66 -8.434 7.281 16.632 505 HA GLU 66 HA GLU 66 -7.134 5.805 14.438 506 HB2 GLU 66 2HB GLU 66 -9.933 5.738 15.592 507 HB3 GLU 66 1HB GLU 66 -9.376 4.698 14.287 508 HG2 GLU 66 2HG GLU 66 -7.614 3.798 15.747 509 HG3 GLU 66 1HG GLU 66 -8.174 4.829 17.064 510 H ILE 67 H ILE 67 -7.416 6.277 12.299 511 HA ILE 67 HA ILE 67 -9.536 8.248 11.554 512 HB ILE 67 HB ILE 67 -6.725 8.144 10.417 513 HG12 ILE 67 2HG1 ILE 67 -8.086 10.169 12.222 514 HG13 ILE 67 1HG1 ILE 67 -6.752 9.105 12.675 515 HG21 ILE 67 1HG2 ILE 67 -8.516 8.807 8.805 516 HG22 ILE 67 2HG2 ILE 67 -7.407 10.127 9.157 517 HG23 ILE 67 3HG2 ILE 67 -8.999 10.090 9.913 518 HD11 ILE 67 1HD1 ILE 67 -5.812 10.313 10.374 519 HD12 ILE 67 2HD1 ILE 67 -5.395 10.794 12.021 520 HD13 ILE 67 3HD1 ILE 67 -6.700 11.616 11.164 521 H VAL 68 H VAL 68 -10.555 7.804 9.549 522 HA VAL 68 HA VAL 68 -10.428 5.051 8.667 523 HB VAL 68 HB VAL 68 -11.689 7.427 7.261 524 HG11 VAL 68 1HG1 VAL 68 -13.069 5.771 6.164 525 HG12 VAL 68 2HG1 VAL 68 -12.387 4.479 7.151 526 HG13 VAL 68 3HG1 VAL 68 -11.385 5.293 5.950 527 HG21 VAL 68 1HG2 VAL 68 -12.548 7.280 9.534 528 HG22 VAL 68 2HG2 VAL 68 -12.775 5.539 9.374 529 HG23 VAL 68 3HG2 VAL 68 -13.770 6.647 8.432 530 H TRP 69 H TRP 69 -9.000 4.206 7.237 531 HA TRP 69 HA TRP 69 -7.386 6.098 5.577 532 HB2 TRP 69 2HB TRP 69 -5.854 4.865 6.831 533 HB3 TRP 69 1HB TRP 69 -6.851 3.413 6.806 534 HD1 TRP 69 HD TRP 69 -4.103 5.169 4.958 535 HE1 TRP 69 1HE TRP 69 -3.363 3.742 2.942 536 HE3 TRP 69 3HE TRP 69 -7.835 1.681 4.924 537 HZ2 TRP 69 2HZ TRP 69 -4.235 1.427 1.508 538 HZ3 TRP 69 3HZ TRP 69 -7.857 -0.122 3.225 539 HH2 TRP 69 HH TRP 69 -6.063 -0.256 1.517 540 H GLY 70 H GLY 70 -9.932 3.930 5.399 541 HA2 GLY 70 2HA GLY 70 -10.479 4.103 2.708 542 HA3 GLY 70 1HA GLY 70 -9.340 2.757 2.797 543 H ARG 71 H ARG 71 -10.803 1.062 2.377 544 HA ARG 71 HA ARG 71 -12.444 0.250 4.635 545 HB2 ARG 71 2HB ARG 71 -13.784 1.919 3.000 546 HB3 ARG 71 1HB ARG 71 -14.050 0.410 2.131 547 HG2 ARG 71 2HG ARG 71 -14.852 -0.627 4.260 548 HG3 ARG 71 1HG ARG 71 -14.696 0.944 5.041 549 HD2 ARG 71 2HD ARG 71 -16.276 1.898 3.369 550 HD3 ARG 71 1HD ARG 71 -16.482 0.286 2.682 551 HE ARG 71 HE ARG 71 -17.039 0.509 5.566 552 HH11 ARG 71 1HH1 ARG 71 -19.158 -0.018 6.142 553 HH12 ARG 71 2HH1 ARG 71 -20.362 -0.181 4.908 554 HH21 ARG 71 1HH2 ARG 71 -18.181 0.534 2.310 555 HH22 ARG 71 2HH2 ARG 71 -19.808 0.130 2.740 556 H ILE 72 H ILE 72 -14.027 -1.624 3.095 557 HA ILE 72 HA ILE 72 -11.938 -3.234 1.715 558 HB ILE 72 HB ILE 72 -13.835 -4.235 3.861 559 HG12 ILE 72 2HG1 ILE 72 -11.320 -4.938 4.621 560 HG13 ILE 72 1HG1 ILE 72 -10.979 -3.429 3.777 561 HG21 ILE 72 1HG2 ILE 72 -13.633 -5.945 2.185 562 HG22 ILE 72 2HG2 ILE 72 -12.533 -6.389 3.490 563 HG23 ILE 72 3HG2 ILE 72 -11.901 -5.658 2.014 564 HD11 ILE 72 1HD1 ILE 72 -11.448 -3.071 6.196 565 HD12 ILE 72 2HD1 ILE 72 -13.056 -3.751 5.961 566 HD13 ILE 72 3HD1 ILE 72 -12.611 -2.246 5.159 567 H LEU 73 H LEU 73 -12.917 -4.939 0.314 568 HA LEU 73 HA LEU 73 -15.692 -4.206 -0.538 569 HB2 LEU 73 2HB LEU 73 -13.888 -3.514 -2.157 570 HB3 LEU 73 1HB LEU 73 -13.461 -5.216 -2.324 571 HG LEU 73 HG LEU 73 -16.028 -5.514 -2.840 572 HD11 LEU 73 1HD1 LEU 73 -16.693 -3.220 -2.329 573 HD12 LEU 73 2HD1 LEU 73 -16.918 -3.520 -4.051 574 HD13 LEU 73 3HD1 LEU 73 -15.525 -2.595 -3.492 575 HD21 LEU 73 1HD2 LEU 73 -14.631 -6.108 -4.593 576 HD22 LEU 73 2HD2 LEU 73 -13.797 -4.554 -4.592 577 HD23 LEU 73 3HD2 LEU 73 -15.410 -4.688 -5.293 578 H GLU 74 H GLU 74 -13.268 -6.822 -0.701 579 HA GLU 74 HA GLU 74 -15.041 -8.782 0.406 580 HB2 GLU 74 2HB GLU 74 -16.135 -8.469 -1.825 581 HB3 GLU 74 1HB GLU 74 -14.632 -8.995 -2.580 582 HG2 GLU 74 2HG GLU 74 -14.778 -11.135 -1.316 583 HG3 GLU 74 1HG GLU 74 -16.335 -10.614 -0.668 584 H TRP 75 H TRP 75 -13.855 -10.584 0.993 585 HA TRP 75 HA TRP 75 -11.017 -10.623 0.087 586 HB2 TRP 75 2HB TRP 75 -10.843 -10.542 2.382 587 HB3 TRP 75 1HB TRP 75 -12.403 -11.324 2.631 588 HD1 TRP 75 HD TRP 75 -8.723 -12.055 2.172 589 HE1 TRP 75 1HE TRP 75 -8.306 -14.576 2.526 590 HE3 TRP 75 3HE TRP 75 -13.543 -13.726 2.372 591 HZ2 TRP 75 2HZ TRP 75 -9.820 -16.983 2.849 592 HZ3 TRP 75 3HZ TRP 75 -14.028 -16.131 2.700 593 HH2 TRP 75 HH TRP 75 -12.175 -17.762 2.940 594 H ASP 76 H ASP 76 -10.397 -12.279 -1.215 595 HA ASP 76 HA ASP 76 -12.168 -14.680 -1.346 596 HB2 ASP 76 2HB ASP 76 -11.587 -12.956 -3.392 597 HB3 ASP 76 1HB ASP 76 -10.354 -14.199 -3.614 598 HA PRO 77 HA PRO 77 -8.819 -16.994 0.582 599 HB2 PRO 77 2HB PRO 77 -9.628 -18.888 -1.618 600 HB3 PRO 77 1HB PRO 77 -9.248 -19.246 0.078 601 HG2 PRO 77 2HG PRO 77 -11.766 -19.060 -0.785 602 HG3 PRO 77 1HG PRO 77 -11.284 -18.530 0.835 603 HD2 PRO 77 2HD PRO 77 -12.144 -16.907 -1.462 604 HD3 PRO 77 1HD PRO 77 -12.035 -16.449 0.252 605 HA PRO 78 HA PRO 78 -4.961 -16.272 -1.421 606 HB2 PRO 78 2HB PRO 78 -4.885 -19.248 -1.807 607 HB3 PRO 78 1HB PRO 78 -3.601 -18.158 -1.249 608 HG2 PRO 78 2HG PRO 78 -5.184 -19.654 0.412 609 HG3 PRO 78 1HG PRO 78 -4.349 -18.168 0.888 610 HD2 PRO 78 2HD PRO 78 -7.191 -18.597 0.701 611 HD3 PRO 78 1HD PRO 78 -6.348 -17.101 1.150 612 H HIS 79 H HIS 79 -6.251 -15.316 -3.219 613 HA HIS 79 HA HIS 79 -5.523 -16.326 -5.772 614 HB2 HIS 79 2HB HIS 79 -7.198 -18.080 -5.309 615 HB3 HIS 79 1HB HIS 79 -8.412 -16.843 -4.998 616 HD1 HIS 79 1HD HIS 79 -9.436 -15.635 -7.020 617 HD2 HIS 79 2HD HIS 79 -6.437 -18.334 -8.075 618 HE1 HIS 79 1HE HIS 79 -9.537 -15.871 -9.542 619 HE2 HIS 79 2HE HIS 79 -7.716 -17.512 -10.194 620 H ARG 80 H ARG 80 -8.201 -14.571 -4.099 621 HA ARG 80 HA ARG 80 -7.601 -12.279 -5.900 622 HB2 ARG 80 2HB ARG 80 -9.703 -13.902 -6.449 623 HB3 ARG 80 1HB ARG 80 -10.473 -12.748 -5.367 624 HG2 ARG 80 2HG ARG 80 -8.820 -11.967 -7.785 625 HG3 ARG 80 1HG ARG 80 -10.579 -12.077 -7.782 626 HD2 ARG 80 2HD ARG 80 -8.836 -10.183 -6.206 627 HD3 ARG 80 1HD ARG 80 -10.088 -9.782 -7.378 628 HE ARG 80 HE ARG 80 -10.523 -10.447 -4.570 629 HH11 ARG 80 1HH1 ARG 80 -12.676 -10.376 -3.886 630 HH12 ARG 80 2HH1 ARG 80 -13.945 -10.337 -5.065 631 HH21 ARG 80 1HH2 ARG 80 -11.786 -10.410 -7.778 632 HH22 ARG 80 2HH2 ARG 80 -13.440 -10.356 -7.268 633 H LEU 81 H LEU 81 -7.598 -10.360 -4.857 634 HA LEU 81 HA LEU 81 -8.915 -10.207 -2.172 635 HB2 LEU 81 2HB LEU 81 -6.405 -10.331 -2.026 636 HB3 LEU 81 1HB LEU 81 -6.322 -8.850 -2.980 637 HG LEU 81 HG LEU 81 -7.929 -7.879 -1.161 638 HD11 LEU 81 1HD1 LEU 81 -8.276 -9.063 0.739 639 HD12 LEU 81 2HD1 LEU 81 -6.604 -9.621 0.798 640 HD13 LEU 81 3HD1 LEU 81 -7.779 -10.464 -0.210 641 HD21 LEU 81 1HD2 LEU 81 -5.939 -6.786 -1.006 642 HD22 LEU 81 2HD2 LEU 81 -5.006 -8.270 -1.203 643 HD23 LEU 81 3HD2 LEU 81 -5.656 -7.840 0.379 644 H ALA 82 H ALA 82 -10.411 -8.579 -2.101 645 HA ALA 82 HA ALA 82 -10.081 -6.293 -4.010 646 HB1 ALA 82 1HB ALA 82 -11.975 -8.046 -4.464 647 HB2 ALA 82 2HB ALA 82 -12.357 -6.327 -4.553 648 HB3 ALA 82 3HB ALA 82 -12.787 -7.252 -3.114 649 H MET 83 H MET 83 -10.483 -4.241 -3.123 650 HA MET 83 HA MET 83 -11.513 -4.151 -0.334 651 HB2 MET 83 2HB MET 83 -8.953 -2.798 -1.221 652 HB3 MET 83 1HB MET 83 -9.667 -2.729 0.389 653 HG2 MET 83 2HG MET 83 -9.460 -5.243 0.494 654 HG3 MET 83 1HG MET 83 -8.545 -5.165 -1.011 655 HE1 MET 83 1HE MET 83 -8.363 -2.637 2.266 656 HE2 MET 83 2HE MET 83 -7.442 -3.832 3.175 657 HE3 MET 83 3HE MET 83 -9.011 -4.266 2.504 658 H THR 84 H THR 84 -12.717 -2.307 0.097 659 HA THR 84 HA THR 84 -13.006 -0.376 -2.161 660 HB THR 84 HB THR 84 -14.739 -0.728 0.312 661 HG1 THR 84 1HG THR 84 -15.882 -1.393 -2.015 662 HG21 THR 84 1HG2 THR 84 -16.145 0.433 -1.839 663 HG22 THR 84 2HG2 THR 84 -14.596 1.273 -1.764 664 HG23 THR 84 3HG2 THR 84 -15.643 1.223 -0.345 665 H TRP 85 H TRP 85 -12.325 1.772 -1.835 666 HA TRP 85 HA TRP 85 -10.981 2.266 0.776 667 HB2 TRP 85 2HB TRP 85 -10.632 3.377 -1.993 668 HB3 TRP 85 1HB TRP 85 -10.021 4.261 -0.595 669 HD1 TRP 85 HD TRP 85 -10.037 0.440 -1.114 670 HE1 TRP 85 1HE TRP 85 -7.608 -0.407 -0.953 671 HE3 TRP 85 3HE TRP 85 -7.583 4.892 -0.649 672 HZ2 TRP 85 2HZ TRP 85 -4.972 0.664 -0.670 673 HZ3 TRP 85 3HZ TRP 85 -5.114 4.951 -0.437 674 HH2 TRP 85 HH TRP 85 -3.807 2.844 -0.447 675 H ARG 86 H ARG 86 -12.036 3.489 2.231 676 HA ARG 86 HA ARG 86 -13.908 5.596 1.214 677 HB2 ARG 86 2HB ARG 86 -15.023 3.805 2.534 678 HB3 ARG 86 1HB ARG 86 -13.948 4.157 3.887 679 HG2 ARG 86 2HG ARG 86 -14.799 6.494 3.923 680 HG3 ARG 86 1HG ARG 86 -15.925 6.082 2.629 681 HD2 ARG 86 2HD ARG 86 -15.832 4.692 5.322 682 HD3 ARG 86 1HD ARG 86 -16.971 5.971 4.899 683 HE ARG 86 HE ARG 86 -17.084 3.859 2.947 684 HH11 ARG 86 1HH1 ARG 86 -18.900 2.513 3.005 685 HH12 ARG 86 2HH1 ARG 86 -19.860 2.438 4.445 686 HH21 ARG 86 1HH2 ARG 86 -17.908 4.715 6.184 687 HH22 ARG 86 2HH2 ARG 86 -19.299 3.684 6.244 688 H ILE 87 H ILE 87 -12.438 7.326 1.148 689 HA ILE 87 HA ILE 87 -11.423 8.206 3.801 690 HB ILE 87 HB ILE 87 -9.593 7.020 2.510 691 HG12 ILE 87 2HG1 ILE 87 -8.990 9.964 2.804 692 HG13 ILE 87 1HG1 ILE 87 -9.313 8.955 4.215 693 HG21 ILE 87 1HG2 ILE 87 -9.566 9.464 0.751 694 HG22 ILE 87 2HG2 ILE 87 -10.515 8.048 0.298 695 HG23 ILE 87 3HG2 ILE 87 -8.767 7.912 0.498 696 HD11 ILE 87 1HD1 ILE 87 -6.845 9.263 3.014 697 HD12 ILE 87 2HD1 ILE 87 -7.417 7.738 2.337 698 HD13 ILE 87 3HD1 ILE 87 -7.296 7.936 4.085 699 H ASP 88 H ASP 88 -10.876 10.546 3.807 700 HA ASP 88 HA ASP 88 -12.606 12.016 1.868 701 HB2 ASP 88 2HB ASP 88 -13.072 12.251 4.331 702 HB3 ASP 88 1HB ASP 88 -11.483 12.997 4.508 703 H GLY 89 H GLY 89 -11.782 13.850 0.786 704 HA2 GLY 89 2HA GLY 89 -9.058 13.734 -0.031 705 HA3 GLY 89 1HA GLY 89 -10.141 15.085 -0.338 706 H HIS 90 H HIS 90 -10.555 15.339 2.683 707 HA HIS 90 HA HIS 90 -8.260 17.126 3.091 708 HB2 HIS 90 2HB HIS 90 -10.708 16.576 4.774 709 HB3 HIS 90 1HB HIS 90 -9.516 17.822 5.114 710 HD1 HIS 90 1HD HIS 90 -9.043 18.992 2.342 711 HD2 HIS 90 2HD HIS 90 -12.835 18.044 3.788 712 HE1 HIS 90 1HE HIS 90 -10.687 20.389 1.009 713 HE2 HIS 90 2HE HIS 90 -13.001 19.816 1.879 714 H TRP 91 H TRP 91 -8.274 13.998 3.323 715 HA TRP 91 HA TRP 91 -7.148 12.425 4.649 716 HB2 TRP 91 2HB TRP 91 -5.756 14.988 5.050 717 HB3 TRP 91 1HB TRP 91 -5.534 13.845 6.373 718 HD1 TRP 91 HD TRP 91 -3.970 14.747 3.277 719 HE1 TRP 91 1HE TRP 91 -2.591 12.809 2.285 720 HE3 TRP 91 3HE TRP 91 -5.813 10.856 6.023 721 HZ2 TRP 91 2HZ TRP 91 -2.308 9.978 2.611 722 HZ3 TRP 91 3HZ TRP 91 -4.972 8.553 5.663 723 HH2 TRP 91 HH TRP 91 -3.224 8.110 3.962 724 H GLN 92 H GLN 92 -9.672 13.841 5.636 725 HA GLN 92 HA GLN 92 -9.286 13.512 8.567 726 HB2 GLN 92 2HB GLN 92 -11.621 14.642 6.999 727 HB3 GLN 92 1HB GLN 92 -11.523 14.558 8.759 728 HG2 GLN 92 2HG GLN 92 -9.631 16.082 6.947 729 HG3 GLN 92 1HG GLN 92 -10.872 16.784 7.975 730 HE21 GLN 92 1HE2 GLN 92 -7.651 16.542 7.943 731 HE22 GLN 92 2HE2 GLN 92 -7.324 16.320 9.593 732 H SER 93 H SER 93 -12.489 13.101 7.643 733 HA SER 93 HA SER 93 -12.325 10.203 7.179 734 HB2 SER 93 2HB SER 93 -13.363 9.506 9.187 735 HB3 SER 93 1HB SER 93 -12.170 10.682 9.723 736 HG SER 93 HG SER 93 -13.791 11.727 10.534 737 H VAL 94 H VAL 94 -14.513 9.319 6.685 738 HA VAL 94 HA VAL 94 -16.485 11.465 6.012 739 HB VAL 94 HB VAL 94 -16.910 9.527 4.089 740 HG11 VAL 94 1HG1 VAL 94 -15.541 11.187 2.634 741 HG12 VAL 94 2HG1 VAL 94 -15.347 12.107 4.126 742 HG13 VAL 94 3HG1 VAL 94 -16.960 11.804 3.479 743 HG21 VAL 94 1HG2 VAL 94 -14.691 8.529 4.961 744 HG22 VAL 94 2HG2 VAL 94 -13.917 9.933 4.227 745 HG23 VAL 94 3HG2 VAL 94 -14.822 8.801 3.223 746 HA PRO 95 HA PRO 95 -19.363 8.873 8.158 747 HB2 PRO 95 2HB PRO 95 -21.693 9.532 6.862 748 HB3 PRO 95 1HB PRO 95 -20.902 10.575 8.059 749 HG2 PRO 95 2HG PRO 95 -20.872 10.736 5.092 750 HG3 PRO 95 1HG PRO 95 -20.919 12.034 6.296 751 HD2 PRO 95 2HD PRO 95 -18.636 11.319 4.959 752 HD3 PRO 95 1HD PRO 95 -18.627 12.030 6.587 753 H ASP 96 H ASP 96 -19.390 8.758 4.623 754 HA ASP 96 HA ASP 96 -19.584 5.851 4.672 755 HB2 ASP 96 2HB ASP 96 -21.686 5.678 3.426 756 HB3 ASP 96 1HB ASP 96 -21.968 6.505 4.957 757 H ASP 97 H ASP 97 -19.588 5.006 2.342 758 HA ASP 97 HA ASP 97 -17.738 6.664 0.780 759 HB2 ASP 97 2HB ASP 97 -17.716 4.672 -0.753 760 HB3 ASP 97 1HB ASP 97 -17.281 4.283 0.911 761 H ASP 98 H ASP 98 -18.807 8.351 -0.222 762 HA ASP 98 HA ASP 98 -21.364 7.802 -1.606 763 HB2 ASP 98 2HB ASP 98 -20.976 9.871 -0.166 764 HB3 ASP 98 1HB ASP 98 -19.903 10.432 -1.443 765 H ARG 99 H ARG 99 -18.223 9.305 -2.352 766 HA ARG 99 HA ARG 99 -18.590 8.425 -5.185 767 HB2 ARG 99 2HB ARG 99 -17.129 10.857 -4.112 768 HB3 ARG 99 1HB ARG 99 -17.185 10.374 -5.806 769 HG2 ARG 99 2HG ARG 99 -19.678 10.531 -5.724 770 HG3 ARG 99 1HG ARG 99 -19.549 11.148 -4.077 771 HD2 ARG 99 2HD ARG 99 -18.355 12.426 -6.554 772 HD3 ARG 99 1HD ARG 99 -19.755 13.013 -5.657 773 HE ARG 99 HE ARG 99 -17.533 12.782 -3.869 774 HH11 ARG 99 1HH1 ARG 99 -16.450 14.675 -3.276 775 HH12 ARG 99 2HH1 ARG 99 -16.610 16.093 -4.258 776 HH21 ARG 99 1HH2 ARG 99 -18.722 14.584 -6.558 777 HH22 ARG 99 2HH2 ARG 99 -17.897 16.041 -6.115 778 H ALA 100 H ALA 100 -17.191 7.301 -2.623 779 HA ALA 100 HA ALA 100 -14.371 7.321 -3.161 780 HB1 ALA 100 1HB ALA 100 -16.090 6.208 -1.213 781 HB2 ALA 100 2HB ALA 100 -14.328 6.198 -1.211 782 HB3 ALA 100 3HB ALA 100 -15.217 4.852 -1.924 783 H SER 101 H SER 101 -13.089 5.666 -4.164 784 HA SER 101 HA SER 101 -14.582 4.164 -6.263 785 HB2 SER 101 2HB SER 101 -11.639 4.870 -6.103 786 HB3 SER 101 1HB SER 101 -12.438 4.077 -7.458 787 HG SER 101 HG SER 101 -13.242 6.590 -6.421 788 H GLU 102 H GLU 102 -13.743 1.979 -6.801 789 HA GLU 102 HA GLU 102 -12.826 0.566 -4.331 790 HB2 GLU 102 2HB GLU 102 -14.318 -0.510 -6.745 791 HB3 GLU 102 1HB GLU 102 -13.874 -1.439 -5.312 792 HG2 GLU 102 2HG GLU 102 -15.228 0.104 -3.914 793 HG3 GLU 102 1HG GLU 102 -15.716 0.968 -5.373 794 H ILE 103 H ILE 103 -11.217 -1.066 -4.554 795 HA ILE 103 HA ILE 103 -9.550 -0.785 -7.026 796 HB ILE 103 HB ILE 103 -8.638 -1.505 -4.229 797 HG12 ILE 103 2HG1 ILE 103 -8.336 1.120 -5.719 798 HG13 ILE 103 1HG1 ILE 103 -9.503 0.842 -4.425 799 HG21 ILE 103 1HG2 ILE 103 -6.739 -2.093 -5.277 800 HG22 ILE 103 2HG2 ILE 103 -6.583 -0.437 -5.863 801 HG23 ILE 103 3HG2 ILE 103 -7.430 -1.640 -6.834 802 HD11 ILE 103 1HD1 ILE 103 -7.755 1.703 -3.182 803 HD12 ILE 103 2HD1 ILE 103 -6.526 1.072 -4.278 804 HD13 ILE 103 3HD1 ILE 103 -7.328 -0.009 -3.137 805 H GLU 104 H GLU 104 -8.901 -2.684 -8.042 806 HA GLU 104 HA GLU 104 -9.889 -5.226 -6.801 807 HB2 GLU 104 2HB GLU 104 -10.916 -4.594 -9.004 808 HB3 GLU 104 1HB GLU 104 -9.310 -4.684 -9.728 809 HG2 GLU 104 2HG GLU 104 -9.131 -7.051 -8.960 810 HG3 GLU 104 1HG GLU 104 -10.784 -6.950 -8.352 811 H VAL 105 H VAL 105 -8.258 -6.410 -5.973 812 HA VAL 105 HA VAL 105 -5.610 -6.335 -7.353 813 HB VAL 105 HB VAL 105 -6.087 -6.703 -4.383 814 HG11 VAL 105 1HG1 VAL 105 -4.043 -7.757 -5.105 815 HG12 VAL 105 2HG1 VAL 105 -3.603 -6.234 -4.330 816 HG13 VAL 105 3HG1 VAL 105 -3.608 -6.359 -6.089 817 HG21 VAL 105 1HG2 VAL 105 -6.486 -4.457 -4.466 818 HG22 VAL 105 2HG2 VAL 105 -5.768 -4.289 -6.067 819 HG23 VAL 105 3HG2 VAL 105 -4.734 -4.348 -4.640 820 H ASP 106 H ASP 106 -4.895 -8.344 -7.976 821 HA ASP 106 HA ASP 106 -6.311 -10.698 -6.795 822 HB2 ASP 106 2HB ASP 106 -5.173 -10.322 -9.576 823 HB3 ASP 106 1HB ASP 106 -5.835 -11.838 -8.966 824 H PHE 107 H PHE 107 -5.043 -12.201 -5.818 825 HA PHE 107 HA PHE 107 -2.089 -11.987 -6.230 826 HB2 PHE 107 2HB PHE 107 -3.758 -12.363 -3.797 827 HB3 PHE 107 1HB PHE 107 -2.242 -13.261 -3.875 828 HD1 PHE 107 1HD PHE 107 -3.761 -10.080 -3.225 829 HD2 PHE 107 2HD PHE 107 -0.120 -11.962 -4.494 830 HE1 PHE 107 1HE PHE 107 -2.500 -8.024 -2.643 831 HE2 PHE 107 2HE PHE 107 1.148 -9.909 -3.910 832 HZ PHE 107 HZ PHE 107 -0.041 -7.941 -2.986 833 H VAL 108 H VAL 108 -1.311 -13.689 -7.334 834 HA VAL 108 HA VAL 108 -2.510 -16.363 -6.833 835 HB VAL 108 HB VAL 108 -2.473 -14.813 -9.305 836 HG11 VAL 108 1HG1 VAL 108 -1.288 -17.604 -9.330 837 HG12 VAL 108 2HG1 VAL 108 -0.534 -16.121 -9.914 838 HG13 VAL 108 3HG1 VAL 108 -1.927 -16.793 -10.756 839 HG21 VAL 108 1HG2 VAL 108 -3.718 -17.502 -8.718 840 HG22 VAL 108 2HG2 VAL 108 -4.275 -16.275 -9.858 841 HG23 VAL 108 3HG2 VAL 108 -4.392 -15.984 -8.122 842 HA PRO 109 HA PRO 109 1.754 -17.477 -6.209 843 HB2 PRO 109 2HB PRO 109 1.628 -20.125 -7.076 844 HB3 PRO 109 1HB PRO 109 1.243 -19.562 -5.443 845 HG2 PRO 109 2HG PRO 109 -0.561 -20.271 -7.672 846 HG3 PRO 109 1HG PRO 109 -0.794 -20.444 -5.925 847 HD2 PRO 109 2HD PRO 109 -2.015 -18.494 -7.389 848 HD3 PRO 109 1HD PRO 109 -1.582 -18.285 -5.678 849 H ASN 110 H ASN 110 3.561 -17.257 -7.464 850 HA ASN 110 HA ASN 110 3.252 -17.621 -10.404 851 HB2 ASN 110 2HB ASN 110 3.960 -15.353 -9.354 852 HB3 ASN 110 1HB ASN 110 5.512 -16.143 -9.086 853 HD21 ASN 110 1HD2 ASN 110 6.084 -14.273 -10.742 854 HD22 ASN 110 2HD2 ASN 110 6.019 -14.705 -12.382 855 H GLY 111 H GLY 111 4.803 -18.874 -11.528 856 HA2 GLY 111 2HA GLY 111 5.824 -21.169 -10.330 857 HA3 GLY 111 1HA GLY 111 6.532 -20.461 -11.783 858 H SER 112 H SER 112 7.324 -17.972 -10.544 859 HA SER 112 HA SER 112 9.875 -18.775 -9.462 860 HB2 SER 112 2HB SER 112 8.527 -16.069 -9.391 861 HB3 SER 112 1HB SER 112 10.233 -16.372 -9.088 862 HG SER 112 HG SER 112 9.704 -17.537 -11.358 863 H GLY 113 H GLY 113 10.640 -18.157 -7.257 864 HA2 GLY 113 2HA GLY 113 8.813 -19.069 -5.222 865 HA3 GLY 113 1HA GLY 113 10.403 -18.364 -4.927 866 H GLY 114 H GLY 114 7.848 -16.740 -6.733 867 HA2 GLY 114 2HA GLY 114 7.365 -14.943 -4.419 868 HA3 GLY 114 1HA GLY 114 7.871 -14.241 -5.955 869 H THR 115 H THR 115 5.392 -13.579 -4.783 870 HA THR 115 HA THR 115 3.408 -15.107 -6.395 871 HB THR 115 HB THR 115 2.877 -12.978 -4.305 872 HG1 THR 115 1HG THR 115 2.850 -15.797 -4.024 873 HG21 THR 115 1HG2 THR 115 1.166 -15.153 -5.535 874 HG22 THR 115 2HG2 THR 115 1.019 -13.422 -5.840 875 HG23 THR 115 3HG2 THR 115 0.654 -14.072 -4.241 876 H ARG 116 H ARG 116 2.243 -14.099 -8.031 877 HA ARG 116 HA ARG 116 3.182 -11.355 -8.766 878 HB2 ARG 116 2HB ARG 116 3.570 -13.197 -10.427 879 HB3 ARG 116 1HB ARG 116 1.823 -13.429 -10.517 880 HG2 ARG 116 2HG ARG 116 1.532 -11.115 -11.280 881 HG3 ARG 116 1HG ARG 116 3.268 -10.839 -11.147 882 HD2 ARG 116 2HD ARG 116 2.793 -11.316 -13.463 883 HD3 ARG 116 1HD ARG 116 3.608 -12.728 -12.789 884 HE ARG 116 HE ARG 116 0.889 -13.245 -12.446 885 HH11 ARG 116 1HH1 ARG 116 -0.306 -14.385 -13.990 886 HH12 ARG 116 2HH1 ARG 116 0.239 -14.420 -15.634 887 HH21 ARG 116 1HH2 ARG 116 3.034 -12.460 -15.027 888 HH22 ARG 116 2HH2 ARG 116 2.130 -13.329 -16.221 889 H VAL 117 H VAL 117 1.713 -9.723 -8.627 890 HA VAL 117 HA VAL 117 -1.170 -10.482 -8.504 891 HB VAL 117 HB VAL 117 -0.786 -9.914 -6.296 892 HG11 VAL 117 1HG1 VAL 117 0.694 -7.913 -5.711 893 HG12 VAL 117 2HG1 VAL 117 1.199 -7.923 -7.402 894 HG13 VAL 117 3HG1 VAL 117 1.520 -9.321 -6.377 895 HG21 VAL 117 1HG2 VAL 117 -2.438 -8.331 -7.554 896 HG22 VAL 117 2HG2 VAL 117 -1.182 -7.116 -7.334 897 HG23 VAL 117 3HG2 VAL 117 -1.918 -7.885 -5.930 898 H GLU 118 H GLU 118 -2.616 -9.210 -9.565 899 HA GLU 118 HA GLU 118 -1.483 -7.041 -11.276 900 HB2 GLU 118 2HB GLU 118 -2.585 -8.884 -12.494 901 HB3 GLU 118 1HB GLU 118 -4.047 -8.653 -11.537 902 HG2 GLU 118 2HG GLU 118 -4.229 -6.332 -12.433 903 HG3 GLU 118 1HG GLU 118 -2.825 -6.640 -13.450 904 H LEU 119 H LEU 119 -1.905 -5.023 -10.509 905 HA LEU 119 HA LEU 119 -4.372 -4.639 -8.873 906 HB2 LEU 119 2HB LEU 119 -2.130 -4.248 -7.753 907 HB3 LEU 119 1HB LEU 119 -1.890 -2.905 -8.866 908 HG LEU 119 HG LEU 119 -4.479 -2.945 -7.394 909 HD11 LEU 119 1HD1 LEU 119 -3.478 -2.019 -5.364 910 HD12 LEU 119 2HD1 LEU 119 -1.864 -2.199 -6.051 911 HD13 LEU 119 3HD1 LEU 119 -2.822 -3.628 -5.664 912 HD21 LEU 119 1HD2 LEU 119 -2.411 -0.832 -8.085 913 HD22 LEU 119 2HD2 LEU 119 -3.935 -0.504 -7.263 914 HD23 LEU 119 3HD2 LEU 119 -3.940 -1.112 -8.916 915 H ALA 120 H ALA 120 -5.920 -3.420 -9.811 916 HA ALA 120 HA ALA 120 -5.083 -1.365 -11.808 917 HB1 ALA 120 1HB ALA 120 -7.290 -3.420 -12.056 918 HB2 ALA 120 2HB ALA 120 -5.931 -3.156 -13.149 919 HB3 ALA 120 3HB ALA 120 -7.228 -1.965 -13.051 920 H HIS 121 H HIS 121 -5.969 0.608 -11.368 921 HA HIS 121 HA HIS 121 -8.338 0.684 -9.537 922 HB2 HIS 121 2HB HIS 121 -6.220 1.508 -8.474 923 HB3 HIS 121 1HB HIS 121 -6.131 2.755 -9.722 924 HD1 HIS 121 1HD HIS 121 -9.060 3.574 -9.930 925 HD2 HIS 121 2HD HIS 121 -7.132 2.977 -6.281 926 HE1 HIS 121 1HE HIS 121 -10.411 4.824 -8.200 927 HE2 HIS 121 2HE HIS 121 -9.244 4.478 -5.971 928 H VAL 122 H VAL 122 -10.077 1.819 -10.308 929 HA VAL 122 HA VAL 122 -9.617 3.667 -12.607 930 HB VAL 122 HB VAL 122 -11.645 2.747 -13.696 931 HG11 VAL 122 1HG1 VAL 122 -9.494 0.717 -13.021 932 HG12 VAL 122 2HG1 VAL 122 -9.457 1.871 -14.353 933 HG13 VAL 122 3HG1 VAL 122 -10.639 0.564 -14.354 934 HG21 VAL 122 1HG2 VAL 122 -11.541 0.924 -11.287 935 HG22 VAL 122 2HG2 VAL 122 -12.362 0.443 -12.772 936 HG23 VAL 122 3HG2 VAL 122 -12.906 1.867 -11.886 937 H LYS 123 H LYS 123 -11.350 5.210 -12.925 938 HA LYS 123 HA LYS 123 -12.851 6.825 -12.182 939 HB2 LYS 123 2HB LYS 123 -13.869 4.522 -10.499 940 HB3 LYS 123 1HB LYS 123 -14.736 6.025 -10.811 941 HG2 LYS 123 2HG LYS 123 -14.623 5.545 -13.255 942 HG3 LYS 123 1HG LYS 123 -13.862 3.997 -12.888 943 HD2 LYS 123 2HD LYS 123 -15.862 3.404 -11.499 944 HD3 LYS 123 1HD LYS 123 -16.631 4.895 -12.044 945 HE2 LYS 123 2HE LYS 123 -16.649 4.166 -14.321 946 HE3 LYS 123 1HE LYS 123 -15.566 2.818 -13.968 947 HZ1 LYS 123 1HZ LYS 123 -18.410 2.998 -13.675 948 HZ2 LYS 123 2HZ LYS 123 -17.649 2.447 -12.260 949 HZ3 LYS 123 3HZ LYS 123 -17.414 1.626 -13.728 950 H LEU 124 H LEU 124 -10.298 6.685 -10.762 951 HA LEU 124 HA LEU 124 -10.789 7.014 -7.928 952 HB2 LEU 124 2HB LEU 124 -8.543 6.473 -8.792 953 HB3 LEU 124 1HB LEU 124 -8.493 8.024 -9.632 954 HG LEU 124 HG LEU 124 -8.681 9.206 -7.475 955 HD11 LEU 124 1HD1 LEU 124 -9.811 7.915 -5.941 956 HD12 LEU 124 2HD1 LEU 124 -8.165 7.487 -5.473 957 HD13 LEU 124 3HD1 LEU 124 -9.091 6.413 -6.521 958 HD21 LEU 124 1HD2 LEU 124 -6.465 7.898 -8.478 959 HD22 LEU 124 2HD2 LEU 124 -6.499 7.354 -6.800 960 HD23 LEU 124 3HD2 LEU 124 -6.435 9.077 -7.167 961 H HIS 125 H HIS 125 -10.600 9.237 -10.674 962 HA HIS 125 HA HIS 125 -10.746 11.661 -9.185 963 HB2 HIS 125 2HB HIS 125 -10.179 11.706 -11.547 964 HB3 HIS 125 1HB HIS 125 -11.756 11.038 -11.963 965 HD1 HIS 125 1HD HIS 125 -11.729 13.483 -9.204 966 HD2 HIS 125 2HD HIS 125 -12.308 13.574 -13.334 967 HE1 HIS 125 1HE HIS 125 -12.798 15.715 -9.723 968 HE2 HIS 125 2HE HIS 125 -13.142 15.792 -12.239 969 H ARG 126 H ARG 126 -13.193 9.304 -9.985 970 HA ARG 126 HA ARG 126 -15.542 10.768 -9.916 971 HB2 ARG 126 2HB ARG 126 -16.543 8.747 -9.676 972 HB3 ARG 126 1HB ARG 126 -14.911 8.090 -9.753 973 HG2 ARG 126 2HG ARG 126 -14.784 8.362 -7.237 974 HG3 ARG 126 1HG ARG 126 -16.504 8.761 -7.268 975 HD2 ARG 126 2HD ARG 126 -15.255 6.183 -8.255 976 HD3 ARG 126 1HD ARG 126 -16.220 6.379 -6.793 977 HE ARG 126 HE ARG 126 -17.932 7.279 -8.726 978 HH11 ARG 126 1HH1 ARG 126 -19.294 5.954 -9.949 979 HH12 ARG 126 2HH1 ARG 126 -18.858 4.299 -10.217 980 HH21 ARG 126 1HH2 ARG 126 -15.905 4.508 -8.411 981 HH22 ARG 126 2HH2 ARG 126 -16.940 3.480 -9.345 982 H HIS 127 H HIS 127 -13.360 10.083 -7.241 983 HA HIS 127 HA HIS 127 -15.072 10.824 -5.099 984 HB2 HIS 127 2HB HIS 127 -12.364 10.144 -5.396 985 HB3 HIS 127 1HB HIS 127 -12.353 11.763 -4.699 986 HD1 HIS 127 1HD HIS 127 -15.206 11.168 -3.192 987 HD2 HIS 127 2HD HIS 127 -11.648 9.016 -2.845 988 HE1 HIS 127 1HE HIS 127 -15.314 9.952 -0.971 989 HE2 HIS 127 2HE HIS 127 -13.156 8.640 -0.751 990 H GLY 128 H GLY 128 -12.981 12.787 -7.183 991 HA2 GLY 128 2HA GLY 128 -12.784 15.131 -7.366 992 HA3 GLY 128 1HA GLY 128 -14.546 15.050 -7.377 993 H ASP 129 H ASP 129 -13.193 13.848 -4.488 994 HA ASP 129 HA ASP 129 -14.067 16.320 -3.088 995 HB2 ASP 129 2HB ASP 129 -14.156 14.935 -1.080 996 HB3 ASP 129 1HB ASP 129 -15.032 14.130 -2.382 997 H GLY 130 H GLY 130 -11.299 15.439 -4.419 998 HA2 GLY 130 2HA GLY 130 -9.208 16.565 -3.963 999 HA3 GLY 130 1HA GLY 130 -9.698 16.731 -2.276 1000 H ALA 131 H ALA 131 -10.368 13.653 -3.547 1001 HA ALA 131 HA ALA 131 -8.779 12.227 -1.719 1002 HB1 ALA 131 1HB ALA 131 -9.427 11.219 -4.495 1003 HB2 ALA 131 2HB ALA 131 -10.652 11.344 -3.230 1004 HB3 ALA 131 3HB ALA 131 -9.263 10.280 -3.010 1005 H TRP 132 H TRP 132 -7.913 13.580 -4.849 1006 HA TRP 132 HA TRP 132 -5.552 12.131 -5.365 1007 HB2 TRP 132 2HB TRP 132 -6.646 13.900 -6.842 1008 HB3 TRP 132 1HB TRP 132 -5.845 15.106 -5.834 1009 HD1 TRP 132 HD TRP 132 -3.628 15.863 -6.788 1010 HE1 TRP 132 1HE TRP 132 -1.764 14.802 -8.219 1011 HE3 TRP 132 3HE TRP 132 -5.541 11.164 -7.403 1012 HZ2 TRP 132 2HZ TRP 132 -1.162 12.293 -9.453 1013 HZ3 TRP 132 3HZ TRP 132 -4.301 9.463 -8.697 1014 HH2 TRP 132 HH TRP 132 -2.118 10.018 -9.725 1015 H ASN 133 H ASN 133 -6.074 14.893 -3.203 1016 HA ASN 133 HA ASN 133 -3.357 15.397 -2.536 1017 HB2 ASN 133 2HB ASN 133 -5.408 16.751 -1.838 1018 HB3 ASN 133 1HB ASN 133 -5.666 15.542 -0.579 1019 HD21 ASN 133 1HD2 ASN 133 -4.708 16.096 1.377 1020 HD22 ASN 133 2HD2 ASN 133 -3.317 17.051 1.550 1021 H ILE 134 H ILE 134 -5.663 13.017 -1.233 1022 HA ILE 134 HA ILE 134 -4.000 12.042 0.870 1023 HB ILE 134 HB ILE 134 -6.237 10.854 -0.740 1024 HG12 ILE 134 2HG1 ILE 134 -7.423 10.973 1.340 1025 HG13 ILE 134 1HG1 ILE 134 -5.935 11.251 2.244 1026 HG21 ILE 134 1HG2 ILE 134 -4.422 9.442 1.218 1027 HG22 ILE 134 2HG2 ILE 134 -4.880 8.927 -0.406 1028 HG23 ILE 134 3HG2 ILE 134 -6.066 8.891 0.898 1029 HD11 ILE 134 1HD1 ILE 134 -5.694 13.451 1.384 1030 HD12 ILE 134 2HD1 ILE 134 -7.408 13.309 1.759 1031 HD13 ILE 134 3HD1 ILE 134 -6.857 13.158 0.093 1032 H HIS 135 H HIS 135 -4.276 11.084 -2.544 1033 HA HIS 135 HA HIS 135 -2.371 8.956 -2.443 1034 HB2 HIS 135 2HB HIS 135 -3.927 9.485 -4.373 1035 HB3 HIS 135 1HB HIS 135 -2.858 10.828 -4.777 1036 HD1 HIS 135 1HD HIS 135 -0.171 9.277 -4.056 1037 HD2 HIS 135 2HD HIS 135 -3.185 7.874 -6.574 1038 HE1 HIS 135 1HE HIS 135 0.907 7.561 -5.578 1039 HE2 HIS 135 2HE HIS 135 -0.918 6.700 -7.114 1040 H LYS 136 H LYS 136 -2.048 12.449 -2.909 1041 HA LYS 136 HA LYS 136 0.700 12.567 -3.567 1042 HB2 LYS 136 2HB LYS 136 -0.875 14.508 -3.588 1043 HB3 LYS 136 1HB LYS 136 -0.831 14.511 -1.833 1044 HG2 LYS 136 2HG LYS 136 1.614 14.838 -1.912 1045 HG3 LYS 136 1HG LYS 136 1.527 14.909 -3.668 1046 HD2 LYS 136 2HD LYS 136 -0.059 16.834 -3.461 1047 HD3 LYS 136 1HD LYS 136 0.203 16.809 -1.717 1048 HE2 LYS 136 2HE LYS 136 2.672 17.079 -2.170 1049 HE3 LYS 136 1HE LYS 136 2.272 17.329 -3.868 1050 HZ1 LYS 136 1HZ LYS 136 0.586 19.020 -2.664 1051 HZ2 LYS 136 2HZ LYS 136 2.118 19.462 -3.250 1052 HZ3 LYS 136 3HZ LYS 136 1.908 19.094 -1.605 1053 H ALA 137 H ALA 137 -0.906 12.402 -0.407 1054 HA ALA 137 HA ALA 137 1.500 12.610 1.157 1055 HB1 ALA 137 1HB ALA 137 -0.315 12.921 2.533 1056 HB2 ALA 137 2HB ALA 137 -0.121 11.186 2.778 1057 HB3 ALA 137 3HB ALA 137 -1.319 11.786 1.632 1058 H LEU 138 H LEU 138 -0.204 9.927 -0.359 1059 HA LEU 138 HA LEU 138 1.610 7.940 0.817 1060 HB2 LEU 138 2HB LEU 138 -0.490 7.597 -1.338 1061 HB3 LEU 138 1HB LEU 138 0.266 6.321 -0.399 1062 HG LEU 138 HG LEU 138 -1.566 8.496 0.641 1063 HD11 LEU 138 1HD1 LEU 138 -3.107 6.726 1.078 1064 HD12 LEU 138 2HD1 LEU 138 -1.886 5.490 0.771 1065 HD13 LEU 138 3HD1 LEU 138 -2.525 6.450 -0.565 1066 HD21 LEU 138 1HD2 LEU 138 -0.052 8.212 2.393 1067 HD22 LEU 138 2HD2 LEU 138 0.249 6.524 1.987 1068 HD23 LEU 138 3HD2 LEU 138 -1.263 6.985 2.770 1069 H ASP 139 H ASP 139 1.738 10.146 -1.668 1070 HA ASP 139 HA ASP 139 3.078 8.479 -3.655 1071 HB2 ASP 139 2HB ASP 139 1.754 10.523 -4.245 1072 HB3 ASP 139 1HB ASP 139 2.986 11.502 -3.448 1073 H GLY 140 H GLY 140 5.086 7.751 -3.249 1074 HA2 GLY 140 2HA GLY 140 6.936 9.426 -1.632 1075 HA3 GLY 140 1HA GLY 140 7.127 7.696 -1.919 1076 HA PRO 141 HA PRO 141 9.928 10.246 -4.774 1077 HB2 PRO 141 2HB PRO 141 11.682 7.942 -4.072 1078 HB3 PRO 141 1HB PRO 141 12.070 9.670 -4.158 1079 HG2 PRO 141 2HG PRO 141 11.792 8.394 -1.824 1080 HG3 PRO 141 1HG PRO 141 11.316 10.086 -2.040 1081 HD2 PRO 141 2HD PRO 141 9.591 7.665 -1.800 1082 HD3 PRO 141 1HD PRO 141 9.255 9.344 -1.326 1083 H SER 142 H SER 142 10.235 9.717 -6.962 1084 HA SER 142 HA SER 142 9.834 8.528 -8.950 1085 HB2 SER 142 2HB SER 142 10.440 5.984 -7.475 1086 HB3 SER 142 1HB SER 142 10.921 6.469 -9.099 1087 HG SER 142 HG SER 142 11.957 7.262 -6.598 1088 HA PRO 143 HA PRO 143 5.657 7.387 -7.030 1089 HB2 PRO 143 2HB PRO 143 4.841 8.952 -9.428 1090 HB3 PRO 143 1HB PRO 143 4.221 9.021 -7.768 1091 HG2 PRO 143 2HG PRO 143 5.812 10.922 -8.773 1092 HG3 PRO 143 1HG PRO 143 5.866 10.445 -7.068 1093 HD2 PRO 143 2HD PRO 143 7.809 9.848 -9.248 1094 HD3 PRO 143 1HD PRO 143 8.086 10.025 -7.501 1095 H GLY 144 H GLY 144 4.267 5.765 -7.821 1096 HA2 GLY 144 2HA GLY 144 4.092 4.994 -10.579 1097 HA3 GLY 144 1HA GLY 144 5.236 3.945 -9.742 1098 H GLU 145 H GLU 145 3.395 2.392 -10.457 1099 HA GLU 145 HA GLU 145 0.851 2.375 -9.232 1100 HB2 GLU 145 2HB GLU 145 2.619 0.009 -9.930 1101 HB3 GLU 145 1HB GLU 145 0.887 -0.073 -9.607 1102 HG2 GLU 145 2HG GLU 145 0.919 0.072 -11.937 1103 HG3 GLU 145 1HG GLU 145 0.727 1.763 -11.478 1104 H THR 146 H THR 146 0.086 1.293 -7.320 1105 HA THR 146 HA THR 146 1.630 1.686 -4.979 1106 HB THR 146 HB THR 146 -0.713 -0.155 -5.474 1107 HG1 THR 146 1HG THR 146 -1.902 1.528 -4.841 1108 HG21 THR 146 1HG2 THR 146 0.819 0.539 -2.992 1109 HG22 THR 146 2HG2 THR 146 0.174 -1.021 -3.504 1110 HG23 THR 146 3HG2 THR 146 -0.914 0.223 -2.886 1111 H LEU 147 H LEU 147 1.236 -1.167 -7.026 1112 HA LEU 147 HA LEU 147 2.477 -3.067 -5.339 1113 HB2 LEU 147 2HB LEU 147 2.658 -2.915 -8.359 1114 HB3 LEU 147 1HB LEU 147 2.858 -4.353 -7.357 1115 HG LEU 147 HG LEU 147 0.329 -2.704 -7.592 1116 HD11 LEU 147 1HD1 LEU 147 1.397 -5.028 -9.024 1117 HD12 LEU 147 2HD1 LEU 147 0.047 -3.974 -9.444 1118 HD13 LEU 147 3HD1 LEU 147 -0.198 -5.319 -8.331 1119 HD21 LEU 147 1HD2 LEU 147 1.214 -4.921 -5.791 1120 HD22 LEU 147 2HD2 LEU 147 -0.455 -4.943 -6.359 1121 HD23 LEU 147 3HD2 LEU 147 0.148 -3.558 -5.448 1122 H ALA 148 H ALA 148 3.847 -0.559 -7.388 1123 HA ALA 148 HA ALA 148 6.529 -1.497 -7.490 1124 HB1 ALA 148 1HB ALA 148 5.151 0.788 -8.332 1125 HB2 ALA 148 2HB ALA 148 6.858 0.437 -8.606 1126 HB3 ALA 148 3HB ALA 148 6.366 1.396 -7.209 1127 H ARG 149 H ARG 149 5.141 0.919 -5.231 1128 HA ARG 149 HA ARG 149 7.455 0.969 -3.541 1129 HB2 ARG 149 2HB ARG 149 4.578 1.701 -2.984 1130 HB3 ARG 149 1HB ARG 149 5.916 2.046 -1.894 1131 HG2 ARG 149 2HG ARG 149 7.032 3.292 -3.776 1132 HG3 ARG 149 1HG ARG 149 5.554 3.081 -4.716 1133 HD2 ARG 149 2HD ARG 149 5.452 5.252 -3.650 1134 HD3 ARG 149 1HD ARG 149 4.290 4.196 -2.847 1135 HE ARG 149 HE ARG 149 6.664 3.942 -1.381 1136 HH11 ARG 149 1HH1 ARG 149 7.045 5.210 0.448 1137 HH12 ARG 149 2HH1 ARG 149 6.220 6.723 0.625 1138 HH21 ARG 149 1HH2 ARG 149 4.490 6.429 -2.365 1139 HH22 ARG 149 2HH2 ARG 149 4.773 7.412 -0.967 1140 H PHE 150 H PHE 150 4.429 -0.882 -3.407 1141 HA PHE 150 HA PHE 150 4.898 -2.107 -0.864 1142 HB2 PHE 150 2HB PHE 150 2.700 -2.154 -1.957 1143 HB3 PHE 150 1HB PHE 150 3.357 -3.131 -3.265 1144 HD1 PHE 150 1HD PHE 150 2.597 -3.106 0.375 1145 HD2 PHE 150 2HD PHE 150 3.677 -5.478 -3.039 1146 HE1 PHE 150 1HE PHE 150 2.158 -5.177 1.670 1147 HE2 PHE 150 2HE PHE 150 3.238 -7.545 -1.746 1148 HZ PHE 150 HZ PHE 150 2.483 -7.395 0.607 1149 H ALA 151 H ALA 151 5.782 -3.119 -4.169 1150 HA ALA 151 HA ALA 151 6.905 -5.638 -3.341 1151 HB1 ALA 151 1HB ALA 151 7.781 -5.794 -5.554 1152 HB2 ALA 151 2HB ALA 151 7.776 -4.042 -5.757 1153 HB3 ALA 151 3HB ALA 151 6.252 -4.930 -5.716 1154 H ASN 152 H ASN 152 8.263 -2.385 -3.734 1155 HA ASN 152 HA ASN 152 10.999 -3.129 -3.376 1156 HB2 ASN 152 2HB ASN 152 9.584 -0.532 -2.773 1157 HB3 ASN 152 1HB ASN 152 11.334 -0.731 -2.786 1158 HD21 ASN 152 1HD2 ASN 152 10.054 1.056 -4.615 1159 HD22 ASN 152 2HD2 ASN 152 10.219 0.430 -6.184 1160 H VAL 153 H VAL 153 8.623 -1.896 -0.998 1161 HA VAL 153 HA VAL 153 10.446 -2.156 1.220 1162 HB VAL 153 HB VAL 153 8.600 -1.602 2.602 1163 HG11 VAL 153 1HG1 VAL 153 7.360 -0.217 0.384 1164 HG12 VAL 153 2HG1 VAL 153 9.117 -0.171 0.246 1165 HG13 VAL 153 3HG1 VAL 153 8.330 0.438 1.701 1166 HG21 VAL 153 1HG2 VAL 153 6.874 -3.079 2.233 1167 HG22 VAL 153 2HG2 VAL 153 7.048 -2.996 0.483 1168 HG23 VAL 153 3HG2 VAL 153 6.240 -1.693 1.346 1169 H ILE 154 H ILE 154 8.208 -4.329 -0.367 1170 HA ILE 154 HA ILE 154 8.352 -6.333 1.762 1171 HB ILE 154 HB ILE 154 7.110 -6.232 -0.977 1172 HG12 ILE 154 2HG1 ILE 154 6.206 -5.132 1.256 1173 HG13 ILE 154 1HG1 ILE 154 5.108 -5.956 0.153 1174 HG21 ILE 154 1HG2 ILE 154 6.045 -8.455 -0.150 1175 HG22 ILE 154 2HG2 ILE 154 7.474 -8.556 0.882 1176 HG23 ILE 154 3HG2 ILE 154 7.654 -8.494 -0.872 1177 HD11 ILE 154 1HD1 ILE 154 4.970 -7.868 1.510 1178 HD12 ILE 154 2HD1 ILE 154 5.013 -6.557 2.690 1179 HD13 ILE 154 3HD1 ILE 154 6.471 -7.488 2.354 Start of MODEL 12 1 H1 MET 1 1HT MET 1 3.087 3.538 -14.968 2 H2 MET 1 2HT MET 1 2.988 5.180 -15.391 3 H3 MET 1 3HT MET 1 1.571 4.272 -15.155 4 HA MET 1 HA MET 1 1.568 4.628 -12.978 5 HB2 MET 1 2HB MET 1 3.523 4.144 -11.591 6 HB3 MET 1 1HB MET 1 3.342 2.882 -12.809 7 HG2 MET 1 2HG MET 1 5.461 3.299 -13.446 8 HG3 MET 1 1HG MET 1 4.908 4.867 -14.036 9 HE1 MET 1 1HE MET 1 7.330 4.955 -13.827 10 HE2 MET 1 2HE MET 1 8.167 4.342 -12.403 11 HE3 MET 1 3HE MET 1 7.970 6.080 -12.621 12 HA PRO 2 HA PRO 2 3.376 8.843 -13.845 13 HB2 PRO 2 2HB PRO 2 1.206 10.129 -14.738 14 HB3 PRO 2 1HB PRO 2 2.113 9.040 -15.809 15 HG2 PRO 2 2HG PRO 2 -0.435 8.557 -14.341 16 HG3 PRO 2 1HG PRO 2 0.018 8.094 -15.992 17 HD2 PRO 2 2HD PRO 2 0.137 6.390 -13.785 18 HD3 PRO 2 1HD PRO 2 1.045 6.157 -15.294 19 H GLU 3 H GLU 3 3.081 10.732 -12.496 20 HA GLU 3 HA GLU 3 1.872 10.250 -9.946 21 HB2 GLU 3 2HB GLU 3 2.789 12.813 -11.255 22 HB3 GLU 3 1HB GLU 3 2.287 12.694 -9.568 23 HG2 GLU 3 2HG GLU 3 4.034 10.974 -9.185 24 HG3 GLU 3 1HG GLU 3 4.562 11.156 -10.860 25 H GLU 4 H GLU 4 0.710 11.807 -12.889 26 HA GLU 4 HA GLU 4 -1.625 13.027 -11.740 27 HB2 GLU 4 2HB GLU 4 -1.170 11.972 -14.551 28 HB3 GLU 4 1HB GLU 4 -2.495 13.031 -14.065 29 HG2 GLU 4 2HG GLU 4 -0.835 14.730 -13.329 30 HG3 GLU 4 1HG GLU 4 0.463 13.682 -13.903 31 H ILE 5 H ILE 5 -3.680 12.155 -11.357 32 HA ILE 5 HA ILE 5 -4.006 9.491 -10.638 33 HB ILE 5 HB ILE 5 -6.228 11.118 -11.879 34 HG12 ILE 5 2HG1 ILE 5 -4.674 11.502 -9.359 35 HG13 ILE 5 1HG1 ILE 5 -5.480 12.696 -10.373 36 HG21 ILE 5 1HG2 ILE 5 -7.654 9.836 -10.474 37 HG22 ILE 5 2HG2 ILE 5 -6.303 9.254 -9.501 38 HG23 ILE 5 3HG2 ILE 5 -6.519 8.667 -11.149 39 HD11 ILE 5 1HD1 ILE 5 -6.791 12.617 -8.402 40 HD12 ILE 5 2HD1 ILE 5 -6.704 10.857 -8.315 41 HD13 ILE 5 3HD1 ILE 5 -7.685 11.633 -9.561 42 HA PRO 6 HA PRO 6 -4.063 7.833 -14.895 43 HB2 PRO 6 2HB PRO 6 -2.971 5.442 -14.383 44 HB3 PRO 6 1HB PRO 6 -1.988 6.917 -14.361 45 HG2 PRO 6 2HG PRO 6 -3.053 5.321 -12.095 46 HG3 PRO 6 1HG PRO 6 -1.514 6.183 -12.241 47 HD2 PRO 6 2HD PRO 6 -3.814 7.134 -10.918 48 HD3 PRO 6 1HD PRO 6 -2.400 8.102 -11.385 49 H ASP 7 H ASP 7 -5.476 6.321 -15.935 50 HA ASP 7 HA ASP 7 -7.782 5.461 -14.432 51 HB2 ASP 7 2HB ASP 7 -8.450 4.353 -16.520 52 HB3 ASP 7 1HB ASP 7 -7.849 5.969 -16.871 53 H VAL 8 H VAL 8 -7.403 2.772 -16.160 54 HA VAL 8 HA VAL 8 -6.941 1.024 -14.008 55 HB VAL 8 HB VAL 8 -6.086 0.543 -16.883 56 HG11 VAL 8 1HG1 VAL 8 -6.115 -1.729 -16.387 57 HG12 VAL 8 2HG1 VAL 8 -7.213 -1.523 -15.023 58 HG13 VAL 8 3HG1 VAL 8 -5.517 -1.067 -14.866 59 HG21 VAL 8 1HG2 VAL 8 -8.680 1.091 -15.787 60 HG22 VAL 8 2HG2 VAL 8 -8.626 -0.603 -16.277 61 HG23 VAL 8 3HG2 VAL 8 -8.263 0.667 -17.446 62 H ARG 9 H ARG 9 -5.069 0.322 -12.961 63 HA ARG 9 HA ARG 9 -2.601 1.772 -13.658 64 HB2 ARG 9 2HB ARG 9 -3.312 0.022 -11.297 65 HB3 ARG 9 1HB ARG 9 -1.735 0.771 -11.517 66 HG2 ARG 9 2HG ARG 9 -2.859 2.997 -11.644 67 HG3 ARG 9 1HG ARG 9 -4.394 2.206 -11.285 68 HD2 ARG 9 2HD ARG 9 -3.384 1.323 -9.171 69 HD3 ARG 9 1HD ARG 9 -1.936 2.268 -9.511 70 HE ARG 9 HE ARG 9 -3.827 4.202 -9.598 71 HH11 ARG 9 1HH1 ARG 9 -4.725 5.271 -7.824 72 HH12 ARG 9 2HH1 ARG 9 -4.788 4.472 -6.288 73 HH21 ARG 9 1HH2 ARG 9 -3.289 1.565 -7.438 74 HH22 ARG 9 2HH2 ARG 9 -3.976 2.376 -6.071 75 H LYS 10 H LYS 10 -0.754 -0.191 -12.615 76 HA LYS 10 HA LYS 10 -0.831 -2.158 -14.858 77 HB2 LYS 10 2HB LYS 10 1.485 -0.716 -13.561 78 HB3 LYS 10 1HB LYS 10 1.680 -2.063 -14.676 79 HG2 LYS 10 2HG LYS 10 0.371 -0.805 -16.377 80 HG3 LYS 10 1HG LYS 10 0.305 0.566 -15.268 81 HD2 LYS 10 2HD LYS 10 2.803 0.602 -15.230 82 HD3 LYS 10 1HD LYS 10 2.808 -0.684 -16.438 83 HE2 LYS 10 2HE LYS 10 1.061 1.233 -17.481 84 HE3 LYS 10 1HE LYS 10 2.386 2.176 -16.797 85 HZ1 LYS 10 1HZ LYS 10 3.341 -0.121 -18.181 86 HZ2 LYS 10 2HZ LYS 10 3.739 1.515 -18.405 87 HZ3 LYS 10 3HZ LYS 10 2.391 0.850 -19.197 88 H SER 11 H SER 11 1.085 -3.855 -14.258 89 HA SER 11 HA SER 11 0.457 -4.900 -11.522 90 HB2 SER 11 2HB SER 11 0.408 -7.138 -12.419 91 HB3 SER 11 1HB SER 11 -0.657 -6.151 -13.412 92 HG SER 11 HG SER 11 1.977 -6.176 -14.205 93 H VAL 12 H VAL 12 2.192 -6.112 -10.529 94 HA VAL 12 HA VAL 12 4.822 -5.953 -11.900 95 HB VAL 12 HB VAL 12 4.152 -4.789 -9.210 96 HG11 VAL 12 1HG1 VAL 12 6.755 -5.846 -10.275 97 HG12 VAL 12 2HG1 VAL 12 6.083 -5.989 -8.651 98 HG13 VAL 12 3HG1 VAL 12 6.753 -4.452 -9.194 99 HG21 VAL 12 1HG2 VAL 12 5.028 -2.788 -10.122 100 HG22 VAL 12 2HG2 VAL 12 4.102 -3.490 -11.449 101 HG23 VAL 12 3HG2 VAL 12 5.858 -3.652 -11.417 102 H VAL 13 H VAL 13 6.344 -7.499 -11.152 103 HA VAL 13 HA VAL 13 5.087 -9.764 -9.673 104 HB VAL 13 HB VAL 13 7.647 -9.707 -11.305 105 HG11 VAL 13 1HG1 VAL 13 7.673 -11.488 -9.664 106 HG12 VAL 13 2HG1 VAL 13 7.316 -12.204 -11.235 107 HG13 VAL 13 3HG1 VAL 13 6.019 -11.945 -10.068 108 HG21 VAL 13 1HG2 VAL 13 5.169 -9.412 -12.348 109 HG22 VAL 13 2HG2 VAL 13 5.223 -11.171 -12.220 110 HG23 VAL 13 3HG2 VAL 13 6.444 -10.317 -13.165 111 H VAL 14 H VAL 14 5.842 -10.296 -7.655 112 HA VAL 14 HA VAL 14 8.383 -9.005 -6.744 113 HB VAL 14 HB VAL 14 7.371 -8.548 -4.591 114 HG11 VAL 14 1HG1 VAL 14 5.378 -7.713 -6.712 115 HG12 VAL 14 2HG1 VAL 14 6.969 -6.972 -6.541 116 HG13 VAL 14 3HG1 VAL 14 5.794 -6.851 -5.231 117 HG21 VAL 14 1HG2 VAL 14 5.921 -10.411 -4.267 118 HG22 VAL 14 2HG2 VAL 14 5.045 -10.087 -5.763 119 HG23 VAL 14 3HG2 VAL 14 4.850 -9.014 -4.377 120 H ALA 15 H ALA 15 9.495 -10.201 -5.038 121 HA ALA 15 HA ALA 15 9.078 -13.107 -5.320 122 HB1 ALA 15 1HB ALA 15 11.353 -11.699 -5.214 123 HB2 ALA 15 2HB ALA 15 11.257 -13.350 -4.601 124 HB3 ALA 15 3HB ALA 15 11.149 -11.987 -3.486 125 H ALA 16 H ALA 16 7.201 -13.512 -4.115 126 HA ALA 16 HA ALA 16 7.567 -13.748 -1.245 127 HB1 ALA 16 1HB ALA 16 6.566 -11.292 -2.112 128 HB2 ALA 16 2HB ALA 16 6.410 -11.955 -0.485 129 HB3 ALA 16 3HB ALA 16 5.122 -12.202 -1.664 130 H SER 17 H SER 17 5.981 -15.181 -0.361 131 HA SER 17 HA SER 17 4.679 -16.882 -2.313 132 HB2 SER 17 2HB SER 17 3.994 -18.207 -0.446 133 HB3 SER 17 1HB SER 17 5.587 -17.587 -0.027 134 HG SER 17 HG SER 17 3.048 -16.634 0.807 135 H VAL 18 H VAL 18 2.370 -17.206 -2.514 136 HA VAL 18 HA VAL 18 0.844 -14.812 -2.673 137 HB VAL 18 HB VAL 18 -0.816 -17.185 -2.283 138 HG11 VAL 18 1HG1 VAL 18 -1.232 -14.974 -3.578 139 HG12 VAL 18 2HG1 VAL 18 -1.774 -16.478 -4.320 140 HG13 VAL 18 3HG1 VAL 18 -0.279 -15.715 -4.862 141 HG21 VAL 18 1HG2 VAL 18 0.080 -18.311 -4.379 142 HG22 VAL 18 2HG2 VAL 18 1.098 -18.478 -2.950 143 HG23 VAL 18 3HG2 VAL 18 1.522 -17.312 -4.208 144 H GLU 19 H GLU 19 0.969 -17.334 -0.177 145 HA GLU 19 HA GLU 19 -1.115 -16.336 1.483 146 HB2 GLU 19 2HB GLU 19 1.444 -17.778 2.243 147 HB3 GLU 19 1HB GLU 19 0.070 -17.537 3.323 148 HG2 GLU 19 2HG GLU 19 -1.381 -18.752 1.713 149 HG3 GLU 19 1HG GLU 19 0.028 -19.045 0.692 150 H HIS 20 H HIS 20 2.286 -15.441 1.178 151 HA HIS 20 HA HIS 20 2.482 -13.752 3.454 152 HB2 HIS 20 2HB HIS 20 4.370 -14.558 1.963 153 HB3 HIS 20 1HB HIS 20 3.861 -13.347 0.787 154 HD1 HIS 20 1HD HIS 20 4.637 -13.403 4.525 155 HD2 HIS 20 2HD HIS 20 5.195 -10.967 1.184 156 HE1 HIS 20 1HE HIS 20 5.950 -11.394 5.315 157 HE2 HIS 20 2HE HIS 20 6.297 -9.905 3.292 158 H CYS 21 H CYS 21 1.374 -13.146 0.138 159 HA CYS 21 HA CYS 21 1.140 -10.344 0.215 160 HB2 CYS 21 2HB CYS 21 -0.704 -12.340 -1.136 161 HB3 CYS 21 1HB CYS 21 -0.566 -10.631 -1.540 162 HG CYS 21 HG CYS 21 1.210 -12.717 -2.651 163 H PHE 22 H PHE 22 -1.511 -12.684 0.866 164 HA PHE 22 HA PHE 22 -3.239 -10.612 1.914 165 HB2 PHE 22 2HB PHE 22 -3.546 -13.533 2.565 166 HB3 PHE 22 1HB PHE 22 -4.802 -12.326 2.269 167 HD1 PHE 22 1HD PHE 22 -5.310 -11.568 -0.038 168 HD2 PHE 22 2HD PHE 22 -2.382 -14.605 0.751 169 HE1 PHE 22 1HE PHE 22 -5.315 -12.199 -2.436 170 HE2 PHE 22 2HE PHE 22 -2.388 -15.239 -1.640 171 HZ PHE 22 HZ PHE 22 -3.852 -14.036 -3.236 172 H GLU 23 H GLU 23 -1.040 -12.959 3.342 173 HA GLU 23 HA GLU 23 -1.796 -12.527 6.078 174 HB2 GLU 23 2HB GLU 23 -0.485 -14.483 5.244 175 HB3 GLU 23 1HB GLU 23 0.880 -13.405 4.973 176 HG2 GLU 23 2HG GLU 23 0.856 -12.801 7.376 177 HG3 GLU 23 1HG GLU 23 -0.451 -13.953 7.631 178 H VAL 24 H VAL 24 0.458 -10.890 3.914 179 HA VAL 24 HA VAL 24 1.850 -9.400 5.923 180 HB VAL 24 HB VAL 24 1.510 -9.211 2.964 181 HG11 VAL 24 1HG1 VAL 24 3.048 -7.147 3.133 182 HG12 VAL 24 2HG1 VAL 24 2.456 -7.003 4.789 183 HG13 VAL 24 3HG1 VAL 24 1.328 -6.902 3.436 184 HG21 VAL 24 1HG2 VAL 24 3.898 -9.237 4.836 185 HG22 VAL 24 2HG2 VAL 24 3.971 -9.326 3.076 186 HG23 VAL 24 3HG2 VAL 24 3.245 -10.644 3.996 187 H PHE 25 H PHE 25 -0.966 -8.503 3.878 188 HA PHE 25 HA PHE 25 -1.189 -5.833 4.834 189 HB2 PHE 25 2HB PHE 25 -3.634 -7.468 4.225 190 HB3 PHE 25 1HB PHE 25 -3.305 -5.780 3.841 191 HD1 PHE 25 1HD PHE 25 -4.034 -8.494 2.183 192 HD2 PHE 25 2HD PHE 25 -0.611 -5.944 2.629 193 HE1 PHE 25 1HE PHE 25 -3.230 -9.178 -0.069 194 HE2 PHE 25 2HE PHE 25 0.198 -6.627 0.385 195 HZ PHE 25 HZ PHE 25 -1.114 -8.245 -0.965 196 H THR 26 H THR 26 -2.858 -8.773 5.968 197 HA THR 26 HA THR 26 -4.078 -7.355 8.195 198 HB THR 26 HB THR 26 -5.001 -9.523 8.777 199 HG1 THR 26 1HG THR 26 -2.776 -10.438 7.917 200 HG21 THR 26 1HG2 THR 26 -5.985 -10.148 6.546 201 HG22 THR 26 2HG2 THR 26 -4.863 -9.011 5.798 202 HG23 THR 26 3HG2 THR 26 -6.092 -8.428 6.922 203 H SER 27 H SER 27 -1.051 -8.985 7.722 204 HA SER 27 HA SER 27 -0.606 -9.741 10.468 205 HB2 SER 27 2HB SER 27 1.181 -9.308 8.101 206 HB3 SER 27 1HB SER 27 1.872 -9.594 9.693 207 HG SER 27 HG SER 27 1.579 -11.603 9.051 208 H ARG 28 H ARG 28 0.988 -7.091 8.652 209 HA ARG 28 HA ARG 28 0.400 -5.068 10.586 210 HB2 ARG 28 2HB ARG 28 2.726 -4.878 11.563 211 HB3 ARG 28 1HB ARG 28 1.808 -6.275 12.125 212 HG2 ARG 28 2HG ARG 28 3.238 -6.932 9.697 213 HG3 ARG 28 1HG ARG 28 4.346 -6.290 10.905 214 HD2 ARG 28 2HD ARG 28 2.323 -8.414 11.589 215 HD3 ARG 28 1HD ARG 28 3.923 -8.818 10.968 216 HE ARG 28 HE ARG 28 4.342 -7.047 13.111 217 HH11 ARG 28 1HH1 ARG 28 4.795 -7.840 15.179 218 HH12 ARG 28 2HH1 ARG 28 4.319 -9.453 15.597 219 HH21 ARG 28 1HH2 ARG 28 2.913 -10.125 12.499 220 HH22 ARG 28 2HH2 ARG 28 3.254 -10.746 14.080 221 HA PRO 29 HA PRO 29 1.949 -3.773 6.392 222 HB2 PRO 29 2HB PRO 29 0.118 -1.537 7.093 223 HB3 PRO 29 1HB PRO 29 0.237 -2.470 5.590 224 HG2 PRO 29 2HG PRO 29 -1.775 -2.833 7.299 225 HG3 PRO 29 1HG PRO 29 -1.073 -4.174 6.382 226 HD2 PRO 29 2HD PRO 29 -0.727 -3.488 9.271 227 HD3 PRO 29 1HD PRO 29 -0.767 -5.082 8.486 228 H ALA 30 H ALA 30 1.922 -2.269 9.527 229 HA ALA 30 HA ALA 30 3.268 0.170 8.896 230 HB1 ALA 30 1HB ALA 30 2.547 -1.327 11.277 231 HB2 ALA 30 2HB ALA 30 2.748 0.414 11.074 232 HB3 ALA 30 3HB ALA 30 4.145 -0.598 11.444 233 H ASP 31 H ASP 31 4.400 -3.065 8.845 234 HA ASP 31 HA ASP 31 7.104 -2.784 9.614 235 HB2 ASP 31 2HB ASP 31 5.849 -4.490 7.448 236 HB3 ASP 31 1HB ASP 31 7.535 -4.636 7.943 237 H TRP 32 H TRP 32 5.473 -1.768 6.657 238 HA TRP 32 HA TRP 32 8.002 -0.406 5.853 239 HB2 TRP 32 2HB TRP 32 7.079 -1.016 3.421 240 HB3 TRP 32 1HB TRP 32 8.123 -2.122 4.313 241 HD1 TRP 32 HD TRP 32 7.183 -4.434 4.840 242 HE1 TRP 32 1HE TRP 32 4.878 -5.564 4.653 243 HE3 TRP 32 3HE TRP 32 4.346 -0.404 3.564 244 HZ2 TRP 32 2HZ TRP 32 2.186 -4.847 4.045 245 HZ3 TRP 32 3HZ TRP 32 1.909 -0.648 3.181 246 HH2 TRP 32 HH TRP 32 0.823 -2.866 3.418 247 H TRP 33 H TRP 33 4.844 -0.019 6.688 248 HA TRP 33 HA TRP 33 3.840 1.731 4.660 249 HB2 TRP 33 2HB TRP 33 2.640 0.665 6.757 250 HB3 TRP 33 1HB TRP 33 3.108 2.177 7.533 251 HD1 TRP 33 HD TRP 33 2.246 4.471 6.337 252 HE1 TRP 33 1HE TRP 33 0.090 4.920 5.000 253 HE3 TRP 33 3HE TRP 33 0.897 -0.321 5.202 254 HZ2 TRP 33 2HZ TRP 33 -1.939 3.443 3.629 255 HZ3 TRP 33 3HZ TRP 33 -1.151 -0.771 3.882 256 HH2 TRP 33 HH TRP 33 -2.570 1.103 3.094 257 HA PRO 34 HA PRO 34 5.773 5.212 7.494 258 HB2 PRO 34 2HB PRO 34 8.229 3.913 8.454 259 HB3 PRO 34 1HB PRO 34 7.022 4.844 9.356 260 HG2 PRO 34 2HG PRO 34 7.297 2.187 9.627 261 HG3 PRO 34 1HG PRO 34 5.736 3.009 9.791 262 HD2 PRO 34 2HD PRO 34 6.795 1.419 7.480 263 HD3 PRO 34 1HD PRO 34 5.145 1.497 8.133 264 HA PRO 35 HA PRO 35 8.729 5.499 4.007 265 HB2 PRO 35 2HB PRO 35 7.869 7.808 2.959 266 HB3 PRO 35 1HB PRO 35 6.908 6.325 2.790 267 HG2 PRO 35 2HG PRO 35 6.498 8.647 4.588 268 HG3 PRO 35 1HG PRO 35 5.305 7.616 3.783 269 HD2 PRO 35 2HD PRO 35 6.165 7.389 6.474 270 HD3 PRO 35 1HD PRO 35 5.204 6.203 5.567 271 H SER 36 H SER 36 10.411 7.218 3.433 272 HA SER 36 HA SER 36 11.783 8.175 5.719 273 HB2 SER 36 2HB SER 36 11.900 9.347 2.922 274 HB3 SER 36 1HB SER 36 13.134 9.492 4.170 275 HG SER 36 HG SER 36 12.210 7.075 2.992 276 H HIS 37 H HIS 37 9.364 9.715 3.655 277 HA HIS 37 HA HIS 37 9.042 11.821 5.739 278 HB2 HIS 37 2HB HIS 37 10.377 12.760 3.851 279 HB3 HIS 37 1HB HIS 37 9.065 12.343 2.748 280 HD1 HIS 37 1HD HIS 37 9.459 14.299 6.012 281 HD2 HIS 37 2HD HIS 37 7.264 14.413 2.466 282 HE1 HIS 37 1HE HIS 37 8.032 16.392 6.117 283 HE2 HIS 37 2HE HIS 37 6.694 16.470 3.965 284 H VAL 38 H VAL 38 6.882 12.166 6.221 285 HA VAL 38 HA VAL 38 4.864 11.060 4.308 286 HB VAL 38 HB VAL 38 5.259 9.537 6.277 287 HG11 VAL 38 1HG1 VAL 38 3.990 11.792 7.852 288 HG12 VAL 38 2HG1 VAL 38 5.717 11.433 7.876 289 HG13 VAL 38 3HG1 VAL 38 4.560 10.246 8.476 290 HG21 VAL 38 1HG2 VAL 38 2.698 10.763 5.458 291 HG22 VAL 38 2HG2 VAL 38 2.644 9.912 7.001 292 HG23 VAL 38 3HG2 VAL 38 3.154 9.061 5.543 293 H LEU 39 H LEU 39 3.040 12.307 4.044 294 HA LEU 39 HA LEU 39 3.110 15.065 4.826 295 HB2 LEU 39 2HB LEU 39 0.747 13.417 3.869 296 HB3 LEU 39 1HB LEU 39 0.851 15.178 3.868 297 HG LEU 39 HG LEU 39 2.719 13.332 2.351 298 HD11 LEU 39 1HD1 LEU 39 0.079 14.147 1.736 299 HD12 LEU 39 2HD1 LEU 39 1.235 13.366 0.657 300 HD13 LEU 39 3HD1 LEU 39 1.145 15.126 0.729 301 HD21 LEU 39 1HD2 LEU 39 2.556 16.290 2.796 302 HD22 LEU 39 2HD2 LEU 39 3.102 15.707 1.224 303 HD23 LEU 39 3HD2 LEU 39 3.978 15.253 2.687 304 H VAL 40 H VAL 40 1.726 12.191 6.271 305 HA VAL 40 HA VAL 40 -0.157 13.350 8.038 306 HB VAL 40 HB VAL 40 1.671 11.048 8.731 307 HG11 VAL 40 1HG1 VAL 40 0.099 12.052 10.464 308 HG12 VAL 40 2HG1 VAL 40 -0.118 10.331 10.146 309 HG13 VAL 40 3HG1 VAL 40 -1.231 11.505 9.443 310 HG21 VAL 40 1HG2 VAL 40 0.141 9.579 7.569 311 HG22 VAL 40 2HG2 VAL 40 0.628 10.836 6.434 312 HG23 VAL 40 3HG2 VAL 40 -0.950 10.919 7.214 313 H LYS 41 H LYS 41 0.058 14.431 9.995 314 HA LYS 41 HA LYS 41 2.456 15.815 10.585 315 HB2 LYS 41 2HB LYS 41 0.186 16.447 11.428 316 HB3 LYS 41 1HB LYS 41 0.271 15.086 12.543 317 HG2 LYS 41 2HG LYS 41 2.264 16.028 13.601 318 HG3 LYS 41 1HG LYS 41 2.271 17.358 12.443 319 HD2 LYS 41 2HD LYS 41 1.242 18.143 14.497 320 HD3 LYS 41 1HD LYS 41 -0.008 18.011 13.260 321 HE2 LYS 41 2HE LYS 41 -1.019 16.204 14.274 322 HE3 LYS 41 1HE LYS 41 0.492 15.612 14.965 323 HZ1 LYS 41 1HZ LYS 41 -0.036 18.125 16.061 324 HZ2 LYS 41 2HZ LYS 41 -0.022 16.619 16.848 325 HZ3 LYS 41 3HZ LYS 41 -1.463 17.216 16.173 326 H LYS 42 H LYS 42 1.207 12.728 11.799 327 HA LYS 42 HA LYS 42 3.881 12.259 13.053 328 HB2 LYS 42 2HB LYS 42 1.220 11.207 14.024 329 HB3 LYS 42 1HB LYS 42 2.785 10.945 14.786 330 HG2 LYS 42 2HG LYS 42 2.180 13.779 14.318 331 HG3 LYS 42 1HG LYS 42 1.041 12.992 15.410 332 HD2 LYS 42 2HD LYS 42 2.903 13.885 16.707 333 HD3 LYS 42 1HD LYS 42 2.973 12.123 16.733 334 HE2 LYS 42 2HE LYS 42 4.746 12.060 15.156 335 HE3 LYS 42 1HE LYS 42 4.488 13.738 14.679 336 HZ1 LYS 42 1HZ LYS 42 6.357 13.011 16.395 337 HZ2 LYS 42 2HZ LYS 42 5.079 13.250 17.489 338 HZ3 LYS 42 3HZ LYS 42 5.582 14.517 16.475 339 H GLU 43 H GLU 43 4.826 10.271 12.602 340 HA GLU 43 HA GLU 43 3.910 8.826 10.297 341 HB2 GLU 43 2HB GLU 43 5.899 8.023 12.430 342 HB3 GLU 43 1HB GLU 43 5.697 7.210 10.879 343 HG2 GLU 43 2HG GLU 43 6.247 9.339 9.720 344 HG3 GLU 43 1HG GLU 43 6.517 10.102 11.288 345 H ARG 44 H ARG 44 2.597 7.022 10.159 346 HA ARG 44 HA ARG 44 1.113 6.257 12.553 347 HB2 ARG 44 2HB ARG 44 1.041 5.244 9.703 348 HB3 ARG 44 1HB ARG 44 0.002 4.619 10.985 349 HG2 ARG 44 2HG ARG 44 -0.638 7.093 11.400 350 HG3 ARG 44 1HG ARG 44 0.069 7.397 9.814 351 HD2 ARG 44 2HD ARG 44 -1.492 5.943 8.737 352 HD3 ARG 44 1HD ARG 44 -2.037 5.283 10.279 353 HE ARG 44 HE ARG 44 -3.293 7.275 10.667 354 HH11 ARG 44 1HH1 ARG 44 -4.350 9.087 9.833 355 HH12 ARG 44 2HH1 ARG 44 -3.860 9.735 8.303 356 HH21 ARG 44 1HH2 ARG 44 -1.366 7.384 7.798 357 HH22 ARG 44 2HH2 ARG 44 -2.176 8.770 7.153 358 H ALA 45 H ALA 45 1.212 4.299 13.644 359 HA ALA 45 HA ALA 45 3.434 2.462 12.848 360 HB1 ALA 45 1HB ALA 45 3.031 2.659 15.734 361 HB2 ALA 45 2HB ALA 45 3.524 4.192 15.013 362 HB3 ALA 45 3HB ALA 45 4.525 2.755 14.799 363 H GLY 46 H GLY 46 0.249 2.850 14.295 364 HA2 GLY 46 2HA GLY 46 0.109 -0.124 14.630 365 HA3 GLY 46 1HA GLY 46 -0.918 1.021 15.485 366 H LEU 47 H LEU 47 -1.688 -1.251 13.743 367 HA LEU 47 HA LEU 47 -3.581 0.253 12.047 368 HB2 LEU 47 2HB LEU 47 -1.759 -1.904 10.934 369 HB3 LEU 47 1HB LEU 47 -3.121 -1.183 10.082 370 HG LEU 47 HG LEU 47 -1.938 1.089 10.601 371 HD11 LEU 47 1HD1 LEU 47 0.132 1.038 11.493 372 HD12 LEU 47 2HD1 LEU 47 0.664 -0.163 10.319 373 HD13 LEU 47 3HD1 LEU 47 -0.109 -0.679 11.815 374 HD21 LEU 47 1HD2 LEU 47 -1.559 -0.910 8.490 375 HD22 LEU 47 2HD2 LEU 47 -0.218 0.228 8.605 376 HD23 LEU 47 3HD2 LEU 47 -1.859 0.821 8.355 377 H ALA 48 H ALA 48 -5.570 -0.740 12.061 378 HA ALA 48 HA ALA 48 -5.765 -3.643 12.524 379 HB1 ALA 48 1HB ALA 48 -5.771 -3.019 14.813 380 HB2 ALA 48 2HB ALA 48 -7.479 -3.167 14.401 381 HB3 ALA 48 3HB ALA 48 -6.731 -1.573 14.501 382 H PHE 49 H PHE 49 -7.380 -4.362 11.200 383 HA PHE 49 HA PHE 49 -9.761 -2.663 10.794 384 HB2 PHE 49 2HB PHE 49 -9.592 -2.802 8.336 385 HB3 PHE 49 1HB PHE 49 -8.227 -1.927 9.030 386 HD1 PHE 49 1HD PHE 49 -9.297 -4.897 7.208 387 HD2 PHE 49 2HD PHE 49 -6.010 -3.033 9.250 388 HE1 PHE 49 1HE PHE 49 -7.726 -6.469 6.113 389 HE2 PHE 49 2HE PHE 49 -4.437 -4.608 8.158 390 HZ PHE 49 HZ PHE 49 -5.293 -6.319 6.584 391 H GLU 50 H GLU 50 -11.585 -3.829 10.067 392 HA GLU 50 HA GLU 50 -11.407 -6.739 10.509 393 HB2 GLU 50 2HB GLU 50 -13.903 -5.211 9.784 394 HB3 GLU 50 1HB GLU 50 -13.759 -6.687 10.736 395 HG2 GLU 50 2HG GLU 50 -12.337 -5.183 12.350 396 HG3 GLU 50 1HG GLU 50 -13.172 -3.855 11.544 397 HA PRO 51 HA PRO 51 -11.176 -6.932 5.962 398 HB2 PRO 51 2HB PRO 51 -10.471 -9.550 5.755 399 HB3 PRO 51 1HB PRO 51 -9.320 -8.267 6.173 400 HG2 PRO 51 2HG PRO 51 -10.638 -10.270 7.916 401 HG3 PRO 51 1HG PRO 51 -9.014 -9.573 8.017 402 HD2 PRO 51 2HD PRO 51 -11.169 -8.793 9.589 403 HD3 PRO 51 1HD PRO 51 -9.724 -7.804 9.292 404 H PHE 52 H PHE 52 -13.443 -6.705 5.581 405 HA PHE 52 HA PHE 52 -14.763 -9.168 4.723 406 HB2 PHE 52 2HB PHE 52 -16.095 -7.483 6.869 407 HB3 PHE 52 1HB PHE 52 -16.719 -8.967 6.147 408 HD1 PHE 52 1HD PHE 52 -15.450 -11.136 6.490 409 HD2 PHE 52 2HD PHE 52 -14.559 -7.547 8.674 410 HE1 PHE 52 1HE PHE 52 -14.206 -12.468 8.173 411 HE2 PHE 52 2HE PHE 52 -13.321 -8.877 10.356 412 HZ PHE 52 HZ PHE 52 -13.138 -11.337 10.105 413 H VAL 53 H VAL 53 -17.142 -8.410 3.937 414 HA VAL 53 HA VAL 53 -16.623 -6.128 2.176 415 HB VAL 53 HB VAL 53 -19.240 -7.613 2.574 416 HG11 VAL 53 1HG1 VAL 53 -19.283 -6.920 0.021 417 HG12 VAL 53 2HG1 VAL 53 -18.136 -5.688 0.552 418 HG13 VAL 53 3HG1 VAL 53 -19.748 -5.762 1.267 419 HG21 VAL 53 1HG2 VAL 53 -18.444 -9.382 1.410 420 HG22 VAL 53 2HG2 VAL 53 -16.835 -8.745 1.741 421 HG23 VAL 53 3HG2 VAL 53 -17.649 -8.341 0.231 422 H GLY 54 H GLY 54 -17.046 -4.046 2.776 423 HA2 GLY 54 2HA GLY 54 -18.217 -2.250 3.782 424 HA3 GLY 54 1HA GLY 54 -19.404 -3.409 4.387 425 H GLY 55 H GLY 55 -16.089 -4.155 4.950 426 HA2 GLY 55 2HA GLY 55 -16.454 -4.109 7.824 427 HA3 GLY 55 1HA GLY 55 -14.937 -4.427 6.981 428 H ARG 56 H ARG 56 -14.521 -2.920 9.095 429 HA ARG 56 HA ARG 56 -14.461 -0.097 8.085 430 HB2 ARG 56 2HB ARG 56 -14.553 -1.126 10.938 431 HB3 ARG 56 1HB ARG 56 -14.368 0.570 10.487 432 HG2 ARG 56 2HG ARG 56 -16.527 0.435 9.242 433 HG3 ARG 56 1HG ARG 56 -16.723 -1.219 9.821 434 HD2 ARG 56 2HD ARG 56 -16.549 -0.335 12.175 435 HD3 ARG 56 1HD ARG 56 -16.584 1.296 11.504 436 HE ARG 56 HE ARG 56 -18.828 0.138 10.410 437 HH11 ARG 56 1HH1 ARG 56 -20.847 0.126 11.424 438 HH12 ARG 56 2HH1 ARG 56 -20.936 0.233 13.151 439 HH21 ARG 56 1HH2 ARG 56 -17.499 0.392 13.582 440 HH22 ARG 56 2HH2 ARG 56 -19.040 0.384 14.372 441 H TYR 57 H TYR 57 -12.459 0.879 7.989 442 HA TYR 57 HA TYR 57 -10.151 -0.722 9.020 443 HB2 TYR 57 2HB TYR 57 -10.504 -0.398 6.450 444 HB3 TYR 57 1HB TYR 57 -9.940 1.245 6.751 445 HD1 TYR 57 1HD TYR 57 -8.928 -2.059 6.008 446 HD2 TYR 57 2HD TYR 57 -7.743 1.418 8.235 447 HE1 TYR 57 1HE TYR 57 -6.584 -2.874 6.026 448 HE2 TYR 57 2HE TYR 57 -5.400 0.605 8.253 449 HH TYR 57 HH TYR 57 -4.490 -2.422 6.603 450 H TYR 58 H TYR 58 -8.918 0.297 10.512 451 HA TYR 58 HA TYR 58 -8.791 3.252 10.513 452 HB2 TYR 58 2HB TYR 58 -9.245 3.305 12.969 453 HB3 TYR 58 1HB TYR 58 -10.640 2.780 12.022 454 HD1 TYR 58 1HD TYR 58 -10.885 0.221 11.639 455 HD2 TYR 58 2HD TYR 58 -8.475 1.963 14.734 456 HE1 TYR 58 1HE TYR 58 -10.965 -1.915 12.900 457 HE2 TYR 58 2HE TYR 58 -8.553 -0.173 15.995 458 HH TYR 58 HH TYR 58 -10.700 -2.714 15.177 459 H GLU 59 H GLU 59 -6.963 4.052 11.790 460 HA GLU 59 HA GLU 59 -4.992 1.957 12.568 461 HB2 GLU 59 2HB GLU 59 -4.372 4.372 10.835 462 HB3 GLU 59 1HB GLU 59 -3.207 3.169 11.394 463 HG2 GLU 59 2HG GLU 59 -4.475 1.406 10.190 464 HG3 GLU 59 1HG GLU 59 -5.588 2.635 9.592 465 H TRP 60 H TRP 60 -3.311 2.824 14.049 466 HA TRP 60 HA TRP 60 -4.392 5.120 15.624 467 HB2 TRP 60 2HB TRP 60 -2.421 2.938 16.364 468 HB3 TRP 60 1HB TRP 60 -2.851 4.284 17.416 469 HD1 TRP 60 HD TRP 60 -5.479 4.437 18.155 470 HE1 TRP 60 1HE TRP 60 -7.164 2.538 18.603 471 HE3 TRP 60 3HE TRP 60 -3.141 0.596 15.737 472 HZ2 TRP 60 2HZ TRP 60 -7.476 -0.243 18.016 473 HZ3 TRP 60 3HZ TRP 60 -4.151 -1.666 15.697 474 HH2 TRP 60 HH TRP 60 -6.314 -2.090 16.832 475 H ASP 61 H ASP 61 -3.230 6.993 15.762 476 HA ASP 61 HA ASP 61 -0.623 7.084 14.328 477 HB2 ASP 61 2HB ASP 61 -2.434 9.291 15.352 478 HB3 ASP 61 1HB ASP 61 -0.917 9.559 14.496 479 H ILE 62 H ILE 62 1.217 8.140 15.406 480 HA ILE 62 HA ILE 62 1.735 7.214 18.005 481 HB ILE 62 HB ILE 62 2.906 9.645 16.649 482 HG12 ILE 62 2HG1 ILE 62 3.965 6.826 16.814 483 HG13 ILE 62 1HG1 ILE 62 3.076 7.449 15.432 484 HG21 ILE 62 1HG2 ILE 62 4.050 9.946 18.558 485 HG22 ILE 62 2HG2 ILE 62 4.763 8.351 18.323 486 HG23 ILE 62 3HG2 ILE 62 3.288 8.524 19.271 487 HD11 ILE 62 1HD1 ILE 62 5.696 8.508 16.516 488 HD12 ILE 62 2HD1 ILE 62 4.771 9.280 15.228 489 HD13 ILE 62 3HD1 ILE 62 5.454 7.672 14.982 490 H ASP 63 H ASP 63 0.401 10.341 16.990 491 HA ASP 63 HA ASP 63 -0.297 10.849 19.859 492 HB2 ASP 63 2HB ASP 63 1.452 12.405 18.976 493 HB3 ASP 63 1HB ASP 63 0.308 12.931 17.740 494 H GLY 64 H GLY 64 -1.339 10.776 16.537 495 HA2 GLY 64 2HA GLY 64 -3.882 12.119 17.068 496 HA3 GLY 64 1HA GLY 64 -3.431 11.318 15.562 497 H THR 65 H THR 65 -5.930 11.086 17.118 498 HA THR 65 HA THR 65 -6.003 8.536 18.456 499 HB THR 65 HB THR 65 -8.291 8.912 18.675 500 HG1 THR 65 1HG THR 65 -9.493 9.494 17.042 501 HG21 THR 65 1HG2 THR 65 -7.473 11.720 17.968 502 HG22 THR 65 2HG2 THR 65 -6.808 10.908 19.385 503 HG23 THR 65 3HG2 THR 65 -8.546 11.179 19.259 504 H GLU 66 H GLU 66 -8.436 7.653 16.983 505 HA GLU 66 HA GLU 66 -7.028 6.094 14.910 506 HB2 GLU 66 2HB GLU 66 -9.801 5.876 16.105 507 HB3 GLU 66 1HB GLU 66 -9.173 4.799 14.864 508 HG2 GLU 66 2HG GLU 66 -7.311 4.169 16.358 509 HG3 GLU 66 1HG GLU 66 -7.972 5.218 17.613 510 H ILE 67 H ILE 67 -7.251 6.524 12.769 511 HA ILE 67 HA ILE 67 -9.549 8.242 11.909 512 HB ILE 67 HB ILE 67 -6.731 8.269 10.784 513 HG12 ILE 67 2HG1 ILE 67 -8.229 10.316 12.454 514 HG13 ILE 67 1HG1 ILE 67 -6.869 9.336 13.004 515 HG21 ILE 67 1HG2 ILE 67 -9.233 9.035 9.667 516 HG22 ILE 67 2HG2 ILE 67 -7.623 9.324 9.009 517 HG23 ILE 67 3HG2 ILE 67 -8.369 10.519 10.068 518 HD11 ILE 67 1HD1 ILE 67 -5.796 10.394 10.753 519 HD12 ILE 67 2HD1 ILE 67 -5.652 11.156 12.339 520 HD13 ILE 67 3HD1 ILE 67 -6.894 11.698 11.209 521 H VAL 68 H VAL 68 -10.628 7.524 10.064 522 HA VAL 68 HA VAL 68 -10.247 4.784 9.271 523 HB VAL 68 HB VAL 68 -11.754 6.970 7.800 524 HG11 VAL 68 1HG1 VAL 68 -11.313 4.857 6.534 525 HG12 VAL 68 2HG1 VAL 68 -13.028 5.122 6.851 526 HG13 VAL 68 3HG1 VAL 68 -12.122 3.959 7.819 527 HG21 VAL 68 1HG2 VAL 68 -12.367 6.636 10.248 528 HG22 VAL 68 2HG2 VAL 68 -12.830 4.987 9.824 529 HG23 VAL 68 3HG2 VAL 68 -13.679 6.355 9.103 530 H TRP 69 H TRP 69 -8.831 3.984 7.789 531 HA TRP 69 HA TRP 69 -7.324 5.934 6.121 532 HB2 TRP 69 2HB TRP 69 -5.741 4.625 7.205 533 HB3 TRP 69 1HB TRP 69 -6.763 3.188 7.181 534 HD1 TRP 69 HD TRP 69 -4.179 5.057 5.170 535 HE1 TRP 69 1HE TRP 69 -3.584 3.698 3.062 536 HE3 TRP 69 3HE TRP 69 -7.799 1.462 5.386 537 HZ2 TRP 69 2HZ TRP 69 -4.517 1.388 1.655 538 HZ3 TRP 69 3HZ TRP 69 -7.923 -0.304 3.651 539 HH2 TRP 69 HH TRP 69 -6.288 -0.348 1.787 540 H GLY 70 H GLY 70 -9.910 3.809 5.881 541 HA2 GLY 70 2HA GLY 70 -10.508 4.149 3.221 542 HA3 GLY 70 1HA GLY 70 -9.374 2.797 3.199 543 H ARG 71 H ARG 71 -10.793 1.099 2.744 544 HA ARG 71 HA ARG 71 -12.459 0.193 4.953 545 HB2 ARG 71 2HB ARG 71 -13.778 1.883 3.304 546 HB3 ARG 71 1HB ARG 71 -14.030 0.371 2.437 547 HG2 ARG 71 2HG ARG 71 -14.890 -0.671 4.511 548 HG3 ARG 71 1HG ARG 71 -14.678 0.863 5.354 549 HD2 ARG 71 2HD ARG 71 -16.990 0.717 4.668 550 HD3 ARG 71 1HD ARG 71 -16.202 1.923 3.651 551 HE ARG 71 HE ARG 71 -15.928 -0.298 2.118 552 HH11 ARG 71 1HH1 ARG 71 -17.495 -1.149 0.732 553 HH12 ARG 71 2HH1 ARG 71 -19.172 -0.872 1.067 554 HH21 ARG 71 1HH2 ARG 71 -18.567 0.980 3.935 555 HH22 ARG 71 2HH2 ARG 71 -19.778 0.332 2.880 556 H ILE 72 H ILE 72 -13.992 -1.650 3.352 557 HA ILE 72 HA ILE 72 -11.875 -3.198 1.938 558 HB ILE 72 HB ILE 72 -13.752 -4.274 4.063 559 HG12 ILE 72 2HG1 ILE 72 -11.243 -4.965 4.818 560 HG13 ILE 72 1HG1 ILE 72 -10.895 -3.453 3.981 561 HG21 ILE 72 1HG2 ILE 72 -12.453 -6.408 3.639 562 HG22 ILE 72 2HG2 ILE 72 -11.791 -5.637 2.197 563 HG23 ILE 72 3HG2 ILE 72 -13.527 -5.930 2.324 564 HD11 ILE 72 1HD1 ILE 72 -12.670 -2.343 5.352 565 HD12 ILE 72 2HD1 ILE 72 -11.336 -2.965 6.323 566 HD13 ILE 72 3HD1 ILE 72 -12.861 -3.846 6.253 567 H LEU 73 H LEU 73 -12.835 -4.903 0.516 568 HA LEU 73 HA LEU 73 -15.615 -4.182 -0.334 569 HB2 LEU 73 2HB LEU 73 -13.804 -3.450 -1.933 570 HB3 LEU 73 1HB LEU 73 -13.370 -5.148 -2.129 571 HG LEU 73 HG LEU 73 -15.942 -5.436 -2.649 572 HD11 LEU 73 1HD1 LEU 73 -16.579 -3.133 -2.114 573 HD12 LEU 73 2HD1 LEU 73 -16.828 -3.431 -3.834 574 HD13 LEU 73 3HD1 LEU 73 -15.420 -2.518 -3.292 575 HD21 LEU 73 1HD2 LEU 73 -13.724 -4.432 -4.407 576 HD22 LEU 73 2HD2 LEU 73 -15.335 -4.643 -5.093 577 HD23 LEU 73 3HD2 LEU 73 -14.494 -6.019 -4.381 578 H GLU 74 H GLU 74 -13.166 -6.770 -0.547 579 HA GLU 74 HA GLU 74 -14.910 -8.769 0.534 580 HB2 GLU 74 2HB GLU 74 -16.030 -8.427 -1.680 581 HB3 GLU 74 1HB GLU 74 -14.530 -8.919 -2.460 582 HG2 GLU 74 2HG GLU 74 -14.637 -11.085 -1.236 583 HG3 GLU 74 1HG GLU 74 -16.193 -10.596 -0.564 584 H TRP 75 H TRP 75 -13.702 -10.574 1.070 585 HA TRP 75 HA TRP 75 -10.868 -10.551 0.161 586 HB2 TRP 75 2HB TRP 75 -10.717 -10.587 2.462 587 HB3 TRP 75 1HB TRP 75 -12.264 -11.413 2.653 588 HD1 TRP 75 HD TRP 75 -8.564 -12.045 2.149 589 HE1 TRP 75 1HE TRP 75 -8.097 -14.571 2.382 590 HE3 TRP 75 3HE TRP 75 -13.351 -13.814 2.306 591 HZ2 TRP 75 2HZ TRP 75 -9.564 -17.018 2.606 592 HZ3 TRP 75 3HZ TRP 75 -13.789 -16.241 2.528 593 HH2 TRP 75 HH TRP 75 -11.904 -17.845 2.679 594 H ASP 76 H ASP 76 -10.301 -12.070 -1.315 595 HA ASP 76 HA ASP 76 -12.017 -14.500 -1.544 596 HB2 ASP 76 2HB ASP 76 -11.442 -12.634 -3.483 597 HB3 ASP 76 1HB ASP 76 -10.253 -13.897 -3.809 598 HA PRO 77 HA PRO 77 -8.567 -16.812 0.241 599 HB2 PRO 77 2HB PRO 77 -9.502 -18.681 -1.932 600 HB3 PRO 77 1HB PRO 77 -9.025 -19.062 -0.266 601 HG2 PRO 77 2HG PRO 77 -11.585 -18.868 -0.964 602 HG3 PRO 77 1HG PRO 77 -11.007 -18.330 0.621 603 HD2 PRO 77 2HD PRO 77 -11.986 -16.717 -1.643 604 HD3 PRO 77 1HD PRO 77 -11.810 -16.258 0.067 605 HA PRO 78 HA PRO 78 -4.815 -16.096 -1.957 606 HB2 PRO 78 2HB PRO 78 -4.789 -19.066 -2.403 607 HB3 PRO 78 1HB PRO 78 -3.467 -17.997 -1.894 608 HG2 PRO 78 2HG PRO 78 -4.978 -19.515 -0.181 609 HG3 PRO 78 1HG PRO 78 -4.092 -18.054 0.280 610 HD2 PRO 78 2HD PRO 78 -6.944 -18.431 0.254 611 HD3 PRO 78 1HD PRO 78 -6.053 -16.954 0.670 612 H HIS 79 H HIS 79 -6.024 -15.057 -3.698 613 HA HIS 79 HA HIS 79 -5.499 -16.024 -6.278 614 HB2 HIS 79 2HB HIS 79 -7.951 -17.128 -5.062 615 HB3 HIS 79 1HB HIS 79 -8.182 -16.419 -6.660 616 HD1 HIS 79 1HD HIS 79 -7.329 -19.531 -5.164 617 HD2 HIS 79 2HD HIS 79 -5.908 -17.452 -8.490 618 HE1 HIS 79 1HE HIS 79 -6.135 -21.231 -6.618 619 HE2 HIS 79 2HE HIS 79 -5.268 -19.975 -8.644 620 H ARG 80 H ARG 80 -8.069 -14.319 -4.401 621 HA ARG 80 HA ARG 80 -7.605 -12.009 -6.212 622 HB2 ARG 80 2HB ARG 80 -9.787 -13.626 -6.578 623 HB3 ARG 80 1HB ARG 80 -10.432 -12.386 -5.504 624 HG2 ARG 80 2HG ARG 80 -8.901 -11.791 -8.051 625 HG3 ARG 80 1HG ARG 80 -10.660 -11.806 -7.933 626 HD2 ARG 80 2HD ARG 80 -9.833 -10.199 -5.796 627 HD3 ARG 80 1HD ARG 80 -8.782 -9.733 -7.132 628 HE ARG 80 HE ARG 80 -11.497 -8.980 -6.908 629 HH11 ARG 80 1HH1 ARG 80 -12.617 -8.245 -8.727 630 HH12 ARG 80 2HH1 ARG 80 -12.038 -8.652 -10.307 631 HH21 ARG 80 1HH2 ARG 80 -9.327 -10.469 -9.136 632 HH22 ARG 80 2HH2 ARG 80 -10.176 -9.911 -10.539 633 H LEU 81 H LEU 81 -7.615 -10.080 -5.195 634 HA LEU 81 HA LEU 81 -8.672 -9.970 -2.399 635 HB2 LEU 81 2HB LEU 81 -6.175 -10.052 -2.423 636 HB3 LEU 81 1HB LEU 81 -6.165 -8.604 -3.429 637 HG LEU 81 HG LEU 81 -7.479 -7.432 -1.619 638 HD11 LEU 81 1HD1 LEU 81 -7.072 -8.658 0.682 639 HD12 LEU 81 2HD1 LEU 81 -7.044 -10.105 -0.325 640 HD13 LEU 81 3HD1 LEU 81 -8.473 -9.074 -0.303 641 HD21 LEU 81 1HD2 LEU 81 -4.698 -8.150 -1.698 642 HD22 LEU 81 2HD2 LEU 81 -5.211 -8.034 -0.014 643 HD23 LEU 81 3HD2 LEU 81 -5.431 -6.662 -1.099 644 H ALA 82 H ALA 82 -10.139 -8.335 -2.144 645 HA ALA 82 HA ALA 82 -9.981 -6.004 -4.007 646 HB1 ALA 82 1HB ALA 82 -12.223 -6.144 -4.605 647 HB2 ALA 82 2HB ALA 82 -12.657 -7.057 -3.160 648 HB3 ALA 82 3HB ALA 82 -11.814 -7.855 -4.486 649 H MET 83 H MET 83 -10.401 -4.028 -3.000 650 HA MET 83 HA MET 83 -11.497 -4.093 -0.241 651 HB2 MET 83 2HB MET 83 -8.888 -2.739 -0.976 652 HB3 MET 83 1HB MET 83 -9.660 -2.713 0.609 653 HG2 MET 83 2HG MET 83 -9.504 -5.227 0.642 654 HG3 MET 83 1HG MET 83 -8.549 -5.128 -0.838 655 HE1 MET 83 1HE MET 83 -6.805 -2.242 -0.103 656 HE2 MET 83 2HE MET 83 -6.705 -3.638 -1.174 657 HE3 MET 83 3HE MET 83 -5.412 -3.329 -0.017 658 H THR 84 H THR 84 -12.689 -2.252 0.266 659 HA THR 84 HA THR 84 -12.910 -0.218 -1.908 660 HB THR 84 HB THR 84 -14.684 -0.642 0.521 661 HG1 THR 84 1HG THR 84 -14.850 -2.394 -0.840 662 HG21 THR 84 1HG2 THR 84 -16.158 0.614 -1.425 663 HG22 THR 84 2HG2 THR 84 -14.565 1.337 -1.652 664 HG23 THR 84 3HG2 THR 84 -15.363 1.435 -0.083 665 H TRP 85 H TRP 85 -12.152 1.874 -1.501 666 HA TRP 85 HA TRP 85 -10.885 2.266 1.160 667 HB2 TRP 85 2HB TRP 85 -10.467 3.474 -1.558 668 HB3 TRP 85 1HB TRP 85 -9.906 4.326 -0.121 669 HD1 TRP 85 HD TRP 85 -9.837 0.566 0.044 670 HE1 TRP 85 1HE TRP 85 -7.398 -0.256 -0.061 671 HE3 TRP 85 3HE TRP 85 -7.488 4.931 -1.184 672 HZ2 TRP 85 2HZ TRP 85 -4.792 0.798 -0.596 673 HZ3 TRP 85 3HZ TRP 85 -5.029 4.993 -1.484 674 HH2 TRP 85 HH TRP 85 -3.679 2.934 -1.192 675 H ARG 86 H ARG 86 -11.998 3.427 2.637 676 HA ARG 86 HA ARG 86 -13.818 5.585 1.638 677 HB2 ARG 86 2HB ARG 86 -14.992 3.748 2.840 678 HB3 ARG 86 1HB ARG 86 -13.980 4.053 4.253 679 HG2 ARG 86 2HG ARG 86 -14.831 6.396 4.312 680 HG3 ARG 86 1HG ARG 86 -15.905 6.012 2.967 681 HD2 ARG 86 2HD ARG 86 -15.908 4.612 5.657 682 HD3 ARG 86 1HD ARG 86 -17.074 5.832 5.145 683 HE ARG 86 HE ARG 86 -16.874 3.545 3.327 684 HH11 ARG 86 1HH1 ARG 86 -18.744 2.283 3.183 685 HH12 ARG 86 2HH1 ARG 86 -19.998 2.479 4.362 686 HH21 ARG 86 1HH2 ARG 86 -18.320 4.950 6.125 687 HH22 ARG 86 2HH2 ARG 86 -19.758 3.990 6.027 688 H ILE 87 H ILE 87 -12.281 7.251 1.666 689 HA ILE 87 HA ILE 87 -11.491 8.166 4.371 690 HB ILE 87 HB ILE 87 -9.560 6.859 3.417 691 HG12 ILE 87 2HG1 ILE 87 -8.953 9.818 3.566 692 HG13 ILE 87 1HG1 ILE 87 -9.406 8.886 4.993 693 HG21 ILE 87 1HG2 ILE 87 -8.741 7.279 1.343 694 HG22 ILE 87 2HG2 ILE 87 -8.858 9.026 1.559 695 HG23 ILE 87 3HG2 ILE 87 -10.273 8.102 1.056 696 HD11 ILE 87 1HD1 ILE 87 -7.351 7.981 5.149 697 HD12 ILE 87 2HD1 ILE 87 -6.834 9.132 3.920 698 HD13 ILE 87 3HD1 ILE 87 -7.360 7.515 3.448 699 H ASP 88 H ASP 88 -10.793 10.488 4.305 700 HA ASP 88 HA ASP 88 -12.282 11.907 2.145 701 HB2 ASP 88 2HB ASP 88 -12.842 12.366 4.562 702 HB3 ASP 88 1HB ASP 88 -11.219 13.031 4.754 703 H GLY 89 H GLY 89 -11.262 13.567 0.948 704 HA2 GLY 89 2HA GLY 89 -8.408 13.226 0.541 705 HA3 GLY 89 1HA GLY 89 -9.430 14.414 -0.267 706 H HIS 90 H HIS 90 -10.353 15.274 2.544 707 HA HIS 90 HA HIS 90 -8.236 17.284 2.886 708 HB2 HIS 90 2HB HIS 90 -10.905 16.911 4.252 709 HB3 HIS 90 1HB HIS 90 -9.837 18.284 4.498 710 HD1 HIS 90 1HD HIS 90 -8.956 18.898 1.647 711 HD2 HIS 90 2HD HIS 90 -12.895 17.981 2.657 712 HE1 HIS 90 1HE HIS 90 -10.411 19.864 -0.191 713 HE2 HIS 90 2HE HIS 90 -12.812 19.308 0.412 714 H TRP 91 H TRP 91 -8.149 14.285 3.767 715 HA TRP 91 HA TRP 91 -7.212 13.092 5.551 716 HB2 TRP 91 2HB TRP 91 -6.040 15.817 5.723 717 HB3 TRP 91 1HB TRP 91 -5.886 14.809 7.163 718 HD1 TRP 91 HD TRP 91 -4.040 15.561 4.190 719 HE1 TRP 91 1HE TRP 91 -2.457 13.641 3.515 720 HE3 TRP 91 3HE TRP 91 -5.970 11.786 7.032 721 HZ2 TRP 91 2HZ TRP 91 -2.068 10.870 4.105 722 HZ3 TRP 91 3HZ TRP 91 -4.978 9.517 6.956 723 HH2 TRP 91 HH TRP 91 -3.028 9.055 5.496 724 H GLN 92 H GLN 92 -9.907 14.485 5.823 725 HA GLN 92 HA GLN 92 -10.008 14.881 8.758 726 HB2 GLN 92 2HB GLN 92 -12.149 15.212 6.638 727 HB3 GLN 92 1HB GLN 92 -12.333 15.610 8.348 728 HG2 GLN 92 2HG GLN 92 -10.308 16.847 6.460 729 HG3 GLN 92 1HG GLN 92 -11.782 17.617 7.036 730 HE21 GLN 92 1HE2 GLN 92 -8.601 17.830 7.571 731 HE22 GLN 92 2HE2 GLN 92 -8.571 18.116 9.245 732 H SER 93 H SER 93 -12.932 13.746 7.508 733 HA SER 93 HA SER 93 -12.336 10.895 7.895 734 HB2 SER 93 2HB SER 93 -13.702 10.553 9.810 735 HB3 SER 93 1HB SER 93 -12.719 11.958 10.204 736 HG SER 93 HG SER 93 -14.467 13.271 9.595 737 H VAL 94 H VAL 94 -14.151 9.550 7.225 738 HA VAL 94 HA VAL 94 -16.327 11.043 5.821 739 HB VAL 94 HB VAL 94 -16.007 8.823 4.257 740 HG11 VAL 94 1HG1 VAL 94 -14.599 10.488 2.803 741 HG12 VAL 94 2HG1 VAL 94 -14.955 11.636 4.093 742 HG13 VAL 94 3HG1 VAL 94 -16.272 10.887 3.190 743 HG21 VAL 94 1HG2 VAL 94 -13.718 8.349 3.914 744 HG22 VAL 94 2HG2 VAL 94 -13.875 8.413 5.670 745 HG23 VAL 94 3HG2 VAL 94 -13.197 9.786 4.794 746 HA PRO 95 HA PRO 95 -18.080 8.007 8.875 747 HB2 PRO 95 2HB PRO 95 -20.404 9.786 8.297 748 HB3 PRO 95 1HB PRO 95 -19.796 9.194 9.854 749 HG2 PRO 95 2HG PRO 95 -19.400 11.709 9.051 750 HG3 PRO 95 1HG PRO 95 -18.197 10.826 10.005 751 HD2 PRO 95 2HD PRO 95 -18.145 11.538 7.112 752 HD3 PRO 95 1HD PRO 95 -16.795 11.305 8.243 753 H ASP 96 H ASP 96 -18.930 8.975 5.645 754 HA ASP 96 HA ASP 96 -20.167 6.328 5.208 755 HB2 ASP 96 2HB ASP 96 -22.023 7.925 5.803 756 HB3 ASP 96 1HB ASP 96 -21.584 8.864 4.378 757 H ASP 97 H ASP 97 -19.991 5.657 3.012 758 HA ASP 97 HA ASP 97 -17.961 7.127 1.487 759 HB2 ASP 97 2HB ASP 97 -18.186 5.205 -0.110 760 HB3 ASP 97 1HB ASP 97 -17.803 4.704 1.537 761 H ASP 98 H ASP 98 -18.825 8.969 0.567 762 HA ASP 98 HA ASP 98 -21.469 8.883 -0.714 763 HB2 ASP 98 2HB ASP 98 -20.542 10.877 0.580 764 HB3 ASP 98 1HB ASP 98 -19.468 11.136 -0.791 765 H ARG 99 H ARG 99 -18.144 9.632 -1.728 766 HA ARG 99 HA ARG 99 -18.834 8.602 -4.442 767 HB2 ARG 99 2HB ARG 99 -17.129 11.006 -3.724 768 HB3 ARG 99 1HB ARG 99 -17.289 10.343 -5.353 769 HG2 ARG 99 2HG ARG 99 -19.739 10.723 -5.247 770 HG3 ARG 99 1HG ARG 99 -19.546 11.433 -3.645 771 HD2 ARG 99 2HD ARG 99 -19.620 13.260 -5.204 772 HD3 ARG 99 1HD ARG 99 -17.941 13.097 -4.689 773 HE ARG 99 HE ARG 99 -17.400 12.580 -6.917 774 HH11 ARG 99 1HH1 ARG 99 -17.890 12.027 -9.052 775 HH12 ARG 99 2HH1 ARG 99 -19.511 11.578 -9.465 776 HH21 ARG 99 1HH2 ARG 99 -20.725 11.975 -6.242 777 HH22 ARG 99 2HH2 ARG 99 -21.116 11.548 -7.874 778 H ALA 100 H ALA 100 -17.579 7.273 -2.117 779 HA ALA 100 HA ALA 100 -14.733 7.150 -2.467 780 HB1 ALA 100 1HB ALA 100 -16.206 6.283 -0.505 781 HB2 ALA 100 2HB ALA 100 -14.778 5.351 -0.954 782 HB3 ALA 100 3HB ALA 100 -16.376 4.826 -1.483 783 H SER 101 H SER 101 -13.480 5.531 -3.534 784 HA SER 101 HA SER 101 -14.917 4.192 -5.788 785 HB2 SER 101 2HB SER 101 -12.017 5.055 -5.583 786 HB3 SER 101 1HB SER 101 -12.753 4.266 -6.976 787 HG SER 101 HG SER 101 -13.571 6.116 -7.537 788 H GLU 102 H GLU 102 -14.002 2.067 -6.445 789 HA GLU 102 HA GLU 102 -13.010 0.573 -4.053 790 HB2 GLU 102 2HB GLU 102 -14.468 -0.443 -6.512 791 HB3 GLU 102 1HB GLU 102 -13.984 -1.420 -5.126 792 HG2 GLU 102 2HG GLU 102 -15.393 0.002 -3.655 793 HG3 GLU 102 1HG GLU 102 -15.916 0.916 -5.071 794 H ILE 103 H ILE 103 -11.346 -0.976 -4.346 795 HA ILE 103 HA ILE 103 -9.681 -0.527 -6.793 796 HB ILE 103 HB ILE 103 -8.782 -1.361 -4.020 797 HG12 ILE 103 2HG1 ILE 103 -8.450 1.318 -5.401 798 HG13 ILE 103 1HG1 ILE 103 -9.677 0.992 -4.177 799 HG21 ILE 103 1HG2 ILE 103 -6.904 -1.947 -5.109 800 HG22 ILE 103 2HG2 ILE 103 -6.687 -0.244 -5.516 801 HG23 ILE 103 3HG2 ILE 103 -7.531 -1.317 -6.633 802 HD11 ILE 103 1HD1 ILE 103 -6.677 0.762 -3.807 803 HD12 ILE 103 2HD1 ILE 103 -7.877 0.328 -2.589 804 HD13 ILE 103 3HD1 ILE 103 -7.721 2.005 -3.117 805 H GLU 104 H GLU 104 -8.978 -2.360 -7.909 806 HA GLU 104 HA GLU 104 -9.934 -4.984 -6.824 807 HB2 GLU 104 2HB GLU 104 -10.953 -4.258 -8.992 808 HB3 GLU 104 1HB GLU 104 -9.339 -4.252 -9.705 809 HG2 GLU 104 2HG GLU 104 -9.095 -6.659 -9.079 810 HG3 GLU 104 1HG GLU 104 -10.761 -6.645 -8.499 811 H VAL 105 H VAL 105 -8.331 -6.302 -6.149 812 HA VAL 105 HA VAL 105 -5.667 -6.083 -7.476 813 HB VAL 105 HB VAL 105 -6.133 -6.585 -4.523 814 HG11 VAL 105 1HG1 VAL 105 -3.673 -6.187 -4.413 815 HG12 VAL 105 2HG1 VAL 105 -3.637 -6.086 -6.173 816 HG13 VAL 105 3HG1 VAL 105 -4.083 -7.599 -5.385 817 HG21 VAL 105 1HG2 VAL 105 -6.508 -4.341 -4.470 818 HG22 VAL 105 2HG2 VAL 105 -5.881 -4.107 -6.102 819 HG23 VAL 105 3HG2 VAL 105 -4.769 -4.208 -4.736 820 H ASP 106 H ASP 106 -4.921 -8.035 -8.188 821 HA ASP 106 HA ASP 106 -6.277 -10.483 -7.134 822 HB2 ASP 106 2HB ASP 106 -6.810 -9.988 -9.513 823 HB3 ASP 106 1HB ASP 106 -5.087 -10.044 -9.887 824 H PHE 107 H PHE 107 -4.947 -12.011 -6.247 825 HA PHE 107 HA PHE 107 -2.009 -11.676 -6.697 826 HB2 PHE 107 2HB PHE 107 -3.592 -12.010 -4.229 827 HB3 PHE 107 1HB PHE 107 -2.146 -13.018 -4.334 828 HD1 PHE 107 1HD PHE 107 -3.436 -9.630 -3.996 829 HD2 PHE 107 2HD PHE 107 0.078 -11.986 -4.723 830 HE1 PHE 107 1HE PHE 107 -2.019 -7.660 -3.496 831 HE2 PHE 107 2HE PHE 107 1.502 -10.015 -4.217 832 HZ PHE 107 HZ PHE 107 0.458 -7.857 -3.606 833 H VAL 108 H VAL 108 -1.128 -13.340 -7.741 834 HA VAL 108 HA VAL 108 -2.239 -16.062 -7.303 835 HB VAL 108 HB VAL 108 -2.209 -14.486 -9.750 836 HG11 VAL 108 1HG1 VAL 108 -0.146 -15.634 -10.298 837 HG12 VAL 108 2HG1 VAL 108 -1.451 -16.364 -11.227 838 HG13 VAL 108 3HG1 VAL 108 -0.824 -17.185 -9.802 839 HG21 VAL 108 1HG2 VAL 108 -3.874 -16.060 -10.398 840 HG22 VAL 108 2HG2 VAL 108 -4.068 -15.841 -8.659 841 HG23 VAL 108 3HG2 VAL 108 -3.258 -17.279 -9.281 842 HA PRO 109 HA PRO 109 2.036 -17.029 -6.546 843 HB2 PRO 109 2HB PRO 109 2.070 -19.646 -7.510 844 HB3 PRO 109 1HB PRO 109 1.572 -19.161 -5.880 845 HG2 PRO 109 2HG PRO 109 -0.080 -19.848 -8.236 846 HG3 PRO 109 1HG PRO 109 -0.391 -20.121 -6.513 847 HD2 PRO 109 2HD PRO 109 -1.632 -18.156 -7.933 848 HD3 PRO 109 1HD PRO 109 -1.274 -18.004 -6.198 849 H ASN 110 H ASN 110 3.859 -16.612 -7.733 850 HA ASN 110 HA ASN 110 3.734 -17.060 -10.681 851 HB2 ASN 110 2HB ASN 110 3.878 -14.670 -9.947 852 HB3 ASN 110 1HB ASN 110 5.420 -15.050 -9.183 853 HD21 ASN 110 1HD2 ASN 110 3.787 -15.207 -12.387 854 HD22 ASN 110 2HD2 ASN 110 5.209 -14.991 -13.288 855 H GLY 111 H GLY 111 4.995 -18.770 -11.267 856 HA2 GLY 111 2HA GLY 111 6.771 -20.311 -11.247 857 HA3 GLY 111 1HA GLY 111 7.763 -18.958 -10.694 858 H SER 112 H SER 112 8.810 -19.541 -8.855 859 HA SER 112 HA SER 112 7.210 -20.907 -6.728 860 HB2 SER 112 2HB SER 112 9.171 -22.226 -6.123 861 HB3 SER 112 1HB SER 112 8.800 -22.492 -7.824 862 HG SER 112 HG SER 112 10.820 -21.930 -8.067 863 H GLY 113 H GLY 113 7.562 -20.120 -4.644 864 HA2 GLY 113 2HA GLY 113 8.226 -18.580 -3.007 865 HA3 GLY 113 1HA GLY 113 9.796 -18.574 -3.809 866 H GLY 114 H GLY 114 7.119 -17.703 -5.802 867 HA2 GLY 114 2HA GLY 114 7.518 -14.819 -5.263 868 HA3 GLY 114 1HA GLY 114 7.889 -15.400 -6.885 869 H THR 115 H THR 115 5.757 -13.521 -5.975 870 HA THR 115 HA THR 115 3.455 -14.987 -7.173 871 HB THR 115 HB THR 115 3.232 -14.750 -4.668 872 HG1 THR 115 1HG THR 115 1.131 -13.515 -4.981 873 HG21 THR 115 1HG2 THR 115 4.271 -12.255 -5.088 874 HG22 THR 115 2HG2 THR 115 3.400 -12.739 -3.635 875 HG23 THR 115 3HG2 THR 115 2.551 -11.898 -4.931 876 H ARG 116 H ARG 116 2.199 -13.760 -8.575 877 HA ARG 116 HA ARG 116 3.227 -11.006 -9.158 878 HB2 ARG 116 2HB ARG 116 3.602 -12.655 -10.986 879 HB3 ARG 116 1HB ARG 116 1.867 -12.968 -11.037 880 HG2 ARG 116 2HG ARG 116 1.469 -10.575 -11.559 881 HG3 ARG 116 1HG ARG 116 3.212 -10.301 -11.564 882 HD2 ARG 116 2HD ARG 116 3.435 -12.012 -13.370 883 HD3 ARG 116 1HD ARG 116 1.677 -12.151 -13.413 884 HE ARG 116 HE ARG 116 3.259 -9.892 -14.439 885 HH11 ARG 116 1HH1 ARG 116 2.057 -8.374 -15.603 886 HH12 ARG 116 2HH1 ARG 116 0.327 -8.423 -15.537 887 HH21 ARG 116 1HH2 ARG 116 0.221 -11.157 -13.408 888 HH22 ARG 116 2HH2 ARG 116 -0.712 -9.999 -14.294 889 H VAL 117 H VAL 117 1.750 -9.378 -8.925 890 HA VAL 117 HA VAL 117 -1.123 -10.165 -8.750 891 HB VAL 117 HB VAL 117 -0.734 -9.662 -6.538 892 HG11 VAL 117 1HG1 VAL 117 0.817 -7.554 -6.063 893 HG12 VAL 117 2HG1 VAL 117 1.440 -7.948 -7.665 894 HG13 VAL 117 3HG1 VAL 117 1.513 -9.145 -6.371 895 HG21 VAL 117 1HG2 VAL 117 -1.036 -6.822 -7.522 896 HG22 VAL 117 2HG2 VAL 117 -1.725 -7.557 -6.076 897 HG23 VAL 117 3HG2 VAL 117 -2.351 -7.988 -7.665 898 H GLU 118 H GLU 118 -2.608 -8.873 -9.728 899 HA GLU 118 HA GLU 118 -1.545 -6.622 -11.374 900 HB2 GLU 118 2HB GLU 118 -2.636 -8.447 -12.636 901 HB3 GLU 118 1HB GLU 118 -4.092 -8.253 -11.662 902 HG2 GLU 118 2HG GLU 118 -4.289 -5.905 -12.483 903 HG3 GLU 118 1HG GLU 118 -2.895 -6.178 -13.523 904 H LEU 119 H LEU 119 -2.048 -4.618 -10.634 905 HA LEU 119 HA LEU 119 -4.474 -4.329 -8.917 906 HB2 LEU 119 2HB LEU 119 -2.209 -3.927 -7.828 907 HB3 LEU 119 1HB LEU 119 -2.032 -2.538 -8.898 908 HG LEU 119 HG LEU 119 -4.583 -2.710 -7.367 909 HD11 LEU 119 1HD1 LEU 119 -1.958 -1.922 -6.070 910 HD12 LEU 119 2HD1 LEU 119 -2.861 -3.391 -5.703 911 HD13 LEU 119 3HD1 LEU 119 -3.558 -1.812 -5.336 912 HD21 LEU 119 1HD2 LEU 119 -4.122 -0.258 -7.178 913 HD22 LEU 119 2HD2 LEU 119 -4.141 -0.818 -8.850 914 HD23 LEU 119 3HD2 LEU 119 -2.605 -0.508 -8.041 915 H ALA 120 H ALA 120 -6.053 -3.078 -9.785 916 HA ALA 120 HA ALA 120 -5.264 -1.015 -11.795 917 HB1 ALA 120 1HB ALA 120 -7.640 -1.687 -12.786 918 HB2 ALA 120 2HB ALA 120 -7.246 -3.236 -12.039 919 HB3 ALA 120 3HB ALA 120 -6.175 -2.546 -13.260 920 H HIS 121 H HIS 121 -6.304 0.931 -11.562 921 HA HIS 121 HA HIS 121 -8.488 1.080 -9.518 922 HB2 HIS 121 2HB HIS 121 -7.305 2.635 -8.394 923 HB3 HIS 121 1HB HIS 121 -5.950 2.347 -9.483 924 HD1 HIS 121 1HD HIS 121 -9.286 4.190 -9.933 925 HD2 HIS 121 2HD HIS 121 -5.200 4.783 -10.521 926 HE1 HIS 121 1HE HIS 121 -9.036 6.480 -10.987 927 HE2 HIS 121 2HE HIS 121 -6.555 6.858 -11.329 928 H VAL 122 H VAL 122 -10.332 2.158 -10.181 929 HA VAL 122 HA VAL 122 -10.169 3.736 -12.701 930 HB VAL 122 HB VAL 122 -12.239 2.637 -13.518 931 HG11 VAL 122 1HG1 VAL 122 -11.126 0.799 -14.428 932 HG12 VAL 122 2HG1 VAL 122 -10.291 0.430 -12.919 933 HG13 VAL 122 3HG1 VAL 122 -9.770 1.799 -13.902 934 HG21 VAL 122 1HG2 VAL 122 -13.365 1.799 -11.654 935 HG22 VAL 122 2HG2 VAL 122 -11.889 1.168 -10.921 936 HG23 VAL 122 3HG2 VAL 122 -12.623 0.329 -12.288 937 H LYS 123 H LYS 123 -11.654 5.414 -12.838 938 HA LYS 123 HA LYS 123 -13.089 7.080 -12.049 939 HB2 LYS 123 2HB LYS 123 -14.349 4.734 -10.604 940 HB3 LYS 123 1HB LYS 123 -15.116 6.290 -10.926 941 HG2 LYS 123 2HG LYS 123 -14.827 5.911 -13.361 942 HG3 LYS 123 1HG LYS 123 -14.130 4.328 -13.015 943 HD2 LYS 123 2HD LYS 123 -16.252 3.738 -11.802 944 HD3 LYS 123 1HD LYS 123 -16.941 5.257 -12.380 945 HE2 LYS 123 2HE LYS 123 -16.312 4.483 -14.735 946 HE3 LYS 123 1HE LYS 123 -16.011 2.896 -14.026 947 HZ1 LYS 123 1HZ LYS 123 -18.248 2.983 -14.834 948 HZ2 LYS 123 2HZ LYS 123 -18.564 4.413 -13.972 949 HZ3 LYS 123 3HZ LYS 123 -18.295 2.957 -13.139 950 H LEU 124 H LEU 124 -10.656 6.421 -10.395 951 HA LEU 124 HA LEU 124 -11.379 6.654 -7.613 952 HB2 LEU 124 2HB LEU 124 -9.134 5.897 -8.379 953 HB3 LEU 124 1HB LEU 124 -8.812 7.530 -8.971 954 HG LEU 124 HG LEU 124 -9.219 8.374 -6.635 955 HD11 LEU 124 1HD1 LEU 124 -8.853 6.406 -4.914 956 HD12 LEU 124 2HD1 LEU 124 -9.549 5.420 -6.199 957 HD13 LEU 124 3HD1 LEU 124 -10.472 6.759 -5.515 958 HD21 LEU 124 1HD2 LEU 124 -6.971 8.284 -6.544 959 HD22 LEU 124 2HD2 LEU 124 -6.973 6.965 -7.716 960 HD23 LEU 124 3HD2 LEU 124 -7.064 6.611 -5.991 961 H HIS 125 H HIS 125 -10.678 8.978 -10.170 962 HA HIS 125 HA HIS 125 -10.592 11.327 -8.573 963 HB2 HIS 125 2HB HIS 125 -9.857 11.452 -10.852 964 HB3 HIS 125 1HB HIS 125 -11.425 10.906 -11.442 965 HD1 HIS 125 1HD HIS 125 -11.209 13.402 -8.659 966 HD2 HIS 125 2HD HIS 125 -11.954 13.391 -12.763 967 HE1 HIS 125 1HE HIS 125 -12.125 15.694 -9.226 968 HE2 HIS 125 2HE HIS 125 -12.572 15.702 -11.724 969 H ARG 126 H ARG 126 -13.279 9.319 -9.456 970 HA ARG 126 HA ARG 126 -15.418 11.089 -9.537 971 HB2 ARG 126 2HB ARG 126 -16.801 9.297 -8.773 972 HB3 ARG 126 1HB ARG 126 -15.482 8.536 -9.658 973 HG2 ARG 126 2HG ARG 126 -14.282 8.272 -7.442 974 HG3 ARG 126 1HG ARG 126 -15.775 8.790 -6.661 975 HD2 ARG 126 2HD ARG 126 -15.481 6.396 -8.495 976 HD3 ARG 126 1HD ARG 126 -15.673 6.337 -6.743 977 HE ARG 126 HE ARG 126 -17.849 7.815 -7.858 978 HH11 ARG 126 1HH1 ARG 126 -19.849 6.781 -8.059 979 HH12 ARG 126 2HH1 ARG 126 -19.919 5.049 -8.047 980 HH21 ARG 126 1HH2 ARG 126 -16.494 4.650 -7.679 981 HH22 ARG 126 2HH2 ARG 126 -18.018 3.844 -7.833 982 H HIS 127 H HIS 127 -13.457 10.134 -6.777 983 HA HIS 127 HA HIS 127 -15.097 11.162 -4.701 984 HB2 HIS 127 2HB HIS 127 -12.567 10.020 -4.867 985 HB3 HIS 127 1HB HIS 127 -12.239 11.656 -4.298 986 HD1 HIS 127 1HD HIS 127 -15.245 11.617 -2.853 987 HD2 HIS 127 2HD HIS 127 -11.986 9.105 -2.162 988 HE1 HIS 127 1HE HIS 127 -15.560 10.654 -0.530 989 HE2 HIS 127 2HE HIS 127 -13.583 9.124 -0.101 990 H GLY 128 H GLY 128 -12.697 12.737 -6.774 991 HA2 GLY 128 2HA GLY 128 -12.167 15.011 -7.047 992 HA3 GLY 128 1HA GLY 128 -13.917 15.222 -6.976 993 H ASP 129 H ASP 129 -12.762 13.839 -4.116 994 HA ASP 129 HA ASP 129 -13.109 16.433 -2.726 995 HB2 ASP 129 2HB ASP 129 -13.278 15.099 -0.688 996 HB3 ASP 129 1HB ASP 129 -14.339 14.415 -1.919 997 H GLY 130 H GLY 130 -10.604 15.098 -4.206 998 HA2 GLY 130 2HA GLY 130 -8.320 15.772 -3.963 999 HA3 GLY 130 1HA GLY 130 -8.668 16.270 -2.306 1000 H ALA 131 H ALA 131 -9.843 13.180 -3.289 1001 HA ALA 131 HA ALA 131 -8.610 11.736 -1.225 1002 HB1 ALA 131 1HB ALA 131 -9.165 10.493 -3.917 1003 HB2 ALA 131 2HB ALA 131 -10.483 11.017 -2.867 1004 HB3 ALA 131 3HB ALA 131 -9.356 9.778 -2.315 1005 H TRP 132 H TRP 132 -7.384 12.411 -4.501 1006 HA TRP 132 HA TRP 132 -5.170 10.650 -4.460 1007 HB2 TRP 132 2HB TRP 132 -5.790 11.930 -6.471 1008 HB3 TRP 132 1HB TRP 132 -5.300 13.428 -5.673 1009 HD1 TRP 132 HD TRP 132 -2.715 13.811 -5.223 1010 HE1 TRP 132 1HE TRP 132 -0.607 12.774 -6.279 1011 HE3 TRP 132 3HE TRP 132 -4.786 9.753 -7.550 1012 HZ2 TRP 132 2HZ TRP 132 0.106 10.533 -7.891 1013 HZ3 TRP 132 3HZ TRP 132 -3.356 8.187 -8.846 1014 HH2 TRP 132 HH TRP 132 -0.917 8.575 -9.014 1015 H ASN 133 H ASN 133 -5.562 13.862 -3.008 1016 HA ASN 133 HA ASN 133 -2.877 14.331 -2.252 1017 HB2 ASN 133 2HB ASN 133 -5.454 14.983 -0.786 1018 HB3 ASN 133 1HB ASN 133 -3.878 15.644 -0.369 1019 HD21 ASN 133 1HD2 ASN 133 -2.831 16.091 -2.987 1020 HD22 ASN 133 2HD2 ASN 133 -3.768 17.284 -3.749 1021 H ILE 134 H ILE 134 -5.423 12.420 -0.698 1022 HA ILE 134 HA ILE 134 -3.911 11.687 1.626 1023 HB ILE 134 HB ILE 134 -6.384 10.795 0.277 1024 HG12 ILE 134 2HG1 ILE 134 -7.254 10.930 2.524 1025 HG13 ILE 134 1HG1 ILE 134 -5.627 10.934 3.206 1026 HG21 ILE 134 1HG2 ILE 134 -5.368 8.626 0.328 1027 HG22 ILE 134 2HG2 ILE 134 -6.439 8.704 1.722 1028 HG23 ILE 134 3HG2 ILE 134 -4.701 8.907 1.938 1029 HD11 ILE 134 1HD1 ILE 134 -6.179 13.050 1.205 1030 HD12 ILE 134 2HD1 ILE 134 -5.285 13.141 2.722 1031 HD13 ILE 134 3HD1 ILE 134 -7.047 13.199 2.732 1032 H HIS 135 H HIS 135 -4.330 10.192 -1.567 1033 HA HIS 135 HA HIS 135 -2.680 7.902 -1.077 1034 HB2 HIS 135 2HB HIS 135 -4.171 7.988 -3.014 1035 HB3 HIS 135 1HB HIS 135 -3.294 9.376 -3.659 1036 HD1 HIS 135 1HD HIS 135 -1.039 6.973 -2.102 1037 HD2 HIS 135 2HD HIS 135 -2.738 7.456 -5.881 1038 HE1 HIS 135 1HE HIS 135 0.323 5.543 -3.688 1039 HE2 HIS 135 2HE HIS 135 -0.704 5.826 -5.990 1040 H LYS 136 H LYS 136 -1.996 11.212 -2.065 1041 HA LYS 136 HA LYS 136 0.666 10.930 -2.945 1042 HB2 LYS 136 2HB LYS 136 -0.675 13.044 -3.023 1043 HB3 LYS 136 1HB LYS 136 -0.426 13.210 -1.292 1044 HG2 LYS 136 2HG LYS 136 2.009 13.217 -1.649 1045 HG3 LYS 136 1HG LYS 136 1.746 13.100 -3.384 1046 HD2 LYS 136 2HD LYS 136 0.420 15.229 -3.264 1047 HD3 LYS 136 1HD LYS 136 0.889 15.369 -1.569 1048 HE2 LYS 136 2HE LYS 136 2.480 15.854 -4.007 1049 HE3 LYS 136 1HE LYS 136 2.668 16.526 -2.388 1050 HZ1 LYS 136 1HZ LYS 136 3.664 14.460 -1.667 1051 HZ2 LYS 136 2HZ LYS 136 4.521 15.087 -2.993 1052 HZ3 LYS 136 3HZ LYS 136 3.454 13.783 -3.208 1053 H ALA 137 H ALA 137 -0.615 11.213 0.358 1054 HA ALA 137 HA ALA 137 1.946 11.306 1.659 1055 HB1 ALA 137 1HB ALA 137 -0.338 9.926 2.993 1056 HB2 ALA 137 2HB ALA 137 -0.560 11.624 2.564 1057 HB3 ALA 137 3HB ALA 137 0.759 11.148 3.636 1058 H LEU 138 H LEU 138 -0.231 8.655 0.779 1059 HA LEU 138 HA LEU 138 1.383 6.549 1.869 1060 HB2 LEU 138 2HB LEU 138 -0.535 6.449 -0.479 1061 HB3 LEU 138 1HB LEU 138 0.019 5.077 0.469 1062 HG LEU 138 HG LEU 138 -1.657 7.396 1.467 1063 HD11 LEU 138 1HD1 LEU 138 -3.417 6.092 0.950 1064 HD12 LEU 138 2HD1 LEU 138 -2.753 4.789 1.937 1065 HD13 LEU 138 3HD1 LEU 138 -2.320 4.913 0.232 1066 HD21 LEU 138 1HD2 LEU 138 -0.376 6.853 3.328 1067 HD22 LEU 138 2HD2 LEU 138 -0.178 5.176 2.825 1068 HD23 LEU 138 3HD2 LEU 138 -1.713 5.717 3.505 1069 H ASP 139 H ASP 139 1.431 8.395 -1.095 1070 HA ASP 139 HA ASP 139 3.268 6.610 -2.484 1071 HB2 ASP 139 2HB ASP 139 1.672 8.168 -3.645 1072 HB3 ASP 139 1HB ASP 139 2.640 9.520 -3.060 1073 H GLY 140 H GLY 140 5.242 6.379 -1.538 1074 HA2 GLY 140 2HA GLY 140 6.586 8.690 -0.294 1075 HA3 GLY 140 1HA GLY 140 7.154 7.021 -0.258 1076 HA PRO 141 HA PRO 141 9.964 9.283 -3.180 1077 HB2 PRO 141 2HB PRO 141 11.539 6.828 -2.575 1078 HB3 PRO 141 1HB PRO 141 12.053 8.525 -2.581 1079 HG2 PRO 141 2HG PRO 141 11.663 7.175 -0.309 1080 HG3 PRO 141 1HG PRO 141 11.301 8.903 -0.453 1081 HD2 PRO 141 2HD PRO 141 9.420 6.591 -0.342 1082 HD3 PRO 141 1HD PRO 141 9.191 8.263 0.217 1083 H SER 142 H SER 142 10.407 8.791 -5.375 1084 HA SER 142 HA SER 142 10.120 7.692 -7.428 1085 HB2 SER 142 2HB SER 142 11.434 5.921 -5.989 1086 HB3 SER 142 1HB SER 142 9.891 5.072 -5.973 1087 HG SER 142 HG SER 142 11.678 5.057 -7.871 1088 HA PRO 143 HA PRO 143 5.556 7.538 -6.188 1089 HB2 PRO 143 2HB PRO 143 5.480 9.326 -8.562 1090 HB3 PRO 143 1HB PRO 143 4.671 9.499 -6.993 1091 HG2 PRO 143 2HG PRO 143 6.783 10.990 -7.667 1092 HG3 PRO 143 1HG PRO 143 6.501 10.452 -6.003 1093 HD2 PRO 143 2HD PRO 143 8.498 9.460 -7.987 1094 HD3 PRO 143 1HD PRO 143 8.609 9.545 -6.215 1095 H GLY 144 H GLY 144 3.988 6.280 -7.246 1096 HA2 GLY 144 2HA GLY 144 3.745 5.742 -9.978 1097 HA3 GLY 144 1HA GLY 144 4.895 4.547 -9.374 1098 H GLU 145 H GLU 145 2.891 3.202 -10.185 1099 HA GLU 145 HA GLU 145 0.447 3.089 -8.828 1100 HB2 GLU 145 2HB GLU 145 0.351 0.727 -9.457 1101 HB3 GLU 145 1HB GLU 145 1.063 1.656 -10.776 1102 HG2 GLU 145 2HG GLU 145 3.331 1.050 -9.928 1103 HG3 GLU 145 1HG GLU 145 2.569 0.039 -8.702 1104 H THR 146 H THR 146 -0.252 1.652 -7.053 1105 HA THR 146 HA THR 146 1.299 1.945 -4.695 1106 HB THR 146 HB THR 146 -0.889 -0.040 -5.329 1107 HG1 THR 146 1HG THR 146 -1.900 1.811 -5.332 1108 HG21 THR 146 1HG2 THR 146 -1.079 0.191 -2.700 1109 HG22 THR 146 2HG2 THR 146 0.637 0.575 -2.834 1110 HG23 THR 146 3HG2 THR 146 0.031 -0.974 -3.425 1111 H LEU 147 H LEU 147 1.069 -0.713 -7.003 1112 HA LEU 147 HA LEU 147 2.499 -2.668 -5.541 1113 HB2 LEU 147 2HB LEU 147 2.553 -2.233 -8.538 1114 HB3 LEU 147 1HB LEU 147 2.861 -3.741 -7.676 1115 HG LEU 147 HG LEU 147 0.244 -2.215 -7.649 1116 HD11 LEU 147 1HD1 LEU 147 0.006 -3.248 -9.656 1117 HD12 LEU 147 2HD1 LEU 147 -0.241 -4.704 -8.692 1118 HD13 LEU 147 3HD1 LEU 147 1.353 -4.346 -9.356 1119 HD21 LEU 147 1HD2 LEU 147 -0.355 -4.646 -6.680 1120 HD22 LEU 147 2HD2 LEU 147 0.169 -3.330 -5.631 1121 HD23 LEU 147 3HD2 LEU 147 1.324 -4.559 -6.148 1122 H ALA 148 H ALA 148 3.613 0.156 -7.301 1123 HA ALA 148 HA ALA 148 6.331 -0.575 -7.679 1124 HB1 ALA 148 1HB ALA 148 4.824 1.663 -8.207 1125 HB2 ALA 148 2HB ALA 148 6.575 1.571 -8.398 1126 HB3 ALA 148 3HB ALA 148 5.884 2.239 -6.919 1127 H ARG 149 H ARG 149 4.962 1.383 -5.010 1128 HA ARG 149 HA ARG 149 7.381 1.284 -3.459 1129 HB2 ARG 149 2HB ARG 149 4.533 1.894 -2.667 1130 HB3 ARG 149 1HB ARG 149 5.928 2.131 -1.622 1131 HG2 ARG 149 2HG ARG 149 6.922 3.632 -3.350 1132 HG3 ARG 149 1HG ARG 149 5.447 3.461 -4.301 1133 HD2 ARG 149 2HD ARG 149 5.226 5.493 -3.046 1134 HD3 ARG 149 1HD ARG 149 4.172 4.309 -2.278 1135 HE ARG 149 HE ARG 149 6.714 5.348 -1.165 1136 HH11 ARG 149 1HH1 ARG 149 6.976 4.933 1.034 1137 HH12 ARG 149 2HH1 ARG 149 5.894 3.843 1.834 1138 HH21 ARG 149 1HH2 ARG 149 4.037 3.164 -1.010 1139 HH22 ARG 149 2HH2 ARG 149 4.233 2.846 0.680 1140 H PHE 150 H PHE 150 4.392 -0.628 -3.408 1141 HA PHE 150 HA PHE 150 4.981 -2.120 -1.047 1142 HB2 PHE 150 2HB PHE 150 2.748 -2.089 -2.070 1143 HB3 PHE 150 1HB PHE 150 3.379 -2.920 -3.488 1144 HD1 PHE 150 1HD PHE 150 3.609 -5.267 -3.541 1145 HD2 PHE 150 2HD PHE 150 2.880 -3.272 0.193 1146 HE1 PHE 150 1HE PHE 150 3.257 -7.460 -2.440 1147 HE2 PHE 150 2HE PHE 150 2.528 -5.467 1.295 1148 HZ PHE 150 HZ PHE 150 2.720 -7.559 -0.023 1149 H ALA 151 H ALA 151 5.746 -2.773 -4.470 1150 HA ALA 151 HA ALA 151 6.935 -5.343 -3.952 1151 HB1 ALA 151 1HB ALA 151 6.254 -4.829 -6.200 1152 HB2 ALA 151 2HB ALA 151 8.012 -4.967 -6.218 1153 HB3 ALA 151 3HB ALA 151 7.252 -3.376 -6.231 1154 H ASN 152 H ASN 152 8.302 -2.064 -4.199 1155 HA ASN 152 HA ASN 152 11.036 -2.855 -3.997 1156 HB2 ASN 152 2HB ASN 152 9.684 -0.292 -3.151 1157 HB3 ASN 152 1HB ASN 152 11.428 -0.507 -3.259 1158 HD21 ASN 152 1HD2 ASN 152 10.085 1.418 -4.898 1159 HD22 ASN 152 2HD2 ASN 152 10.173 0.902 -6.513 1160 H VAL 153 H VAL 153 8.784 -1.758 -1.447 1161 HA VAL 153 HA VAL 153 10.686 -2.204 0.671 1162 HB VAL 153 HB VAL 153 8.836 -1.803 2.168 1163 HG11 VAL 153 1HG1 VAL 153 7.857 0.277 1.102 1164 HG12 VAL 153 2HG1 VAL 153 8.708 -0.173 -0.375 1165 HG13 VAL 153 3HG1 VAL 153 9.618 0.195 1.090 1166 HG21 VAL 153 1HG2 VAL 153 7.078 -3.155 1.394 1167 HG22 VAL 153 2HG2 VAL 153 7.201 -2.525 -0.248 1168 HG23 VAL 153 3HG2 VAL 153 6.511 -1.526 1.028 1169 H ILE 154 H ILE 154 8.416 -4.252 -1.015 1170 HA ILE 154 HA ILE 154 8.514 -6.360 1.015 1171 HB ILE 154 HB ILE 154 7.319 -6.135 -1.739 1172 HG12 ILE 154 2HG1 ILE 154 6.373 -5.137 0.526 1173 HG13 ILE 154 1HG1 ILE 154 5.295 -5.903 -0.635 1174 HG21 ILE 154 1HG2 ILE 154 6.243 -8.393 -1.032 1175 HG22 ILE 154 2HG2 ILE 154 7.652 -8.535 0.025 1176 HG23 ILE 154 3HG2 ILE 154 7.868 -8.396 -1.720 1177 HD11 ILE 154 1HD1 ILE 154 5.179 -7.908 0.617 1178 HD12 ILE 154 2HD1 ILE 154 5.097 -6.637 1.837 1179 HD13 ILE 154 3HD1 ILE 154 6.611 -7.498 1.562 Start of MODEL 13 1 H1 MET 1 1HT MET 1 0.251 6.929 -3.666 2 H2 MET 1 2HT MET 1 -0.141 5.867 -4.932 3 H3 MET 1 3HT MET 1 -0.043 7.537 -5.222 4 HA MET 1 HA MET 1 2.385 7.174 -4.305 5 HB2 MET 1 2HB MET 1 1.982 4.627 -5.847 6 HB3 MET 1 1HB MET 1 3.276 5.063 -4.732 7 HG2 MET 1 2HG MET 1 2.040 3.636 -3.388 8 HG3 MET 1 1HG MET 1 1.290 5.179 -2.984 9 HE1 MET 1 1HE MET 1 -1.201 4.420 -2.305 10 HE2 MET 1 2HE MET 1 -0.131 3.032 -2.117 11 HE3 MET 1 3HE MET 1 -1.706 2.825 -2.878 12 HA PRO 2 HA PRO 2 2.176 6.922 -9.216 13 HB2 PRO 2 2HB PRO 2 -0.598 7.878 -9.560 14 HB3 PRO 2 1HB PRO 2 0.268 6.604 -10.433 15 HG2 PRO 2 2HG PRO 2 -1.664 6.052 -8.667 16 HG3 PRO 2 1HG PRO 2 -0.253 5.002 -8.886 17 HD2 PRO 2 2HD PRO 2 -0.838 6.939 -6.680 18 HD3 PRO 2 1HD PRO 2 -0.012 5.365 -6.611 19 H GLU 3 H GLU 3 2.675 8.814 -10.434 20 HA GLU 3 HA GLU 3 2.886 11.245 -8.935 21 HB2 GLU 3 2HB GLU 3 3.136 10.772 -11.909 22 HB3 GLU 3 1HB GLU 3 3.654 12.233 -11.071 23 HG2 GLU 3 2HG GLU 3 5.184 10.853 -9.672 24 HG3 GLU 3 1HG GLU 3 4.710 9.428 -10.598 25 H GLU 4 H GLU 4 0.849 10.484 -11.779 26 HA GLU 4 HA GLU 4 -0.918 12.751 -10.978 27 HB2 GLU 4 2HB GLU 4 -0.707 11.393 -13.676 28 HB3 GLU 4 1HB GLU 4 -1.630 12.850 -13.299 29 HG2 GLU 4 2HG GLU 4 0.513 13.958 -12.618 30 HG3 GLU 4 1HG GLU 4 1.381 12.534 -13.183 31 H ILE 5 H ILE 5 -3.150 12.373 -10.750 32 HA ILE 5 HA ILE 5 -4.126 9.927 -9.827 33 HB ILE 5 HB ILE 5 -5.328 12.089 -9.682 34 HG12 ILE 5 2HG1 ILE 5 -7.309 10.434 -11.131 35 HG13 ILE 5 1HG1 ILE 5 -6.430 9.596 -9.850 36 HG21 ILE 5 1HG2 ILE 5 -6.093 13.225 -11.503 37 HG22 ILE 5 2HG2 ILE 5 -6.474 11.751 -12.394 38 HG23 ILE 5 3HG2 ILE 5 -4.811 12.335 -12.323 39 HD11 ILE 5 1HD1 ILE 5 -8.453 10.633 -8.935 40 HD12 ILE 5 2HD1 ILE 5 -7.950 12.203 -9.560 41 HD13 ILE 5 3HD1 ILE 5 -7.021 11.426 -8.280 42 HA PRO 6 HA PRO 6 -3.985 7.939 -13.935 43 HB2 PRO 6 2HB PRO 6 -3.265 5.482 -13.156 44 HB3 PRO 6 1HB PRO 6 -2.109 6.829 -13.125 45 HG2 PRO 6 2HG PRO 6 -3.556 5.528 -10.889 46 HG3 PRO 6 1HG PRO 6 -1.935 6.241 -10.928 47 HD2 PRO 6 2HD PRO 6 -4.295 7.479 -9.952 48 HD3 PRO 6 1HD PRO 6 -2.728 8.257 -10.234 49 H ASP 7 H ASP 7 -5.195 6.173 -14.960 50 HA ASP 7 HA ASP 7 -7.810 5.700 -13.645 51 HB2 ASP 7 2HB ASP 7 -7.689 6.477 -16.041 52 HB3 ASP 7 1HB ASP 7 -6.904 4.950 -16.445 53 H VAL 8 H VAL 8 -7.657 3.195 -15.654 54 HA VAL 8 HA VAL 8 -7.464 1.160 -13.753 55 HB VAL 8 HB VAL 8 -8.163 0.743 -16.080 56 HG11 VAL 8 1HG1 VAL 8 -6.743 0.950 -17.916 57 HG12 VAL 8 2HG1 VAL 8 -5.286 0.764 -16.939 58 HG13 VAL 8 3HG1 VAL 8 -6.185 2.281 -16.901 59 HG21 VAL 8 1HG2 VAL 8 -6.424 -0.885 -14.520 60 HG22 VAL 8 2HG2 VAL 8 -5.946 -1.081 -16.206 61 HG23 VAL 8 3HG2 VAL 8 -7.608 -1.410 -15.716 62 H ARG 9 H ARG 9 -5.735 0.071 -12.759 63 HA ARG 9 HA ARG 9 -3.125 1.419 -13.001 64 HB2 ARG 9 2HB ARG 9 -4.525 -0.005 -10.916 65 HB3 ARG 9 1HB ARG 9 -2.908 -0.677 -11.139 66 HG2 ARG 9 2HG ARG 9 -2.863 1.188 -9.525 67 HG3 ARG 9 1HG ARG 9 -1.942 1.586 -10.976 68 HD2 ARG 9 2HD ARG 9 -3.290 3.326 -11.445 69 HD3 ARG 9 1HD ARG 9 -4.730 2.321 -11.294 70 HE ARG 9 HE ARG 9 -5.053 3.453 -9.260 71 HH11 ARG 9 1HH1 ARG 9 -4.389 4.321 -7.286 72 HH12 ARG 9 2HH1 ARG 9 -2.701 4.378 -6.903 73 HH21 ARG 9 1HH2 ARG 9 -1.703 2.926 -9.887 74 HH22 ARG 9 2HH2 ARG 9 -1.181 3.587 -8.374 75 H LYS 10 H LYS 10 -1.228 -0.374 -12.587 76 HA LYS 10 HA LYS 10 -1.450 -2.197 -14.928 77 HB2 LYS 10 2HB LYS 10 0.926 -0.896 -13.594 78 HB3 LYS 10 1HB LYS 10 1.065 -2.107 -14.860 79 HG2 LYS 10 2HG LYS 10 -0.289 -0.674 -16.357 80 HG3 LYS 10 1HG LYS 10 -0.349 0.558 -15.094 81 HD2 LYS 10 2HD LYS 10 2.147 0.635 -15.108 82 HD3 LYS 10 1HD LYS 10 2.144 -0.499 -16.460 83 HE2 LYS 10 2HE LYS 10 0.670 1.157 -17.701 84 HE3 LYS 10 1HE LYS 10 1.009 2.308 -16.407 85 HZ1 LYS 10 1HZ LYS 10 2.796 2.826 -17.609 86 HZ2 LYS 10 2HZ LYS 10 2.692 1.425 -18.563 87 HZ3 LYS 10 3HZ LYS 10 3.462 1.370 -17.049 88 H SER 11 H SER 11 0.446 -3.971 -14.608 89 HA SER 11 HA SER 11 -0.154 -5.327 -12.004 90 HB2 SER 11 2HB SER 11 -0.039 -7.424 -13.138 91 HB3 SER 11 1HB SER 11 -0.998 -6.382 -14.184 92 HG SER 11 HG SER 11 0.917 -5.960 -15.367 93 H VAL 12 H VAL 12 1.614 -6.289 -10.906 94 HA VAL 12 HA VAL 12 4.298 -5.980 -12.130 95 HB VAL 12 HB VAL 12 3.414 -4.772 -9.521 96 HG11 VAL 12 1HG1 VAL 12 5.914 -4.243 -9.288 97 HG12 VAL 12 2HG1 VAL 12 6.180 -5.507 -10.489 98 HG13 VAL 12 3HG1 VAL 12 5.431 -5.904 -8.942 99 HG21 VAL 12 1HG2 VAL 12 4.585 -2.790 -10.525 100 HG22 VAL 12 2HG2 VAL 12 3.198 -3.335 -11.471 101 HG23 VAL 12 3HG2 VAL 12 4.835 -3.742 -11.989 102 H VAL 13 H VAL 13 5.873 -7.390 -11.258 103 HA VAL 13 HA VAL 13 4.716 -9.654 -9.686 104 HB VAL 13 HB VAL 13 7.298 -9.552 -11.282 105 HG11 VAL 13 1HG1 VAL 13 6.953 -12.090 -11.131 106 HG12 VAL 13 2HG1 VAL 13 5.762 -11.744 -9.877 107 HG13 VAL 13 3HG1 VAL 13 7.447 -11.277 -9.646 108 HG21 VAL 13 1HG2 VAL 13 4.765 -9.467 -12.336 109 HG22 VAL 13 2HG2 VAL 13 5.047 -11.205 -12.237 110 HG23 VAL 13 3HG2 VAL 13 6.157 -10.183 -13.149 111 H VAL 14 H VAL 14 5.494 -10.038 -7.637 112 HA VAL 14 HA VAL 14 7.931 -8.525 -6.784 113 HB VAL 14 HB VAL 14 6.876 -8.092 -4.633 114 HG11 VAL 14 1HG1 VAL 14 4.823 -7.398 -6.737 115 HG12 VAL 14 2HG1 VAL 14 6.406 -6.624 -6.693 116 HG13 VAL 14 3HG1 VAL 14 5.304 -6.454 -5.327 117 HG21 VAL 14 1HG2 VAL 14 4.754 -9.883 -5.788 118 HG22 VAL 14 2HG2 VAL 14 4.312 -8.673 -4.584 119 HG23 VAL 14 3HG2 VAL 14 5.489 -9.924 -4.185 120 H ALA 15 H ALA 15 9.119 -9.547 -5.015 121 HA ALA 15 HA ALA 15 8.959 -12.487 -5.185 122 HB1 ALA 15 1HB ALA 15 11.135 -12.516 -4.382 123 HB2 ALA 15 2HB ALA 15 10.903 -11.067 -3.404 124 HB3 ALA 15 3HB ALA 15 11.108 -10.930 -5.150 125 H ALA 16 H ALA 16 7.119 -13.020 -3.980 126 HA ALA 16 HA ALA 16 7.468 -13.133 -1.105 127 HB1 ALA 16 1HB ALA 16 4.913 -11.827 -1.482 128 HB2 ALA 16 2HB ALA 16 6.209 -10.811 -2.114 129 HB3 ALA 16 3HB ALA 16 6.252 -11.352 -0.435 130 H SER 17 H SER 17 6.011 -14.682 -0.202 131 HA SER 17 HA SER 17 4.849 -16.509 -2.128 132 HB2 SER 17 2HB SER 17 4.289 -17.868 -0.258 133 HB3 SER 17 1HB SER 17 5.797 -17.077 0.198 134 HG SER 17 HG SER 17 3.556 -15.619 0.794 135 H VAL 18 H VAL 18 2.571 -17.012 -2.327 136 HA VAL 18 HA VAL 18 0.876 -14.733 -2.523 137 HB VAL 18 HB VAL 18 -0.562 -17.266 -2.153 138 HG11 VAL 18 1HG1 VAL 18 -1.646 -16.591 -4.123 139 HG12 VAL 18 2HG1 VAL 18 -0.236 -15.709 -4.709 140 HG13 VAL 18 3HG1 VAL 18 -1.198 -15.054 -3.385 141 HG21 VAL 18 1HG2 VAL 18 0.429 -18.164 -4.355 142 HG22 VAL 18 2HG2 VAL 18 1.402 -18.380 -2.901 143 HG23 VAL 18 3HG2 VAL 18 1.793 -17.092 -4.043 144 H GLU 19 H GLU 19 1.117 -17.257 -0.032 145 HA GLU 19 HA GLU 19 -1.053 -16.369 1.587 146 HB2 GLU 19 2HB GLU 19 1.535 -17.738 2.378 147 HB3 GLU 19 1HB GLU 19 0.136 -17.554 3.436 148 HG2 GLU 19 2HG GLU 19 -1.249 -18.788 1.781 149 HG3 GLU 19 1HG GLU 19 0.186 -19.024 0.784 150 H HIS 20 H HIS 20 2.353 -15.393 1.467 151 HA HIS 20 HA HIS 20 2.354 -13.718 3.763 152 HB2 HIS 20 2HB HIS 20 4.359 -14.489 2.411 153 HB3 HIS 20 1HB HIS 20 3.930 -13.265 1.215 154 HD1 HIS 20 1HD HIS 20 4.205 -13.253 5.025 155 HD2 HIS 20 2HD HIS 20 5.415 -11.002 1.728 156 HE1 HIS 20 1HE HIS 20 5.490 -11.278 5.939 157 HE2 HIS 20 2HE HIS 20 6.233 -9.902 3.943 158 H CYS 21 H CYS 21 1.456 -13.083 0.384 159 HA CYS 21 HA CYS 21 1.202 -10.289 0.472 160 HB2 CYS 21 2HB CYS 21 -0.370 -12.402 -1.013 161 HB3 CYS 21 1HB CYS 21 -0.651 -10.682 -1.255 162 HG CYS 21 HG CYS 21 1.238 -11.728 -2.917 163 H PHE 22 H PHE 22 -1.465 -12.639 1.023 164 HA PHE 22 HA PHE 22 -3.265 -10.589 1.956 165 HB2 PHE 22 2HB PHE 22 -3.493 -13.491 2.724 166 HB3 PHE 22 1HB PHE 22 -4.783 -12.336 2.382 167 HD1 PHE 22 1HD PHE 22 -2.294 -14.592 0.962 168 HD2 PHE 22 2HD PHE 22 -5.290 -11.661 0.046 169 HE1 PHE 22 1HE PHE 22 -2.264 -15.311 -1.404 170 HE2 PHE 22 2HE PHE 22 -5.262 -12.378 -2.329 171 HZ PHE 22 HZ PHE 22 -3.746 -14.205 -3.053 172 H GLU 23 H GLU 23 -1.047 -12.802 3.593 173 HA GLU 23 HA GLU 23 -1.950 -12.161 6.257 174 HB2 GLU 23 2HB GLU 23 0.649 -13.318 5.222 175 HB3 GLU 23 1HB GLU 23 0.276 -13.144 6.937 176 HG2 GLU 23 2HG GLU 23 -1.738 -14.536 6.638 177 HG3 GLU 23 1HG GLU 23 -1.356 -14.729 4.930 178 H VAL 24 H VAL 24 0.498 -10.777 4.109 179 HA VAL 24 HA VAL 24 1.869 -9.179 5.984 180 HB VAL 24 HB VAL 24 1.249 -8.779 3.057 181 HG11 VAL 24 1HG1 VAL 24 3.171 -7.067 3.279 182 HG12 VAL 24 2HG1 VAL 24 2.771 -7.048 4.996 183 HG13 VAL 24 3HG1 VAL 24 1.564 -6.567 3.803 184 HG21 VAL 24 1HG2 VAL 24 4.012 -9.071 4.020 185 HG22 VAL 24 2HG2 VAL 24 3.183 -9.911 2.709 186 HG23 VAL 24 3HG2 VAL 24 2.991 -10.466 4.371 187 H PHE 25 H PHE 25 -1.050 -8.374 4.069 188 HA PHE 25 HA PHE 25 -1.294 -5.719 5.145 189 HB2 PHE 25 2HB PHE 25 -3.677 -7.354 4.316 190 HB3 PHE 25 1HB PHE 25 -3.383 -5.632 4.084 191 HD1 PHE 25 1HD PHE 25 -3.812 -8.411 2.276 192 HD2 PHE 25 2HD PHE 25 -0.783 -5.433 2.887 193 HE1 PHE 25 1HE PHE 25 -2.885 -8.891 0.020 194 HE2 PHE 25 2HE PHE 25 0.146 -5.909 0.636 195 HZ PHE 25 HZ PHE 25 -0.905 -7.638 -0.798 196 H THR 26 H THR 26 -2.661 -8.842 6.140 197 HA THR 26 HA THR 26 -3.998 -7.526 8.427 198 HB THR 26 HB THR 26 -5.147 -9.638 8.717 199 HG1 THR 26 1HG THR 26 -3.873 -11.264 8.294 200 HG21 THR 26 1HG2 THR 26 -6.041 -9.944 6.340 201 HG22 THR 26 2HG2 THR 26 -4.877 -8.712 5.853 202 HG23 THR 26 3HG2 THR 26 -6.150 -8.317 7.010 203 H SER 27 H SER 27 -0.953 -8.886 7.911 204 HA SER 27 HA SER 27 -0.841 -9.967 10.692 205 HB2 SER 27 2HB SER 27 -0.036 -11.431 8.839 206 HB3 SER 27 1HB SER 27 1.218 -10.242 8.504 207 HG SER 27 HG SER 27 1.290 -12.186 10.253 208 H ARG 28 H ARG 28 1.493 -8.202 8.595 209 HA ARG 28 HA ARG 28 1.990 -6.391 10.917 210 HB2 ARG 28 2HB ARG 28 4.375 -6.665 10.713 211 HB3 ARG 28 1HB ARG 28 3.659 -8.270 10.853 212 HG2 ARG 28 2HG ARG 28 3.593 -7.818 8.129 213 HG3 ARG 28 1HG ARG 28 5.114 -7.072 8.601 214 HD2 ARG 28 2HD ARG 28 5.482 -9.271 9.953 215 HD3 ARG 28 1HD ARG 28 4.248 -9.928 8.879 216 HE ARG 28 HE ARG 28 5.985 -8.770 7.113 217 HH11 ARG 28 1HH1 ARG 28 7.827 -9.784 6.283 218 HH12 ARG 28 2HH1 ARG 28 8.597 -11.036 7.200 219 HH21 ARG 28 1HH2 ARG 28 6.348 -10.857 9.833 220 HH22 ARG 28 2HH2 ARG 28 7.759 -11.644 9.208 221 HA PRO 29 HA PRO 29 1.739 -4.237 6.715 222 HB2 PRO 29 2HB PRO 29 -0.185 -2.422 7.524 223 HB3 PRO 29 1HB PRO 29 -0.533 -3.942 6.682 224 HG2 PRO 29 2HG PRO 29 -0.753 -3.280 9.565 225 HG3 PRO 29 1HG PRO 29 -1.765 -4.332 8.563 226 HD2 PRO 29 2HD PRO 29 0.103 -5.295 10.312 227 HD3 PRO 29 1HD PRO 29 -0.371 -6.157 8.831 228 H ALA 30 H ALA 30 1.943 -3.208 10.055 229 HA ALA 30 HA ALA 30 2.847 -0.511 9.539 230 HB1 ALA 30 1HB ALA 30 3.730 -0.873 12.002 231 HB2 ALA 30 2HB ALA 30 2.737 -2.329 11.911 232 HB3 ALA 30 3HB ALA 30 1.999 -0.742 11.683 233 H ASP 31 H ASP 31 4.429 -3.582 9.457 234 HA ASP 31 HA ASP 31 7.056 -2.837 10.214 235 HB2 ASP 31 2HB ASP 31 6.054 -4.920 8.272 236 HB3 ASP 31 1HB ASP 31 7.762 -4.740 8.677 237 H TRP 32 H TRP 32 5.360 -2.280 7.155 238 HA TRP 32 HA TRP 32 7.839 -0.898 6.186 239 HB2 TRP 32 2HB TRP 32 6.842 -1.432 3.858 240 HB3 TRP 32 1HB TRP 32 7.631 -2.737 4.742 241 HD1 TRP 32 HD TRP 32 6.194 -4.756 5.456 242 HE1 TRP 32 1HE TRP 32 3.729 -5.422 5.131 243 HE3 TRP 32 3HE TRP 32 4.351 -0.369 3.656 244 HZ2 TRP 32 2HZ TRP 32 1.295 -4.242 4.223 245 HZ3 TRP 32 3HZ TRP 32 1.954 -0.159 3.063 246 HH2 TRP 32 HH TRP 32 0.421 -2.085 3.342 247 H TRP 33 H TRP 33 4.598 -0.446 7.076 248 HA TRP 33 HA TRP 33 3.714 1.458 5.171 249 HB2 TRP 33 2HB TRP 33 2.667 0.446 7.492 250 HB3 TRP 33 1HB TRP 33 3.010 2.112 7.956 251 HD1 TRP 33 HD TRP 33 1.938 4.054 6.364 252 HE1 TRP 33 1HE TRP 33 -0.274 4.058 5.040 253 HE3 TRP 33 3HE TRP 33 0.985 -0.961 6.220 254 HZ2 TRP 33 2HZ TRP 33 -2.194 2.183 4.051 255 HZ3 TRP 33 3HZ TRP 33 -1.041 -1.824 5.083 256 HH2 TRP 33 HH TRP 33 -2.630 -0.260 3.999 257 HA PRO 34 HA PRO 34 5.954 4.744 7.993 258 HB2 PRO 34 2HB PRO 34 8.229 3.197 9.046 259 HB3 PRO 34 1HB PRO 34 7.110 4.275 9.899 260 HG2 PRO 34 2HG PRO 34 7.070 1.611 10.222 261 HG3 PRO 34 1HG PRO 34 5.605 2.605 10.313 262 HD2 PRO 34 2HD PRO 34 6.565 0.866 8.066 263 HD3 PRO 34 1HD PRO 34 4.909 1.133 8.655 264 HA PRO 35 HA PRO 35 8.865 4.654 4.469 265 HB2 PRO 35 2HB PRO 35 8.579 7.238 3.718 266 HB3 PRO 35 1HB PRO 35 7.360 6.004 3.342 267 HG2 PRO 35 2HG PRO 35 7.334 8.119 5.421 268 HG3 PRO 35 1HG PRO 35 6.001 7.455 4.463 269 HD2 PRO 35 2HD PRO 35 6.592 6.752 7.108 270 HD3 PRO 35 1HD PRO 35 5.576 5.811 5.996 271 H SER 36 H SER 36 10.955 5.696 4.043 272 HA SER 36 HA SER 36 12.522 6.221 6.339 273 HB2 SER 36 2HB SER 36 13.037 7.223 3.523 274 HB3 SER 36 1HB SER 36 14.238 7.022 4.796 275 HG SER 36 HG SER 36 12.604 4.933 3.780 276 H HIS 37 H HIS 37 10.627 8.380 4.306 277 HA HIS 37 HA HIS 37 11.656 10.768 5.706 278 HB2 HIS 37 2HB HIS 37 9.537 10.428 3.560 279 HB3 HIS 37 1HB HIS 37 10.055 11.982 4.212 280 HD1 HIS 37 1HD HIS 37 11.190 9.158 2.018 281 HD2 HIS 37 2HD HIS 37 12.668 12.806 3.402 282 HE1 HIS 37 1HE HIS 37 13.265 9.657 0.651 283 HE2 HIS 37 2HE HIS 37 14.172 11.874 1.485 284 H VAL 38 H VAL 38 9.457 12.334 6.079 285 HA VAL 38 HA VAL 38 8.013 10.830 8.200 286 HB VAL 38 HB VAL 38 8.126 13.817 7.684 287 HG11 VAL 38 1HG1 VAL 38 7.571 13.122 10.390 288 HG12 VAL 38 2HG1 VAL 38 6.484 12.178 9.371 289 HG13 VAL 38 3HG1 VAL 38 6.508 13.937 9.243 290 HG21 VAL 38 1HG2 VAL 38 9.726 13.871 9.545 291 HG22 VAL 38 2HG2 VAL 38 10.338 12.830 8.259 292 HG23 VAL 38 3HG2 VAL 38 9.624 12.117 9.706 293 H LEU 39 H LEU 39 5.892 10.335 7.964 294 HA LEU 39 HA LEU 39 4.417 11.564 5.669 295 HB2 LEU 39 2HB LEU 39 4.913 9.002 5.753 296 HB3 LEU 39 1HB LEU 39 3.656 8.965 6.990 297 HG LEU 39 HG LEU 39 2.130 10.152 5.381 298 HD11 LEU 39 1HD1 LEU 39 3.230 9.532 2.916 299 HD12 LEU 39 2HD1 LEU 39 4.615 10.142 3.821 300 HD13 LEU 39 3HD1 LEU 39 3.176 11.142 3.636 301 HD21 LEU 39 1HD2 LEU 39 2.751 7.825 3.771 302 HD22 LEU 39 2HD2 LEU 39 1.379 8.096 4.844 303 HD23 LEU 39 3HD2 LEU 39 2.884 7.438 5.486 304 H VAL 40 H VAL 40 2.214 12.231 6.082 305 HA VAL 40 HA VAL 40 0.588 13.269 7.447 306 HB VAL 40 HB VAL 40 1.016 11.272 9.612 307 HG11 VAL 40 1HG1 VAL 40 -1.370 12.241 8.007 308 HG12 VAL 40 2HG1 VAL 40 -0.935 12.727 9.646 309 HG13 VAL 40 3HG1 VAL 40 -1.465 11.077 9.329 310 HG21 VAL 40 1HG2 VAL 40 -0.237 9.582 8.088 311 HG22 VAL 40 2HG2 VAL 40 1.499 9.764 7.846 312 HG23 VAL 40 3HG2 VAL 40 0.367 10.556 6.750 313 H LYS 41 H LYS 41 0.313 13.941 9.985 314 HA LYS 41 HA LYS 41 2.472 15.684 10.580 315 HB2 LYS 41 2HB LYS 41 0.389 14.508 12.435 316 HB3 LYS 41 1HB LYS 41 1.442 15.858 12.846 317 HG2 LYS 41 2HG LYS 41 0.530 17.111 10.887 318 HG3 LYS 41 1HG LYS 41 -0.596 15.783 10.603 319 HD2 LYS 41 2HD LYS 41 -1.487 16.099 12.915 320 HD3 LYS 41 1HD LYS 41 -0.433 17.501 13.095 321 HE2 LYS 41 2HE LYS 41 -2.611 17.169 11.012 322 HE3 LYS 41 1HE LYS 41 -2.680 18.223 12.423 323 HZ1 LYS 41 1HZ LYS 41 -0.599 18.427 10.320 324 HZ2 LYS 41 2HZ LYS 41 -0.902 19.524 11.583 325 HZ3 LYS 41 3HZ LYS 41 -2.025 19.347 10.320 326 H LYS 42 H LYS 42 1.749 12.392 11.627 327 HA LYS 42 HA LYS 42 4.544 12.192 12.653 328 HB2 LYS 42 2HB LYS 42 2.159 10.808 13.892 329 HB3 LYS 42 1HB LYS 42 3.812 10.826 14.497 330 HG2 LYS 42 2HG LYS 42 2.287 13.396 14.126 331 HG3 LYS 42 1HG LYS 42 2.087 12.433 15.586 332 HD2 LYS 42 2HD LYS 42 4.244 12.825 16.312 333 HD3 LYS 42 1HD LYS 42 4.875 13.036 14.681 334 HE2 LYS 42 2HE LYS 42 3.649 15.186 14.510 335 HE3 LYS 42 1HE LYS 42 3.113 14.985 16.180 336 HZ1 LYS 42 1HZ LYS 42 5.130 16.393 15.895 337 HZ2 LYS 42 2HZ LYS 42 5.965 15.011 15.366 338 HZ3 LYS 42 3HZ LYS 42 5.340 15.078 16.946 339 H GLU 43 H GLU 43 5.527 10.129 12.275 340 HA GLU 43 HA GLU 43 4.652 8.766 9.924 341 HB2 GLU 43 2HB GLU 43 6.518 7.832 12.112 342 HB3 GLU 43 1HB GLU 43 6.350 7.061 10.537 343 HG2 GLU 43 2HG GLU 43 7.017 9.195 9.451 344 HG3 GLU 43 1HG GLU 43 7.259 9.910 11.045 345 H ARG 44 H ARG 44 3.265 7.034 9.673 346 HA ARG 44 HA ARG 44 1.521 6.322 11.847 347 HB2 ARG 44 2HB ARG 44 1.969 5.072 9.131 348 HB3 ARG 44 1HB ARG 44 0.739 4.511 10.265 349 HG2 ARG 44 2HG ARG 44 -0.114 6.903 10.343 350 HG3 ARG 44 1HG ARG 44 0.953 7.238 8.978 351 HD2 ARG 44 2HD ARG 44 -1.111 5.034 9.005 352 HD3 ARG 44 1HD ARG 44 -1.394 6.628 8.304 353 HE ARG 44 HE ARG 44 0.379 4.535 7.211 354 HH11 ARG 44 1HH1 ARG 44 1.065 4.934 5.096 355 HH12 ARG 44 2HH1 ARG 44 0.799 6.493 4.392 356 HH21 ARG 44 1HH2 ARG 44 -0.748 7.799 7.204 357 HH22 ARG 44 2HH2 ARG 44 -0.226 8.111 5.584 358 H ALA 45 H ALA 45 1.486 4.463 13.127 359 HA ALA 45 HA ALA 45 3.851 2.662 12.863 360 HB1 ALA 45 1HB ALA 45 3.157 4.453 15.029 361 HB2 ALA 45 2HB ALA 45 4.628 3.512 14.788 362 HB3 ALA 45 3HB ALA 45 3.236 2.783 15.589 363 H GLY 46 H GLY 46 0.471 3.021 13.919 364 HA2 GLY 46 2HA GLY 46 0.310 0.028 13.852 365 HA3 GLY 46 1HA GLY 46 -0.450 0.933 15.156 366 H LEU 47 H LEU 47 -1.652 -0.817 13.084 367 HA LEU 47 HA LEU 47 -3.864 0.954 12.402 368 HB2 LEU 47 2HB LEU 47 -3.783 0.426 9.961 369 HB3 LEU 47 1HB LEU 47 -2.434 1.428 10.488 370 HG LEU 47 HG LEU 47 -2.277 -1.592 10.274 371 HD11 LEU 47 1HD1 LEU 47 -0.729 -0.328 8.260 372 HD12 LEU 47 2HD1 LEU 47 -2.341 0.385 8.185 373 HD13 LEU 47 3HD1 LEU 47 -2.142 -1.362 8.042 374 HD21 LEU 47 1HD2 LEU 47 0.246 -0.663 9.965 375 HD22 LEU 47 2HD2 LEU 47 -0.433 -1.067 11.540 376 HD23 LEU 47 3HD2 LEU 47 -0.403 0.610 10.996 377 H ALA 48 H ALA 48 -5.771 -0.226 12.073 378 HA ALA 48 HA ALA 48 -5.543 -3.173 11.804 379 HB1 ALA 48 1HB ALA 48 -5.648 -2.949 14.190 380 HB2 ALA 48 2HB ALA 48 -7.268 -3.407 13.664 381 HB3 ALA 48 3HB ALA 48 -6.917 -1.730 14.083 382 H PHE 49 H PHE 49 -7.302 -4.050 10.684 383 HA PHE 49 HA PHE 49 -9.667 -2.334 10.224 384 HB2 PHE 49 2HB PHE 49 -9.491 -2.562 7.778 385 HB3 PHE 49 1HB PHE 49 -8.090 -1.716 8.439 386 HD1 PHE 49 1HD PHE 49 -9.284 -4.753 6.787 387 HD2 PHE 49 2HD PHE 49 -5.918 -2.861 8.664 388 HE1 PHE 49 1HE PHE 49 -7.774 -6.444 5.782 389 HE2 PHE 49 2HE PHE 49 -4.409 -4.549 7.664 390 HZ PHE 49 HZ PHE 49 -5.333 -6.341 6.221 391 H GLU 50 H GLU 50 -11.509 -3.511 9.568 392 HA GLU 50 HA GLU 50 -11.348 -6.404 10.122 393 HB2 GLU 50 2HB GLU 50 -13.846 -4.883 9.392 394 HB3 GLU 50 1HB GLU 50 -13.694 -6.326 10.392 395 HG2 GLU 50 2HG GLU 50 -12.382 -4.931 12.045 396 HG3 GLU 50 1HG GLU 50 -12.827 -3.513 11.095 397 HA PRO 51 HA PRO 51 -11.222 -6.788 5.589 398 HB2 PRO 51 2HB PRO 51 -10.593 -9.435 5.478 399 HB3 PRO 51 1HB PRO 51 -9.399 -8.164 5.801 400 HG2 PRO 51 2HG PRO 51 -10.702 -10.057 7.671 401 HG3 PRO 51 1HG PRO 51 -9.066 -9.381 7.699 402 HD2 PRO 51 2HD PRO 51 -11.175 -8.500 9.285 403 HD3 PRO 51 1HD PRO 51 -9.718 -7.553 8.918 404 H PHE 52 H PHE 52 -13.488 -6.513 5.257 405 HA PHE 52 HA PHE 52 -14.901 -8.963 4.524 406 HB2 PHE 52 2HB PHE 52 -16.121 -7.171 6.649 407 HB3 PHE 52 1HB PHE 52 -16.813 -8.654 5.989 408 HD1 PHE 52 1HD PHE 52 -15.631 -10.856 6.390 409 HD2 PHE 52 2HD PHE 52 -14.528 -7.229 8.406 410 HE1 PHE 52 1HE PHE 52 -14.405 -12.176 8.096 411 HE2 PHE 52 2HE PHE 52 -13.306 -8.546 10.110 412 HZ PHE 52 HZ PHE 52 -13.240 -11.020 9.955 413 H VAL 53 H VAL 53 -17.265 -8.178 3.765 414 HA VAL 53 HA VAL 53 -16.754 -5.941 1.943 415 HB VAL 53 HB VAL 53 -19.384 -7.373 2.428 416 HG11 VAL 53 1HG1 VAL 53 -18.241 -5.639 0.238 417 HG12 VAL 53 2HG1 VAL 53 -19.770 -5.460 1.101 418 HG13 VAL 53 3HG1 VAL 53 -19.572 -6.753 -0.081 419 HG21 VAL 53 1HG2 VAL 53 -16.968 -8.515 1.525 420 HG22 VAL 53 2HG2 VAL 53 -17.934 -8.243 0.075 421 HG23 VAL 53 3HG2 VAL 53 -18.582 -9.213 1.399 422 H GLY 54 H GLY 54 -17.128 -3.842 2.522 423 HA2 GLY 54 2HA GLY 54 -18.281 -2.016 3.509 424 HA3 GLY 54 1HA GLY 54 -19.434 -3.161 4.202 425 H GLY 55 H GLY 55 -16.115 -3.923 4.648 426 HA2 GLY 55 2HA GLY 55 -16.344 -3.750 7.531 427 HA3 GLY 55 1HA GLY 55 -14.874 -4.134 6.634 428 H ARG 56 H ARG 56 -14.315 -2.550 8.653 429 HA ARG 56 HA ARG 56 -14.261 0.228 7.521 430 HB2 ARG 56 2HB ARG 56 -14.255 -0.676 10.417 431 HB3 ARG 56 1HB ARG 56 -14.053 0.993 9.888 432 HG2 ARG 56 2HG ARG 56 -16.262 0.851 8.730 433 HG3 ARG 56 1HG ARG 56 -16.471 -0.768 9.398 434 HD2 ARG 56 2HD ARG 56 -16.134 1.791 10.991 435 HD3 ARG 56 1HD ARG 56 -17.624 0.864 10.815 436 HE ARG 56 HE ARG 56 -15.433 0.230 12.611 437 HH11 ARG 56 1HH1 ARG 56 -15.663 -1.665 13.824 438 HH12 ARG 56 2HH1 ARG 56 -16.846 -2.840 13.353 439 HH21 ARG 56 1HH2 ARG 56 -17.957 -1.016 10.621 440 HH22 ARG 56 2HH2 ARG 56 -18.144 -2.472 11.539 441 H TYR 57 H TYR 57 -12.252 1.153 7.274 442 HA TYR 57 HA TYR 57 -9.921 -0.407 8.318 443 HB2 TYR 57 2HB TYR 57 -10.342 -0.260 5.748 444 HB3 TYR 57 1HB TYR 57 -9.783 1.404 5.914 445 HD1 TYR 57 1HD TYR 57 -7.514 1.791 7.094 446 HD2 TYR 57 2HD TYR 57 -8.797 -2.029 5.605 447 HE1 TYR 57 1HE TYR 57 -5.164 1.000 7.100 448 HE2 TYR 57 2HE TYR 57 -6.447 -2.823 5.614 449 HH TYR 57 HH TYR 57 -4.026 -1.371 7.266 450 H TYR 58 H TYR 58 -8.600 0.707 9.684 451 HA TYR 58 HA TYR 58 -8.585 3.674 9.521 452 HB2 TYR 58 2HB TYR 58 -8.585 3.412 12.191 453 HB3 TYR 58 1HB TYR 58 -10.073 3.615 11.268 454 HD1 TYR 58 1HD TYR 58 -8.189 1.437 13.438 455 HD2 TYR 58 2HD TYR 58 -11.319 1.518 10.497 456 HE1 TYR 58 1HE TYR 58 -8.985 -0.778 14.220 457 HE2 TYR 58 2HE TYR 58 -12.112 -0.697 11.279 458 HH TYR 58 HH TYR 58 -10.487 -2.786 12.833 459 H GLU 59 H GLU 59 -6.733 4.636 10.588 460 HA GLU 59 HA GLU 59 -4.527 2.707 11.164 461 HB2 GLU 59 2HB GLU 59 -4.324 5.313 9.627 462 HB3 GLU 59 1HB GLU 59 -2.972 4.260 10.046 463 HG2 GLU 59 2HG GLU 59 -4.025 2.419 8.758 464 HG3 GLU 59 1HG GLU 59 -5.334 3.509 8.299 465 H TRP 60 H TRP 60 -3.091 3.375 12.844 466 HA TRP 60 HA TRP 60 -4.104 5.689 14.447 467 HB2 TRP 60 2HB TRP 60 -2.381 3.359 15.337 468 HB3 TRP 60 1HB TRP 60 -3.013 4.639 16.370 469 HD1 TRP 60 HD TRP 60 -5.925 4.878 15.731 470 HE1 TRP 60 1HE TRP 60 -7.590 2.933 16.037 471 HE3 TRP 60 3HE TRP 60 -2.690 0.924 15.610 472 HZ2 TRP 60 2HZ TRP 60 -7.553 0.076 16.213 473 HZ3 TRP 60 3HZ TRP 60 -3.533 -1.394 15.854 474 HH2 TRP 60 HH TRP 60 -5.956 -1.823 16.154 475 H ASP 61 H ASP 61 -2.752 7.386 14.853 476 HA ASP 61 HA ASP 61 -0.034 7.256 13.641 477 HB2 ASP 61 2HB ASP 61 -1.737 9.579 14.563 478 HB3 ASP 61 1HB ASP 61 -0.101 9.752 13.933 479 H ILE 62 H ILE 62 1.763 8.254 14.903 480 HA ILE 62 HA ILE 62 2.094 7.135 17.455 481 HB ILE 62 HB ILE 62 3.365 9.641 16.358 482 HG12 ILE 62 2HG1 ILE 62 4.359 6.793 16.341 483 HG13 ILE 62 1HG1 ILE 62 3.601 7.577 14.964 484 HG21 ILE 62 1HG2 ILE 62 4.427 9.783 18.322 485 HG22 ILE 62 2HG2 ILE 62 5.106 8.181 18.028 486 HG23 ILE 62 3HG2 ILE 62 3.584 8.346 18.903 487 HD11 ILE 62 1HD1 ILE 62 5.871 7.948 14.534 488 HD12 ILE 62 2HD1 ILE 62 6.253 8.166 16.242 489 HD13 ILE 62 3HD1 ILE 62 5.405 9.435 15.359 490 H ASP 63 H ASP 63 1.056 10.442 16.628 491 HA ASP 63 HA ASP 63 0.023 10.691 19.428 492 HB2 ASP 63 2HB ASP 63 1.231 12.836 17.657 493 HB3 ASP 63 1HB ASP 63 0.443 13.147 19.203 494 H GLY 64 H GLY 64 -0.621 10.899 16.047 495 HA2 GLY 64 2HA GLY 64 -3.000 12.563 16.293 496 HA3 GLY 64 1HA GLY 64 -2.536 11.638 14.864 497 H THR 65 H THR 65 -5.166 11.812 16.196 498 HA THR 65 HA THR 65 -5.716 9.435 17.681 499 HB THR 65 HB THR 65 -7.971 10.047 17.503 500 HG1 THR 65 1HG THR 65 -8.812 11.040 15.726 501 HG21 THR 65 1HG2 THR 65 -6.746 12.700 16.807 502 HG22 THR 65 2HG2 THR 65 -6.324 11.895 18.319 503 HG23 THR 65 3HG2 THR 65 -8.000 12.336 17.992 504 H GLU 66 H GLU 66 -8.040 8.671 16.030 505 HA GLU 66 HA GLU 66 -6.612 6.835 14.169 506 HB2 GLU 66 2HB GLU 66 -8.010 5.853 15.991 507 HB3 GLU 66 1HB GLU 66 -9.418 6.661 15.305 508 HG2 GLU 66 2HG GLU 66 -9.006 5.451 13.156 509 HG3 GLU 66 1HG GLU 66 -7.703 4.565 13.951 510 H ILE 67 H ILE 67 -7.033 6.938 11.985 511 HA ILE 67 HA ILE 67 -9.318 8.646 11.084 512 HB ILE 67 HB ILE 67 -6.542 8.553 9.868 513 HG12 ILE 67 2HG1 ILE 67 -7.993 10.801 11.304 514 HG13 ILE 67 1HG1 ILE 67 -6.704 9.825 12.012 515 HG21 ILE 67 1HG2 ILE 67 -9.086 10.016 9.114 516 HG22 ILE 67 2HG2 ILE 67 -8.177 8.869 8.131 517 HG23 ILE 67 3HG2 ILE 67 -7.498 10.456 8.484 518 HD11 ILE 67 1HD1 ILE 67 -6.519 12.060 10.140 519 HD12 ILE 67 2HD1 ILE 67 -5.639 10.639 9.575 520 HD13 ILE 67 3HD1 ILE 67 -5.265 11.341 11.151 521 H VAL 68 H VAL 68 -10.061 8.100 8.868 522 HA VAL 68 HA VAL 68 -9.875 5.183 8.416 523 HB VAL 68 HB VAL 68 -11.540 7.259 6.960 524 HG11 VAL 68 1HG1 VAL 68 -12.526 4.515 7.126 525 HG12 VAL 68 2HG1 VAL 68 -10.965 4.611 6.311 526 HG13 VAL 68 3HG1 VAL 68 -12.332 5.551 5.711 527 HG21 VAL 68 1HG2 VAL 68 -13.078 5.556 8.661 528 HG22 VAL 68 2HG2 VAL 68 -12.877 7.304 8.773 529 HG23 VAL 68 3HG2 VAL 68 -11.765 6.233 9.625 530 H TRP 69 H TRP 69 -8.614 4.327 6.820 531 HA TRP 69 HA TRP 69 -7.260 6.245 4.978 532 HB2 TRP 69 2HB TRP 69 -5.529 5.094 5.955 533 HB3 TRP 69 1HB TRP 69 -6.507 3.658 6.246 534 HD1 TRP 69 HD TRP 69 -4.001 5.083 3.905 535 HE1 TRP 69 1HE TRP 69 -3.648 3.494 1.905 536 HE3 TRP 69 3HE TRP 69 -7.942 1.906 4.591 537 HZ2 TRP 69 2HZ TRP 69 -4.871 1.181 0.752 538 HZ3 TRP 69 3HZ TRP 69 -8.323 0.020 3.030 539 HH2 TRP 69 HH TRP 69 -6.794 -0.348 1.112 540 H GLY 70 H GLY 70 -9.785 4.040 4.985 541 HA2 GLY 70 2HA GLY 70 -10.504 4.215 2.329 542 HA3 GLY 70 1HA GLY 70 -9.347 2.882 2.342 543 H ARG 71 H ARG 71 -10.767 1.147 2.030 544 HA ARG 71 HA ARG 71 -12.331 0.348 4.351 545 HB2 ARG 71 2HB ARG 71 -13.726 1.959 2.707 546 HB3 ARG 71 1HB ARG 71 -13.998 0.427 1.886 547 HG2 ARG 71 2HG ARG 71 -14.754 -0.561 4.046 548 HG3 ARG 71 1HG ARG 71 -14.568 1.019 4.803 549 HD2 ARG 71 2HD ARG 71 -16.197 1.962 3.182 550 HD3 ARG 71 1HD ARG 71 -16.419 0.353 2.495 551 HE ARG 71 HE ARG 71 -16.932 0.017 5.207 552 HH11 ARG 71 1HH1 ARG 71 -19.014 0.210 6.064 553 HH12 ARG 71 2HH1 ARG 71 -20.193 1.167 5.232 554 HH21 ARG 71 1HH2 ARG 71 -18.046 2.052 2.658 555 HH22 ARG 71 2HH2 ARG 71 -19.646 2.210 3.303 556 H ILE 72 H ILE 72 -13.930 -1.568 2.905 557 HA ILE 72 HA ILE 72 -11.876 -3.199 1.500 558 HB ILE 72 HB ILE 72 -13.700 -4.163 3.722 559 HG12 ILE 72 2HG1 ILE 72 -11.174 -4.806 4.462 560 HG13 ILE 72 1HG1 ILE 72 -10.850 -3.337 3.542 561 HG21 ILE 72 1HG2 ILE 72 -11.767 -5.612 1.892 562 HG22 ILE 72 2HG2 ILE 72 -13.499 -5.900 2.059 563 HG23 ILE 72 3HG2 ILE 72 -12.405 -6.311 3.380 564 HD11 ILE 72 1HD1 ILE 72 -11.251 -2.768 5.888 565 HD12 ILE 72 2HD1 ILE 72 -12.802 -3.603 5.844 566 HD13 ILE 72 3HD1 ILE 72 -12.562 -2.142 4.889 567 H LEU 73 H LEU 73 -12.890 -4.951 0.186 568 HA LEU 73 HA LEU 73 -15.693 -4.259 -0.602 569 HB2 LEU 73 2HB LEU 73 -13.944 -3.619 -2.299 570 HB3 LEU 73 1HB LEU 73 -13.507 -5.323 -2.415 571 HG LEU 73 HG LEU 73 -16.079 -5.663 -2.852 572 HD11 LEU 73 1HD1 LEU 73 -17.018 -3.709 -4.110 573 HD12 LEU 73 2HD1 LEU 73 -15.632 -2.754 -3.586 574 HD13 LEU 73 3HD1 LEU 73 -16.777 -3.374 -2.396 575 HD21 LEU 73 1HD2 LEU 73 -15.541 -4.905 -5.346 576 HD22 LEU 73 2HD2 LEU 73 -14.725 -6.292 -4.625 577 HD23 LEU 73 3HD2 LEU 73 -13.911 -4.728 -4.695 578 H GLU 74 H GLU 74 -13.258 -6.859 -0.754 579 HA GLU 74 HA GLU 74 -14.961 -8.796 0.492 580 HB2 GLU 74 2HB GLU 74 -16.146 -8.579 -1.706 581 HB3 GLU 74 1HB GLU 74 -14.669 -9.118 -2.497 582 HG2 GLU 74 2HG GLU 74 -14.741 -11.209 -1.147 583 HG3 GLU 74 1HG GLU 74 -16.277 -10.679 -0.460 584 H TRP 75 H TRP 75 -13.718 -10.550 1.104 585 HA TRP 75 HA TRP 75 -10.925 -10.587 0.070 586 HB2 TRP 75 2HB TRP 75 -10.640 -10.397 2.346 587 HB3 TRP 75 1HB TRP 75 -12.177 -11.182 2.707 588 HD1 TRP 75 HD TRP 75 -8.514 -11.896 2.107 589 HE1 TRP 75 1HE TRP 75 -8.048 -14.392 2.561 590 HE3 TRP 75 3HE TRP 75 -13.297 -13.603 2.621 591 HZ2 TRP 75 2HZ TRP 75 -9.515 -16.795 3.073 592 HZ3 TRP 75 3HZ TRP 75 -13.736 -15.994 3.088 593 HH2 TRP 75 HH TRP 75 -11.854 -17.593 3.316 594 H ASP 76 H ASP 76 -10.346 -12.286 -1.191 595 HA ASP 76 HA ASP 76 -12.064 -14.726 -1.108 596 HB2 ASP 76 2HB ASP 76 -11.563 -13.070 -3.269 597 HB3 ASP 76 1HB ASP 76 -10.423 -14.398 -3.506 598 HA PRO 77 HA PRO 77 -8.568 -16.878 0.735 599 HB2 PRO 77 2HB PRO 77 -9.435 -18.869 -1.355 600 HB3 PRO 77 1HB PRO 77 -8.952 -19.159 0.327 601 HG2 PRO 77 2HG PRO 77 -11.519 -19.065 -0.394 602 HG3 PRO 77 1HG PRO 77 -10.961 -18.459 1.175 603 HD2 PRO 77 2HD PRO 77 -11.990 -16.950 -1.130 604 HD3 PRO 77 1HD PRO 77 -11.795 -16.422 0.556 605 HA PRO 78 HA PRO 78 -4.829 -16.130 -1.462 606 HB2 PRO 78 2HB PRO 78 -4.676 -19.118 -1.723 607 HB3 PRO 78 1HB PRO 78 -3.404 -17.966 -1.268 608 HG2 PRO 78 2HG PRO 78 -4.865 -19.435 0.523 609 HG3 PRO 78 1HG PRO 78 -4.061 -17.905 0.898 610 HD2 PRO 78 2HD PRO 78 -6.894 -18.431 0.848 611 HD3 PRO 78 1HD PRO 78 -6.082 -16.893 1.203 612 H HIS 79 H HIS 79 -5.903 -15.226 -3.314 613 HA HIS 79 HA HIS 79 -5.353 -16.314 -5.807 614 HB2 HIS 79 2HB HIS 79 -7.724 -17.537 -4.565 615 HB3 HIS 79 1HB HIS 79 -8.014 -16.900 -6.183 616 HD1 HIS 79 1HD HIS 79 -6.972 -19.906 -4.626 617 HD2 HIS 79 2HD HIS 79 -5.632 -17.802 -7.970 618 HE1 HIS 79 1HE HIS 79 -5.649 -21.552 -6.027 619 HE2 HIS 79 2HE HIS 79 -4.830 -20.282 -8.065 620 H ARG 80 H ARG 80 -8.026 -14.649 -4.045 621 HA ARG 80 HA ARG 80 -7.702 -12.449 -6.016 622 HB2 ARG 80 2HB ARG 80 -9.767 -14.205 -6.300 623 HB3 ARG 80 1HB ARG 80 -10.504 -12.977 -5.275 624 HG2 ARG 80 2HG ARG 80 -9.027 -12.388 -7.854 625 HG3 ARG 80 1HG ARG 80 -10.782 -12.492 -7.709 626 HD2 ARG 80 2HD ARG 80 -8.929 -10.489 -6.415 627 HD3 ARG 80 1HD ARG 80 -10.253 -10.172 -7.533 628 HE ARG 80 HE ARG 80 -10.508 -10.644 -4.656 629 HH11 ARG 80 1HH1 ARG 80 -12.610 -10.465 -3.844 630 HH12 ARG 80 2HH1 ARG 80 -13.949 -10.444 -4.941 631 HH21 ARG 80 1HH2 ARG 80 -11.972 -10.728 -7.776 632 HH22 ARG 80 2HH2 ARG 80 -13.588 -10.591 -7.168 633 H LEU 81 H LEU 81 -7.723 -10.488 -5.098 634 HA LEU 81 HA LEU 81 -8.855 -10.219 -2.342 635 HB2 LEU 81 2HB LEU 81 -6.350 -10.283 -2.330 636 HB3 LEU 81 1HB LEU 81 -6.345 -8.880 -3.395 637 HG LEU 81 HG LEU 81 -7.743 -7.682 -1.632 638 HD11 LEU 81 1HD1 LEU 81 -7.261 -8.731 0.713 639 HD12 LEU 81 2HD1 LEU 81 -7.066 -10.235 -0.185 640 HD13 LEU 81 3HD1 LEU 81 -8.599 -9.365 -0.243 641 HD21 LEU 81 1HD2 LEU 81 -5.751 -7.247 -0.185 642 HD22 LEU 81 2HD2 LEU 81 -5.365 -7.207 -1.905 643 HD23 LEU 81 3HD2 LEU 81 -4.943 -8.620 -0.939 644 H ALA 82 H ALA 82 -10.276 -8.523 -2.153 645 HA ALA 82 HA ALA 82 -10.153 -6.355 -4.208 646 HB1 ALA 82 1HB ALA 82 -12.009 -8.186 -4.520 647 HB2 ALA 82 2HB ALA 82 -12.446 -6.484 -4.667 648 HB3 ALA 82 3HB ALA 82 -12.795 -7.359 -3.175 649 H MET 83 H MET 83 -10.635 -4.281 -3.373 650 HA MET 83 HA MET 83 -11.548 -4.141 -0.552 651 HB2 MET 83 2HB MET 83 -9.010 -2.843 -1.571 652 HB3 MET 83 1HB MET 83 -9.705 -2.605 0.033 653 HG2 MET 83 2HG MET 83 -9.528 -5.085 0.405 654 HG3 MET 83 1HG MET 83 -8.667 -5.202 -1.130 655 HE1 MET 83 1HE MET 83 -5.493 -3.342 -0.778 656 HE2 MET 83 2HE MET 83 -6.861 -2.238 -0.889 657 HE3 MET 83 3HE MET 83 -6.886 -3.754 -1.786 658 H THR 84 H THR 84 -12.753 -2.305 -0.103 659 HA THR 84 HA THR 84 -13.200 -0.437 -2.388 660 HB THR 84 HB THR 84 -14.802 -0.795 0.170 661 HG1 THR 84 1HG THR 84 -16.270 -1.591 -1.682 662 HG21 THR 84 1HG2 THR 84 -15.341 0.747 -2.381 663 HG22 THR 84 2HG2 THR 84 -15.049 1.436 -0.785 664 HG23 THR 84 3HG2 THR 84 -16.515 0.505 -1.088 665 H TRP 85 H TRP 85 -12.704 1.788 -2.112 666 HA TRP 85 HA TRP 85 -11.141 2.378 0.354 667 HB2 TRP 85 2HB TRP 85 -11.089 3.442 -2.448 668 HB3 TRP 85 1HB TRP 85 -10.424 4.405 -1.127 669 HD1 TRP 85 HD TRP 85 -10.236 0.578 -1.589 670 HE1 TRP 85 1HE TRP 85 -7.752 -0.111 -1.594 671 HE3 TRP 85 3HE TRP 85 -8.044 5.182 -1.339 672 HZ2 TRP 85 2HZ TRP 85 -5.176 1.128 -1.509 673 HZ3 TRP 85 3HZ TRP 85 -5.576 5.400 -1.304 674 HH2 TRP 85 HH TRP 85 -4.140 3.380 -1.387 675 H ARG 86 H ARG 86 -12.078 3.604 1.885 676 HA ARG 86 HA ARG 86 -14.134 5.614 1.035 677 HB2 ARG 86 2HB ARG 86 -15.018 3.796 2.500 678 HB3 ARG 86 1HB ARG 86 -13.834 4.238 3.730 679 HG2 ARG 86 2HG ARG 86 -14.816 6.481 3.885 680 HG3 ARG 86 1HG ARG 86 -15.977 6.075 2.622 681 HD2 ARG 86 2HD ARG 86 -17.140 5.754 4.680 682 HD3 ARG 86 1HD ARG 86 -16.708 4.137 4.128 683 HE ARG 86 HE ARG 86 -14.721 5.324 5.912 684 HH11 ARG 86 1HH1 ARG 86 -14.497 4.297 7.914 685 HH12 ARG 86 2HH1 ARG 86 -15.705 3.169 8.433 686 HH21 ARG 86 1HH2 ARG 86 -17.646 3.529 5.583 687 HH22 ARG 86 2HH2 ARG 86 -17.488 2.735 7.113 688 H ILE 87 H ILE 87 -12.852 7.464 0.844 689 HA ILE 87 HA ILE 87 -11.347 8.271 3.296 690 HB ILE 87 HB ILE 87 -9.872 7.335 1.412 691 HG12 ILE 87 2HG1 ILE 87 -8.588 9.790 1.567 692 HG13 ILE 87 1HG1 ILE 87 -9.623 9.793 2.994 693 HG21 ILE 87 1HG2 ILE 87 -10.419 10.033 0.171 694 HG22 ILE 87 2HG2 ILE 87 -11.268 8.576 -0.345 695 HG23 ILE 87 3HG2 ILE 87 -9.516 8.683 -0.517 696 HD11 ILE 87 1HD1 ILE 87 -7.668 8.739 3.768 697 HD12 ILE 87 2HD1 ILE 87 -7.439 7.854 2.260 698 HD13 ILE 87 3HD1 ILE 87 -8.721 7.379 3.374 699 H ASP 88 H ASP 88 -11.125 10.577 3.559 700 HA ASP 88 HA ASP 88 -13.207 12.116 2.077 701 HB2 ASP 88 2HB ASP 88 -13.326 12.024 4.590 702 HB3 ASP 88 1HB ASP 88 -11.774 12.860 4.646 703 H GLY 89 H GLY 89 -12.648 14.134 1.123 704 HA2 GLY 89 2HA GLY 89 -9.899 14.303 0.182 705 HA3 GLY 89 1HA GLY 89 -11.198 15.421 -0.224 706 H HIS 90 H HIS 90 -11.673 15.715 2.812 707 HA HIS 90 HA HIS 90 -9.766 17.932 3.123 708 HB2 HIS 90 2HB HIS 90 -12.058 16.998 4.856 709 HB3 HIS 90 1HB HIS 90 -11.131 18.467 5.117 710 HD1 HIS 90 1HD HIS 90 -10.912 19.569 2.287 711 HD2 HIS 90 2HD HIS 90 -14.437 17.968 3.832 712 HE1 HIS 90 1HE HIS 90 -12.805 20.547 0.914 713 HE2 HIS 90 2HE HIS 90 -14.957 19.576 1.843 714 H TRP 91 H TRP 91 -9.194 14.881 3.454 715 HA TRP 91 HA TRP 91 -7.802 13.583 4.812 716 HB2 TRP 91 2HB TRP 91 -6.865 16.330 5.031 717 HB3 TRP 91 1HB TRP 91 -6.536 15.412 6.503 718 HD1 TRP 91 HD TRP 91 -5.117 16.064 3.211 719 HE1 TRP 91 1HE TRP 91 -3.352 14.290 2.585 720 HE3 TRP 91 3HE TRP 91 -6.123 12.530 6.755 721 HZ2 TRP 91 2HZ TRP 91 -2.488 11.708 3.471 722 HZ3 TRP 91 3HZ TRP 91 -4.817 10.426 6.841 723 HH2 TRP 91 HH TRP 91 -3.002 10.011 5.205 724 H GLN 92 H GLN 92 -10.536 14.520 5.755 725 HA GLN 92 HA GLN 92 -10.136 14.384 8.696 726 HB2 GLN 92 2HB GLN 92 -12.649 14.858 7.068 727 HB3 GLN 92 1HB GLN 92 -12.541 14.920 8.829 728 HG2 GLN 92 2HG GLN 92 -11.031 16.701 6.895 729 HG3 GLN 92 1HG GLN 92 -12.403 17.179 7.885 730 HE21 GLN 92 1HE2 GLN 92 -9.207 17.653 7.837 731 HE22 GLN 92 2HE2 GLN 92 -8.847 17.624 9.496 732 H SER 93 H SER 93 -13.138 13.179 7.688 733 HA SER 93 HA SER 93 -12.238 10.390 7.437 734 HB2 SER 93 2HB SER 93 -13.275 9.567 9.402 735 HB3 SER 93 1HB SER 93 -12.402 10.999 9.934 736 HG SER 93 HG SER 93 -14.279 12.123 10.009 737 H VAL 94 H VAL 94 -14.045 8.969 6.819 738 HA VAL 94 HA VAL 94 -16.441 10.472 5.855 739 HB VAL 94 HB VAL 94 -16.102 8.362 4.079 740 HG11 VAL 94 1HG1 VAL 94 -16.869 10.512 3.371 741 HG12 VAL 94 2HG1 VAL 94 -15.339 10.249 2.533 742 HG13 VAL 94 3HG1 VAL 94 -15.401 11.302 3.947 743 HG21 VAL 94 1HG2 VAL 94 -13.437 9.748 4.474 744 HG22 VAL 94 2HG2 VAL 94 -13.807 8.440 3.353 745 HG23 VAL 94 3HG2 VAL 94 -13.785 8.132 5.088 746 HA PRO 95 HA PRO 95 -17.943 6.947 8.364 747 HB2 PRO 95 2HB PRO 95 -20.445 7.992 8.847 748 HB3 PRO 95 1HB PRO 95 -19.012 8.323 9.836 749 HG2 PRO 95 2HG PRO 95 -20.356 10.018 7.837 750 HG3 PRO 95 1HG PRO 95 -19.424 10.473 9.269 751 HD2 PRO 95 2HD PRO 95 -18.502 10.592 6.643 752 HD3 PRO 95 1HD PRO 95 -17.469 10.601 8.089 753 H ASP 96 H ASP 96 -19.074 8.225 5.385 754 HA ASP 96 HA ASP 96 -20.498 5.668 4.872 755 HB2 ASP 96 2HB ASP 96 -22.181 7.411 5.536 756 HB3 ASP 96 1HB ASP 96 -21.664 8.358 4.144 757 H ASP 97 H ASP 97 -20.435 5.032 2.671 758 HA ASP 97 HA ASP 97 -18.285 6.263 1.115 759 HB2 ASP 97 2HB ASP 97 -20.110 3.895 0.677 760 HB3 ASP 97 1HB ASP 97 -18.965 4.435 -0.545 761 H ASP 98 H ASP 98 -18.900 8.220 0.217 762 HA ASP 98 HA ASP 98 -21.554 8.434 -1.069 763 HB2 ASP 98 2HB ASP 98 -20.538 10.280 0.379 764 HB3 ASP 98 1HB ASP 98 -19.411 10.552 -0.947 765 H ARG 99 H ARG 99 -18.154 9.032 -1.923 766 HA ARG 99 HA ARG 99 -18.803 8.207 -4.722 767 HB2 ARG 99 2HB ARG 99 -16.944 10.424 -3.822 768 HB3 ARG 99 1HB ARG 99 -17.158 9.885 -5.489 769 HG2 ARG 99 2HG ARG 99 -19.548 10.488 -5.378 770 HG3 ARG 99 1HG ARG 99 -19.330 11.038 -3.716 771 HD2 ARG 99 2HD ARG 99 -17.650 12.694 -4.511 772 HD3 ARG 99 1HD ARG 99 -17.960 12.182 -6.171 773 HE ARG 99 HE ARG 99 -19.712 13.858 -4.529 774 HH11 ARG 99 1HH1 ARG 99 -21.557 14.627 -5.585 775 HH12 ARG 99 2HH1 ARG 99 -22.027 13.928 -7.098 776 HH21 ARG 99 1HH2 ARG 99 -19.387 11.682 -7.182 777 HH22 ARG 99 2HH2 ARG 99 -20.799 12.261 -8.002 778 H ALA 100 H ALA 100 -17.644 6.694 -2.407 779 HA ALA 100 HA ALA 100 -14.806 6.475 -2.729 780 HB1 ALA 100 1HB ALA 100 -15.337 4.066 -1.787 781 HB2 ALA 100 2HB ALA 100 -16.941 4.752 -1.538 782 HB3 ALA 100 3HB ALA 100 -15.539 5.489 -0.765 783 H SER 101 H SER 101 -13.581 4.897 -3.858 784 HA SER 101 HA SER 101 -14.986 3.761 -6.236 785 HB2 SER 101 2HB SER 101 -12.843 3.850 -7.365 786 HB3 SER 101 1HB SER 101 -13.133 5.421 -6.624 787 HG SER 101 HG SER 101 -11.550 5.073 -5.260 788 H GLU 102 H GLU 102 -14.197 1.620 -6.973 789 HA GLU 102 HA GLU 102 -13.367 -0.069 -4.651 790 HB2 GLU 102 2HB GLU 102 -14.858 -0.832 -7.181 791 HB3 GLU 102 1HB GLU 102 -14.426 -1.940 -5.877 792 HG2 GLU 102 2HG GLU 102 -15.755 -0.562 -4.294 793 HG3 GLU 102 1HG GLU 102 -16.229 0.485 -5.631 794 H ILE 103 H ILE 103 -11.669 -1.507 -4.906 795 HA ILE 103 HA ILE 103 -10.074 -1.196 -7.421 796 HB ILE 103 HB ILE 103 -9.064 -1.779 -4.624 797 HG12 ILE 103 2HG1 ILE 103 -8.893 0.777 -6.249 798 HG13 ILE 103 1HG1 ILE 103 -9.991 0.528 -4.892 799 HG21 ILE 103 1HG2 ILE 103 -7.138 -2.309 -5.650 800 HG22 ILE 103 2HG2 ILE 103 -7.112 -0.726 -6.427 801 HG23 ILE 103 3HG2 ILE 103 -7.916 -2.082 -7.217 802 HD11 ILE 103 1HD1 ILE 103 -7.760 -0.183 -3.647 803 HD12 ILE 103 2HD1 ILE 103 -8.204 1.518 -3.794 804 HD13 ILE 103 3HD1 ILE 103 -7.011 0.819 -4.887 805 H GLU 104 H GLU 104 -9.409 -3.083 -8.427 806 HA GLU 104 HA GLU 104 -10.224 -5.637 -7.093 807 HB2 GLU 104 2HB GLU 104 -11.381 -5.090 -9.255 808 HB3 GLU 104 1HB GLU 104 -9.807 -5.128 -10.053 809 HG2 GLU 104 2HG GLU 104 -9.497 -7.472 -9.252 810 HG3 GLU 104 1HG GLU 104 -11.125 -7.425 -8.572 811 H VAL 105 H VAL 105 -8.502 -6.723 -6.314 812 HA VAL 105 HA VAL 105 -5.941 -6.599 -7.846 813 HB VAL 105 HB VAL 105 -6.235 -6.814 -4.835 814 HG11 VAL 105 1HG1 VAL 105 -3.856 -6.523 -6.689 815 HG12 VAL 105 2HG1 VAL 105 -4.213 -7.880 -5.622 816 HG13 VAL 105 3HG1 VAL 105 -3.765 -6.316 -4.940 817 HG21 VAL 105 1HG2 VAL 105 -6.449 -4.572 -4.823 818 HG22 VAL 105 2HG2 VAL 105 -6.349 -4.525 -6.583 819 HG23 VAL 105 3HG2 VAL 105 -4.877 -4.448 -5.614 820 H ASP 106 H ASP 106 -5.167 -8.593 -8.406 821 HA ASP 106 HA ASP 106 -6.403 -10.958 -7.055 822 HB2 ASP 106 2HB ASP 106 -5.401 -10.662 -9.900 823 HB3 ASP 106 1HB ASP 106 -5.974 -12.171 -9.192 824 H PHE 107 H PHE 107 -4.998 -12.362 -6.088 825 HA PHE 107 HA PHE 107 -2.085 -11.975 -6.653 826 HB2 PHE 107 2HB PHE 107 -3.608 -12.217 -4.127 827 HB3 PHE 107 1HB PHE 107 -2.100 -13.131 -4.201 828 HD1 PHE 107 1HD PHE 107 -3.616 -9.810 -4.092 829 HD2 PHE 107 2HD PHE 107 0.050 -11.981 -4.635 830 HE1 PHE 107 1HE PHE 107 -2.328 -7.726 -3.724 831 HE2 PHE 107 2HE PHE 107 1.340 -9.898 -4.267 832 HZ PHE 107 HZ PHE 107 0.157 -7.771 -3.812 833 H VAL 108 H VAL 108 -1.185 -13.694 -7.621 834 HA VAL 108 HA VAL 108 -2.179 -16.415 -6.918 835 HB VAL 108 HB VAL 108 -2.551 -17.019 -9.111 836 HG11 VAL 108 1HG1 VAL 108 -3.612 -15.209 -10.339 837 HG12 VAL 108 2HG1 VAL 108 -2.731 -14.007 -9.396 838 HG13 VAL 108 3HG1 VAL 108 -3.960 -15.007 -8.621 839 HG21 VAL 108 1HG2 VAL 108 -1.343 -15.805 -11.024 840 HG22 VAL 108 2HG2 VAL 108 -0.332 -16.784 -9.962 841 HG23 VAL 108 3HG2 VAL 108 -0.368 -15.030 -9.776 842 HA PRO 109 HA PRO 109 2.108 -17.306 -6.321 843 HB2 PRO 109 2HB PRO 109 2.228 -19.891 -7.353 844 HB3 PRO 109 1HB PRO 109 1.713 -19.469 -5.711 845 HG2 PRO 109 2HG PRO 109 0.088 -20.147 -8.088 846 HG3 PRO 109 1HG PRO 109 -0.217 -20.475 -6.374 847 HD2 PRO 109 2HD PRO 109 -1.515 -18.510 -7.751 848 HD3 PRO 109 1HD PRO 109 -1.180 -18.402 -6.008 849 H ASN 110 H ASN 110 3.889 -16.743 -7.503 850 HA ASN 110 HA ASN 110 3.827 -17.228 -10.449 851 HB2 ASN 110 2HB ASN 110 3.684 -14.807 -9.667 852 HB3 ASN 110 1HB ASN 110 5.329 -15.009 -9.069 853 HD21 ASN 110 1HD2 ASN 110 6.896 -14.398 -10.559 854 HD22 ASN 110 2HD2 ASN 110 6.713 -14.447 -12.246 855 H GLY 111 H GLY 111 5.293 -18.777 -10.977 856 HA2 GLY 111 2HA GLY 111 7.242 -20.087 -10.911 857 HA3 GLY 111 1HA GLY 111 8.056 -18.613 -10.378 858 H SER 112 H SER 112 9.242 -19.235 -8.611 859 HA SER 112 HA SER 112 7.747 -20.591 -6.403 860 HB2 SER 112 2HB SER 112 10.638 -21.019 -7.173 861 HB3 SER 112 1HB SER 112 9.827 -21.762 -5.802 862 HG SER 112 HG SER 112 8.377 -22.124 -8.026 863 H GLY 113 H GLY 113 7.987 -19.642 -4.403 864 HA2 GLY 113 2HA GLY 113 8.717 -18.120 -2.773 865 HA3 GLY 113 1HA GLY 113 10.232 -18.002 -3.666 866 H GLY 114 H GLY 114 7.433 -17.331 -5.548 867 HA2 GLY 114 2HA GLY 114 7.572 -14.433 -4.966 868 HA3 GLY 114 1HA GLY 114 8.008 -14.940 -6.596 869 H THR 115 H THR 115 5.753 -13.252 -5.878 870 HA THR 115 HA THR 115 3.573 -14.968 -6.966 871 HB THR 115 HB THR 115 3.308 -14.562 -4.482 872 HG1 THR 115 1HG THR 115 1.115 -13.657 -4.826 873 HG21 THR 115 1HG2 THR 115 3.297 -12.472 -3.606 874 HG22 THR 115 2HG2 THR 115 2.390 -11.806 -4.963 875 HG23 THR 115 3HG2 THR 115 4.136 -12.023 -5.090 876 H ARG 116 H ARG 116 2.241 -13.946 -8.457 877 HA ARG 116 HA ARG 116 3.088 -11.187 -9.252 878 HB2 ARG 116 2HB ARG 116 3.550 -12.930 -10.959 879 HB3 ARG 116 1HB ARG 116 1.842 -13.371 -10.956 880 HG2 ARG 116 2HG ARG 116 1.229 -11.125 -11.711 881 HG3 ARG 116 1HG ARG 116 2.918 -10.620 -11.642 882 HD2 ARG 116 2HD ARG 116 2.416 -11.160 -13.941 883 HD3 ARG 116 1HD ARG 116 3.444 -12.444 -13.306 884 HE ARG 116 HE ARG 116 1.615 -13.940 -13.489 885 HH11 ARG 116 1HH1 ARG 116 -0.486 -14.443 -14.152 886 HH12 ARG 116 2HH1 ARG 116 -1.594 -13.162 -14.521 887 HH21 ARG 116 1HH2 ARG 116 0.682 -10.639 -13.829 888 HH22 ARG 116 2HH2 ARG 116 -0.932 -11.009 -14.338 889 H VAL 117 H VAL 117 1.543 -9.640 -9.073 890 HA VAL 117 HA VAL 117 -1.292 -10.541 -8.854 891 HB VAL 117 HB VAL 117 -0.898 -9.909 -6.665 892 HG11 VAL 117 1HG1 VAL 117 0.540 -7.811 -6.194 893 HG12 VAL 117 2HG1 VAL 117 1.059 -7.956 -7.873 894 HG13 VAL 117 3HG1 VAL 117 1.375 -9.266 -6.736 895 HG21 VAL 117 1HG2 VAL 117 -2.035 -7.860 -6.319 896 HG22 VAL 117 2HG2 VAL 117 -2.623 -8.407 -7.888 897 HG23 VAL 117 3HG2 VAL 117 -1.387 -7.153 -7.798 898 H GLU 118 H GLU 118 -2.829 -9.338 -9.897 899 HA GLU 118 HA GLU 118 -1.820 -7.156 -11.669 900 HB2 GLU 118 2HB GLU 118 -2.915 -9.080 -12.797 901 HB3 GLU 118 1HB GLU 118 -4.365 -8.812 -11.829 902 HG2 GLU 118 2HG GLU 118 -4.544 -6.519 -12.796 903 HG3 GLU 118 1HG GLU 118 -3.162 -6.877 -13.828 904 H LEU 119 H LEU 119 -2.286 -5.141 -10.915 905 HA LEU 119 HA LEU 119 -4.699 -4.811 -9.191 906 HB2 LEU 119 2HB LEU 119 -2.394 -4.341 -8.202 907 HB3 LEU 119 1HB LEU 119 -2.297 -2.975 -9.309 908 HG LEU 119 HG LEU 119 -4.738 -3.242 -7.579 909 HD11 LEU 119 1HD1 LEU 119 -2.795 -3.615 -6.070 910 HD12 LEU 119 2HD1 LEU 119 -3.620 -2.091 -5.740 911 HD13 LEU 119 3HD1 LEU 119 -2.098 -2.095 -6.630 912 HD21 LEU 119 1HD2 LEU 119 -4.395 -0.711 -7.566 913 HD22 LEU 119 2HD2 LEU 119 -4.767 -1.416 -9.135 914 HD23 LEU 119 3HD2 LEU 119 -3.109 -0.963 -8.744 915 H ALA 120 H ALA 120 -6.320 -3.628 -10.055 916 HA ALA 120 HA ALA 120 -5.632 -1.583 -12.119 917 HB1 ALA 120 1HB ALA 120 -6.634 -2.973 -13.610 918 HB2 ALA 120 2HB ALA 120 -8.132 -2.396 -12.879 919 HB3 ALA 120 3HB ALA 120 -7.419 -3.918 -12.347 920 H HIS 121 H HIS 121 -6.329 0.371 -11.424 921 HA HIS 121 HA HIS 121 -8.721 0.460 -9.623 922 HB2 HIS 121 2HB HIS 121 -6.635 1.063 -8.439 923 HB3 HIS 121 1HB HIS 121 -6.312 2.303 -9.650 924 HD1 HIS 121 1HD HIS 121 -9.082 3.544 -9.970 925 HD2 HIS 121 2HD HIS 121 -7.434 2.594 -6.260 926 HE1 HIS 121 1HE HIS 121 -10.277 4.977 -8.268 927 HE2 HIS 121 2HE HIS 121 -9.290 4.407 -6.003 928 H VAL 122 H VAL 122 -10.386 1.730 -10.354 929 HA VAL 122 HA VAL 122 -9.778 3.741 -12.473 930 HB VAL 122 HB VAL 122 -11.795 2.995 -13.710 931 HG11 VAL 122 1HG1 VAL 122 -9.569 2.108 -14.317 932 HG12 VAL 122 2HG1 VAL 122 -10.824 0.896 -14.574 933 HG13 VAL 122 3HG1 VAL 122 -9.777 0.795 -13.158 934 HG21 VAL 122 1HG2 VAL 122 -11.833 0.953 -11.480 935 HG22 VAL 122 2HG2 VAL 122 -12.619 0.645 -13.029 936 HG23 VAL 122 3HG2 VAL 122 -13.146 1.998 -12.027 937 H LYS 123 H LYS 123 -11.591 5.266 -12.808 938 HA LYS 123 HA LYS 123 -13.095 6.853 -12.014 939 HB2 LYS 123 2HB LYS 123 -14.048 4.504 -10.357 940 HB3 LYS 123 1HB LYS 123 -14.924 6.018 -10.568 941 HG2 LYS 123 2HG LYS 123 -14.915 5.634 -13.036 942 HG3 LYS 123 1HG LYS 123 -14.157 4.065 -12.756 943 HD2 LYS 123 2HD LYS 123 -16.096 3.432 -11.315 944 HD3 LYS 123 1HD LYS 123 -16.868 4.960 -11.736 945 HE2 LYS 123 2HE LYS 123 -16.457 4.195 -14.204 946 HE3 LYS 123 1HE LYS 123 -16.295 2.589 -13.494 947 HZ1 LYS 123 1HZ LYS 123 -18.611 3.485 -14.237 948 HZ2 LYS 123 2HZ LYS 123 -18.584 4.252 -12.720 949 HZ3 LYS 123 3HZ LYS 123 -18.462 2.561 -12.823 950 H LEU 124 H LEU 124 -10.510 6.760 -10.663 951 HA LEU 124 HA LEU 124 -10.949 7.045 -7.806 952 HB2 LEU 124 2HB LEU 124 -8.705 6.560 -8.781 953 HB3 LEU 124 1HB LEU 124 -8.708 8.161 -9.522 954 HG LEU 124 HG LEU 124 -8.947 9.168 -7.246 955 HD11 LEU 124 1HD1 LEU 124 -8.071 7.212 -5.525 956 HD12 LEU 124 2HD1 LEU 124 -9.180 6.314 -6.561 957 HD13 LEU 124 3HD1 LEU 124 -9.750 7.731 -5.681 958 HD21 LEU 124 1HD2 LEU 124 -6.561 7.762 -6.629 959 HD22 LEU 124 2HD2 LEU 124 -6.709 9.328 -7.426 960 HD23 LEU 124 3HD2 LEU 124 -6.657 7.851 -8.388 961 H HIS 125 H HIS 125 -10.685 9.315 -10.510 962 HA HIS 125 HA HIS 125 -10.947 11.699 -8.980 963 HB2 HIS 125 2HB HIS 125 -10.195 11.726 -11.308 964 HB3 HIS 125 1HB HIS 125 -11.785 11.173 -11.833 965 HD1 HIS 125 1HD HIS 125 -11.122 13.757 -9.156 966 HD2 HIS 125 2HD HIS 125 -12.726 13.551 -13.000 967 HE1 HIS 125 1HE HIS 125 -12.167 16.012 -9.614 968 HE2 HIS 125 2HE HIS 125 -13.136 15.909 -11.959 969 H ARG 126 H ARG 126 -13.270 9.268 -9.566 970 HA ARG 126 HA ARG 126 -15.663 10.599 -9.949 971 HB2 ARG 126 2HB ARG 126 -16.751 8.788 -8.792 972 HB3 ARG 126 1HB ARG 126 -15.357 8.118 -9.634 973 HG2 ARG 126 2HG ARG 126 -14.043 8.335 -7.507 974 HG3 ARG 126 1HG ARG 126 -15.527 8.829 -6.693 975 HD2 ARG 126 2HD ARG 126 -15.070 6.188 -8.112 976 HD3 ARG 126 1HD ARG 126 -15.170 6.429 -6.368 977 HE ARG 126 HE ARG 126 -17.563 7.453 -7.302 978 HH11 ARG 126 1HH1 ARG 126 -19.421 6.192 -7.550 979 HH12 ARG 126 2HH1 ARG 126 -19.268 4.483 -7.789 980 HH21 ARG 126 1HH2 ARG 126 -15.802 4.510 -7.662 981 HH22 ARG 126 2HH2 ARG 126 -17.218 3.532 -7.853 982 H HIS 127 H HIS 127 -13.791 10.432 -6.937 983 HA HIS 127 HA HIS 127 -15.802 11.662 -5.315 984 HB2 HIS 127 2HB HIS 127 -13.917 12.115 -3.743 985 HB3 HIS 127 1HB HIS 127 -13.995 10.436 -4.263 986 HD1 HIS 127 1HD HIS 127 -12.328 13.624 -5.558 987 HD2 HIS 127 2HD HIS 127 -11.517 9.564 -5.061 988 HE1 HIS 127 1HE HIS 127 -9.970 13.260 -6.393 989 HE2 HIS 127 2HE HIS 127 -9.460 10.793 -6.094 990 H GLY 128 H GLY 128 -13.079 13.042 -7.130 991 HA2 GLY 128 2HA GLY 128 -12.528 15.314 -7.475 992 HA3 GLY 128 1HA GLY 128 -14.261 15.467 -7.782 993 H ASP 129 H ASP 129 -13.471 14.327 -4.659 994 HA ASP 129 HA ASP 129 -14.336 16.916 -3.500 995 HB2 ASP 129 2HB ASP 129 -14.064 14.144 -2.306 996 HB3 ASP 129 1HB ASP 129 -14.583 15.566 -1.401 997 H GLY 130 H GLY 130 -11.463 15.661 -4.362 998 HA2 GLY 130 2HA GLY 130 -9.405 16.815 -3.721 999 HA3 GLY 130 1HA GLY 130 -10.080 17.040 -2.109 1000 H ALA 131 H ALA 131 -10.793 13.915 -3.134 1001 HA ALA 131 HA ALA 131 -9.216 12.629 -1.178 1002 HB1 ALA 131 1HB ALA 131 -9.607 11.054 -3.629 1003 HB2 ALA 131 2HB ALA 131 -11.083 11.792 -3.006 1004 HB3 ALA 131 3HB ALA 131 -10.136 10.717 -1.983 1005 H TRP 132 H TRP 132 -8.475 13.514 -4.506 1006 HA TRP 132 HA TRP 132 -6.095 12.083 -4.917 1007 HB2 TRP 132 2HB TRP 132 -7.090 13.463 -6.666 1008 HB3 TRP 132 1HB TRP 132 -6.797 14.922 -5.723 1009 HD1 TRP 132 HD TRP 132 -4.774 16.195 -6.497 1010 HE1 TRP 132 1HE TRP 132 -2.508 15.616 -7.575 1011 HE3 TRP 132 3HE TRP 132 -5.189 11.100 -6.761 1012 HZ2 TRP 132 2HZ TRP 132 -1.063 13.314 -8.430 1013 HZ3 TRP 132 3HZ TRP 132 -3.342 9.747 -7.705 1014 HH2 TRP 132 HH TRP 132 -1.282 10.844 -8.544 1015 H ASN 133 H ASN 133 -6.675 15.010 -3.032 1016 HA ASN 133 HA ASN 133 -3.957 15.683 -2.483 1017 HB2 ASN 133 2HB ASN 133 -6.045 17.062 -1.954 1018 HB3 ASN 133 1HB ASN 133 -6.255 16.024 -0.542 1019 HD21 ASN 133 1HD2 ASN 133 -5.865 18.510 0.282 1020 HD22 ASN 133 2HD2 ASN 133 -4.261 18.825 0.739 1021 H ILE 134 H ILE 134 -6.174 13.366 -0.932 1022 HA ILE 134 HA ILE 134 -4.535 12.785 1.322 1023 HB ILE 134 HB ILE 134 -6.981 11.924 0.497 1024 HG12 ILE 134 2HG1 ILE 134 -6.445 9.977 2.291 1025 HG13 ILE 134 1HG1 ILE 134 -5.053 11.016 2.578 1026 HG21 ILE 134 1HG2 ILE 134 -6.939 9.563 -0.009 1027 HG22 ILE 134 2HG2 ILE 134 -5.187 9.502 0.161 1028 HG23 ILE 134 3HG2 ILE 134 -5.915 10.382 -1.183 1029 HD11 ILE 134 1HD1 ILE 134 -7.005 11.609 4.014 1030 HD12 ILE 134 2HD1 ILE 134 -7.934 11.969 2.558 1031 HD13 ILE 134 3HD1 ILE 134 -6.514 12.935 2.960 1032 H HIS 135 H HIS 135 -4.568 11.492 -1.971 1033 HA HIS 135 HA HIS 135 -2.506 9.530 -1.569 1034 HB2 HIS 135 2HB HIS 135 -3.479 9.085 -3.586 1035 HB3 HIS 135 1HB HIS 135 -3.893 10.777 -3.867 1036 HD1 HIS 135 1HD HIS 135 -0.787 8.555 -3.859 1037 HD2 HIS 135 2HD HIS 135 -2.220 12.030 -5.669 1038 HE1 HIS 135 1HE HIS 135 0.969 9.261 -5.547 1039 HE2 HIS 135 2HE HIS 135 0.107 11.374 -6.655 1040 H LYS 136 H LYS 136 -2.505 12.969 -2.308 1041 HA LYS 136 HA LYS 136 0.139 13.312 -3.198 1042 HB2 LYS 136 2HB LYS 136 -1.613 15.108 -3.042 1043 HB3 LYS 136 1HB LYS 136 -1.328 15.158 -1.310 1044 HG2 LYS 136 2HG LYS 136 1.039 15.691 -1.719 1045 HG3 LYS 136 1HG LYS 136 0.732 15.682 -3.451 1046 HD2 LYS 136 2HD LYS 136 -0.969 17.484 -3.111 1047 HD3 LYS 136 1HD LYS 136 -0.510 17.546 -1.409 1048 HE2 LYS 136 2HE LYS 136 1.680 17.756 -3.425 1049 HE3 LYS 136 1HE LYS 136 0.620 19.152 -3.229 1050 HZ1 LYS 136 1HZ LYS 136 1.353 19.537 -1.147 1051 HZ2 LYS 136 2HZ LYS 136 2.740 18.732 -1.710 1052 HZ3 LYS 136 3HZ LYS 136 1.584 17.895 -0.789 1053 H ALA 137 H ALA 137 -1.099 13.063 0.122 1054 HA ALA 137 HA ALA 137 1.476 13.465 1.367 1055 HB1 ALA 137 1HB ALA 137 0.227 13.445 3.242 1056 HB2 ALA 137 2HB ALA 137 -0.271 11.780 2.939 1057 HB3 ALA 137 3HB ALA 137 -1.185 13.117 2.237 1058 H LEU 138 H LEU 138 -0.346 10.597 0.344 1059 HA LEU 138 HA LEU 138 1.581 8.701 1.363 1060 HB2 LEU 138 2HB LEU 138 -0.508 8.390 -0.811 1061 HB3 LEU 138 1HB LEU 138 0.351 7.073 -0.028 1062 HG LEU 138 HG LEU 138 -1.475 9.058 1.353 1063 HD11 LEU 138 1HD1 LEU 138 -1.889 6.081 1.085 1064 HD12 LEU 138 2HD1 LEU 138 -2.444 7.185 -0.176 1065 HD13 LEU 138 3HD1 LEU 138 -3.077 7.330 1.464 1066 HD21 LEU 138 1HD2 LEU 138 -0.030 8.469 3.048 1067 HD22 LEU 138 2HD2 LEU 138 0.420 6.952 2.271 1068 HD23 LEU 138 3HD2 LEU 138 -1.117 7.081 3.127 1069 H ASP 139 H ASP 139 1.759 10.928 -1.103 1070 HA ASP 139 HA ASP 139 3.055 9.421 -3.173 1071 HB2 ASP 139 2HB ASP 139 2.128 11.720 -3.470 1072 HB3 ASP 139 1HB ASP 139 3.426 12.342 -2.449 1073 H GLY 140 H GLY 140 4.788 8.185 -2.603 1074 HA2 GLY 140 2HA GLY 140 6.941 9.461 -0.978 1075 HA3 GLY 140 1HA GLY 140 6.653 7.723 -1.035 1076 HA PRO 141 HA PRO 141 10.063 9.136 -4.066 1077 HB2 PRO 141 2HB PRO 141 11.328 6.744 -2.828 1078 HB3 PRO 141 1HB PRO 141 12.035 8.325 -3.208 1079 HG2 PRO 141 2HG PRO 141 11.445 7.593 -0.702 1080 HG3 PRO 141 1HG PRO 141 11.313 9.269 -1.257 1081 HD2 PRO 141 2HD PRO 141 9.146 7.303 -0.686 1082 HD3 PRO 141 1HD PRO 141 9.130 9.076 -0.561 1083 H SER 142 H SER 142 10.430 8.112 -6.062 1084 HA SER 142 HA SER 142 10.035 6.606 -7.815 1085 HB2 SER 142 2HB SER 142 9.693 4.418 -5.785 1086 HB3 SER 142 1HB SER 142 10.454 4.348 -7.372 1087 HG SER 142 HG SER 142 11.439 5.279 -4.927 1088 HA PRO 143 HA PRO 143 5.481 6.719 -6.475 1089 HB2 PRO 143 2HB PRO 143 4.774 8.519 -8.476 1090 HB3 PRO 143 1HB PRO 143 5.093 8.939 -6.786 1091 HG2 PRO 143 2HG PRO 143 6.826 9.227 -9.167 1092 HG3 PRO 143 1HG PRO 143 6.724 10.231 -7.711 1093 HD2 PRO 143 2HD PRO 143 8.760 8.457 -8.165 1094 HD3 PRO 143 1HD PRO 143 8.215 8.916 -6.537 1095 H GLY 144 H GLY 144 3.760 5.737 -7.672 1096 HA2 GLY 144 2HA GLY 144 3.323 5.257 -10.288 1097 HA3 GLY 144 1HA GLY 144 4.689 4.181 -9.998 1098 H GLU 145 H GLU 145 3.429 2.288 -10.340 1099 HA GLU 145 HA GLU 145 0.934 1.658 -9.224 1100 HB2 GLU 145 2HB GLU 145 3.319 -0.168 -9.656 1101 HB3 GLU 145 1HB GLU 145 1.661 -0.714 -9.400 1102 HG2 GLU 145 2HG GLU 145 2.519 1.119 -11.654 1103 HG3 GLU 145 1HG GLU 145 2.306 -0.625 -11.816 1104 H THR 146 H THR 146 0.269 0.808 -7.235 1105 HA THR 146 HA THR 146 1.701 1.513 -4.882 1106 HB THR 146 HB THR 146 -0.453 -0.566 -5.306 1107 HG1 THR 146 1HG THR 146 -1.634 1.221 -4.215 1108 HG21 THR 146 1HG2 THR 146 0.942 0.428 -2.850 1109 HG22 THR 146 2HG2 THR 146 0.428 -1.210 -3.258 1110 HG23 THR 146 3HG2 THR 146 -0.764 -0.010 -2.753 1111 H LEU 147 H LEU 147 1.608 -1.429 -6.796 1112 HA LEU 147 HA LEU 147 2.949 -3.173 -5.020 1113 HB2 LEU 147 2HB LEU 147 3.096 -3.083 -8.043 1114 HB3 LEU 147 1HB LEU 147 3.477 -4.475 -7.026 1115 HG LEU 147 HG LEU 147 0.777 -3.106 -7.224 1116 HD11 LEU 147 1HD1 LEU 147 1.822 -5.768 -8.220 1117 HD12 LEU 147 2HD1 LEU 147 1.180 -4.440 -9.189 1118 HD13 LEU 147 3HD1 LEU 147 0.107 -5.363 -8.137 1119 HD21 LEU 147 1HD2 LEU 147 0.783 -3.915 -5.044 1120 HD22 LEU 147 2HD2 LEU 147 1.910 -5.218 -5.421 1121 HD23 LEU 147 3HD2 LEU 147 0.222 -5.344 -5.913 1122 H ALA 148 H ALA 148 4.168 -0.608 -7.086 1123 HA ALA 148 HA ALA 148 6.906 -1.364 -7.168 1124 HB1 ALA 148 1HB ALA 148 7.370 0.965 -7.675 1125 HB2 ALA 148 2HB ALA 148 5.819 1.460 -6.999 1126 HB3 ALA 148 3HB ALA 148 5.870 0.508 -8.483 1127 H ARG 149 H ARG 149 5.356 0.949 -4.908 1128 HA ARG 149 HA ARG 149 7.654 1.139 -3.206 1129 HB2 ARG 149 2HB ARG 149 4.734 1.675 -2.646 1130 HB3 ARG 149 1HB ARG 149 6.054 2.136 -1.579 1131 HG2 ARG 149 2HG ARG 149 7.046 3.474 -3.431 1132 HG3 ARG 149 1HG ARG 149 5.651 3.072 -4.432 1133 HD2 ARG 149 2HD ARG 149 5.225 5.234 -3.459 1134 HD3 ARG 149 1HD ARG 149 4.186 4.075 -2.629 1135 HE ARG 149 HE ARG 149 6.762 4.518 -1.308 1136 HH11 ARG 149 1HH1 ARG 149 6.631 5.490 0.728 1137 HH12 ARG 149 2HH1 ARG 149 5.147 6.232 1.225 1138 HH21 ARG 149 1HH2 ARG 149 3.475 5.474 -1.717 1139 HH22 ARG 149 2HH2 ARG 149 3.360 6.223 -0.160 1140 H PHE 150 H PHE 150 4.737 -0.868 -3.082 1141 HA PHE 150 HA PHE 150 5.275 -2.094 -0.549 1142 HB2 PHE 150 2HB PHE 150 3.070 -2.176 -1.647 1143 HB3 PHE 150 1HB PHE 150 3.748 -3.155 -2.940 1144 HD1 PHE 150 1HD PHE 150 3.224 -3.105 0.760 1145 HD2 PHE 150 2HD PHE 150 3.861 -5.488 -2.757 1146 HE1 PHE 150 1HE PHE 150 2.802 -5.163 2.077 1147 HE2 PHE 150 2HE PHE 150 3.443 -7.546 -1.440 1148 HZ PHE 150 HZ PHE 150 2.918 -7.384 0.975 1149 H ALA 151 H ALA 151 6.252 -2.945 -3.857 1150 HA ALA 151 HA ALA 151 7.367 -5.507 -3.161 1151 HB1 ALA 151 1HB ALA 151 8.227 -3.712 -5.440 1152 HB2 ALA 151 2HB ALA 151 6.777 -4.715 -5.488 1153 HB3 ALA 151 3HB ALA 151 8.365 -5.469 -5.350 1154 H ASN 152 H ASN 152 8.805 -2.252 -3.380 1155 HA ASN 152 HA ASN 152 11.504 -3.113 -2.977 1156 HB2 ASN 152 2HB ASN 152 12.033 -0.892 -3.001 1157 HB3 ASN 152 1HB ASN 152 10.381 -0.736 -3.601 1158 HD21 ASN 152 1HD2 ASN 152 8.814 0.235 -2.217 1159 HD22 ASN 152 2HD2 ASN 152 9.194 0.873 -0.693 1160 H VAL 153 H VAL 153 9.113 -1.864 -0.621 1161 HA VAL 153 HA VAL 153 10.866 -2.238 1.634 1162 HB VAL 153 HB VAL 153 8.931 -1.777 2.986 1163 HG11 VAL 153 1HG1 VAL 153 9.825 -0.083 1.072 1164 HG12 VAL 153 2HG1 VAL 153 8.575 0.350 2.238 1165 HG13 VAL 153 3HG1 VAL 153 8.124 -0.189 0.620 1166 HG21 VAL 153 1HG2 VAL 153 6.688 -1.604 1.530 1167 HG22 VAL 153 2HG2 VAL 153 7.168 -3.102 2.331 1168 HG23 VAL 153 3HG2 VAL 153 7.507 -2.869 0.618 1169 H ILE 154 H ILE 154 8.661 -4.310 -0.113 1170 HA ILE 154 HA ILE 154 8.684 -6.402 1.935 1171 HB ILE 154 HB ILE 154 7.580 -6.200 -0.859 1172 HG12 ILE 154 2HG1 ILE 154 6.601 -5.077 1.331 1173 HG13 ILE 154 1HG1 ILE 154 5.531 -5.850 0.169 1174 HG21 ILE 154 1HG2 ILE 154 6.393 -8.389 -0.092 1175 HG22 ILE 154 2HG2 ILE 154 7.773 -8.544 0.997 1176 HG23 ILE 154 3HG2 ILE 154 8.029 -8.477 -0.747 1177 HD11 ILE 154 1HD1 ILE 154 5.242 -7.758 1.505 1178 HD12 ILE 154 2HD1 ILE 154 5.287 -6.458 2.697 1179 HD13 ILE 154 3HD1 ILE 154 6.718 -7.451 2.423 Start of MODEL 14 1 H1 MET 1 1HT MET 1 3.663 13.527 -4.185 2 H2 MET 1 2HT MET 1 4.255 12.106 -4.905 3 H3 MET 1 3HT MET 1 2.613 12.230 -4.488 4 HA MET 1 HA MET 1 2.108 13.618 -6.230 5 HB2 MET 1 2HB MET 1 4.001 15.189 -5.613 6 HB3 MET 1 1HB MET 1 5.063 14.178 -6.593 7 HG2 MET 1 2HG MET 1 4.406 15.357 -8.396 8 HG3 MET 1 1HG MET 1 2.799 14.658 -8.196 9 HE1 MET 1 1HE MET 1 2.424 16.486 -9.584 10 HE2 MET 1 2HE MET 1 2.900 18.157 -9.290 11 HE3 MET 1 3HE MET 1 1.281 17.618 -8.848 12 HA PRO 2 HA PRO 2 3.574 9.895 -8.489 13 HB2 PRO 2 2HB PRO 2 1.149 8.615 -8.563 14 HB3 PRO 2 1HB PRO 2 2.311 8.439 -7.236 15 HG2 PRO 2 2HG PRO 2 -0.260 9.789 -7.265 16 HG3 PRO 2 1HG PRO 2 0.751 9.323 -5.891 17 HD2 PRO 2 2HD PRO 2 0.472 11.941 -7.126 18 HD3 PRO 2 1HD PRO 2 1.351 11.506 -5.643 19 H GLU 3 H GLU 3 2.764 9.070 -10.672 20 HA GLU 3 HA GLU 3 2.295 11.086 -12.524 21 HB2 GLU 3 2HB GLU 3 1.136 8.291 -12.660 22 HB3 GLU 3 1HB GLU 3 1.416 9.361 -14.030 23 HG2 GLU 3 2HG GLU 3 3.853 9.372 -13.463 24 HG3 GLU 3 1HG GLU 3 3.528 8.189 -12.194 25 H GLU 4 H GLU 4 0.312 11.917 -13.511 26 HA GLU 4 HA GLU 4 -1.709 12.687 -11.749 27 HB2 GLU 4 2HB GLU 4 -2.018 12.146 -14.720 28 HB3 GLU 4 1HB GLU 4 -3.116 13.114 -13.737 29 HG2 GLU 4 2HG GLU 4 -1.235 14.643 -13.181 30 HG3 GLU 4 1HG GLU 4 -0.184 13.702 -14.241 31 H ILE 5 H ILE 5 -3.882 11.877 -11.386 32 HA ILE 5 HA ILE 5 -4.144 9.237 -10.664 33 HB ILE 5 HB ILE 5 -6.263 11.080 -11.800 34 HG12 ILE 5 2HG1 ILE 5 -5.743 10.195 -8.949 35 HG13 ILE 5 1HG1 ILE 5 -5.073 11.674 -9.637 36 HG21 ILE 5 1HG2 ILE 5 -7.144 8.881 -12.089 37 HG22 ILE 5 2HG2 ILE 5 -7.836 9.476 -10.580 38 HG23 ILE 5 3HG2 ILE 5 -6.489 8.338 -10.544 39 HD11 ILE 5 1HD1 ILE 5 -7.074 12.371 -8.567 40 HD12 ILE 5 2HD1 ILE 5 -7.973 10.975 -9.162 41 HD13 ILE 5 3HD1 ILE 5 -7.502 12.261 -10.275 42 HA PRO 6 HA PRO 6 -4.122 7.557 -14.922 43 HB2 PRO 6 2HB PRO 6 -2.825 5.260 -14.409 44 HB3 PRO 6 1HB PRO 6 -1.965 6.812 -14.449 45 HG2 PRO 6 2HG PRO 6 -2.787 5.164 -12.125 46 HG3 PRO 6 1HG PRO 6 -1.363 6.195 -12.337 47 HD2 PRO 6 2HD PRO 6 -3.736 6.890 -10.960 48 HD3 PRO 6 1HD PRO 6 -2.431 7.994 -11.433 49 H ASP 7 H ASP 7 -5.454 5.960 -15.921 50 HA ASP 7 HA ASP 7 -7.667 4.971 -14.369 51 HB2 ASP 7 2HB ASP 7 -6.688 4.260 -17.154 52 HB3 ASP 7 1HB ASP 7 -8.218 3.715 -16.472 53 H VAL 8 H VAL 8 -7.207 2.307 -16.099 54 HA VAL 8 HA VAL 8 -6.640 0.594 -13.945 55 HB VAL 8 HB VAL 8 -5.912 0.107 -16.851 56 HG11 VAL 8 1HG1 VAL 8 -5.451 -2.017 -16.240 57 HG12 VAL 8 2HG1 VAL 8 -6.923 -2.128 -15.275 58 HG13 VAL 8 3HG1 VAL 8 -5.457 -1.444 -14.572 59 HG21 VAL 8 1HG2 VAL 8 -8.119 0.026 -17.309 60 HG22 VAL 8 2HG2 VAL 8 -8.438 0.649 -15.691 61 HG23 VAL 8 3HG2 VAL 8 -8.388 -1.092 -15.971 62 H ARG 9 H ARG 9 -4.756 -0.050 -12.949 63 HA ARG 9 HA ARG 9 -2.290 1.362 -13.738 64 HB2 ARG 9 2HB ARG 9 -2.965 -0.336 -11.327 65 HB3 ARG 9 1HB ARG 9 -1.400 0.429 -11.583 66 HG2 ARG 9 2HG ARG 9 -2.558 2.638 -11.738 67 HG3 ARG 9 1HG ARG 9 -4.076 1.831 -11.338 68 HD2 ARG 9 2HD ARG 9 -2.999 0.994 -9.226 69 HD3 ARG 9 1HD ARG 9 -1.593 1.987 -9.607 70 HE ARG 9 HE ARG 9 -3.590 3.833 -9.697 71 HH11 ARG 9 1HH1 ARG 9 -4.442 4.919 -7.908 72 HH12 ARG 9 2HH1 ARG 9 -4.381 4.170 -6.347 73 HH21 ARG 9 1HH2 ARG 9 -2.807 1.301 -7.494 74 HH22 ARG 9 2HH2 ARG 9 -3.456 2.121 -6.114 75 H LYS 10 H LYS 10 -0.529 -0.712 -12.587 76 HA LYS 10 HA LYS 10 -0.673 -2.705 -14.805 77 HB2 LYS 10 2HB LYS 10 1.711 -1.277 -13.622 78 HB3 LYS 10 1HB LYS 10 1.840 -2.659 -14.700 79 HG2 LYS 10 2HG LYS 10 0.507 -1.420 -16.398 80 HG3 LYS 10 1HG LYS 10 0.514 -0.015 -15.330 81 HD2 LYS 10 2HD LYS 10 3.010 -0.042 -15.374 82 HD3 LYS 10 1HD LYS 10 2.946 -1.366 -16.537 83 HE2 LYS 10 2HE LYS 10 1.457 0.188 -17.955 84 HE3 LYS 10 1HE LYS 10 2.015 1.483 -16.896 85 HZ1 LYS 10 1HZ LYS 10 3.714 1.600 -18.323 86 HZ2 LYS 10 2HZ LYS 10 3.430 0.051 -18.963 87 HZ3 LYS 10 3HZ LYS 10 4.308 0.229 -17.519 88 H SER 11 H SER 11 1.200 -4.437 -14.215 89 HA SER 11 HA SER 11 0.613 -5.387 -11.435 90 HB2 SER 11 2HB SER 11 0.536 -7.641 -12.252 91 HB3 SER 11 1HB SER 11 -0.479 -6.691 -13.329 92 HG SER 11 HG SER 11 1.511 -6.471 -14.629 93 H VAL 12 H VAL 12 2.366 -6.471 -10.373 94 HA VAL 12 HA VAL 12 4.984 -6.421 -11.774 95 HB VAL 12 HB VAL 12 4.371 -5.080 -9.148 96 HG11 VAL 12 1HG1 VAL 12 6.946 -4.688 -9.231 97 HG12 VAL 12 2HG1 VAL 12 6.964 -6.103 -10.284 98 HG13 VAL 12 3HG1 VAL 12 6.355 -6.238 -8.634 99 HG21 VAL 12 1HG2 VAL 12 4.089 -3.731 -11.189 100 HG22 VAL 12 2HG2 VAL 12 5.716 -4.173 -11.706 101 HG23 VAL 12 3HG2 VAL 12 5.487 -3.174 -10.270 102 H VAL 13 H VAL 13 6.565 -7.838 -10.796 103 HA VAL 13 HA VAL 13 5.267 -10.072 -9.322 104 HB VAL 13 HB VAL 13 8.000 -9.960 -10.635 105 HG11 VAL 13 1HG1 VAL 13 8.293 -11.876 -9.475 106 HG12 VAL 13 2HG1 VAL 13 7.063 -12.585 -10.521 107 HG13 VAL 13 3HG1 VAL 13 6.606 -11.902 -8.961 108 HG21 VAL 13 1HG2 VAL 13 5.575 -11.399 -11.703 109 HG22 VAL 13 2HG2 VAL 13 7.046 -10.934 -12.558 110 HG23 VAL 13 3HG2 VAL 13 5.862 -9.706 -12.104 111 H VAL 14 H VAL 14 5.861 -10.574 -7.237 112 HA VAL 14 HA VAL 14 8.109 -8.996 -6.043 113 HB VAL 14 HB VAL 14 6.826 -8.749 -4.014 114 HG11 VAL 14 1HG1 VAL 14 6.189 -7.509 -6.362 115 HG12 VAL 14 2HG1 VAL 14 5.471 -7.095 -4.805 116 HG13 VAL 14 3HG1 VAL 14 4.624 -8.182 -5.906 117 HG21 VAL 14 1HG2 VAL 14 5.250 -10.915 -5.251 118 HG22 VAL 14 2HG2 VAL 14 4.278 -9.670 -4.468 119 HG23 VAL 14 3HG2 VAL 14 5.502 -10.542 -3.546 120 H ALA 15 H ALA 15 9.210 -10.090 -4.256 121 HA ALA 15 HA ALA 15 9.191 -13.024 -4.634 122 HB1 ALA 15 1HB ALA 15 11.101 -12.159 -2.672 123 HB2 ALA 15 2HB ALA 15 11.196 -11.094 -4.076 124 HB3 ALA 15 3HB ALA 15 11.397 -12.835 -4.274 125 H ALA 16 H ALA 16 7.358 -13.696 -3.492 126 HA ALA 16 HA ALA 16 7.650 -14.087 -0.669 127 HB1 ALA 16 1HB ALA 16 5.206 -12.623 -0.722 128 HB2 ALA 16 2HB ALA 16 6.445 -11.604 -1.453 129 HB3 ALA 16 3HB ALA 16 6.675 -12.240 0.176 130 H SER 17 H SER 17 6.125 -15.655 0.045 131 HA SER 17 HA SER 17 4.858 -17.210 -2.007 132 HB2 SER 17 2HB SER 17 4.058 -18.599 -0.236 133 HB3 SER 17 1HB SER 17 5.625 -18.002 0.303 134 HG SER 17 HG SER 17 3.395 -16.446 0.891 135 H VAL 18 H VAL 18 2.532 -17.549 -2.293 136 HA VAL 18 HA VAL 18 1.049 -15.135 -2.499 137 HB VAL 18 HB VAL 18 -0.450 -17.701 -2.254 138 HG11 VAL 18 1HG1 VAL 18 -0.469 -16.055 -4.718 139 HG12 VAL 18 2HG1 VAL 18 -1.043 -15.243 -3.263 140 HG13 VAL 18 3HG1 VAL 18 -1.817 -16.729 -3.806 141 HG21 VAL 18 1HG2 VAL 18 1.332 -18.733 -3.329 142 HG22 VAL 18 2HG2 VAL 18 1.858 -17.242 -4.112 143 HG23 VAL 18 3HG2 VAL 18 0.445 -18.104 -4.717 144 H GLU 19 H GLU 19 1.004 -17.706 -0.047 145 HA GLU 19 HA GLU 19 -1.184 -16.732 1.487 146 HB2 GLU 19 2HB GLU 19 1.328 -18.177 2.391 147 HB3 GLU 19 1HB GLU 19 -0.106 -17.946 3.390 148 HG2 GLU 19 2HG GLU 19 -0.065 -19.378 0.717 149 HG3 GLU 19 1HG GLU 19 -0.093 -20.174 2.291 150 H HIS 20 H HIS 20 2.235 -15.846 1.439 151 HA HIS 20 HA HIS 20 2.253 -14.160 3.726 152 HB2 HIS 20 2HB HIS 20 4.259 -14.981 2.427 153 HB3 HIS 20 1HB HIS 20 3.861 -13.795 1.183 154 HD1 HIS 20 1HD HIS 20 4.330 -13.784 4.973 155 HD2 HIS 20 2HD HIS 20 5.132 -11.398 1.649 156 HE1 HIS 20 1HE HIS 20 5.559 -11.751 5.831 157 HE2 HIS 20 2HE HIS 20 6.054 -10.291 3.818 158 H CYS 21 H CYS 21 1.434 -13.539 0.326 159 HA CYS 21 HA CYS 21 1.237 -10.743 0.365 160 HB2 CYS 21 2HB CYS 21 -0.471 -12.784 -1.087 161 HB3 CYS 21 1HB CYS 21 -0.491 -11.058 -1.434 162 HG CYS 21 HG CYS 21 2.196 -11.377 -1.892 163 H PHE 22 H PHE 22 -1.488 -13.020 0.916 164 HA PHE 22 HA PHE 22 -3.253 -10.917 1.802 165 HB2 PHE 22 2HB PHE 22 -3.546 -13.822 2.550 166 HB3 PHE 22 1HB PHE 22 -4.815 -12.636 2.232 167 HD1 PHE 22 1HD PHE 22 -5.168 -11.785 -0.118 168 HD2 PHE 22 2HD PHE 22 -2.513 -15.032 0.791 169 HE1 PHE 22 1HE PHE 22 -5.148 -12.440 -2.510 170 HE2 PHE 22 2HE PHE 22 -2.496 -15.692 -1.592 171 HZ PHE 22 HZ PHE 22 -3.807 -14.394 -3.246 172 H GLU 23 H GLU 23 -1.114 -13.174 3.455 173 HA GLU 23 HA GLU 23 -2.007 -12.584 6.123 174 HB2 GLU 23 2HB GLU 23 -0.647 -14.587 5.437 175 HB3 GLU 23 1HB GLU 23 0.735 -13.513 5.242 176 HG2 GLU 23 2HG GLU 23 0.497 -12.819 7.617 177 HG3 GLU 23 1HG GLU 23 -0.811 -13.985 7.797 178 H VAL 24 H VAL 24 0.436 -11.139 4.011 179 HA VAL 24 HA VAL 24 1.743 -9.536 5.956 180 HB VAL 24 HB VAL 24 1.427 -9.426 2.984 181 HG11 VAL 24 1HG1 VAL 24 2.394 -7.210 4.784 182 HG12 VAL 24 2HG1 VAL 24 1.301 -7.108 3.404 183 HG13 VAL 24 3HG1 VAL 24 3.022 -7.394 3.146 184 HG21 VAL 24 1HG2 VAL 24 3.898 -9.575 3.132 185 HG22 VAL 24 2HG2 VAL 24 3.124 -10.882 4.028 186 HG23 VAL 24 3HG2 VAL 24 3.791 -9.495 4.890 187 H PHE 25 H PHE 25 -1.038 -8.712 3.837 188 HA PHE 25 HA PHE 25 -1.280 -6.015 4.727 189 HB2 PHE 25 2HB PHE 25 -3.716 -7.651 4.096 190 HB3 PHE 25 1HB PHE 25 -3.356 -5.980 3.664 191 HD1 PHE 25 1HD PHE 25 -0.674 -6.155 2.502 192 HD2 PHE 25 2HD PHE 25 -4.030 -8.801 2.116 193 HE1 PHE 25 1HE PHE 25 0.192 -6.924 0.306 194 HE2 PHE 25 2HE PHE 25 -3.169 -9.575 -0.084 195 HZ PHE 25 HZ PHE 25 -1.057 -8.635 -0.987 196 H THR 26 H THR 26 -2.799 -8.991 5.949 197 HA THR 26 HA THR 26 -4.148 -7.520 8.085 198 HB THR 26 HB THR 26 -5.041 -9.693 8.712 199 HG1 THR 26 1HG THR 26 -3.560 -10.907 6.674 200 HG21 THR 26 1HG2 THR 26 -6.141 -8.646 6.839 201 HG22 THR 26 2HG2 THR 26 -5.998 -10.369 6.480 202 HG23 THR 26 3HG2 THR 26 -4.894 -9.216 5.727 203 H SER 27 H SER 27 -1.112 -9.245 7.761 204 HA SER 27 HA SER 27 -0.762 -9.839 10.558 205 HB2 SER 27 2HB SER 27 1.623 -10.094 10.006 206 HB3 SER 27 1HB SER 27 0.613 -10.905 8.819 207 HG SER 27 HG SER 27 0.812 -8.547 7.868 208 H ARG 28 H ARG 28 0.443 -7.106 8.570 209 HA ARG 28 HA ARG 28 0.033 -5.077 10.441 210 HB2 ARG 28 2HB ARG 28 2.545 -4.926 11.245 211 HB3 ARG 28 1HB ARG 28 1.397 -5.928 12.126 212 HG2 ARG 28 2HG ARG 28 2.394 -7.876 11.460 213 HG3 ARG 28 1HG ARG 28 2.758 -7.254 9.850 214 HD2 ARG 28 2HD ARG 28 4.827 -7.623 11.144 215 HD3 ARG 28 1HD ARG 28 4.603 -5.909 10.781 216 HE ARG 28 HE ARG 28 4.444 -5.529 13.096 217 HH11 ARG 28 1HH1 ARG 28 4.233 -6.176 15.252 218 HH12 ARG 28 2HH1 ARG 28 3.850 -7.827 15.613 219 HH21 ARG 28 1HH2 ARG 28 3.730 -8.804 12.289 220 HH22 ARG 28 2HH2 ARG 28 3.565 -9.314 13.936 221 HA PRO 29 HA PRO 29 1.666 -3.903 6.245 222 HB2 PRO 29 2HB PRO 29 -0.095 -1.597 6.929 223 HB3 PRO 29 1HB PRO 29 0.023 -2.517 5.416 224 HG2 PRO 29 2HG PRO 29 -2.035 -2.857 7.059 225 HG3 PRO 29 1HG PRO 29 -1.319 -4.222 6.187 226 HD2 PRO 29 2HD PRO 29 -1.034 -3.479 9.075 227 HD3 PRO 29 1HD PRO 29 -1.108 -5.089 8.328 228 H ALA 30 H ALA 30 1.677 -2.382 9.369 229 HA ALA 30 HA ALA 30 3.168 -0.020 8.745 230 HB1 ALA 30 1HB ALA 30 3.928 -0.976 11.320 231 HB2 ALA 30 2HB ALA 30 2.220 -1.355 11.092 232 HB3 ALA 30 3HB ALA 30 2.783 0.309 10.937 233 H ASP 31 H ASP 31 4.029 -3.277 8.581 234 HA ASP 31 HA ASP 31 6.728 -3.295 9.426 235 HB2 ASP 31 2HB ASP 31 5.358 -5.292 8.708 236 HB3 ASP 31 1HB ASP 31 5.621 -4.791 7.037 237 H TRP 32 H TRP 32 5.285 -2.013 6.461 238 HA TRP 32 HA TRP 32 7.976 -0.929 5.771 239 HB2 TRP 32 2HB TRP 32 7.107 -1.415 3.287 240 HB3 TRP 32 1HB TRP 32 8.038 -2.602 4.200 241 HD1 TRP 32 HD TRP 32 6.955 -4.873 4.520 242 HE1 TRP 32 1HE TRP 32 4.588 -5.846 4.252 243 HE3 TRP 32 3HE TRP 32 4.379 -0.605 3.484 244 HZ2 TRP 32 2HZ TRP 32 1.949 -4.930 3.671 245 HZ3 TRP 32 3HZ TRP 32 1.936 -0.679 3.071 246 HH2 TRP 32 HH TRP 32 0.716 -2.836 3.163 247 H TRP 33 H TRP 33 4.934 -0.110 6.549 248 HA TRP 33 HA TRP 33 4.127 1.658 4.459 249 HB2 TRP 33 2HB TRP 33 2.920 0.895 6.712 250 HB3 TRP 33 1HB TRP 33 3.553 2.437 7.281 251 HD1 TRP 33 HD TRP 33 2.747 4.656 5.983 252 HE1 TRP 33 1HE TRP 33 0.618 5.124 4.610 253 HE3 TRP 33 3HE TRP 33 1.163 -0.128 5.147 254 HZ2 TRP 33 2HZ TRP 33 -1.482 3.666 3.327 255 HZ3 TRP 33 3HZ TRP 33 -0.903 -0.559 3.847 256 HH2 TRP 33 HH TRP 33 -2.227 1.330 2.938 257 HA PRO 34 HA PRO 34 6.653 4.940 7.351 258 HB2 PRO 34 2HB PRO 34 8.984 3.044 7.283 259 HB3 PRO 34 1HB PRO 34 8.617 4.326 8.455 260 HG2 PRO 34 2HG PRO 34 8.092 1.823 9.053 261 HG3 PRO 34 1HG PRO 34 6.928 3.096 9.464 262 HD2 PRO 34 2HD PRO 34 6.784 1.034 7.325 263 HD3 PRO 34 1HD PRO 34 5.467 1.798 8.234 264 HA PRO 35 HA PRO 35 8.327 5.452 3.110 265 HB2 PRO 35 2HB PRO 35 7.068 7.756 2.497 266 HB3 PRO 35 1HB PRO 35 6.224 6.196 2.459 267 HG2 PRO 35 2HG PRO 35 6.039 8.391 4.420 268 HG3 PRO 35 1HG PRO 35 4.833 7.183 3.954 269 HD2 PRO 35 2HD PRO 35 6.520 7.132 6.265 270 HD3 PRO 35 1HD PRO 35 5.404 5.865 5.719 271 H SER 36 H SER 36 9.829 7.085 2.217 272 HA SER 36 HA SER 36 11.623 8.194 4.112 273 HB2 SER 36 2HB SER 36 12.168 7.770 1.708 274 HB3 SER 36 1HB SER 36 11.163 9.148 1.269 275 HG SER 36 HG SER 36 12.778 10.382 1.773 276 H HIS 37 H HIS 37 8.818 9.607 2.482 277 HA HIS 37 HA HIS 37 9.049 11.954 4.324 278 HB2 HIS 37 2HB HIS 37 8.081 11.977 1.448 279 HB3 HIS 37 1HB HIS 37 8.118 13.368 2.533 280 HD1 HIS 37 1HD HIS 37 10.643 13.899 3.533 281 HD2 HIS 37 2HD HIS 37 10.426 11.669 0.014 282 HE1 HIS 37 1HE HIS 37 12.936 14.024 2.461 283 HE2 HIS 37 2HE HIS 37 12.815 12.672 0.320 284 H VAL 38 H VAL 38 7.078 12.633 5.246 285 HA VAL 38 HA VAL 38 4.672 10.996 4.531 286 HB VAL 38 HB VAL 38 4.067 10.962 6.913 287 HG11 VAL 38 1HG1 VAL 38 5.248 9.021 6.464 288 HG12 VAL 38 2HG1 VAL 38 6.283 9.729 7.704 289 HG13 VAL 38 3HG1 VAL 38 6.709 9.893 6.000 290 HG21 VAL 38 1HG2 VAL 38 4.948 12.898 7.875 291 HG22 VAL 38 2HG2 VAL 38 6.516 12.692 7.096 292 HG23 VAL 38 3HG2 VAL 38 6.072 11.676 8.468 293 H LEU 39 H LEU 39 2.797 12.161 4.287 294 HA LEU 39 HA LEU 39 2.998 15.108 4.634 295 HB2 LEU 39 2HB LEU 39 0.835 13.492 3.248 296 HB3 LEU 39 1HB LEU 39 1.056 15.240 3.174 297 HG LEU 39 HG LEU 39 2.972 13.140 2.121 298 HD11 LEU 39 1HD1 LEU 39 1.700 13.329 0.267 299 HD12 LEU 39 2HD1 LEU 39 2.275 14.991 0.136 300 HD13 LEU 39 3HD1 LEU 39 0.763 14.644 0.975 301 HD21 LEU 39 1HD2 LEU 39 4.028 15.364 1.181 302 HD22 LEU 39 2HD2 LEU 39 4.407 14.846 2.824 303 HD23 LEU 39 3HD2 LEU 39 3.203 16.106 2.551 304 H VAL 40 H VAL 40 2.147 12.580 6.480 305 HA VAL 40 HA VAL 40 -0.354 13.751 7.569 306 HB VAL 40 HB VAL 40 0.735 11.455 8.998 307 HG11 VAL 40 1HG1 VAL 40 -1.598 12.162 9.142 308 HG12 VAL 40 2HG1 VAL 40 -1.518 10.551 8.429 309 HG13 VAL 40 3HG1 VAL 40 -1.794 11.957 7.402 310 HG21 VAL 40 1HG2 VAL 40 1.771 10.896 6.863 311 HG22 VAL 40 2HG2 VAL 40 0.265 11.227 6.008 312 HG23 VAL 40 3HG2 VAL 40 0.373 9.848 7.102 313 H LYS 41 H LYS 41 -0.472 14.496 9.744 314 HA LYS 41 HA LYS 41 1.791 15.863 10.762 315 HB2 LYS 41 2HB LYS 41 -0.680 14.896 12.213 316 HB3 LYS 41 1HB LYS 41 0.471 16.058 12.868 317 HG2 LYS 41 2HG LYS 41 0.040 17.531 10.897 318 HG3 LYS 41 1HG LYS 41 -1.199 16.395 10.359 319 HD2 LYS 41 2HD LYS 41 -2.375 16.710 12.540 320 HD3 LYS 41 1HD LYS 41 -1.183 17.938 12.970 321 HE2 LYS 41 2HE LYS 41 -2.046 18.662 10.406 322 HE3 LYS 41 1HE LYS 41 -3.515 18.170 11.249 323 HZ1 LYS 41 1HZ LYS 41 -1.867 19.710 12.956 324 HZ2 LYS 41 2HZ LYS 41 -3.462 20.011 12.451 325 HZ3 LYS 41 3HZ LYS 41 -2.153 20.559 11.516 326 H LYS 42 H LYS 42 0.549 12.624 11.444 327 HA LYS 42 HA LYS 42 3.060 12.082 12.968 328 HB2 LYS 42 2HB LYS 42 0.355 10.840 13.486 329 HB3 LYS 42 1HB LYS 42 1.821 10.586 14.428 330 HG2 LYS 42 2HG LYS 42 0.661 13.348 14.064 331 HG3 LYS 42 1HG LYS 42 0.083 12.278 15.340 332 HD2 LYS 42 2HD LYS 42 1.965 12.544 16.578 333 HD3 LYS 42 1HD LYS 42 3.020 12.452 15.172 334 HE2 LYS 42 2HE LYS 42 2.368 14.782 14.573 335 HE3 LYS 42 1HE LYS 42 1.409 14.863 16.050 336 HZ1 LYS 42 1HZ LYS 42 3.219 15.199 17.272 337 HZ2 LYS 42 2HZ LYS 42 4.050 15.487 15.818 338 HZ3 LYS 42 3HZ LYS 42 4.074 13.941 16.522 339 H GLU 43 H GLU 43 3.974 9.995 12.608 340 HA GLU 43 HA GLU 43 3.304 8.868 9.986 341 HB2 GLU 43 2HB GLU 43 5.660 9.126 10.800 342 HB3 GLU 43 1HB GLU 43 5.325 7.905 12.030 343 HG2 GLU 43 2HG GLU 43 4.711 6.303 10.223 344 HG3 GLU 43 1HG GLU 43 5.167 7.518 9.028 345 H ARG 44 H ARG 44 2.137 7.010 9.639 346 HA ARG 44 HA ARG 44 0.564 5.888 11.759 347 HB2 ARG 44 2HB ARG 44 1.196 4.827 8.990 348 HB3 ARG 44 1HB ARG 44 -0.010 4.127 10.066 349 HG2 ARG 44 2HG ARG 44 -0.037 7.015 9.146 350 HG3 ARG 44 1HG ARG 44 -0.971 5.729 8.382 351 HD2 ARG 44 2HD ARG 44 -1.819 5.284 10.837 352 HD3 ARG 44 1HD ARG 44 -1.306 6.949 11.103 353 HE ARG 44 HE ARG 44 -3.546 6.082 9.405 354 HH11 ARG 44 1HH1 ARG 44 -4.856 7.771 8.676 355 HH12 ARG 44 2HH1 ARG 44 -4.321 9.408 8.861 356 HH21 ARG 44 1HH2 ARG 44 -1.328 8.540 10.380 357 HH22 ARG 44 2HH2 ARG 44 -2.326 9.842 9.828 358 H ALA 45 H ALA 45 0.884 4.068 13.008 359 HA ALA 45 HA ALA 45 3.368 2.492 12.505 360 HB1 ALA 45 1HB ALA 45 2.527 3.114 15.316 361 HB2 ALA 45 2HB ALA 45 3.459 4.304 14.408 362 HB3 ALA 45 3HB ALA 45 4.124 2.696 14.694 363 H GLY 46 H GLY 46 0.235 2.639 14.226 364 HA2 GLY 46 2HA GLY 46 0.260 -0.350 14.305 365 HA3 GLY 46 1HA GLY 46 -0.762 0.677 15.306 366 H LEU 47 H LEU 47 -1.549 -1.516 13.454 367 HA LEU 47 HA LEU 47 -3.563 0.048 11.948 368 HB2 LEU 47 2HB LEU 47 -1.779 -2.053 10.695 369 HB3 LEU 47 1HB LEU 47 -3.211 -1.369 9.929 370 HG LEU 47 HG LEU 47 -2.000 0.928 10.532 371 HD11 LEU 47 1HD1 LEU 47 0.269 0.848 10.840 372 HD12 LEU 47 2HD1 LEU 47 0.456 -0.590 9.836 373 HD13 LEU 47 3HD1 LEU 47 -0.104 -0.745 11.500 374 HD21 LEU 47 1HD2 LEU 47 -1.825 -0.920 8.218 375 HD22 LEU 47 2HD2 LEU 47 -0.646 0.390 8.239 376 HD23 LEU 47 3HD2 LEU 47 -2.370 0.753 8.283 377 H ALA 48 H ALA 48 -5.542 -0.934 11.934 378 HA ALA 48 HA ALA 48 -5.773 -3.834 12.381 379 HB1 ALA 48 1HB ALA 48 -5.777 -3.263 14.673 380 HB2 ALA 48 2HB ALA 48 -7.492 -3.308 14.264 381 HB3 ALA 48 3HB ALA 48 -6.656 -1.760 14.389 382 H PHE 49 H PHE 49 -7.409 -4.508 11.050 383 HA PHE 49 HA PHE 49 -9.746 -2.741 10.657 384 HB2 PHE 49 2HB PHE 49 -9.574 -2.871 8.199 385 HB3 PHE 49 1HB PHE 49 -8.182 -2.044 8.900 386 HD1 PHE 49 1HD PHE 49 -6.011 -3.252 9.153 387 HD2 PHE 49 2HD PHE 49 -9.340 -4.943 7.031 388 HE1 PHE 49 1HE PHE 49 -4.488 -4.874 8.061 389 HE2 PHE 49 2HE PHE 49 -7.819 -6.569 5.941 390 HZ PHE 49 HZ PHE 49 -5.390 -6.528 6.452 391 H GLU 50 H GLU 50 -11.598 -3.845 9.921 392 HA GLU 50 HA GLU 50 -11.514 -6.763 10.340 393 HB2 GLU 50 2HB GLU 50 -13.954 -5.141 9.620 394 HB3 GLU 50 1HB GLU 50 -13.869 -6.632 10.554 395 HG2 GLU 50 2HG GLU 50 -12.985 -3.869 11.405 396 HG3 GLU 50 1HG GLU 50 -14.226 -4.882 12.144 397 HA PRO 51 HA PRO 51 -11.267 -6.917 5.789 398 HB2 PRO 51 2HB PRO 51 -10.644 -9.555 5.557 399 HB3 PRO 51 1HB PRO 51 -9.455 -8.311 5.987 400 HG2 PRO 51 2HG PRO 51 -10.835 -10.287 7.712 401 HG3 PRO 51 1HG PRO 51 -9.190 -9.642 7.820 402 HD2 PRO 51 2HD PRO 51 -11.316 -8.809 9.400 403 HD3 PRO 51 1HD PRO 51 -9.845 -7.861 9.105 404 H PHE 52 H PHE 52 -13.526 -6.616 5.405 405 HA PHE 52 HA PHE 52 -14.918 -9.028 4.518 406 HB2 PHE 52 2HB PHE 52 -16.207 -7.322 6.671 407 HB3 PHE 52 1HB PHE 52 -16.870 -8.783 5.935 408 HD1 PHE 52 1HD PHE 52 -15.661 -10.989 6.264 409 HD2 PHE 52 2HD PHE 52 -14.676 -7.443 8.478 410 HE1 PHE 52 1HE PHE 52 -14.449 -12.366 7.934 411 HE2 PHE 52 2HE PHE 52 -13.472 -8.819 10.146 412 HZ PHE 52 HZ PHE 52 -13.348 -11.280 9.874 413 H VAL 53 H VAL 53 -17.243 -8.209 3.684 414 HA VAL 53 HA VAL 53 -16.644 -5.913 1.970 415 HB VAL 53 HB VAL 53 -19.304 -7.334 2.302 416 HG11 VAL 53 1HG1 VAL 53 -19.277 -6.626 -0.246 417 HG12 VAL 53 2HG1 VAL 53 -18.107 -5.430 0.313 418 HG13 VAL 53 3HG1 VAL 53 -19.733 -5.462 0.996 419 HG21 VAL 53 1HG2 VAL 53 -17.721 -8.106 -0.020 420 HG22 VAL 53 2HG2 VAL 53 -18.514 -9.127 1.178 421 HG23 VAL 53 3HG2 VAL 53 -16.896 -8.504 1.485 422 H GLY 54 H GLY 54 -17.027 -3.829 2.591 423 HA2 GLY 54 2HA GLY 54 -18.199 -2.024 3.589 424 HA3 GLY 54 1HA GLY 54 -19.394 -3.177 4.194 425 H GLY 55 H GLY 55 -16.114 -4.011 4.748 426 HA2 GLY 55 2HA GLY 55 -16.457 -3.929 7.624 427 HA3 GLY 55 1HA GLY 55 -14.959 -4.308 6.773 428 H ARG 56 H ARG 56 -14.475 -2.794 8.871 429 HA ARG 56 HA ARG 56 -14.313 0.010 7.824 430 HB2 ARG 56 2HB ARG 56 -14.467 -0.974 10.688 431 HB3 ARG 56 1HB ARG 56 -14.206 0.706 10.218 432 HG2 ARG 56 2HG ARG 56 -16.359 0.640 8.948 433 HG3 ARG 56 1HG ARG 56 -16.633 -0.991 9.563 434 HD2 ARG 56 2HD ARG 56 -16.327 1.523 11.234 435 HD3 ARG 56 1HD ARG 56 -17.820 0.624 10.967 436 HE ARG 56 HE ARG 56 -15.643 -0.150 12.773 437 HH11 ARG 56 1HH1 ARG 56 -16.062 -1.985 14.023 438 HH12 ARG 56 2HH1 ARG 56 -17.409 -3.000 13.624 439 HH21 ARG 56 1HH2 ARG 56 -18.395 -1.074 10.914 440 HH22 ARG 56 2HH2 ARG 56 -18.729 -2.483 11.865 441 H TYR 57 H TYR 57 -12.282 0.918 7.734 442 HA TYR 57 HA TYR 57 -10.034 -0.740 8.808 443 HB2 TYR 57 2HB TYR 57 -10.343 -0.426 6.225 444 HB3 TYR 57 1HB TYR 57 -9.719 1.196 6.526 445 HD1 TYR 57 1HD TYR 57 -7.535 1.314 8.009 446 HD2 TYR 57 2HD TYR 57 -8.833 -2.172 5.861 447 HE1 TYR 57 1HE TYR 57 -5.224 0.415 8.068 448 HE2 TYR 57 2HE TYR 57 -6.522 -3.076 5.925 449 HH TYR 57 HH TYR 57 -4.127 -1.842 7.941 450 H TYR 58 H TYR 58 -8.773 0.266 10.287 451 HA TYR 58 HA TYR 58 -8.616 3.220 10.275 452 HB2 TYR 58 2HB TYR 58 -9.090 3.300 12.709 453 HB3 TYR 58 1HB TYR 58 -10.474 2.723 11.782 454 HD1 TYR 58 1HD TYR 58 -10.661 0.154 11.453 455 HD2 TYR 58 2HD TYR 58 -8.278 2.013 14.499 456 HE1 TYR 58 1HE TYR 58 -10.683 -1.959 12.754 457 HE2 TYR 58 2HE TYR 58 -8.299 -0.097 15.802 458 HH TYR 58 HH TYR 58 -10.158 -2.253 15.784 459 H GLU 59 H GLU 59 -6.790 4.014 11.553 460 HA GLU 59 HA GLU 59 -4.794 1.907 12.253 461 HB2 GLU 59 2HB GLU 59 -4.202 4.467 10.737 462 HB3 GLU 59 1HB GLU 59 -3.034 3.220 11.176 463 HG2 GLU 59 2HG GLU 59 -4.285 1.582 9.798 464 HG3 GLU 59 1HG GLU 59 -5.413 2.854 9.329 465 H TRP 60 H TRP 60 -3.103 2.743 13.769 466 HA TRP 60 HA TRP 60 -4.257 4.885 15.502 467 HB2 TRP 60 2HB TRP 60 -2.247 2.693 16.072 468 HB3 TRP 60 1HB TRP 60 -2.589 4.007 17.196 469 HD1 TRP 60 HD TRP 60 -5.217 4.219 17.995 470 HE1 TRP 60 1HE TRP 60 -6.908 2.339 18.495 471 HE3 TRP 60 3HE TRP 60 -2.995 0.347 15.512 472 HZ2 TRP 60 2HZ TRP 60 -7.268 -0.439 17.923 473 HZ3 TRP 60 3HZ TRP 60 -4.032 -1.903 15.510 474 HH2 TRP 60 HH TRP 60 -6.165 -2.300 16.711 475 H ASP 61 H ASP 61 -3.206 6.790 15.678 476 HA ASP 61 HA ASP 61 -0.713 7.172 14.139 477 HB2 ASP 61 2HB ASP 61 -2.549 9.102 15.576 478 HB3 ASP 61 1HB ASP 61 -1.113 9.589 14.681 479 H ILE 62 H ILE 62 1.115 8.351 15.176 480 HA ILE 62 HA ILE 62 2.020 7.127 17.540 481 HB ILE 62 HB ILE 62 2.773 9.835 16.436 482 HG12 ILE 62 2HG1 ILE 62 4.097 7.146 16.079 483 HG13 ILE 62 1HG1 ILE 62 3.030 7.881 14.893 484 HG21 ILE 62 1HG2 ILE 62 4.932 8.548 17.717 485 HG22 ILE 62 2HG2 ILE 62 3.565 8.450 18.826 486 HG23 ILE 62 3HG2 ILE 62 4.108 10.019 18.231 487 HD11 ILE 62 1HD1 ILE 62 5.825 8.381 15.335 488 HD12 ILE 62 2HD1 ILE 62 4.915 9.865 15.620 489 HD13 ILE 62 3HD1 ILE 62 4.779 9.031 14.072 490 H ASP 63 H ASP 63 0.454 10.308 17.157 491 HA ASP 63 HA ASP 63 -0.196 10.201 20.077 492 HB2 ASP 63 2HB ASP 63 0.641 12.611 18.438 493 HB3 ASP 63 1HB ASP 63 0.006 12.699 20.082 494 H GLY 64 H GLY 64 -1.477 10.030 17.073 495 HA2 GLY 64 2HA GLY 64 -3.872 11.667 17.743 496 HA3 GLY 64 1HA GLY 64 -3.463 11.100 16.125 497 H THR 65 H THR 65 -5.950 10.719 17.659 498 HA THR 65 HA THR 65 -6.189 8.075 18.673 499 HB THR 65 HB THR 65 -7.908 9.784 19.048 500 HG1 THR 65 1HG THR 65 -9.719 8.449 18.332 501 HG21 THR 65 1HG2 THR 65 -9.160 10.742 17.326 502 HG22 THR 65 2HG2 THR 65 -8.795 9.431 16.204 503 HG23 THR 65 3HG2 THR 65 -7.557 10.621 16.602 504 H GLU 66 H GLU 66 -8.473 7.307 16.919 505 HA GLU 66 HA GLU 66 -6.849 5.936 14.866 506 HB2 GLU 66 2HB GLU 66 -9.690 5.510 15.824 507 HB3 GLU 66 1HB GLU 66 -8.884 4.526 14.609 508 HG2 GLU 66 2HG GLU 66 -7.125 3.953 16.255 509 HG3 GLU 66 1HG GLU 66 -7.980 4.895 17.475 510 H ILE 67 H ILE 67 -7.063 6.349 12.705 511 HA ILE 67 HA ILE 67 -9.288 8.155 11.840 512 HB ILE 67 HB ILE 67 -6.456 8.100 10.751 513 HG12 ILE 67 2HG1 ILE 67 -7.889 10.166 12.453 514 HG13 ILE 67 1HG1 ILE 67 -6.570 9.123 12.993 515 HG21 ILE 67 1HG2 ILE 67 -7.184 10.044 9.443 516 HG22 ILE 67 2HG2 ILE 67 -8.792 9.943 10.159 517 HG23 ILE 67 3HG2 ILE 67 -8.221 8.663 9.090 518 HD11 ILE 67 1HD1 ILE 67 -5.254 10.877 12.363 519 HD12 ILE 67 2HD1 ILE 67 -6.488 11.541 11.290 520 HD13 ILE 67 3HD1 ILE 67 -5.472 10.206 10.745 521 H VAL 68 H VAL 68 -10.349 7.518 9.946 522 HA VAL 68 HA VAL 68 -10.067 4.782 9.111 523 HB VAL 68 HB VAL 68 -11.721 5.365 7.398 524 HG11 VAL 68 1HG1 VAL 68 -12.600 7.032 9.710 525 HG12 VAL 68 2HG1 VAL 68 -12.166 5.355 10.036 526 HG13 VAL 68 3HG1 VAL 68 -13.447 5.726 8.884 527 HG21 VAL 68 1HG2 VAL 68 -11.114 7.428 6.502 528 HG22 VAL 68 2HG2 VAL 68 -10.799 8.136 8.086 529 HG23 VAL 68 3HG2 VAL 68 -12.460 7.899 7.539 530 H TRP 69 H TRP 69 -8.560 3.977 7.732 531 HA TRP 69 HA TRP 69 -7.024 5.886 6.044 532 HB2 TRP 69 2HB TRP 69 -5.450 4.596 7.146 533 HB3 TRP 69 1HB TRP 69 -6.497 3.178 7.201 534 HD1 TRP 69 HD TRP 69 -3.775 4.778 5.204 535 HE1 TRP 69 1HE TRP 69 -3.242 3.339 3.133 536 HE3 TRP 69 3HE TRP 69 -7.721 1.536 5.340 537 HZ2 TRP 69 2HZ TRP 69 -4.343 1.106 1.721 538 HZ3 TRP 69 3HZ TRP 69 -7.952 -0.236 3.624 539 HH2 TRP 69 HH TRP 69 -6.270 -0.457 1.815 540 H GLY 70 H GLY 70 -9.647 3.833 5.784 541 HA2 GLY 70 2HA GLY 70 -10.150 4.129 3.094 542 HA3 GLY 70 1HA GLY 70 -9.082 2.727 3.147 543 H ARG 71 H ARG 71 -10.567 1.095 2.674 544 HA ARG 71 HA ARG 71 -12.365 0.318 4.832 545 HB2 ARG 71 2HB ARG 71 -13.529 2.035 3.101 546 HB3 ARG 71 1HB ARG 71 -13.794 0.528 2.226 547 HG2 ARG 71 2HG ARG 71 -14.794 -0.459 4.284 548 HG3 ARG 71 1HG ARG 71 -14.605 1.097 5.090 549 HD2 ARG 71 2HD ARG 71 -16.012 2.146 3.319 550 HD3 ARG 71 1HD ARG 71 -16.269 0.549 2.616 551 HE ARG 71 HE ARG 71 -16.984 0.586 5.419 552 HH11 ARG 71 1HH1 ARG 71 -19.191 0.497 5.897 553 HH12 ARG 71 2HH1 ARG 71 -20.347 0.860 4.660 554 HH21 ARG 71 1HH2 ARG 71 -17.949 1.482 2.233 555 HH22 ARG 71 2HH2 ARG 71 -19.644 1.417 2.585 556 H ILE 72 H ILE 72 -13.899 -1.495 3.190 557 HA ILE 72 HA ILE 72 -11.794 -3.137 1.876 558 HB ILE 72 HB ILE 72 -13.755 -4.129 3.967 559 HG12 ILE 72 2HG1 ILE 72 -11.289 -4.868 4.807 560 HG13 ILE 72 1HG1 ILE 72 -10.875 -3.386 3.948 561 HG21 ILE 72 1HG2 ILE 72 -11.761 -5.576 2.200 562 HG22 ILE 72 2HG2 ILE 72 -13.508 -5.809 2.239 563 HG23 ILE 72 3HG2 ILE 72 -12.523 -6.303 3.615 564 HD11 ILE 72 1HD1 ILE 72 -11.349 -2.754 6.214 565 HD12 ILE 72 2HD1 ILE 72 -12.836 -3.700 6.228 566 HD13 ILE 72 3HD1 ILE 72 -12.731 -2.240 5.245 567 H LEU 73 H LEU 73 -12.773 -4.826 0.447 568 HA LEU 73 HA LEU 73 -15.509 -4.026 -0.475 569 HB2 LEU 73 2HB LEU 73 -13.640 -3.361 -2.035 570 HB3 LEU 73 1HB LEU 73 -13.248 -5.072 -2.205 571 HG LEU 73 HG LEU 73 -15.816 -5.288 -2.787 572 HD11 LEU 73 1HD1 LEU 73 -15.190 -2.410 -3.517 573 HD12 LEU 73 2HD1 LEU 73 -16.341 -2.927 -2.286 574 HD13 LEU 73 3HD1 LEU 73 -16.644 -3.292 -3.983 575 HD21 LEU 73 1HD2 LEU 73 -14.355 -5.946 -4.474 576 HD22 LEU 73 2HD2 LEU 73 -13.507 -4.399 -4.486 577 HD23 LEU 73 3HD2 LEU 73 -15.103 -4.537 -5.225 578 H GLU 74 H GLU 74 -13.129 -6.675 -0.645 579 HA GLU 74 HA GLU 74 -14.879 -8.641 0.456 580 HB2 GLU 74 2HB GLU 74 -16.067 -8.274 -1.727 581 HB3 GLU 74 1HB GLU 74 -14.602 -8.799 -2.549 582 HG2 GLU 74 2HG GLU 74 -14.715 -10.959 -1.319 583 HG3 GLU 74 1HG GLU 74 -16.238 -10.437 -0.596 584 H TRP 75 H TRP 75 -13.673 -10.462 0.950 585 HA TRP 75 HA TRP 75 -10.881 -10.483 -0.083 586 HB2 TRP 75 2HB TRP 75 -10.608 -12.151 1.888 587 HB3 TRP 75 1HB TRP 75 -10.813 -10.443 2.277 588 HD1 TRP 75 HD TRP 75 -12.989 -9.705 3.492 589 HE1 TRP 75 1HE TRP 75 -14.965 -10.990 4.539 590 HE3 TRP 75 3HE TRP 75 -12.105 -14.369 1.611 591 HZ2 TRP 75 2HZ TRP 75 -16.031 -13.645 4.570 592 HZ3 TRP 75 3HZ TRP 75 -13.615 -16.252 2.160 593 HH2 TRP 75 HH TRP 75 -15.575 -15.898 3.639 594 H ASP 76 H ASP 76 -10.270 -12.119 -1.428 595 HA ASP 76 HA ASP 76 -12.142 -14.428 -1.714 596 HB2 ASP 76 2HB ASP 76 -11.363 -12.615 -3.649 597 HB3 ASP 76 1HB ASP 76 -10.284 -13.982 -3.933 598 HA PRO 77 HA PRO 77 -8.940 -16.970 0.174 599 HB2 PRO 77 2HB PRO 77 -9.805 -18.738 -2.107 600 HB3 PRO 77 1HB PRO 77 -9.468 -19.178 -0.422 601 HG2 PRO 77 2HG PRO 77 -11.962 -18.840 -1.309 602 HG3 PRO 77 1HG PRO 77 -11.479 -18.391 0.336 603 HD2 PRO 77 2HD PRO 77 -12.221 -16.647 -1.915 604 HD3 PRO 77 1HD PRO 77 -12.124 -16.258 -0.183 605 HA PRO 78 HA PRO 78 -5.041 -16.338 -1.769 606 HB2 PRO 78 2HB PRO 78 -5.054 -19.304 -2.235 607 HB3 PRO 78 1HB PRO 78 -3.748 -18.271 -1.618 608 HG2 PRO 78 2HG PRO 78 -5.410 -19.771 -0.037 609 HG3 PRO 78 1HG PRO 78 -4.535 -18.332 0.503 610 HD2 PRO 78 2HD PRO 78 -7.387 -18.657 0.250 611 HD3 PRO 78 1HD PRO 78 -6.502 -17.210 0.772 612 H HIS 79 H HIS 79 -6.017 -15.253 -3.599 613 HA HIS 79 HA HIS 79 -5.370 -16.189 -6.133 614 HB2 HIS 79 2HB HIS 79 -7.856 -17.380 -5.102 615 HB3 HIS 79 1HB HIS 79 -8.028 -16.624 -6.687 616 HD1 HIS 79 1HD HIS 79 -5.710 -17.277 -8.274 617 HD2 HIS 79 2HD HIS 79 -7.077 -20.002 -5.426 618 HE1 HIS 79 1HE HIS 79 -4.773 -19.537 -8.936 619 HE2 HIS 79 2HE HIS 79 -5.599 -21.202 -7.209 620 H ARG 80 H ARG 80 -7.923 -14.446 -4.301 621 HA ARG 80 HA ARG 80 -7.439 -12.169 -6.122 622 HB2 ARG 80 2HB ARG 80 -9.636 -13.841 -6.521 623 HB3 ARG 80 1HB ARG 80 -10.295 -12.460 -5.649 624 HG2 ARG 80 2HG ARG 80 -8.498 -12.128 -8.062 625 HG3 ARG 80 1HG ARG 80 -10.250 -12.258 -8.198 626 HD2 ARG 80 2HD ARG 80 -9.381 -10.339 -6.154 627 HD3 ARG 80 1HD ARG 80 -8.866 -9.908 -7.784 628 HE ARG 80 HE ARG 80 -11.561 -9.753 -6.796 629 HH11 ARG 80 1HH1 ARG 80 -13.194 -9.313 -8.295 630 HH12 ARG 80 2HH1 ARG 80 -12.894 -9.564 -9.982 631 HH21 ARG 80 1HH2 ARG 80 -9.637 -10.658 -9.512 632 HH22 ARG 80 2HH2 ARG 80 -10.880 -10.324 -10.671 633 H LEU 81 H LEU 81 -7.560 -10.234 -5.124 634 HA LEU 81 HA LEU 81 -8.822 -10.121 -2.417 635 HB2 LEU 81 2HB LEU 81 -6.335 -10.271 -2.222 636 HB3 LEU 81 1HB LEU 81 -6.199 -8.815 -3.203 637 HG LEU 81 HG LEU 81 -7.665 -7.643 -1.490 638 HD11 LEU 81 1HD1 LEU 81 -7.280 -10.314 -0.160 639 HD12 LEU 81 2HD1 LEU 81 -8.738 -9.330 -0.278 640 HD13 LEU 81 3HD1 LEU 81 -7.444 -8.859 0.823 641 HD21 LEU 81 1HD2 LEU 81 -5.660 -6.873 -0.821 642 HD22 LEU 81 2HD2 LEU 81 -4.883 -8.350 -1.392 643 HD23 LEU 81 3HD2 LEU 81 -5.505 -8.261 0.256 644 H ALA 82 H ALA 82 -10.211 -8.407 -2.219 645 HA ALA 82 HA ALA 82 -9.878 -6.103 -4.096 646 HB1 ALA 82 1HB ALA 82 -12.634 -6.973 -3.324 647 HB2 ALA 82 2HB ALA 82 -11.798 -7.897 -4.571 648 HB3 ALA 82 3HB ALA 82 -12.084 -6.172 -4.795 649 H MET 83 H MET 83 -10.235 -4.091 -3.108 650 HA MET 83 HA MET 83 -11.448 -4.089 -0.403 651 HB2 MET 83 2HB MET 83 -8.709 -2.949 -0.997 652 HB3 MET 83 1HB MET 83 -9.565 -2.822 0.539 653 HG2 MET 83 2HG MET 83 -9.626 -5.335 0.631 654 HG3 MET 83 1HG MET 83 -8.592 -5.357 -0.797 655 HE1 MET 83 1HE MET 83 -6.627 -4.019 -1.065 656 HE2 MET 83 2HE MET 83 -5.362 -3.815 0.143 657 HE3 MET 83 3HE MET 83 -6.634 -2.604 -0.003 658 H THR 84 H THR 84 -12.545 -2.185 0.064 659 HA THR 84 HA THR 84 -12.508 -0.104 -2.079 660 HB THR 84 HB THR 84 -14.442 -0.406 0.244 661 HG1 THR 84 1HG THR 84 -15.012 -2.081 -0.904 662 HG21 THR 84 1HG2 THR 84 -15.874 1.015 -1.267 663 HG22 THR 84 2HG2 THR 84 -14.467 1.217 -2.311 664 HG23 THR 84 3HG2 THR 84 -14.435 1.832 -0.657 665 H TRP 85 H TRP 85 -11.727 1.978 -1.557 666 HA TRP 85 HA TRP 85 -10.672 2.235 1.222 667 HB2 TRP 85 2HB TRP 85 -8.902 3.520 0.402 668 HB3 TRP 85 1HB TRP 85 -9.131 2.316 -0.861 669 HD1 TRP 85 HD TRP 85 -11.412 3.414 -2.549 670 HE1 TRP 85 1HE TRP 85 -11.208 5.636 -3.841 671 HE3 TRP 85 3HE TRP 85 -7.640 5.614 0.089 672 HZ2 TRP 85 2HZ TRP 85 -9.639 8.031 -3.765 673 HZ3 TRP 85 3HZ TRP 85 -6.807 7.859 -0.543 674 HH2 TRP 85 HH TRP 85 -7.797 9.068 -2.464 675 H ARG 86 H ARG 86 -11.767 3.553 2.534 676 HA ARG 86 HA ARG 86 -13.269 5.845 1.319 677 HB2 ARG 86 2HB ARG 86 -14.674 4.105 2.445 678 HB3 ARG 86 1HB ARG 86 -13.800 4.416 3.944 679 HG2 ARG 86 2HG ARG 86 -14.531 6.768 3.890 680 HG3 ARG 86 1HG ARG 86 -15.406 6.464 2.389 681 HD2 ARG 86 2HD ARG 86 -17.007 6.324 4.183 682 HD3 ARG 86 1HD ARG 86 -16.708 4.679 3.621 683 HE ARG 86 HE ARG 86 -14.882 5.161 5.717 684 HH11 ARG 86 1HH1 ARG 86 -15.360 4.458 7.812 685 HH12 ARG 86 2HH1 ARG 86 -17.009 4.167 8.259 686 HH21 ARG 86 1HH2 ARG 86 -18.280 5.027 5.149 687 HH22 ARG 86 2HH2 ARG 86 -18.660 4.489 6.751 688 H ILE 87 H ILE 87 -11.939 7.613 1.588 689 HA ILE 87 HA ILE 87 -11.085 8.243 4.357 690 HB ILE 87 HB ILE 87 -9.183 7.079 3.199 691 HG12 ILE 87 2HG1 ILE 87 -8.513 9.993 3.623 692 HG13 ILE 87 1HG1 ILE 87 -9.011 8.976 4.974 693 HG21 ILE 87 1HG2 ILE 87 -8.129 8.052 1.311 694 HG22 ILE 87 2HG2 ILE 87 -9.004 9.572 1.503 695 HG23 ILE 87 3HG2 ILE 87 -9.850 8.131 0.941 696 HD11 ILE 87 1HD1 ILE 87 -6.422 9.203 3.940 697 HD12 ILE 87 2HD1 ILE 87 -7.000 7.651 3.336 698 HD13 ILE 87 3HD1 ILE 87 -6.994 7.975 5.068 699 H ASP 88 H ASP 88 -10.689 10.535 4.667 700 HA ASP 88 HA ASP 88 -12.243 12.189 2.787 701 HB2 ASP 88 2HB ASP 88 -12.484 12.387 5.284 702 HB3 ASP 88 1HB ASP 88 -10.843 13.030 5.340 703 H GLY 89 H GLY 89 -11.394 13.980 1.657 704 HA2 GLY 89 2HA GLY 89 -8.748 13.729 0.633 705 HA3 GLY 89 1HA GLY 89 -9.770 15.148 0.436 706 H HIS 90 H HIS 90 -10.030 15.561 3.352 707 HA HIS 90 HA HIS 90 -7.490 16.995 3.723 708 HB2 HIS 90 2HB HIS 90 -10.062 16.943 5.300 709 HB3 HIS 90 1HB HIS 90 -8.673 17.933 5.723 710 HD1 HIS 90 1HD HIS 90 -7.805 18.956 2.983 711 HD2 HIS 90 2HD HIS 90 -11.791 18.795 4.192 712 HE1 HIS 90 1HE HIS 90 -9.056 20.638 1.555 713 HE2 HIS 90 2HE HIS 90 -11.486 20.544 2.281 714 H TRP 91 H TRP 91 -7.874 13.955 4.023 715 HA TRP 91 HA TRP 91 -7.054 12.272 5.429 716 HB2 TRP 91 2HB TRP 91 -5.418 14.681 6.103 717 HB3 TRP 91 1HB TRP 91 -5.303 13.282 7.171 718 HD1 TRP 91 HD TRP 91 -4.157 14.574 3.868 719 HE1 TRP 91 1HE TRP 91 -2.795 12.765 2.636 720 HE3 TRP 91 3HE TRP 91 -5.189 10.536 6.816 721 HZ2 TRP 91 2HZ TRP 91 -2.225 9.972 2.871 722 HZ3 TRP 91 3HZ TRP 91 -4.224 8.315 6.290 723 HH2 TRP 91 HH TRP 91 -2.743 8.028 4.323 724 H GLN 92 H GLN 92 -9.427 13.995 6.253 725 HA GLN 92 HA GLN 92 -9.263 13.881 9.195 726 HB2 GLN 92 2HB GLN 92 -11.503 14.701 7.329 727 HB3 GLN 92 1HB GLN 92 -11.588 14.781 9.090 728 HG2 GLN 92 2HG GLN 92 -9.521 16.200 7.387 729 HG3 GLN 92 1HG GLN 92 -10.943 16.957 8.095 730 HE21 GLN 92 1HE2 GLN 92 -7.763 16.899 8.629 731 HE22 GLN 92 2HE2 GLN 92 -7.713 16.888 10.326 732 H SER 93 H SER 93 -12.356 13.120 7.979 733 HA SER 93 HA SER 93 -11.942 10.210 8.044 734 HB2 SER 93 2HB SER 93 -13.262 9.759 9.963 735 HB3 SER 93 1HB SER 93 -12.182 11.055 10.458 736 HG SER 93 HG SER 93 -14.318 11.528 11.046 737 H VAL 94 H VAL 94 -13.876 9.052 7.342 738 HA VAL 94 HA VAL 94 -15.996 10.800 6.170 739 HB VAL 94 HB VAL 94 -15.734 8.637 4.418 740 HG11 VAL 94 1HG1 VAL 94 -14.933 10.391 2.850 741 HG12 VAL 94 2HG1 VAL 94 -14.679 11.474 4.218 742 HG13 VAL 94 3HG1 VAL 94 -16.309 10.941 3.807 743 HG21 VAL 94 1HG2 VAL 94 -13.526 8.151 5.430 744 HG22 VAL 94 2HG2 VAL 94 -13.019 9.809 5.104 745 HG23 VAL 94 3HG2 VAL 94 -13.359 8.712 3.766 746 HA PRO 95 HA PRO 95 -17.882 7.582 8.929 747 HB2 PRO 95 2HB PRO 95 -20.169 9.430 8.421 748 HB3 PRO 95 1HB PRO 95 -19.605 8.722 9.948 749 HG2 PRO 95 2HG PRO 95 -19.150 11.276 9.335 750 HG3 PRO 95 1HG PRO 95 -17.976 10.305 10.238 751 HD2 PRO 95 2HD PRO 95 -17.876 11.218 7.401 752 HD3 PRO 95 1HD PRO 95 -16.543 10.891 8.531 753 H ASP 96 H ASP 96 -18.746 8.766 5.750 754 HA ASP 96 HA ASP 96 -19.996 6.144 5.182 755 HB2 ASP 96 2HB ASP 96 -21.828 7.748 5.830 756 HB3 ASP 96 1HB ASP 96 -21.360 8.738 4.450 757 H ASP 97 H ASP 97 -19.815 5.560 2.969 758 HA ASP 97 HA ASP 97 -17.769 7.084 1.504 759 HB2 ASP 97 2HB ASP 97 -17.982 5.180 -0.137 760 HB3 ASP 97 1HB ASP 97 -17.546 4.676 1.496 761 H ASP 98 H ASP 98 -18.675 8.931 0.603 762 HA ASP 98 HA ASP 98 -21.313 8.834 -0.664 763 HB2 ASP 98 2HB ASP 98 -20.321 10.863 0.523 764 HB3 ASP 98 1HB ASP 98 -19.271 11.042 -0.879 765 H ARG 99 H ARG 99 -17.996 9.480 -1.788 766 HA ARG 99 HA ARG 99 -18.771 8.316 -4.423 767 HB2 ARG 99 2HB ARG 99 -17.037 10.748 -3.917 768 HB3 ARG 99 1HB ARG 99 -17.260 9.984 -5.491 769 HG2 ARG 99 2HG ARG 99 -19.744 10.341 -5.216 770 HG3 ARG 99 1HG ARG 99 -19.383 11.298 -3.778 771 HD2 ARG 99 2HD ARG 99 -18.430 11.856 -6.598 772 HD3 ARG 99 1HD ARG 99 -19.616 12.791 -5.688 773 HE ARG 99 HE ARG 99 -17.087 12.622 -4.283 774 HH11 ARG 99 1HH1 ARG 99 -15.851 14.515 -4.209 775 HH12 ARG 99 2HH1 ARG 99 -16.214 15.814 -5.295 776 HH21 ARG 99 1HH2 ARG 99 -18.844 14.152 -6.825 777 HH22 ARG 99 2HH2 ARG 99 -17.908 15.608 -6.777 778 H ALA 100 H ALA 100 -17.425 7.088 -2.091 779 HA ALA 100 HA ALA 100 -14.594 6.972 -2.552 780 HB1 ALA 100 1HB ALA 100 -15.948 6.140 -0.504 781 HB2 ALA 100 2HB ALA 100 -14.558 5.183 -1.015 782 HB3 ALA 100 3HB ALA 100 -16.188 4.665 -1.443 783 H SER 101 H SER 101 -13.367 5.415 -3.697 784 HA SER 101 HA SER 101 -14.876 4.072 -5.889 785 HB2 SER 101 2HB SER 101 -11.955 4.842 -5.661 786 HB3 SER 101 1HB SER 101 -12.668 4.012 -7.043 787 HG SER 101 HG SER 101 -12.815 6.650 -6.273 788 H GLU 102 H GLU 102 -13.892 1.951 -6.630 789 HA GLU 102 HA GLU 102 -13.103 0.346 -4.235 790 HB2 GLU 102 2HB GLU 102 -14.412 -0.546 -6.822 791 HB3 GLU 102 1HB GLU 102 -14.031 -1.589 -5.450 792 HG2 GLU 102 2HG GLU 102 -15.509 -0.199 -4.013 793 HG3 GLU 102 1HG GLU 102 -15.932 0.774 -5.422 794 H ILE 103 H ILE 103 -11.402 -1.149 -4.439 795 HA ILE 103 HA ILE 103 -9.620 -0.693 -6.803 796 HB ILE 103 HB ILE 103 -8.842 -1.523 -3.991 797 HG12 ILE 103 2HG1 ILE 103 -8.477 1.164 -5.355 798 HG13 ILE 103 1HG1 ILE 103 -9.734 0.824 -4.163 799 HG21 ILE 103 1HG2 ILE 103 -6.721 -0.361 -5.478 800 HG22 ILE 103 2HG2 ILE 103 -7.490 -1.556 -6.523 801 HG23 ILE 103 3HG2 ILE 103 -6.873 -2.035 -4.942 802 HD11 ILE 103 1HD1 ILE 103 -7.951 1.775 -2.910 803 HD12 ILE 103 2HD1 ILE 103 -6.740 0.818 -3.763 804 HD13 ILE 103 3HD1 ILE 103 -7.835 0.039 -2.622 805 H GLU 104 H GLU 104 -8.880 -2.530 -7.890 806 HA GLU 104 HA GLU 104 -9.872 -5.148 -6.820 807 HB2 GLU 104 2HB GLU 104 -10.811 -4.426 -9.032 808 HB3 GLU 104 1HB GLU 104 -9.173 -4.454 -9.686 809 HG2 GLU 104 2HG GLU 104 -8.984 -6.853 -9.023 810 HG3 GLU 104 1HG GLU 104 -10.664 -6.808 -8.487 811 H VAL 105 H VAL 105 -8.310 -6.479 -6.103 812 HA VAL 105 HA VAL 105 -5.581 -6.232 -7.284 813 HB VAL 105 HB VAL 105 -6.237 -6.861 -4.391 814 HG11 VAL 105 1HG1 VAL 105 -3.709 -6.339 -4.229 815 HG12 VAL 105 2HG1 VAL 105 -3.686 -6.574 -5.977 816 HG13 VAL 105 3HG1 VAL 105 -4.176 -7.895 -4.917 817 HG21 VAL 105 1HG2 VAL 105 -6.675 -4.579 -4.496 818 HG22 VAL 105 2HG2 VAL 105 -5.556 -4.322 -5.834 819 HG23 VAL 105 3HG2 VAL 105 -4.936 -4.559 -4.201 820 H ASP 106 H ASP 106 -4.729 -8.159 -7.967 821 HA ASP 106 HA ASP 106 -6.186 -10.646 -7.170 822 HB2 ASP 106 2HB ASP 106 -6.593 -10.006 -9.535 823 HB3 ASP 106 1HB ASP 106 -4.853 -10.048 -9.824 824 H PHE 107 H PHE 107 -4.917 -12.233 -6.301 825 HA PHE 107 HA PHE 107 -1.954 -11.959 -6.637 826 HB2 PHE 107 2HB PHE 107 -3.614 -12.330 -4.198 827 HB3 PHE 107 1HB PHE 107 -2.124 -13.269 -4.287 828 HD1 PHE 107 1HD PHE 107 0.063 -12.150 -4.488 829 HD2 PHE 107 2HD PHE 107 -3.569 -9.912 -4.009 830 HE1 PHE 107 1HE PHE 107 1.384 -10.142 -3.894 831 HE2 PHE 107 2HE PHE 107 -2.246 -7.899 -3.415 832 HZ PHE 107 HZ PHE 107 0.234 -8.017 -3.359 833 H VAL 108 H VAL 108 -1.138 -13.663 -7.712 834 HA VAL 108 HA VAL 108 -2.345 -16.349 -7.248 835 HB VAL 108 HB VAL 108 -2.642 -16.779 -9.495 836 HG11 VAL 108 1HG1 VAL 108 -3.960 -14.730 -8.897 837 HG12 VAL 108 2HG1 VAL 108 -3.568 -14.834 -10.614 838 HG13 VAL 108 3HG1 VAL 108 -2.655 -13.749 -9.564 839 HG21 VAL 108 1HG2 VAL 108 -1.292 -15.480 -11.258 840 HG22 VAL 108 2HG2 VAL 108 -0.387 -16.605 -10.246 841 HG23 VAL 108 3HG2 VAL 108 -0.329 -14.874 -9.911 842 HA PRO 109 HA PRO 109 1.833 -17.585 -6.517 843 HB2 PRO 109 2HB PRO 109 1.814 -20.103 -7.710 844 HB3 PRO 109 1HB PRO 109 1.255 -19.745 -6.069 845 HG2 PRO 109 2HG PRO 109 -0.303 -20.142 -8.552 846 HG3 PRO 109 1HG PRO 109 -0.709 -20.562 -6.879 847 HD2 PRO 109 2HD PRO 109 -1.805 -18.418 -8.156 848 HD3 PRO 109 1HD PRO 109 -1.521 -18.445 -6.400 849 H ASN 110 H ASN 110 3.668 -17.003 -7.579 850 HA ASN 110 HA ASN 110 3.776 -17.393 -10.537 851 HB2 ASN 110 2HB ASN 110 3.658 -14.989 -9.677 852 HB3 ASN 110 1HB ASN 110 5.262 -15.266 -9.003 853 HD21 ASN 110 1HD2 ASN 110 6.922 -14.652 -10.389 854 HD22 ASN 110 2HD2 ASN 110 6.827 -14.645 -12.083 855 H GLY 111 H GLY 111 5.221 -18.985 -11.006 856 HA2 GLY 111 2HA GLY 111 7.109 -20.374 -10.840 857 HA3 GLY 111 1HA GLY 111 7.946 -18.928 -10.267 858 H SER 112 H SER 112 9.006 -19.524 -8.425 859 HA SER 112 HA SER 112 7.368 -20.769 -6.266 860 HB2 SER 112 2HB SER 112 8.849 -22.479 -7.380 861 HB3 SER 112 1HB SER 112 10.231 -21.523 -6.861 862 HG SER 112 HG SER 112 8.640 -21.828 -4.775 863 H GLY 113 H GLY 113 7.626 -19.740 -4.323 864 HA2 GLY 113 2HA GLY 113 8.602 -18.369 -2.671 865 HA3 GLY 113 1HA GLY 113 10.086 -18.352 -3.627 866 H GLY 114 H GLY 114 7.478 -17.535 -5.585 867 HA2 GLY 114 2HA GLY 114 7.636 -14.650 -4.937 868 HA3 GLY 114 1HA GLY 114 8.126 -15.151 -6.552 869 H THR 115 H THR 115 5.738 -13.547 -5.468 870 HA THR 115 HA THR 115 3.631 -15.149 -6.867 871 HB THR 115 HB THR 115 3.085 -13.115 -4.696 872 HG1 THR 115 1HG THR 115 3.141 -14.741 -3.247 873 HG21 THR 115 1HG2 THR 115 0.934 -14.238 -4.598 874 HG22 THR 115 2HG2 THR 115 1.483 -15.463 -5.737 875 HG23 THR 115 3HG2 THR 115 1.260 -13.798 -6.274 876 H ARG 116 H ARG 116 2.420 -14.036 -8.398 877 HA ARG 116 HA ARG 116 3.344 -11.250 -8.981 878 HB2 ARG 116 2HB ARG 116 3.741 -12.974 -10.758 879 HB3 ARG 116 1HB ARG 116 1.998 -13.229 -10.847 880 HG2 ARG 116 2HG ARG 116 1.695 -10.825 -11.403 881 HG3 ARG 116 1HG ARG 116 3.446 -10.619 -11.382 882 HD2 ARG 116 2HD ARG 116 3.631 -12.361 -13.164 883 HD3 ARG 116 1HD ARG 116 1.870 -12.430 -13.234 884 HE ARG 116 HE ARG 116 3.017 -9.750 -13.616 885 HH11 ARG 116 1HH1 ARG 116 2.595 -8.839 -15.641 886 HH12 ARG 116 2HH1 ARG 116 1.965 -9.834 -16.910 887 HH21 ARG 116 1HH2 ARG 116 1.896 -12.713 -14.978 888 HH22 ARG 116 2HH2 ARG 116 1.569 -12.028 -16.535 889 H VAL 117 H VAL 117 1.855 -9.645 -8.744 890 HA VAL 117 HA VAL 117 -1.014 -10.449 -8.631 891 HB VAL 117 HB VAL 117 -0.736 -9.941 -6.416 892 HG11 VAL 117 1HG1 VAL 117 1.553 -8.264 -7.407 893 HG12 VAL 117 2HG1 VAL 117 1.571 -9.598 -6.253 894 HG13 VAL 117 3HG1 VAL 117 0.931 -8.026 -5.775 895 HG21 VAL 117 1HG2 VAL 117 -2.210 -8.155 -7.548 896 HG22 VAL 117 2HG2 VAL 117 -0.820 -7.081 -7.393 897 HG23 VAL 117 3HG2 VAL 117 -1.574 -7.760 -5.952 898 H GLU 118 H GLU 118 -2.474 -9.164 -9.660 899 HA GLU 118 HA GLU 118 -1.373 -6.883 -11.241 900 HB2 GLU 118 2HB GLU 118 -2.375 -8.684 -12.588 901 HB3 GLU 118 1HB GLU 118 -3.865 -8.572 -11.655 902 HG2 GLU 118 2HG GLU 118 -4.144 -6.221 -12.422 903 HG3 GLU 118 1HG GLU 118 -2.692 -6.385 -13.404 904 H LEU 119 H LEU 119 -1.926 -4.900 -10.471 905 HA LEU 119 HA LEU 119 -4.455 -4.667 -8.900 906 HB2 LEU 119 2HB LEU 119 -2.333 -4.293 -7.598 907 HB3 LEU 119 1HB LEU 119 -1.989 -2.923 -8.652 908 HG LEU 119 HG LEU 119 -4.699 -2.947 -7.451 909 HD11 LEU 119 1HD1 LEU 119 -3.911 -2.169 -5.268 910 HD12 LEU 119 2HD1 LEU 119 -2.235 -2.382 -5.774 911 HD13 LEU 119 3HD1 LEU 119 -3.283 -3.787 -5.581 912 HD21 LEU 119 1HD2 LEU 119 -2.492 -0.882 -7.752 913 HD22 LEU 119 2HD2 LEU 119 -4.112 -0.542 -7.144 914 HD23 LEU 119 3HD2 LEU 119 -3.891 -1.073 -8.810 915 H ALA 120 H ALA 120 -5.961 -3.317 -9.750 916 HA ALA 120 HA ALA 120 -5.046 -1.246 -11.693 917 HB1 ALA 120 1HB ALA 120 -7.117 -1.738 -13.026 918 HB2 ALA 120 2HB ALA 120 -7.382 -3.149 -12.002 919 HB3 ALA 120 3HB ALA 120 -5.948 -3.059 -13.025 920 H HIS 121 H HIS 121 -6.103 0.716 -11.517 921 HA HIS 121 HA HIS 121 -8.287 0.891 -9.477 922 HB2 HIS 121 2HB HIS 121 -7.086 2.434 -8.357 923 HB3 HIS 121 1HB HIS 121 -5.740 2.145 -9.456 924 HD1 HIS 121 1HD HIS 121 -9.076 3.986 -9.907 925 HD2 HIS 121 2HD HIS 121 -4.987 4.597 -10.459 926 HE1 HIS 121 1HE HIS 121 -8.826 6.287 -10.938 927 HE2 HIS 121 2HE HIS 121 -6.343 6.674 -11.262 928 H VAL 122 H VAL 122 -10.127 1.971 -10.142 929 HA VAL 122 HA VAL 122 -9.958 3.556 -12.657 930 HB VAL 122 HB VAL 122 -12.020 2.457 -13.489 931 HG11 VAL 122 1HG1 VAL 122 -9.601 1.636 -13.948 932 HG12 VAL 122 2HG1 VAL 122 -10.929 0.543 -14.337 933 HG13 VAL 122 3HG1 VAL 122 -9.999 0.308 -12.856 934 HG21 VAL 122 1HG2 VAL 122 -11.679 0.970 -10.899 935 HG22 VAL 122 2HG2 VAL 122 -12.427 0.153 -12.273 936 HG23 VAL 122 3HG2 VAL 122 -13.151 1.623 -11.621 937 H LYS 123 H LYS 123 -11.446 5.235 -12.783 938 HA LYS 123 HA LYS 123 -12.884 6.896 -11.982 939 HB2 LYS 123 2HB LYS 123 -14.151 4.536 -10.566 940 HB3 LYS 123 1HB LYS 123 -14.917 6.093 -10.885 941 HG2 LYS 123 2HG LYS 123 -14.607 5.725 -13.320 942 HG3 LYS 123 1HG LYS 123 -13.915 4.140 -12.976 943 HD2 LYS 123 2HD LYS 123 -16.045 3.545 -11.783 944 HD3 LYS 123 1HD LYS 123 -16.728 5.068 -12.354 945 HE2 LYS 123 2HE LYS 123 -16.167 4.344 -14.705 946 HE3 LYS 123 1HE LYS 123 -15.731 2.765 -14.050 947 HZ1 LYS 123 1HZ LYS 123 -17.891 2.337 -14.425 948 HZ2 LYS 123 2HZ LYS 123 -18.347 3.973 -14.395 949 HZ3 LYS 123 3HZ LYS 123 -18.121 3.124 -12.940 950 H LEU 124 H LEU 124 -10.458 6.215 -10.328 951 HA LEU 124 HA LEU 124 -11.176 6.402 -7.541 952 HB2 LEU 124 2HB LEU 124 -8.936 5.671 -8.339 953 HB3 LEU 124 1HB LEU 124 -8.624 7.314 -8.903 954 HG LEU 124 HG LEU 124 -9.019 8.111 -6.546 955 HD11 LEU 124 1HD1 LEU 124 -8.575 6.042 -4.909 956 HD12 LEU 124 2HD1 LEU 124 -9.409 5.168 -6.192 957 HD13 LEU 124 3HD1 LEU 124 -10.208 6.511 -5.378 958 HD21 LEU 124 1HD2 LEU 124 -6.774 6.747 -7.680 959 HD22 LEU 124 2HD2 LEU 124 -6.845 6.351 -5.962 960 HD23 LEU 124 3HD2 LEU 124 -6.770 8.037 -6.476 961 H HIS 125 H HIS 125 -10.482 8.788 -10.051 962 HA HIS 125 HA HIS 125 -10.422 11.094 -8.389 963 HB2 HIS 125 2HB HIS 125 -9.674 11.212 -10.694 964 HB3 HIS 125 1HB HIS 125 -11.292 10.813 -11.267 965 HD1 HIS 125 1HD HIS 125 -11.118 13.049 -8.334 966 HD2 HIS 125 2HD HIS 125 -11.378 13.480 -12.475 967 HE1 HIS 125 1HE HIS 125 -11.794 15.451 -8.762 968 HE2 HIS 125 2HE HIS 125 -11.948 15.729 -11.280 969 H ARG 126 H ARG 126 -13.107 9.148 -9.474 970 HA ARG 126 HA ARG 126 -15.238 10.923 -9.454 971 HB2 ARG 126 2HB ARG 126 -16.640 9.089 -8.920 972 HB3 ARG 126 1HB ARG 126 -15.257 8.352 -9.723 973 HG2 ARG 126 2HG ARG 126 -14.247 7.997 -7.422 974 HG3 ARG 126 1HG ARG 126 -15.801 8.487 -6.752 975 HD2 ARG 126 2HD ARG 126 -15.341 6.164 -8.641 976 HD3 ARG 126 1HD ARG 126 -15.706 6.046 -6.921 977 HE ARG 126 HE ARG 126 -17.765 7.572 -8.151 978 HH11 ARG 126 1HH1 ARG 126 -19.726 6.561 -8.641 979 HH12 ARG 126 2HH1 ARG 126 -19.784 4.835 -8.780 980 HH21 ARG 126 1HH2 ARG 126 -16.412 4.401 -8.099 981 HH22 ARG 126 2HH2 ARG 126 -17.908 3.613 -8.474 982 H HIS 127 H HIS 127 -13.222 9.925 -6.795 983 HA HIS 127 HA HIS 127 -14.875 10.633 -4.604 984 HB2 HIS 127 2HB HIS 127 -12.424 9.603 -4.767 985 HB3 HIS 127 1HB HIS 127 -11.956 11.286 -4.538 986 HD1 HIS 127 1HD HIS 127 -14.638 11.785 -2.703 987 HD2 HIS 127 2HD HIS 127 -11.589 9.005 -2.079 988 HE1 HIS 127 1HE HIS 127 -14.679 11.216 -0.233 989 HE2 HIS 127 2HE HIS 127 -12.828 9.525 0.157 990 H GLY 128 H GLY 128 -12.709 12.595 -6.606 991 HA2 GLY 128 2HA GLY 128 -12.337 14.934 -6.598 992 HA3 GLY 128 1HA GLY 128 -14.090 14.933 -6.782 993 H ASP 129 H ASP 129 -12.793 13.657 -3.826 994 HA ASP 129 HA ASP 129 -13.849 16.059 -2.406 995 HB2 ASP 129 2HB ASP 129 -13.313 13.232 -1.450 996 HB3 ASP 129 1HB ASP 129 -13.853 14.544 -0.404 997 H GLY 130 H GLY 130 -11.030 15.326 -3.637 998 HA2 GLY 130 2HA GLY 130 -8.965 16.418 -3.041 999 HA3 GLY 130 1HA GLY 130 -9.534 16.524 -1.373 1000 H ALA 131 H ALA 131 -10.191 13.506 -2.714 1001 HA ALA 131 HA ALA 131 -8.552 12.064 -0.899 1002 HB1 ALA 131 1HB ALA 131 -9.120 10.661 -3.415 1003 HB2 ALA 131 2HB ALA 131 -10.542 11.427 -2.707 1004 HB3 ALA 131 3HB ALA 131 -9.612 10.258 -1.770 1005 H TRP 132 H TRP 132 -7.883 13.397 -4.061 1006 HA TRP 132 HA TRP 132 -5.639 11.866 -4.810 1007 HB2 TRP 132 2HB TRP 132 -6.673 13.588 -6.255 1008 HB3 TRP 132 1HB TRP 132 -6.057 14.845 -5.185 1009 HD1 TRP 132 HD TRP 132 -3.932 15.893 -6.037 1010 HE1 TRP 132 1HE TRP 132 -1.899 15.124 -7.422 1011 HE3 TRP 132 3HE TRP 132 -5.204 11.008 -6.847 1012 HZ2 TRP 132 2HZ TRP 132 -0.941 12.755 -8.702 1013 HZ3 TRP 132 3HZ TRP 132 -3.709 9.523 -8.142 1014 HH2 TRP 132 HH TRP 132 -1.585 10.387 -9.068 1015 H ASN 133 H ASN 133 -5.858 14.592 -2.547 1016 HA ASN 133 HA ASN 133 -3.070 14.947 -2.105 1017 HB2 ASN 133 2HB ASN 133 -4.975 16.403 -1.230 1018 HB3 ASN 133 1HB ASN 133 -5.201 15.191 0.032 1019 HD21 ASN 133 1HD2 ASN 133 -4.048 15.635 1.910 1020 HD22 ASN 133 2HD2 ASN 133 -2.600 16.518 1.982 1021 H ILE 134 H ILE 134 -5.404 12.722 -0.607 1022 HA ILE 134 HA ILE 134 -3.649 11.594 1.331 1023 HB ILE 134 HB ILE 134 -6.060 10.535 -0.127 1024 HG12 ILE 134 2HG1 ILE 134 -7.156 10.824 1.982 1025 HG13 ILE 134 1HG1 ILE 134 -5.624 11.034 2.825 1026 HG21 ILE 134 1HG2 ILE 134 -5.941 8.640 1.581 1027 HG22 ILE 134 2HG2 ILE 134 -4.263 9.111 1.839 1028 HG23 ILE 134 3HG2 ILE 134 -4.788 8.554 0.252 1029 HD11 ILE 134 1HD1 ILE 134 -5.245 13.165 1.760 1030 HD12 ILE 134 2HD1 ILE 134 -6.888 13.179 2.398 1031 HD13 ILE 134 3HD1 ILE 134 -6.615 12.923 0.676 1032 H HIS 135 H HIS 135 -4.252 10.769 -2.064 1033 HA HIS 135 HA HIS 135 -2.638 8.436 -2.192 1034 HB2 HIS 135 2HB HIS 135 -4.204 9.308 -3.991 1035 HB3 HIS 135 1HB HIS 135 -2.952 10.478 -4.408 1036 HD1 HIS 135 1HD HIS 135 -0.426 8.834 -4.258 1037 HD2 HIS 135 2HD HIS 135 -3.946 7.348 -5.931 1038 HE1 HIS 135 1HE HIS 135 0.255 6.944 -5.802 1039 HE2 HIS 135 2HE HIS 135 -1.879 6.032 -6.827 1040 H LYS 136 H LYS 136 -1.800 11.873 -2.433 1041 HA LYS 136 HA LYS 136 0.866 11.611 -3.327 1042 HB2 LYS 136 2HB LYS 136 -0.307 13.606 -1.386 1043 HB3 LYS 136 1HB LYS 136 1.264 13.773 -2.153 1044 HG2 LYS 136 2HG LYS 136 0.139 13.657 -4.371 1045 HG3 LYS 136 1HG LYS 136 -1.412 13.639 -3.543 1046 HD2 LYS 136 2HD LYS 136 -0.814 15.808 -2.459 1047 HD3 LYS 136 1HD LYS 136 0.663 15.842 -3.422 1048 HE2 LYS 136 2HE LYS 136 -0.827 15.627 -5.481 1049 HE3 LYS 136 1HE LYS 136 -2.194 15.949 -4.412 1050 HZ1 LYS 136 1HZ LYS 136 -0.054 17.800 -4.021 1051 HZ2 LYS 136 2HZ LYS 136 -1.694 18.097 -4.342 1052 HZ3 LYS 136 3HZ LYS 136 -0.613 17.818 -5.621 1053 H ALA 137 H ALA 137 -0.443 11.439 -0.019 1054 HA ALA 137 HA ALA 137 2.140 11.059 1.224 1055 HB1 ALA 137 1HB ALA 137 0.908 11.222 3.102 1056 HB2 ALA 137 2HB ALA 137 0.029 9.752 2.691 1057 HB3 ALA 137 3HB ALA 137 -0.539 11.313 2.099 1058 H LEU 138 H LEU 138 -0.393 8.843 0.099 1059 HA LEU 138 HA LEU 138 0.921 6.428 0.909 1060 HB2 LEU 138 2HB LEU 138 -1.025 6.871 -1.372 1061 HB3 LEU 138 1HB LEU 138 -0.637 5.324 -0.635 1062 HG LEU 138 HG LEU 138 -1.928 7.684 0.760 1063 HD11 LEU 138 1HD1 LEU 138 -3.105 4.944 0.288 1064 HD12 LEU 138 2HD1 LEU 138 -3.283 6.233 -0.903 1065 HD13 LEU 138 3HD1 LEU 138 -3.940 6.437 0.721 1066 HD21 LEU 138 1HD2 LEU 138 -0.769 5.089 1.674 1067 HD22 LEU 138 2HD2 LEU 138 -2.238 5.660 2.467 1068 HD23 LEU 138 3HD2 LEU 138 -0.781 6.656 2.483 1069 H ASP 139 H ASP 139 1.253 8.544 -1.855 1070 HA ASP 139 HA ASP 139 2.468 6.881 -3.744 1071 HB2 ASP 139 2HB ASP 139 1.963 9.368 -3.957 1072 HB3 ASP 139 1HB ASP 139 3.471 9.659 -3.090 1073 H GLY 140 H GLY 140 3.908 8.326 -0.844 1074 HA2 GLY 140 2HA GLY 140 6.006 7.953 0.155 1075 HA3 GLY 140 1HA GLY 140 5.774 6.292 -0.392 1076 HA PRO 141 HA PRO 141 9.442 8.428 -2.556 1077 HB2 PRO 141 2HB PRO 141 11.195 6.362 -1.901 1078 HB3 PRO 141 1HB PRO 141 11.058 7.901 -1.033 1079 HG2 PRO 141 2HG PRO 141 9.929 5.241 -0.361 1080 HG3 PRO 141 1HG PRO 141 10.544 6.515 0.706 1081 HD2 PRO 141 2HD PRO 141 7.887 6.065 0.379 1082 HD3 PRO 141 1HD PRO 141 8.541 7.690 0.686 1083 H SER 142 H SER 142 10.366 7.697 -4.555 1084 HA SER 142 HA SER 142 10.490 6.399 -6.508 1085 HB2 SER 142 2HB SER 142 9.407 4.018 -5.041 1086 HB3 SER 142 1HB SER 142 10.651 4.088 -6.285 1087 HG SER 142 HG SER 142 12.060 4.953 -4.786 1088 HA PRO 143 HA PRO 143 5.839 7.174 -6.627 1089 HB2 PRO 143 2HB PRO 143 6.770 8.541 -9.101 1090 HB3 PRO 143 1HB PRO 143 5.624 9.096 -7.867 1091 HG2 PRO 143 2HG PRO 143 8.102 10.081 -8.044 1092 HG3 PRO 143 1HG PRO 143 7.273 9.880 -6.491 1093 HD2 PRO 143 2HD PRO 143 9.490 8.262 -7.664 1094 HD3 PRO 143 1HD PRO 143 9.115 8.599 -5.959 1095 H GLY 144 H GLY 144 4.415 5.940 -7.852 1096 HA2 GLY 144 2HA GLY 144 4.453 5.075 -10.431 1097 HA3 GLY 144 1HA GLY 144 5.588 3.958 -9.671 1098 H GLU 145 H GLU 145 3.692 2.482 -10.496 1099 HA GLU 145 HA GLU 145 1.173 2.425 -9.226 1100 HB2 GLU 145 2HB GLU 145 2.890 0.081 -10.103 1101 HB3 GLU 145 1HB GLU 145 1.167 -0.001 -9.742 1102 HG2 GLU 145 2HG GLU 145 1.139 0.285 -12.057 1103 HG3 GLU 145 1HG GLU 145 0.987 1.949 -11.493 1104 H THR 146 H THR 146 0.428 1.325 -7.338 1105 HA THR 146 HA THR 146 2.066 1.520 -5.035 1106 HB THR 146 HB THR 146 -0.374 -0.202 -5.503 1107 HG1 THR 146 1HG THR 146 -0.492 2.094 -3.997 1108 HG21 THR 146 1HG2 THR 146 1.257 0.426 -3.074 1109 HG22 THR 146 2HG2 THR 146 0.485 -1.091 -3.543 1110 HG23 THR 146 3HG2 THR 146 -0.488 0.236 -2.904 1111 H LEU 147 H LEU 147 1.408 -1.235 -7.158 1112 HA LEU 147 HA LEU 147 2.639 -3.251 -5.594 1113 HB2 LEU 147 2HB LEU 147 2.627 -3.039 -8.616 1114 HB3 LEU 147 1HB LEU 147 2.786 -4.510 -7.654 1115 HG LEU 147 HG LEU 147 0.373 -2.681 -7.650 1116 HD11 LEU 147 1HD1 LEU 147 -0.440 -5.147 -8.526 1117 HD12 LEU 147 2HD1 LEU 147 1.162 -5.030 -9.249 1118 HD13 LEU 147 3HD1 LEU 147 -0.052 -3.796 -9.586 1119 HD21 LEU 147 1HD2 LEU 147 1.245 -5.014 -6.018 1120 HD22 LEU 147 2HD2 LEU 147 -0.443 -4.998 -6.524 1121 HD23 LEU 147 3HD2 LEU 147 0.206 -3.660 -5.575 1122 H ALA 148 H ALA 148 4.017 -0.829 -7.761 1123 HA ALA 148 HA ALA 148 6.636 -1.940 -7.970 1124 HB1 ALA 148 1HB ALA 148 6.932 -0.111 -9.253 1125 HB2 ALA 148 2HB ALA 148 6.747 0.937 -7.847 1126 HB3 ALA 148 3HB ALA 148 5.328 0.444 -8.771 1127 H ARG 149 H ARG 149 5.448 0.603 -5.753 1128 HA ARG 149 HA ARG 149 7.836 0.662 -4.174 1129 HB2 ARG 149 2HB ARG 149 5.004 1.476 -3.505 1130 HB3 ARG 149 1HB ARG 149 6.414 1.870 -2.528 1131 HG2 ARG 149 2HG ARG 149 7.422 2.999 -4.519 1132 HG3 ARG 149 1HG ARG 149 5.922 2.704 -5.399 1133 HD2 ARG 149 2HD ARG 149 6.224 4.341 -2.866 1134 HD3 ARG 149 1HD ARG 149 5.884 4.961 -4.481 1135 HE ARG 149 HE ARG 149 3.963 3.609 -2.710 1136 HH11 ARG 149 1HH1 ARG 149 1.832 3.632 -3.457 1137 HH12 ARG 149 2HH1 ARG 149 1.506 4.110 -5.089 1138 HH21 ARG 149 1HH2 ARG 149 4.835 4.683 -5.869 1139 HH22 ARG 149 2HH2 ARG 149 3.205 4.705 -6.454 1140 H PHE 150 H PHE 150 4.785 -1.119 -3.848 1141 HA PHE 150 HA PHE 150 5.320 -2.262 -1.280 1142 HB2 PHE 150 2HB PHE 150 3.087 -2.306 -2.311 1143 HB3 PHE 150 1HB PHE 150 3.690 -3.353 -3.593 1144 HD1 PHE 150 1HD PHE 150 4.225 -5.689 -3.179 1145 HD2 PHE 150 2HD PHE 150 2.782 -3.157 -0.024 1146 HE1 PHE 150 1HE PHE 150 3.779 -7.687 -1.781 1147 HE2 PHE 150 2HE PHE 150 2.336 -5.158 1.374 1148 HZ PHE 150 HZ PHE 150 2.836 -7.422 0.493 1149 H ALA 151 H ALA 151 6.033 -3.417 -4.578 1150 HA ALA 151 HA ALA 151 7.133 -5.933 -3.755 1151 HB1 ALA 151 1HB ALA 151 7.961 -4.369 -6.207 1152 HB2 ALA 151 2HB ALA 151 6.437 -5.250 -6.110 1153 HB3 ALA 151 3HB ALA 151 7.967 -6.119 -5.989 1154 H ASN 152 H ASN 152 8.601 -2.734 -4.219 1155 HA ASN 152 HA ASN 152 11.315 -3.566 -3.962 1156 HB2 ASN 152 2HB ASN 152 10.009 -0.944 -3.228 1157 HB3 ASN 152 1HB ASN 152 11.750 -1.197 -3.325 1158 HD21 ASN 152 1HD2 ASN 152 10.434 0.679 -5.045 1159 HD22 ASN 152 2HD2 ASN 152 10.517 0.095 -6.636 1160 H VAL 153 H VAL 153 9.061 -2.343 -1.470 1161 HA VAL 153 HA VAL 153 10.945 -2.703 0.677 1162 HB VAL 153 HB VAL 153 9.003 -2.346 2.142 1163 HG11 VAL 153 1HG1 VAL 153 9.831 -0.298 1.379 1164 HG12 VAL 153 2HG1 VAL 153 8.138 -0.209 0.891 1165 HG13 VAL 153 3HG1 VAL 153 9.377 -0.629 -0.293 1166 HG21 VAL 153 1HG2 VAL 153 6.759 -2.061 1.121 1167 HG22 VAL 153 2HG2 VAL 153 7.368 -3.702 0.911 1168 HG23 VAL 153 3HG2 VAL 153 7.422 -2.561 -0.433 1169 H ILE 154 H ILE 154 8.419 -4.738 -0.725 1170 HA ILE 154 HA ILE 154 8.800 -6.822 1.300 1171 HB ILE 154 HB ILE 154 7.086 -6.486 -1.139 1172 HG12 ILE 154 2HG1 ILE 154 6.765 -5.820 1.505 1173 HG13 ILE 154 1HG1 ILE 154 5.446 -6.077 0.373 1174 HG21 ILE 154 1HG2 ILE 154 7.743 -8.772 -1.328 1175 HG22 ILE 154 2HG2 ILE 154 6.148 -8.773 -0.580 1176 HG23 ILE 154 3HG2 ILE 154 7.587 -9.029 0.410 1177 HD11 ILE 154 1HD1 ILE 154 6.658 -8.303 2.030 1178 HD12 ILE 154 2HD1 ILE 154 5.166 -8.358 1.088 1179 HD13 ILE 154 3HD1 ILE 154 5.255 -7.368 2.544 Start of MODEL 15 1 H1 MET 1 1HT MET 1 3.671 12.166 -4.926 2 H2 MET 1 2HT MET 1 2.192 12.795 -4.375 3 H3 MET 1 3HT MET 1 3.616 13.710 -4.225 4 HA MET 1 HA MET 1 1.828 13.943 -6.235 5 HB2 MET 1 2HB MET 1 4.803 14.514 -6.381 6 HB3 MET 1 1HB MET 1 3.530 15.334 -7.283 7 HG2 MET 1 2HG MET 1 2.563 15.749 -4.834 8 HG3 MET 1 1HG MET 1 4.262 15.573 -4.397 9 HE1 MET 1 1HE MET 1 3.349 18.271 -3.563 10 HE2 MET 1 2HE MET 1 1.903 17.916 -4.505 11 HE3 MET 1 3HE MET 1 2.798 19.404 -4.804 12 HA PRO 2 HA PRO 2 3.459 10.288 -8.526 13 HB2 PRO 2 2HB PRO 2 1.101 8.864 -8.562 14 HB3 PRO 2 1HB PRO 2 2.336 8.709 -7.300 15 HG2 PRO 2 2HG PRO 2 -0.310 9.857 -7.129 16 HG3 PRO 2 1HG PRO 2 0.836 9.485 -5.834 17 HD2 PRO 2 2HD PRO 2 0.252 12.070 -7.068 18 HD3 PRO 2 1HD PRO 2 1.202 11.723 -5.606 19 H GLU 3 H GLU 3 2.643 9.435 -10.693 20 HA GLU 3 HA GLU 3 2.008 11.436 -12.509 21 HB2 GLU 3 2HB GLU 3 1.002 8.583 -12.657 22 HB3 GLU 3 1HB GLU 3 1.217 9.680 -14.018 23 HG2 GLU 3 2HG GLU 3 3.656 9.804 -13.471 24 HG3 GLU 3 1HG GLU 3 3.400 8.593 -12.213 25 H GLU 4 H GLU 4 -0.039 12.164 -13.435 26 HA GLU 4 HA GLU 4 -2.074 12.768 -11.618 27 HB2 GLU 4 2HB GLU 4 -2.384 12.290 -14.601 28 HB3 GLU 4 1HB GLU 4 -3.536 13.154 -13.582 29 HG2 GLU 4 2HG GLU 4 -1.758 14.790 -12.999 30 HG3 GLU 4 1HG GLU 4 -0.656 13.953 -14.093 31 H ILE 5 H ILE 5 -4.132 11.776 -11.162 32 HA ILE 5 HA ILE 5 -4.158 9.080 -10.610 33 HB ILE 5 HB ILE 5 -6.767 10.028 -11.631 34 HG12 ILE 5 2HG1 ILE 5 -5.239 11.536 -9.492 35 HG13 ILE 5 1HG1 ILE 5 -5.911 12.189 -10.983 36 HG21 ILE 5 1HG2 ILE 5 -6.109 8.068 -10.005 37 HG22 ILE 5 2HG2 ILE 5 -7.563 9.015 -9.692 38 HG23 ILE 5 3HG2 ILE 5 -6.085 9.345 -8.789 39 HD11 ILE 5 1HD1 ILE 5 -7.243 11.621 -8.426 40 HD12 ILE 5 2HD1 ILE 5 -8.112 10.997 -9.828 41 HD13 ILE 5 3HD1 ILE 5 -7.723 12.714 -9.724 42 HA PRO 6 HA PRO 6 -4.319 7.689 -14.964 43 HB2 PRO 6 2HB PRO 6 -3.011 5.354 -14.651 44 HB3 PRO 6 1HB PRO 6 -2.152 6.907 -14.644 45 HG2 PRO 6 2HG PRO 6 -2.876 5.134 -12.379 46 HG3 PRO 6 1HG PRO 6 -1.451 6.163 -12.603 47 HD2 PRO 6 2HD PRO 6 -3.719 6.805 -11.058 48 HD3 PRO 6 1HD PRO 6 -2.458 7.939 -11.584 49 H ASP 7 H ASP 7 -5.619 6.073 -16.037 50 HA ASP 7 HA ASP 7 -7.838 5.057 -14.505 51 HB2 ASP 7 2HB ASP 7 -7.913 5.582 -16.966 52 HB3 ASP 7 1HB ASP 7 -6.917 4.155 -17.254 53 H VAL 8 H VAL 8 -7.393 2.401 -16.245 54 HA VAL 8 HA VAL 8 -6.843 0.657 -14.135 55 HB VAL 8 HB VAL 8 -6.380 -1.019 -15.789 56 HG11 VAL 8 1HG1 VAL 8 -8.631 0.460 -15.840 57 HG12 VAL 8 2HG1 VAL 8 -8.363 -0.893 -16.937 58 HG13 VAL 8 3HG1 VAL 8 -8.061 0.757 -17.481 59 HG21 VAL 8 1HG2 VAL 8 -6.075 -0.020 -18.245 60 HG22 VAL 8 2HG2 VAL 8 -4.691 -0.260 -17.178 61 HG23 VAL 8 3HG2 VAL 8 -5.409 1.343 -17.344 62 H ARG 9 H ARG 9 -4.979 0.049 -13.066 63 HA ARG 9 HA ARG 9 -2.531 1.545 -13.749 64 HB2 ARG 9 2HB ARG 9 -3.251 -0.189 -11.377 65 HB3 ARG 9 1HB ARG 9 -1.687 0.596 -11.574 66 HG2 ARG 9 2HG ARG 9 -2.858 2.792 -11.750 67 HG3 ARG 9 1HG ARG 9 -4.384 1.970 -11.421 68 HD2 ARG 9 2HD ARG 9 -3.395 1.127 -9.273 69 HD3 ARG 9 1HD ARG 9 -1.977 2.127 -9.586 70 HE ARG 9 HE ARG 9 -4.632 3.096 -8.771 71 HH11 ARG 9 1HH1 ARG 9 -4.706 5.303 -8.284 72 HH12 ARG 9 2HH1 ARG 9 -3.371 6.317 -8.722 73 HH21 ARG 9 1HH2 ARG 9 -1.531 3.742 -10.136 74 HH22 ARG 9 2HH2 ARG 9 -1.575 5.434 -9.768 75 H LYS 10 H LYS 10 -0.703 -0.433 -12.611 76 HA LYS 10 HA LYS 10 -0.716 -2.405 -14.852 77 HB2 LYS 10 2HB LYS 10 1.570 -0.945 -13.521 78 HB3 LYS 10 1HB LYS 10 1.790 -2.298 -14.624 79 HG2 LYS 10 2HG LYS 10 0.504 -1.053 -16.355 80 HG3 LYS 10 1HG LYS 10 0.419 0.325 -15.256 81 HD2 LYS 10 2HD LYS 10 2.916 0.362 -15.176 82 HD3 LYS 10 1HD LYS 10 2.942 -0.926 -16.380 83 HE2 LYS 10 2HE LYS 10 1.558 0.583 -17.876 84 HE3 LYS 10 1HE LYS 10 1.846 1.876 -16.712 85 HZ1 LYS 10 1HZ LYS 10 3.523 2.088 -18.311 86 HZ2 LYS 10 2HZ LYS 10 3.828 0.417 -18.354 87 HZ3 LYS 10 3HZ LYS 10 4.282 1.331 -16.995 88 H SER 11 H SER 11 1.149 -4.117 -14.225 89 HA SER 11 HA SER 11 0.503 -5.126 -11.479 90 HB2 SER 11 2HB SER 11 0.452 -7.373 -12.350 91 HB3 SER 11 1HB SER 11 -0.598 -6.395 -13.369 92 HG SER 11 HG SER 11 1.388 -7.859 -14.156 93 H VAL 12 H VAL 12 2.228 -6.312 -10.450 94 HA VAL 12 HA VAL 12 4.871 -6.172 -11.804 95 HB VAL 12 HB VAL 12 4.181 -5.003 -9.120 96 HG11 VAL 12 1HG1 VAL 12 6.119 -6.317 -8.655 97 HG12 VAL 12 2HG1 VAL 12 6.719 -4.686 -8.953 98 HG13 VAL 12 3HG1 VAL 12 6.848 -5.917 -10.210 99 HG21 VAL 12 1HG2 VAL 12 5.889 -3.874 -11.333 100 HG22 VAL 12 2HG2 VAL 12 5.074 -3.004 -10.032 101 HG23 VAL 12 3HG2 VAL 12 4.135 -3.702 -11.352 102 H VAL 13 H VAL 13 6.366 -7.740 -11.075 103 HA VAL 13 HA VAL 13 5.096 -9.963 -9.542 104 HB VAL 13 HB VAL 13 7.591 -10.012 -11.268 105 HG11 VAL 13 1HG1 VAL 13 5.885 -12.216 -10.068 106 HG12 VAL 13 2HG1 VAL 13 7.514 -11.775 -9.556 107 HG13 VAL 13 3HG1 VAL 13 7.249 -12.467 -11.157 108 HG21 VAL 13 1HG2 VAL 13 6.217 -10.100 -13.052 109 HG22 VAL 13 2HG2 VAL 13 4.818 -9.909 -11.995 110 HG23 VAL 13 3HG2 VAL 13 5.430 -11.521 -12.363 111 H VAL 14 H VAL 14 5.849 -10.413 -7.527 112 HA VAL 14 HA VAL 14 8.499 -9.275 -6.729 113 HB VAL 14 HB VAL 14 6.233 -9.574 -4.795 114 HG11 VAL 14 1HG1 VAL 14 8.580 -9.159 -4.035 115 HG12 VAL 14 2HG1 VAL 14 7.458 -7.882 -3.568 116 HG13 VAL 14 3HG1 VAL 14 8.554 -7.638 -4.928 117 HG21 VAL 14 1HG2 VAL 14 5.728 -7.142 -5.223 118 HG22 VAL 14 2HG2 VAL 14 5.276 -8.209 -6.553 119 HG23 VAL 14 3HG2 VAL 14 6.747 -7.243 -6.660 120 H ALA 15 H ALA 15 9.684 -10.570 -5.232 121 HA ALA 15 HA ALA 15 9.047 -13.423 -5.394 122 HB1 ALA 15 1HB ALA 15 11.366 -12.956 -5.527 123 HB2 ALA 15 2HB ALA 15 11.146 -13.561 -3.886 124 HB3 ALA 15 3HB ALA 15 11.303 -11.828 -4.174 125 H ALA 16 H ALA 16 7.147 -13.681 -4.175 126 HA ALA 16 HA ALA 16 7.533 -13.863 -1.291 127 HB1 ALA 16 1HB ALA 16 5.790 -12.330 -0.642 128 HB2 ALA 16 2HB ALA 16 5.357 -12.024 -2.324 129 HB3 ALA 16 3HB ALA 16 6.896 -11.443 -1.688 130 H SER 17 H SER 17 5.853 -15.169 -0.323 131 HA SER 17 HA SER 17 4.556 -16.958 -2.223 132 HB2 SER 17 2HB SER 17 3.892 -18.227 -0.310 133 HB3 SER 17 1HB SER 17 5.499 -17.611 0.062 134 HG SER 17 HG SER 17 4.664 -16.483 1.624 135 H VAL 18 H VAL 18 2.229 -17.297 -2.334 136 HA VAL 18 HA VAL 18 0.713 -14.890 -2.539 137 HB VAL 18 HB VAL 18 -0.830 -17.372 -2.093 138 HG11 VAL 18 1HG1 VAL 18 -2.065 -16.574 -3.906 139 HG12 VAL 18 2HG1 VAL 18 -0.673 -15.769 -4.627 140 HG13 VAL 18 3HG1 VAL 18 -1.454 -15.075 -3.208 141 HG21 VAL 18 1HG2 VAL 18 0.969 -18.553 -3.046 142 HG22 VAL 18 2HG2 VAL 18 1.430 -17.201 -4.082 143 HG23 VAL 18 3HG2 VAL 18 -0.012 -18.145 -4.452 144 H GLU 19 H GLU 19 0.877 -17.372 -0.009 145 HA GLU 19 HA GLU 19 -1.199 -16.378 1.657 146 HB2 GLU 19 2HB GLU 19 1.390 -17.764 2.413 147 HB3 GLU 19 1HB GLU 19 0.022 -17.530 3.502 148 HG2 GLU 19 2HG GLU 19 -1.423 -18.794 1.923 149 HG3 GLU 19 1HG GLU 19 -0.018 -19.079 0.895 150 H HIS 20 H HIS 20 2.176 -15.418 1.288 151 HA HIS 20 HA HIS 20 2.335 -13.688 3.554 152 HB2 HIS 20 2HB HIS 20 4.431 -13.385 2.786 153 HB3 HIS 20 1HB HIS 20 4.014 -14.416 1.417 154 HD1 HIS 20 1HD HIS 20 2.714 -13.036 -0.612 155 HD2 HIS 20 2HD HIS 20 5.079 -10.808 2.005 156 HE1 HIS 20 1HE HIS 20 3.193 -10.832 -1.772 157 HE2 HIS 20 2HE HIS 20 4.624 -9.470 -0.186 158 H CYS 21 H CYS 21 1.245 -13.139 0.217 159 HA CYS 21 HA CYS 21 0.966 -10.349 0.248 160 HB2 CYS 21 2HB CYS 21 -1.077 -12.192 -0.999 161 HB3 CYS 21 1HB CYS 21 -0.535 -10.618 -1.575 162 HG CYS 21 HG CYS 21 1.468 -11.667 -2.626 163 H PHE 22 H PHE 22 -1.672 -12.680 0.959 164 HA PHE 22 HA PHE 22 -3.359 -10.579 2.032 165 HB2 PHE 22 2HB PHE 22 -3.792 -13.461 2.718 166 HB3 PHE 22 1HB PHE 22 -4.973 -12.228 2.270 167 HD1 PHE 22 1HD PHE 22 -5.141 -11.468 -0.133 168 HD2 PHE 22 2HD PHE 22 -2.699 -14.786 1.075 169 HE1 PHE 22 1HE PHE 22 -5.002 -12.227 -2.488 170 HE2 PHE 22 2HE PHE 22 -2.561 -15.545 -1.276 171 HZ PHE 22 HZ PHE 22 -3.709 -14.263 -3.058 172 H GLU 23 H GLU 23 -1.191 -12.983 3.423 173 HA GLU 23 HA GLU 23 -1.939 -12.554 6.162 174 HB2 GLU 23 2HB GLU 23 -0.657 -14.530 5.332 175 HB3 GLU 23 1HB GLU 23 0.724 -13.474 5.065 176 HG2 GLU 23 2HG GLU 23 0.689 -12.857 7.471 177 HG3 GLU 23 1HG GLU 23 -0.623 -14.006 7.715 178 H VAL 24 H VAL 24 0.364 -10.951 4.010 179 HA VAL 24 HA VAL 24 1.783 -9.495 6.013 180 HB VAL 24 HB VAL 24 1.373 -9.213 3.069 181 HG11 VAL 24 1HG1 VAL 24 2.901 -7.146 3.270 182 HG12 VAL 24 2HG1 VAL 24 2.345 -7.059 4.942 183 HG13 VAL 24 3HG1 VAL 24 1.187 -6.927 3.618 184 HG21 VAL 24 1HG2 VAL 24 3.780 -9.332 4.914 185 HG22 VAL 24 2HG2 VAL 24 3.862 -9.264 3.155 186 HG23 VAL 24 3HG2 VAL 24 3.146 -10.665 3.950 187 H PHE 25 H PHE 25 -1.058 -8.537 4.037 188 HA PHE 25 HA PHE 25 -1.295 -5.913 5.125 189 HB2 PHE 25 2HB PHE 25 -3.729 -7.539 4.446 190 HB3 PHE 25 1HB PHE 25 -3.417 -5.831 4.145 191 HD1 PHE 25 1HD PHE 25 -4.130 -8.470 2.359 192 HD2 PHE 25 2HD PHE 25 -0.734 -5.905 2.908 193 HE1 PHE 25 1HE PHE 25 -3.335 -9.033 0.071 194 HE2 PHE 25 2HE PHE 25 0.065 -6.465 0.628 195 HZ PHE 25 HZ PHE 25 -1.236 -8.030 -0.793 196 H THR 26 H THR 26 -2.725 -8.987 6.182 197 HA THR 26 HA THR 26 -4.008 -7.687 8.477 198 HB THR 26 HB THR 26 -4.960 -9.868 8.906 199 HG1 THR 26 1HG THR 26 -3.299 -10.848 6.840 200 HG21 THR 26 1HG2 THR 26 -5.930 -10.358 6.635 201 HG22 THR 26 2HG2 THR 26 -4.791 -9.193 5.961 202 HG23 THR 26 3HG2 THR 26 -6.023 -8.660 7.105 203 H SER 27 H SER 27 -0.882 -8.776 7.916 204 HA SER 27 HA SER 27 -0.501 -9.875 10.629 205 HB2 SER 27 2HB SER 27 1.207 -9.586 8.202 206 HB3 SER 27 1HB SER 27 1.996 -9.751 9.764 207 HG SER 27 HG SER 27 0.303 -11.566 9.942 208 H ARG 28 H ARG 28 1.214 -7.294 8.815 209 HA ARG 28 HA ARG 28 0.787 -5.332 10.895 210 HB2 ARG 28 2HB ARG 28 3.459 -5.341 11.256 211 HB3 ARG 28 1HB ARG 28 2.357 -6.238 12.304 212 HG2 ARG 28 2HG ARG 28 2.849 -8.284 11.296 213 HG3 ARG 28 1HG ARG 28 3.375 -7.530 9.793 214 HD2 ARG 28 2HD ARG 28 5.495 -7.223 10.541 215 HD3 ARG 28 1HD ARG 28 4.961 -6.787 12.163 216 HE ARG 28 HE ARG 28 5.827 -9.402 11.349 217 HH11 ARG 28 1HH1 ARG 28 5.546 -11.095 12.819 218 HH12 ARG 28 2HH1 ARG 28 4.425 -10.912 14.126 219 HH21 ARG 28 1HH2 ARG 28 3.482 -7.701 13.217 220 HH22 ARG 28 2HH2 ARG 28 3.256 -8.991 14.352 221 HA PRO 29 HA PRO 29 1.898 -3.814 6.627 222 HB2 PRO 29 2HB PRO 29 0.117 -1.645 7.614 223 HB3 PRO 29 1HB PRO 29 0.106 -2.490 6.056 224 HG2 PRO 29 2HG PRO 29 -1.738 -2.972 7.921 225 HG3 PRO 29 1HG PRO 29 -1.121 -4.250 6.862 226 HD2 PRO 29 2HD PRO 29 -0.518 -3.743 9.747 227 HD3 PRO 29 1HD PRO 29 -0.607 -5.284 8.863 228 H ALA 30 H ALA 30 2.083 -2.481 9.837 229 HA ALA 30 HA ALA 30 3.453 -0.034 9.229 230 HB1 ALA 30 1HB ALA 30 4.269 -0.250 11.627 231 HB2 ALA 30 2HB ALA 30 3.417 -1.794 11.692 232 HB3 ALA 30 3HB ALA 30 2.518 -0.300 11.425 233 H ASP 31 H ASP 31 4.421 -3.306 9.062 234 HA ASP 31 HA ASP 31 7.159 -3.211 9.710 235 HB2 ASP 31 2HB ASP 31 5.833 -5.259 9.065 236 HB3 ASP 31 1HB ASP 31 5.971 -4.744 7.384 237 H TRP 32 H TRP 32 5.497 -2.002 6.833 238 HA TRP 32 HA TRP 32 8.083 -0.776 6.004 239 HB2 TRP 32 2HB TRP 32 7.154 -1.298 3.571 240 HB3 TRP 32 1HB TRP 32 8.124 -2.483 4.447 241 HD1 TRP 32 HD TRP 32 7.050 -4.756 4.875 242 HE1 TRP 32 1HE TRP 32 4.687 -5.747 4.628 243 HE3 TRP 32 3HE TRP 32 4.458 -0.528 3.729 244 HZ2 TRP 32 2HZ TRP 32 2.046 -4.856 4.021 245 HZ3 TRP 32 3HZ TRP 32 2.016 -0.622 3.316 246 HH2 TRP 32 HH TRP 32 0.804 -2.780 3.461 247 H TRP 33 H TRP 33 5.039 -0.157 6.949 248 HA TRP 33 HA TRP 33 4.059 1.603 4.905 249 HB2 TRP 33 2HB TRP 33 2.928 0.654 7.135 250 HB3 TRP 33 1HB TRP 33 3.440 2.222 7.757 251 HD1 TRP 33 HD TRP 33 2.471 4.418 6.522 252 HE1 TRP 33 1HE TRP 33 0.302 4.765 5.174 253 HE3 TRP 33 3HE TRP 33 1.233 -0.446 5.559 254 HZ2 TRP 33 2HZ TRP 33 -1.695 3.194 3.864 255 HZ3 TRP 33 3HZ TRP 33 -0.808 -0.989 4.261 256 HH2 TRP 33 HH TRP 33 -2.272 0.823 3.413 257 HA PRO 34 HA PRO 34 6.352 4.944 7.757 258 HB2 PRO 34 2HB PRO 34 8.808 3.319 8.186 259 HB3 PRO 34 1HB PRO 34 7.995 4.453 9.282 260 HG2 PRO 34 2HG PRO 34 7.821 1.838 9.659 261 HG3 PRO 34 1HG PRO 34 6.428 2.899 9.943 262 HD2 PRO 34 2HD PRO 34 6.963 1.067 7.635 263 HD3 PRO 34 1HD PRO 34 5.425 1.432 8.446 264 HA PRO 35 HA PRO 35 8.624 5.314 3.793 265 HB2 PRO 35 2HB PRO 35 7.732 7.755 3.091 266 HB3 PRO 35 1HB PRO 35 6.705 6.315 2.946 267 HG2 PRO 35 2HG PRO 35 6.637 8.485 4.957 268 HG3 PRO 35 1HG PRO 35 5.314 7.521 4.287 269 HD2 PRO 35 2HD PRO 35 6.589 7.112 6.780 270 HD3 PRO 35 1HD PRO 35 5.471 5.997 5.969 271 H SER 36 H SER 36 10.389 6.770 3.075 272 HA SER 36 HA SER 36 12.086 7.664 5.180 273 HB2 SER 36 2HB SER 36 13.457 8.650 3.438 274 HB3 SER 36 1HB SER 36 12.817 7.127 2.828 275 HG SER 36 HG SER 36 11.318 8.248 1.646 276 H HIS 37 H HIS 37 9.630 9.310 3.273 277 HA HIS 37 HA HIS 37 9.966 11.707 5.035 278 HB2 HIS 37 2HB HIS 37 9.137 11.611 2.114 279 HB3 HIS 37 1HB HIS 37 9.110 13.060 3.118 280 HD1 HIS 37 1HD HIS 37 11.444 10.712 1.363 281 HD2 HIS 37 2HD HIS 37 11.692 14.118 3.758 282 HE1 HIS 37 1HE HIS 37 13.840 11.526 1.208 283 HE2 HIS 37 2HE HIS 37 14.001 13.597 2.662 284 H VAL 38 H VAL 38 8.116 12.212 6.163 285 HA VAL 38 HA VAL 38 5.631 10.737 5.392 286 HB VAL 38 HB VAL 38 6.386 11.916 8.080 287 HG11 VAL 38 1HG1 VAL 38 4.081 11.758 8.178 288 HG12 VAL 38 2HG1 VAL 38 4.507 10.111 8.641 289 HG13 VAL 38 3HG1 VAL 38 4.013 10.460 6.985 290 HG21 VAL 38 1HG2 VAL 38 7.522 10.017 8.516 291 HG22 VAL 38 2HG2 VAL 38 7.381 9.606 6.807 292 HG23 VAL 38 3HG2 VAL 38 6.173 9.028 7.955 293 H LEU 39 H LEU 39 3.874 11.895 4.802 294 HA LEU 39 HA LEU 39 4.033 14.855 4.947 295 HB2 LEU 39 2HB LEU 39 1.966 13.114 3.565 296 HB3 LEU 39 1HB LEU 39 2.178 14.850 3.366 297 HG LEU 39 HG LEU 39 3.233 13.785 1.480 298 HD11 LEU 39 1HD1 LEU 39 4.451 15.647 2.840 299 HD12 LEU 39 2HD1 LEU 39 5.359 14.771 1.608 300 HD13 LEU 39 3HD1 LEU 39 5.555 14.355 3.309 301 HD21 LEU 39 1HD2 LEU 39 5.231 12.288 3.083 302 HD22 LEU 39 2HD2 LEU 39 4.443 11.846 1.571 303 HD23 LEU 39 3HD2 LEU 39 3.598 11.624 3.100 304 H VAL 40 H VAL 40 3.069 12.456 6.905 305 HA VAL 40 HA VAL 40 0.506 13.664 7.788 306 HB VAL 40 HB VAL 40 1.946 11.358 9.085 307 HG11 VAL 40 1HG1 VAL 40 -0.331 10.702 9.710 308 HG12 VAL 40 2HG1 VAL 40 -0.987 12.055 8.788 309 HG13 VAL 40 3HG1 VAL 40 -0.011 12.358 10.225 310 HG21 VAL 40 1HG2 VAL 40 1.785 10.913 6.637 311 HG22 VAL 40 2HG2 VAL 40 0.048 11.205 6.719 312 HG23 VAL 40 3HG2 VAL 40 0.753 9.832 7.574 313 H LYS 41 H LYS 41 0.357 14.815 9.753 314 HA LYS 41 HA LYS 41 2.674 16.094 10.771 315 HB2 LYS 41 2HB LYS 41 0.279 16.819 11.146 316 HB3 LYS 41 1HB LYS 41 0.150 15.530 12.339 317 HG2 LYS 41 2HG LYS 41 2.052 16.516 13.590 318 HG3 LYS 41 1HG LYS 41 2.117 17.833 12.421 319 HD2 LYS 41 2HD LYS 41 -0.266 18.374 12.986 320 HD3 LYS 41 1HD LYS 41 -0.194 17.156 14.261 321 HE2 LYS 41 2HE LYS 41 0.621 18.764 15.615 322 HE3 LYS 41 1HE LYS 41 2.097 18.717 14.649 323 HZ1 LYS 41 1HZ LYS 41 0.420 20.214 13.143 324 HZ2 LYS 41 2HZ LYS 41 1.621 20.827 14.178 325 HZ3 LYS 41 3HZ LYS 41 0.015 20.696 14.719 326 H LYS 42 H LYS 42 0.969 13.175 11.829 327 HA LYS 42 HA LYS 42 3.266 12.556 13.638 328 HB2 LYS 42 2HB LYS 42 0.415 11.546 13.689 329 HB3 LYS 42 1HB LYS 42 1.681 11.025 14.796 330 HG2 LYS 42 2HG LYS 42 0.878 13.926 14.475 331 HG3 LYS 42 1HG LYS 42 0.128 12.861 15.662 332 HD2 LYS 42 2HD LYS 42 1.843 13.232 17.068 333 HD3 LYS 42 1HD LYS 42 2.955 12.537 15.890 334 HE2 LYS 42 2HE LYS 42 3.715 14.774 16.338 335 HE3 LYS 42 1HE LYS 42 2.984 14.783 14.735 336 HZ1 LYS 42 1HZ LYS 42 0.862 15.435 15.973 337 HZ2 LYS 42 2HZ LYS 42 2.062 16.621 15.775 338 HZ3 LYS 42 3HZ LYS 42 1.887 15.827 17.267 339 H GLU 43 H GLU 43 4.196 10.445 13.451 340 HA GLU 43 HA GLU 43 3.851 9.234 10.794 341 HB2 GLU 43 2HB GLU 43 6.103 9.511 11.874 342 HB3 GLU 43 1HB GLU 43 5.611 8.339 13.097 343 HG2 GLU 43 2HG GLU 43 5.202 6.673 11.289 344 HG3 GLU 43 1HG GLU 43 5.810 7.841 10.114 345 H ARG 44 H ARG 44 2.429 7.581 10.436 346 HA ARG 44 HA ARG 44 0.905 6.453 12.613 347 HB2 ARG 44 2HB ARG 44 1.138 5.641 9.709 348 HB3 ARG 44 1HB ARG 44 -0.006 4.927 10.848 349 HG2 ARG 44 2HG ARG 44 -0.788 7.315 11.324 350 HG3 ARG 44 1HG ARG 44 0.123 7.787 9.887 351 HD2 ARG 44 2HD ARG 44 -2.007 5.647 9.952 352 HD3 ARG 44 1HD ARG 44 -2.267 7.295 9.383 353 HE ARG 44 HE ARG 44 -0.079 5.839 8.056 354 HH11 ARG 44 1HH1 ARG 44 -0.370 5.554 5.834 355 HH12 ARG 44 2HH1 ARG 44 -1.921 5.871 5.128 356 HH21 ARG 44 1HH2 ARG 44 -3.395 6.785 8.130 357 HH22 ARG 44 2HH2 ARG 44 -3.632 6.569 6.429 358 H ALA 45 H ALA 45 1.109 4.487 13.629 359 HA ALA 45 HA ALA 45 3.358 2.740 12.759 360 HB1 ALA 45 1HB ALA 45 3.244 4.346 15.117 361 HB2 ALA 45 2HB ALA 45 4.515 3.230 14.614 362 HB3 ALA 45 3HB ALA 45 3.168 2.650 15.594 363 H GLY 46 H GLY 46 0.312 3.024 14.587 364 HA2 GLY 46 2HA GLY 46 0.195 0.056 14.748 365 HA3 GLY 46 1HA GLY 46 -0.874 1.169 15.593 366 H LEU 47 H LEU 47 -1.560 -1.136 13.880 367 HA LEU 47 HA LEU 47 -3.518 0.262 12.176 368 HB2 LEU 47 2HB LEU 47 -1.486 -1.707 11.103 369 HB3 LEU 47 1HB LEU 47 -2.995 -1.345 10.271 370 HG LEU 47 HG LEU 47 -2.081 1.179 10.726 371 HD11 LEU 47 1HD1 LEU 47 0.235 1.345 10.651 372 HD12 LEU 47 2HD1 LEU 47 0.428 -0.260 9.947 373 HD13 LEU 47 3HD1 LEU 47 0.034 -0.089 11.658 374 HD21 LEU 47 1HD2 LEU 47 -2.707 0.747 8.541 375 HD22 LEU 47 2HD2 LEU 47 -1.799 -0.759 8.463 376 HD23 LEU 47 3HD2 LEU 47 -0.957 0.784 8.341 377 H ALA 48 H ALA 48 -5.443 -0.801 12.167 378 HA ALA 48 HA ALA 48 -5.554 -3.698 12.692 379 HB1 ALA 48 1HB ALA 48 -5.617 -3.005 14.969 380 HB2 ALA 48 2HB ALA 48 -7.308 -3.242 14.528 381 HB3 ALA 48 3HB ALA 48 -6.635 -1.613 14.597 382 H PHE 49 H PHE 49 -7.134 -4.480 11.343 383 HA PHE 49 HA PHE 49 -9.519 -2.808 10.847 384 HB2 PHE 49 2HB PHE 49 -9.271 -2.933 8.411 385 HB3 PHE 49 1HB PHE 49 -7.885 -2.118 9.136 386 HD1 PHE 49 1HD PHE 49 -9.009 -4.997 7.224 387 HD2 PHE 49 2HD PHE 49 -5.739 -3.353 9.471 388 HE1 PHE 49 1HE PHE 49 -7.465 -6.630 6.174 389 HE2 PHE 49 2HE PHE 49 -4.197 -4.985 8.426 390 HZ PHE 49 HZ PHE 49 -5.057 -6.618 6.773 391 H GLU 50 H GLU 50 -11.317 -3.987 10.110 392 HA GLU 50 HA GLU 50 -11.103 -6.913 10.524 393 HB2 GLU 50 2HB GLU 50 -13.754 -5.837 9.900 394 HB3 GLU 50 1HB GLU 50 -13.227 -6.763 11.305 395 HG2 GLU 50 2HG GLU 50 -12.123 -4.643 12.154 396 HG3 GLU 50 1HG GLU 50 -12.961 -3.783 10.861 397 HA PRO 51 HA PRO 51 -11.095 -6.956 5.966 398 HB2 PRO 51 2HB PRO 51 -10.369 -9.555 5.635 399 HB3 PRO 51 1HB PRO 51 -9.218 -8.275 6.059 400 HG2 PRO 51 2HG PRO 51 -10.454 -10.353 7.776 401 HG3 PRO 51 1HG PRO 51 -8.829 -9.652 7.836 402 HD2 PRO 51 2HD PRO 51 -10.917 -8.940 9.525 403 HD3 PRO 51 1HD PRO 51 -9.493 -7.930 9.198 404 H PHE 52 H PHE 52 -13.302 -6.777 5.478 405 HA PHE 52 HA PHE 52 -14.652 -9.233 4.676 406 HB2 PHE 52 2HB PHE 52 -16.019 -7.505 6.765 407 HB3 PHE 52 1HB PHE 52 -16.616 -9.014 6.073 408 HD1 PHE 52 1HD PHE 52 -15.590 -11.177 6.681 409 HD2 PHE 52 2HD PHE 52 -14.290 -7.485 8.437 410 HE1 PHE 52 1HE PHE 52 -14.388 -12.440 8.447 411 HE2 PHE 52 2HE PHE 52 -13.092 -8.739 10.201 412 HZ PHE 52 HZ PHE 52 -13.136 -11.220 10.207 413 H VAL 53 H VAL 53 -17.053 -8.428 3.922 414 HA VAL 53 HA VAL 53 -16.487 -6.208 2.097 415 HB VAL 53 HB VAL 53 -19.139 -7.606 2.565 416 HG11 VAL 53 1HG1 VAL 53 -19.643 -5.789 1.223 417 HG12 VAL 53 2HG1 VAL 53 -19.176 -6.957 -0.014 418 HG13 VAL 53 3HG1 VAL 53 -18.028 -5.724 0.515 419 HG21 VAL 53 1HG2 VAL 53 -18.437 -9.402 1.369 420 HG22 VAL 53 2HG2 VAL 53 -16.808 -8.851 1.751 421 HG23 VAL 53 3HG2 VAL 53 -17.554 -8.399 0.220 422 H GLY 54 H GLY 54 -16.897 -4.095 2.590 423 HA2 GLY 54 2HA GLY 54 -18.017 -2.241 3.555 424 HA3 GLY 54 1HA GLY 54 -19.170 -3.363 4.287 425 H GLY 55 H GLY 55 -15.831 -4.086 4.704 426 HA2 GLY 55 2HA GLY 55 -16.038 -3.866 7.591 427 HA3 GLY 55 1HA GLY 55 -14.582 -4.279 6.688 428 H ARG 56 H ARG 56 -14.019 -2.662 8.683 429 HA ARG 56 HA ARG 56 -13.742 0.032 7.412 430 HB2 ARG 56 2HB ARG 56 -14.328 -0.607 10.315 431 HB3 ARG 56 1HB ARG 56 -13.915 1.000 9.716 432 HG2 ARG 56 2HG ARG 56 -15.865 0.896 8.173 433 HG3 ARG 56 1HG ARG 56 -16.299 -0.669 8.860 434 HD2 ARG 56 2HD ARG 56 -16.453 0.424 11.110 435 HD3 ARG 56 1HD ARG 56 -16.178 1.981 10.328 436 HE ARG 56 HE ARG 56 -18.677 0.537 10.363 437 HH11 ARG 56 1HH1 ARG 56 -20.361 1.380 9.114 438 HH12 ARG 56 2HH1 ARG 56 -20.005 2.522 7.861 439 HH21 ARG 56 1HH2 ARG 56 -16.588 2.503 8.452 440 HH22 ARG 56 2HH2 ARG 56 -17.868 3.158 7.487 441 H TYR 57 H TYR 57 -11.714 1.046 7.762 442 HA TYR 57 HA TYR 57 -9.644 -0.747 8.963 443 HB2 TYR 57 2HB TYR 57 -9.667 -0.028 6.407 444 HB3 TYR 57 1HB TYR 57 -8.924 1.438 7.051 445 HD1 TYR 57 1HD TYR 57 -6.945 1.077 8.737 446 HD2 TYR 57 2HD TYR 57 -8.326 -1.890 5.955 447 HE1 TYR 57 1HE TYR 57 -4.775 -0.106 8.920 448 HE2 TYR 57 2HE TYR 57 -6.153 -3.075 6.137 449 HH TYR 57 HH TYR 57 -3.447 -1.680 7.900 450 H TYR 58 H TYR 58 -8.537 0.038 10.698 451 HA TYR 58 HA TYR 58 -8.741 2.976 11.263 452 HB2 TYR 58 2HB TYR 58 -8.499 0.788 13.337 453 HB3 TYR 58 1HB TYR 58 -8.891 2.487 13.602 454 HD1 TYR 58 1HD TYR 58 -10.120 -0.722 12.257 455 HD2 TYR 58 2HD TYR 58 -11.112 3.340 13.227 456 HE1 TYR 58 1HE TYR 58 -12.520 -1.251 11.991 457 HE2 TYR 58 2HE TYR 58 -13.517 2.815 12.962 458 HH TYR 58 HH TYR 58 -14.896 0.369 13.200 459 H GLU 59 H GLU 59 -6.862 4.003 11.902 460 HA GLU 59 HA GLU 59 -4.439 2.314 12.309 461 HB2 GLU 59 2HB GLU 59 -4.606 4.821 10.609 462 HB3 GLU 59 1HB GLU 59 -3.120 3.950 10.994 463 HG2 GLU 59 2HG GLU 59 -4.096 1.905 9.939 464 HG3 GLU 59 1HG GLU 59 -5.496 2.860 9.459 465 H TRP 60 H TRP 60 -3.038 3.128 13.932 466 HA TRP 60 HA TRP 60 -4.197 5.400 15.481 467 HB2 TRP 60 2HB TRP 60 -2.299 3.178 16.256 468 HB3 TRP 60 1HB TRP 60 -2.648 4.555 17.300 469 HD1 TRP 60 HD TRP 60 -5.297 4.904 17.952 470 HE1 TRP 60 1HE TRP 60 -7.095 3.118 18.429 471 HE3 TRP 60 3HE TRP 60 -3.117 0.843 15.749 472 HZ2 TRP 60 2HZ TRP 60 -7.546 0.337 17.946 473 HZ3 TRP 60 3HZ TRP 60 -4.250 -1.360 15.777 474 HH2 TRP 60 HH TRP 60 -6.460 -1.619 16.872 475 H ASP 61 H ASP 61 -3.111 7.265 15.724 476 HA ASP 61 HA ASP 61 -0.479 7.541 14.374 477 HB2 ASP 61 2HB ASP 61 -2.402 9.593 15.504 478 HB3 ASP 61 1HB ASP 61 -0.896 9.980 14.677 479 H ILE 62 H ILE 62 1.240 8.784 15.551 480 HA ILE 62 HA ILE 62 1.863 7.702 18.069 481 HB ILE 62 HB ILE 62 2.726 10.367 16.938 482 HG12 ILE 62 2HG1 ILE 62 4.122 7.693 16.893 483 HG13 ILE 62 1HG1 ILE 62 3.189 8.332 15.550 484 HG21 ILE 62 1HG2 ILE 62 3.227 9.093 19.470 485 HG22 ILE 62 2HG2 ILE 62 3.805 10.654 18.887 486 HG23 ILE 62 3HG2 ILE 62 4.720 9.188 18.539 487 HD11 ILE 62 1HD1 ILE 62 4.664 10.219 15.314 488 HD12 ILE 62 2HD1 ILE 62 5.675 8.776 15.401 489 HD13 ILE 62 3HD1 ILE 62 5.499 9.816 16.814 490 H ASP 63 H ASP 63 0.232 10.761 17.308 491 HA ASP 63 HA ASP 63 -0.659 10.868 20.164 492 HB2 ASP 63 2HB ASP 63 1.045 12.625 19.619 493 HB3 ASP 63 1HB ASP 63 -0.055 13.250 18.388 494 H GLY 64 H GLY 64 -1.455 11.109 16.795 495 HA2 GLY 64 2HA GLY 64 -4.077 12.308 17.202 496 HA3 GLY 64 1HA GLY 64 -3.501 11.567 15.706 497 H THR 65 H THR 65 -6.085 11.215 17.095 498 HA THR 65 HA THR 65 -6.173 8.635 18.355 499 HB THR 65 HB THR 65 -7.932 10.465 18.504 500 HG1 THR 65 1HG THR 65 -8.411 7.759 17.978 501 HG21 THR 65 1HG2 THR 65 -7.854 10.362 15.795 502 HG22 THR 65 2HG2 THR 65 -9.223 10.994 16.709 503 HG23 THR 65 3HG2 THR 65 -9.248 9.333 16.115 504 H GLU 66 H GLU 66 -8.464 7.697 16.695 505 HA GLU 66 HA GLU 66 -6.859 6.188 14.744 506 HB2 GLU 66 2HB GLU 66 -9.732 5.934 15.662 507 HB3 GLU 66 1HB GLU 66 -8.969 4.866 14.490 508 HG2 GLU 66 2HG GLU 66 -7.260 4.253 16.163 509 HG3 GLU 66 1HG GLU 66 -8.051 5.296 17.345 510 H ILE 67 H ILE 67 -7.008 6.453 12.553 511 HA ILE 67 HA ILE 67 -9.115 8.313 11.518 512 HB ILE 67 HB ILE 67 -6.281 8.000 10.478 513 HG12 ILE 67 2HG1 ILE 67 -7.597 10.269 12.008 514 HG13 ILE 67 1HG1 ILE 67 -6.332 9.203 12.624 515 HG21 ILE 67 1HG2 ILE 67 -7.696 10.357 9.611 516 HG22 ILE 67 2HG2 ILE 67 -8.655 8.926 9.237 517 HG23 ILE 67 3HG2 ILE 67 -7.004 9.064 8.632 518 HD11 ILE 67 1HD1 ILE 67 -5.095 10.018 10.393 519 HD12 ILE 67 2HD1 ILE 67 -5.003 10.943 11.892 520 HD13 ILE 67 3HD1 ILE 67 -6.142 11.417 10.631 521 H VAL 68 H VAL 68 -10.165 7.622 9.631 522 HA VAL 68 HA VAL 68 -9.988 4.796 9.004 523 HB VAL 68 HB VAL 68 -11.367 7.003 7.441 524 HG11 VAL 68 1HG1 VAL 68 -12.712 5.230 6.515 525 HG12 VAL 68 2HG1 VAL 68 -11.997 4.044 7.608 526 HG13 VAL 68 3HG1 VAL 68 -11.024 4.757 6.322 527 HG21 VAL 68 1HG2 VAL 68 -12.945 7.087 9.053 528 HG22 VAL 68 2HG2 VAL 68 -11.855 6.152 10.076 529 HG23 VAL 68 3HG2 VAL 68 -13.068 5.329 9.096 530 H TRP 69 H TRP 69 -8.638 3.855 7.531 531 HA TRP 69 HA TRP 69 -7.018 5.670 5.811 532 HB2 TRP 69 2HB TRP 69 -5.537 4.328 7.003 533 HB3 TRP 69 1HB TRP 69 -6.595 2.920 6.936 534 HD1 TRP 69 HD TRP 69 -3.906 4.746 5.013 535 HE1 TRP 69 1HE TRP 69 -3.252 3.365 2.936 536 HE3 TRP 69 3HE TRP 69 -7.567 1.189 5.130 537 HZ2 TRP 69 2HZ TRP 69 -4.161 1.056 1.514 538 HZ3 TRP 69 3HZ TRP 69 -7.650 -0.588 3.404 539 HH2 TRP 69 HH TRP 69 -5.953 -0.660 1.598 540 H GLY 70 H GLY 70 -9.689 3.624 5.592 541 HA2 GLY 70 2HA GLY 70 -10.199 3.935 2.906 542 HA3 GLY 70 1HA GLY 70 -9.121 2.542 2.943 543 H ARG 71 H ARG 71 -10.584 0.910 2.448 544 HA ARG 71 HA ARG 71 -12.374 0.073 4.589 545 HB2 ARG 71 2HB ARG 71 -13.548 1.814 2.871 546 HB3 ARG 71 1HB ARG 71 -13.826 0.305 2.005 547 HG2 ARG 71 2HG ARG 71 -14.899 -0.677 3.954 548 HG3 ARG 71 1HG ARG 71 -14.531 0.756 4.916 549 HD2 ARG 71 2HD ARG 71 -16.824 0.943 4.190 550 HD3 ARG 71 1HD ARG 71 -15.879 2.104 3.259 551 HE ARG 71 HE ARG 71 -15.860 -0.102 1.631 552 HH11 ARG 71 1HH1 ARG 71 -17.479 -0.585 0.130 553 HH12 ARG 71 2HH1 ARG 71 -19.086 0.005 0.391 554 HH21 ARG 71 1HH2 ARG 71 -18.302 1.608 3.363 555 HH22 ARG 71 2HH2 ARG 71 -19.553 1.246 2.221 556 H ILE 72 H ILE 72 -13.893 -1.739 2.972 557 HA ILE 72 HA ILE 72 -11.804 -3.331 1.569 558 HB ILE 72 HB ILE 72 -13.675 -4.341 3.728 559 HG12 ILE 72 2HG1 ILE 72 -10.865 -5.072 3.885 560 HG13 ILE 72 1HG1 ILE 72 -11.067 -3.325 3.847 561 HG21 ILE 72 1HG2 ILE 72 -11.932 -5.796 1.730 562 HG22 ILE 72 2HG2 ILE 72 -13.659 -6.012 2.011 563 HG23 ILE 72 3HG2 ILE 72 -12.494 -6.547 3.222 564 HD11 ILE 72 1HD1 ILE 72 -11.155 -4.431 6.159 565 HD12 ILE 72 2HD1 ILE 72 -12.715 -5.084 5.657 566 HD13 ILE 72 3HD1 ILE 72 -12.483 -3.339 5.758 567 H LEU 73 H LEU 73 -12.834 -5.064 0.194 568 HA LEU 73 HA LEU 73 -15.588 -4.262 -0.666 569 HB2 LEU 73 2HB LEU 73 -13.726 -3.637 -2.278 570 HB3 LEU 73 1HB LEU 73 -13.417 -5.362 -2.471 571 HG LEU 73 HG LEU 73 -16.022 -5.452 -2.934 572 HD11 LEU 73 1HD1 LEU 73 -16.798 -3.421 -4.100 573 HD12 LEU 73 2HD1 LEU 73 -15.278 -2.615 -3.713 574 HD13 LEU 73 3HD1 LEU 73 -16.394 -3.063 -2.423 575 HD21 LEU 73 1HD2 LEU 73 -14.544 -6.180 -4.632 576 HD22 LEU 73 2HD2 LEU 73 -13.814 -4.584 -4.799 577 HD23 LEU 73 3HD2 LEU 73 -15.449 -4.872 -5.395 578 H GLU 74 H GLU 74 -13.219 -6.923 -0.761 579 HA GLU 74 HA GLU 74 -15.031 -8.848 0.329 580 HB2 GLU 74 2HB GLU 74 -16.094 -8.541 -1.924 581 HB3 GLU 74 1HB GLU 74 -14.588 -9.097 -2.651 582 HG2 GLU 74 2HG GLU 74 -14.784 -11.220 -1.365 583 HG3 GLU 74 1HG GLU 74 -16.341 -10.669 -0.744 584 H TRP 75 H TRP 75 -13.884 -10.715 0.879 585 HA TRP 75 HA TRP 75 -11.016 -10.719 0.079 586 HB2 TRP 75 2HB TRP 75 -10.960 -10.745 2.385 587 HB3 TRP 75 1HB TRP 75 -12.512 -11.569 2.516 588 HD1 TRP 75 HD TRP 75 -8.795 -12.205 2.149 589 HE1 TRP 75 1HE TRP 75 -8.339 -14.729 2.413 590 HE3 TRP 75 3HE TRP 75 -13.585 -13.968 2.146 591 HZ2 TRP 75 2HZ TRP 75 -9.816 -17.175 2.599 592 HZ3 TRP 75 3HZ TRP 75 -14.034 -16.394 2.366 593 HH2 TRP 75 HH TRP 75 -12.157 -18.000 2.593 594 H ASP 76 H ASP 76 -10.416 -12.231 -1.386 595 HA ASP 76 HA ASP 76 -12.113 -14.671 -1.652 596 HB2 ASP 76 2HB ASP 76 -11.364 -12.778 -3.584 597 HB3 ASP 76 1HB ASP 76 -10.375 -14.202 -3.914 598 HA PRO 77 HA PRO 77 -8.660 -16.917 0.223 599 HB2 PRO 77 2HB PRO 77 -9.569 -18.830 -1.922 600 HB3 PRO 77 1HB PRO 77 -9.095 -19.179 -0.247 601 HG2 PRO 77 2HG PRO 77 -11.653 -19.017 -0.952 602 HG3 PRO 77 1HG PRO 77 -11.083 -18.437 0.621 603 HD2 PRO 77 2HD PRO 77 -12.062 -16.887 -1.686 604 HD3 PRO 77 1HD PRO 77 -11.903 -16.386 0.014 605 HA PRO 78 HA PRO 78 -4.892 -16.214 -1.950 606 HB2 PRO 78 2HB PRO 78 -4.828 -19.195 -2.314 607 HB3 PRO 78 1HB PRO 78 -3.524 -18.098 -1.817 608 HG2 PRO 78 2HG PRO 78 -5.036 -19.586 -0.081 609 HG3 PRO 78 1HG PRO 78 -4.180 -18.099 0.350 610 HD2 PRO 78 2HD PRO 78 -7.027 -18.524 0.288 611 HD3 PRO 78 1HD PRO 78 -6.164 -17.025 0.687 612 H HIS 79 H HIS 79 -5.985 -15.224 -3.756 613 HA HIS 79 HA HIS 79 -5.448 -16.232 -6.288 614 HB2 HIS 79 2HB HIS 79 -7.867 -17.411 -5.091 615 HB3 HIS 79 1HB HIS 79 -8.126 -16.713 -6.689 616 HD1 HIS 79 1HD HIS 79 -7.190 -19.799 -5.214 617 HD2 HIS 79 2HD HIS 79 -5.781 -17.649 -8.500 618 HE1 HIS 79 1HE HIS 79 -5.924 -21.450 -6.663 619 HE2 HIS 79 2HE HIS 79 -5.063 -20.151 -8.665 620 H ARG 80 H ARG 80 -8.075 -14.562 -4.464 621 HA ARG 80 HA ARG 80 -7.642 -12.268 -6.294 622 HB2 ARG 80 2HB ARG 80 -9.736 -13.944 -6.764 623 HB3 ARG 80 1HB ARG 80 -10.481 -12.772 -5.680 624 HG2 ARG 80 2HG ARG 80 -8.907 -12.052 -8.167 625 HG3 ARG 80 1HG ARG 80 -10.668 -12.105 -8.076 626 HD2 ARG 80 2HD ARG 80 -8.784 -10.262 -6.606 627 HD3 ARG 80 1HD ARG 80 -10.072 -9.824 -7.723 628 HE ARG 80 HE ARG 80 -10.401 -10.341 -4.898 629 HH11 ARG 80 1HH1 ARG 80 -12.518 -10.336 -4.108 630 HH12 ARG 80 2HH1 ARG 80 -13.842 -10.483 -5.217 631 HH21 ARG 80 1HH2 ARG 80 -11.815 -10.682 -8.023 632 HH22 ARG 80 2HH2 ARG 80 -13.443 -10.679 -7.432 633 H LEU 81 H LEU 81 -7.632 -10.370 -5.238 634 HA LEU 81 HA LEU 81 -8.887 -10.248 -2.525 635 HB2 LEU 81 2HB LEU 81 -6.394 -10.421 -2.385 636 HB3 LEU 81 1HB LEU 81 -6.271 -8.953 -3.351 637 HG LEU 81 HG LEU 81 -7.701 -7.803 -1.591 638 HD11 LEU 81 1HD1 LEU 81 -8.736 -9.511 -0.371 639 HD12 LEU 81 2HD1 LEU 81 -7.419 -9.039 0.701 640 HD13 LEU 81 3HD1 LEU 81 -7.268 -10.484 -0.297 641 HD21 LEU 81 1HD2 LEU 81 -4.909 -8.565 -1.531 642 HD22 LEU 81 2HD2 LEU 81 -5.524 -8.366 0.109 643 HD23 LEU 81 3HD2 LEU 81 -5.653 -7.041 -1.046 644 H ALA 82 H ALA 82 -10.359 -8.607 -2.413 645 HA ALA 82 HA ALA 82 -9.990 -6.271 -4.252 646 HB1 ALA 82 1HB ALA 82 -12.713 -7.293 -3.462 647 HB2 ALA 82 2HB ALA 82 -11.865 -7.981 -4.847 648 HB3 ALA 82 3HB ALA 82 -12.272 -6.266 -4.826 649 H MET 83 H MET 83 -10.245 -4.278 -3.251 650 HA MET 83 HA MET 83 -11.482 -4.241 -0.550 651 HB2 MET 83 2HB MET 83 -8.756 -3.076 -1.167 652 HB3 MET 83 1HB MET 83 -9.592 -3.002 0.385 653 HG2 MET 83 2HG MET 83 -9.609 -5.519 0.411 654 HG3 MET 83 1HG MET 83 -8.591 -5.485 -1.029 655 HE1 MET 83 1HE MET 83 -5.370 -3.915 -0.073 656 HE2 MET 83 2HE MET 83 -6.672 -2.738 -0.222 657 HE3 MET 83 3HE MET 83 -6.636 -4.140 -1.288 658 H THR 84 H THR 84 -12.576 -2.334 -0.112 659 HA THR 84 HA THR 84 -12.527 -0.275 -2.273 660 HB THR 84 HB THR 84 -14.476 -0.624 0.031 661 HG1 THR 84 1HG THR 84 -15.574 -1.028 -2.326 662 HG21 THR 84 1HG2 THR 84 -15.201 1.422 -0.543 663 HG22 THR 84 2HG2 THR 84 -15.571 0.811 -2.155 664 HG23 THR 84 3HG2 THR 84 -13.990 1.516 -1.822 665 H TRP 85 H TRP 85 -11.732 1.808 -1.765 666 HA TRP 85 HA TRP 85 -10.681 2.062 1.016 667 HB2 TRP 85 2HB TRP 85 -8.913 3.343 0.194 668 HB3 TRP 85 1HB TRP 85 -9.152 2.152 -1.080 669 HD1 TRP 85 HD TRP 85 -11.435 3.271 -2.751 670 HE1 TRP 85 1HE TRP 85 -11.229 5.510 -4.017 671 HE3 TRP 85 3HE TRP 85 -7.654 5.432 -0.097 672 HZ2 TRP 85 2HZ TRP 85 -9.653 7.902 -3.916 673 HZ3 TRP 85 3HZ TRP 85 -6.815 7.681 -0.703 674 HH2 TRP 85 HH TRP 85 -7.804 8.916 -2.606 675 H ARG 86 H ARG 86 -11.782 3.366 2.332 676 HA ARG 86 HA ARG 86 -13.299 5.653 1.130 677 HB2 ARG 86 2HB ARG 86 -14.719 3.946 2.240 678 HB3 ARG 86 1HB ARG 86 -13.801 4.168 3.730 679 HG2 ARG 86 2HG ARG 86 -14.462 6.553 3.768 680 HG3 ARG 86 1HG ARG 86 -15.416 6.303 2.305 681 HD2 ARG 86 2HD ARG 86 -16.917 6.152 4.192 682 HD3 ARG 86 1HD ARG 86 -16.702 4.524 3.548 683 HE ARG 86 HE ARG 86 -14.760 4.689 5.498 684 HH11 ARG 86 1HH1 ARG 86 -15.127 4.151 7.661 685 HH12 ARG 86 2HH1 ARG 86 -16.732 4.252 8.305 686 HH21 ARG 86 1HH2 ARG 86 -18.143 5.328 5.327 687 HH22 ARG 86 2HH2 ARG 86 -18.439 4.919 6.984 688 H ILE 87 H ILE 87 -11.969 7.418 1.387 689 HA ILE 87 HA ILE 87 -11.145 8.088 4.150 690 HB ILE 87 HB ILE 87 -9.229 6.890 3.012 691 HG12 ILE 87 2HG1 ILE 87 -8.585 9.799 3.529 692 HG13 ILE 87 1HG1 ILE 87 -9.063 8.715 4.836 693 HG21 ILE 87 1HG2 ILE 87 -8.920 9.406 1.385 694 HG22 ILE 87 2HG2 ILE 87 -9.860 8.049 0.765 695 HG23 ILE 87 3HG2 ILE 87 -8.151 7.837 1.147 696 HD11 ILE 87 1HD1 ILE 87 -7.005 7.810 4.912 697 HD12 ILE 87 2HD1 ILE 87 -6.479 9.024 3.746 698 HD13 ILE 87 3HD1 ILE 87 -7.048 7.452 3.186 699 H ASP 88 H ASP 88 -10.805 10.384 4.433 700 HA ASP 88 HA ASP 88 -12.283 11.990 2.451 701 HB2 ASP 88 2HB ASP 88 -12.646 12.235 4.929 702 HB3 ASP 88 1HB ASP 88 -11.011 12.886 5.053 703 H GLY 89 H GLY 89 -11.392 13.764 1.328 704 HA2 GLY 89 2HA GLY 89 -8.693 13.507 0.446 705 HA3 GLY 89 1HA GLY 89 -9.718 14.907 0.151 706 H HIS 90 H HIS 90 -10.091 15.234 3.140 707 HA HIS 90 HA HIS 90 -7.684 16.873 3.539 708 HB2 HIS 90 2HB HIS 90 -10.202 16.519 5.169 709 HB3 HIS 90 1HB HIS 90 -8.914 17.644 5.572 710 HD1 HIS 90 1HD HIS 90 -8.243 18.806 2.834 711 HD2 HIS 90 2HD HIS 90 -12.152 18.197 4.148 712 HE1 HIS 90 1HE HIS 90 -9.707 20.368 1.477 713 HE2 HIS 90 2HE HIS 90 -12.090 20.004 2.268 714 H TRP 91 H TRP 91 -7.896 13.767 3.786 715 HA TRP 91 HA TRP 91 -6.901 12.124 5.129 716 HB2 TRP 91 2HB TRP 91 -5.342 14.587 5.538 717 HB3 TRP 91 1HB TRP 91 -5.208 13.432 6.864 718 HD1 TRP 91 HD TRP 91 -3.535 14.221 3.801 719 HE1 TRP 91 1HE TRP 91 -2.302 12.185 2.808 720 HE3 TRP 91 3HE TRP 91 -5.730 10.471 6.478 721 HZ2 TRP 91 2HZ TRP 91 -2.259 9.337 3.112 722 HZ3 TRP 91 3HZ TRP 91 -5.076 8.111 6.105 723 HH2 TRP 91 HH TRP 91 -3.345 7.540 4.428 724 H GLN 92 H GLN 92 -9.329 13.707 6.074 725 HA GLN 92 HA GLN 92 -9.020 13.522 9.009 726 HB2 GLN 92 2HB GLN 92 -11.363 14.394 7.297 727 HB3 GLN 92 1HB GLN 92 -11.320 14.450 9.060 728 HG2 GLN 92 2HG GLN 92 -9.399 15.901 7.217 729 HG3 GLN 92 1HG GLN 92 -10.743 16.640 8.079 730 HE21 GLN 92 1HE2 GLN 92 -7.525 16.557 8.301 731 HE22 GLN 92 2HE2 GLN 92 -7.312 16.506 9.985 732 H SER 93 H SER 93 -12.170 12.820 7.937 733 HA SER 93 HA SER 93 -11.766 9.905 7.861 734 HB2 SER 93 2HB SER 93 -12.974 9.386 9.827 735 HB3 SER 93 1HB SER 93 -11.915 10.702 10.317 736 HG SER 93 HG SER 93 -14.015 11.133 10.998 737 H VAL 94 H VAL 94 -13.773 8.784 7.239 738 HA VAL 94 HA VAL 94 -15.868 10.614 6.140 739 HB VAL 94 HB VAL 94 -15.705 8.331 4.470 740 HG11 VAL 94 1HG1 VAL 94 -14.726 11.158 3.973 741 HG12 VAL 94 2HG1 VAL 94 -16.418 10.665 3.904 742 HG13 VAL 94 3HG1 VAL 94 -15.258 9.997 2.755 743 HG21 VAL 94 1HG2 VAL 94 -13.023 9.667 4.959 744 HG22 VAL 94 2HG2 VAL 94 -13.376 8.557 3.635 745 HG23 VAL 94 3HG2 VAL 94 -13.420 7.982 5.302 746 HA PRO 95 HA PRO 95 -17.890 7.608 9.016 747 HB2 PRO 95 2HB PRO 95 -20.134 9.459 8.347 748 HB3 PRO 95 1HB PRO 95 -19.612 8.839 9.925 749 HG2 PRO 95 2HG PRO 95 -19.093 11.340 9.164 750 HG3 PRO 95 1HG PRO 95 -17.953 10.404 10.146 751 HD2 PRO 95 2HD PRO 95 -17.788 11.137 7.260 752 HD3 PRO 95 1HD PRO 95 -16.481 10.855 8.432 753 H ASP 96 H ASP 96 -18.633 8.554 5.739 754 HA ASP 96 HA ASP 96 -19.896 5.923 5.311 755 HB2 ASP 96 2HB ASP 96 -21.888 6.860 4.237 756 HB3 ASP 96 1HB ASP 96 -21.785 7.430 5.902 757 H ASP 97 H ASP 97 -20.111 5.459 2.958 758 HA ASP 97 HA ASP 97 -17.946 6.836 1.467 759 HB2 ASP 97 2HB ASP 97 -18.184 4.901 -0.113 760 HB3 ASP 97 1HB ASP 97 -17.781 4.414 1.534 761 H ASP 98 H ASP 98 -18.811 8.659 0.524 762 HA ASP 98 HA ASP 98 -21.459 8.522 -0.766 763 HB2 ASP 98 2HB ASP 98 -20.622 10.526 0.580 764 HB3 ASP 98 1HB ASP 98 -19.545 10.850 -0.773 765 H ARG 99 H ARG 99 -18.136 9.383 -1.698 766 HA ARG 99 HA ARG 99 -18.775 8.457 -4.466 767 HB2 ARG 99 2HB ARG 99 -17.004 10.760 -3.594 768 HB3 ARG 99 1HB ARG 99 -17.149 10.179 -5.255 769 HG2 ARG 99 2HG ARG 99 -19.602 10.630 -5.155 770 HG3 ARG 99 1HG ARG 99 -19.381 11.311 -3.543 771 HD2 ARG 99 2HD ARG 99 -17.717 12.924 -4.547 772 HD3 ARG 99 1HD ARG 99 -18.197 12.332 -6.137 773 HE ARG 99 HE ARG 99 -19.754 14.115 -4.438 774 HH11 ARG 99 1HH1 ARG 99 -21.741 14.778 -5.286 775 HH12 ARG 99 2HH1 ARG 99 -22.417 13.930 -6.637 776 HH21 ARG 99 1HH2 ARG 99 -19.791 11.678 -6.877 777 HH22 ARG 99 2HH2 ARG 99 -21.313 12.174 -7.537 778 H ALA 100 H ALA 100 -17.575 7.003 -2.143 779 HA ALA 100 HA ALA 100 -14.735 6.800 -2.513 780 HB1 ALA 100 1HB ALA 100 -16.473 4.518 -1.583 781 HB2 ALA 100 2HB ALA 100 -16.189 5.926 -0.558 782 HB3 ALA 100 3HB ALA 100 -14.832 4.926 -1.080 783 H SER 101 H SER 101 -13.534 5.200 -3.659 784 HA SER 101 HA SER 101 -15.030 3.977 -5.941 785 HB2 SER 101 2HB SER 101 -13.285 5.675 -6.515 786 HB3 SER 101 1HB SER 101 -12.078 4.644 -5.752 787 HG SER 101 HG SER 101 -13.361 3.061 -7.338 788 H GLU 102 H GLU 102 -14.053 1.874 -6.731 789 HA GLU 102 HA GLU 102 -13.214 0.234 -4.378 790 HB2 GLU 102 2HB GLU 102 -14.555 -0.614 -6.962 791 HB3 GLU 102 1HB GLU 102 -14.136 -1.687 -5.626 792 HG2 GLU 102 2HG GLU 102 -15.600 -0.354 -4.124 793 HG3 GLU 102 1HG GLU 102 -16.060 0.654 -5.495 794 H ILE 103 H ILE 103 -11.517 -1.254 -4.616 795 HA ILE 103 HA ILE 103 -9.755 -0.782 -6.991 796 HB ILE 103 HB ILE 103 -8.953 -1.595 -4.182 797 HG12 ILE 103 2HG1 ILE 103 -8.558 1.077 -5.560 798 HG13 ILE 103 1HG1 ILE 103 -9.849 0.760 -4.400 799 HG21 ILE 103 1HG2 ILE 103 -6.695 -0.735 -5.244 800 HG22 ILE 103 2HG2 ILE 103 -7.505 -1.123 -6.762 801 HG23 ILE 103 3HG2 ILE 103 -7.251 -2.380 -5.551 802 HD11 ILE 103 1HD1 ILE 103 -6.866 0.741 -3.924 803 HD12 ILE 103 2HD1 ILE 103 -7.989 -0.041 -2.809 804 HD13 ILE 103 3HD1 ILE 103 -8.099 1.697 -3.098 805 H GLU 104 H GLU 104 -9.053 -2.617 -8.100 806 HA GLU 104 HA GLU 104 -9.974 -5.242 -6.986 807 HB2 GLU 104 2HB GLU 104 -11.006 -4.545 -9.163 808 HB3 GLU 104 1HB GLU 104 -9.392 -4.554 -9.880 809 HG2 GLU 104 2HG GLU 104 -9.146 -6.947 -9.214 810 HG3 GLU 104 1HG GLU 104 -10.805 -6.922 -8.614 811 H VAL 105 H VAL 105 -8.355 -6.521 -6.289 812 HA VAL 105 HA VAL 105 -5.698 -6.310 -7.633 813 HB VAL 105 HB VAL 105 -6.139 -6.787 -4.672 814 HG11 VAL 105 1HG1 VAL 105 -3.630 -6.088 -4.749 815 HG12 VAL 105 2HG1 VAL 105 -3.737 -6.486 -6.464 816 HG13 VAL 105 3HG1 VAL 105 -4.062 -7.723 -5.250 817 HG21 VAL 105 1HG2 VAL 105 -4.843 -4.372 -4.913 818 HG22 VAL 105 2HG2 VAL 105 -6.572 -4.556 -4.617 819 HG23 VAL 105 3HG2 VAL 105 -5.979 -4.311 -6.260 820 H ASP 106 H ASP 106 -4.992 -8.286 -8.353 821 HA ASP 106 HA ASP 106 -6.337 -10.704 -7.210 822 HB2 ASP 106 2HB ASP 106 -6.946 -10.277 -9.566 823 HB3 ASP 106 1HB ASP 106 -5.238 -10.288 -10.004 824 H PHE 107 H PHE 107 -5.008 -12.213 -6.309 825 HA PHE 107 HA PHE 107 -2.073 -11.899 -6.779 826 HB2 PHE 107 2HB PHE 107 -3.674 -12.369 -4.341 827 HB3 PHE 107 1HB PHE 107 -2.213 -13.346 -4.490 828 HD1 PHE 107 1HD PHE 107 -0.004 -12.298 -4.708 829 HD2 PHE 107 2HD PHE 107 -3.555 -9.971 -4.072 830 HE1 PHE 107 1HE PHE 107 1.389 -10.342 -4.075 831 HE2 PHE 107 2HE PHE 107 -2.169 -8.016 -3.444 832 HZ PHE 107 HZ PHE 107 0.312 -8.206 -3.446 833 H VAL 108 H VAL 108 -1.132 -13.541 -7.814 834 HA VAL 108 HA VAL 108 -2.280 -16.266 -7.529 835 HB VAL 108 HB VAL 108 -2.058 -14.618 -9.939 836 HG11 VAL 108 1HG1 VAL 108 -0.061 -15.879 -10.420 837 HG12 VAL 108 2HG1 VAL 108 -1.365 -16.565 -11.386 838 HG13 VAL 108 3HG1 VAL 108 -0.829 -17.388 -9.926 839 HG21 VAL 108 1HG2 VAL 108 -3.792 -16.064 -10.691 840 HG22 VAL 108 2HG2 VAL 108 -4.058 -15.864 -8.959 841 HG23 VAL 108 3HG2 VAL 108 -3.312 -17.340 -9.573 842 HA PRO 109 HA PRO 109 1.978 -17.178 -6.578 843 HB2 PRO 109 2HB PRO 109 2.039 -19.839 -7.376 844 HB3 PRO 109 1HB PRO 109 1.457 -19.262 -5.804 845 HG2 PRO 109 2HG PRO 109 -0.072 -20.073 -8.206 846 HG3 PRO 109 1HG PRO 109 -0.465 -20.271 -6.491 847 HD2 PRO 109 2HD PRO 109 -1.636 -18.371 -8.056 848 HD3 PRO 109 1HD PRO 109 -1.372 -18.149 -6.312 849 H ASN 110 H ASN 110 3.819 -16.794 -7.743 850 HA ASN 110 HA ASN 110 3.782 -17.433 -10.658 851 HB2 ASN 110 2HB ASN 110 3.827 -15.002 -10.136 852 HB3 ASN 110 1HB ASN 110 5.326 -15.255 -9.245 853 HD21 ASN 110 1HD2 ASN 110 3.935 -15.833 -12.522 854 HD22 ASN 110 2HD2 ASN 110 5.400 -15.593 -13.345 855 H GLY 111 H GLY 111 5.109 -19.121 -11.109 856 HA2 GLY 111 2HA GLY 111 6.961 -20.560 -11.011 857 HA3 GLY 111 1HA GLY 111 7.869 -19.167 -10.418 858 H SER 112 H SER 112 8.822 -19.645 -8.509 859 HA SER 112 HA SER 112 7.223 -21.173 -6.491 860 HB2 SER 112 2HB SER 112 9.279 -22.254 -5.744 861 HB3 SER 112 1HB SER 112 9.067 -22.547 -7.468 862 HG SER 112 HG SER 112 10.506 -20.807 -7.847 863 H GLY 113 H GLY 113 7.563 -20.518 -4.297 864 HA2 GLY 113 2HA GLY 113 7.710 -18.775 -2.711 865 HA3 GLY 113 1HA GLY 113 9.399 -18.766 -3.221 866 H GLY 114 H GLY 114 6.975 -17.997 -5.589 867 HA2 GLY 114 2HA GLY 114 7.452 -15.090 -5.193 868 HA3 GLY 114 1HA GLY 114 7.809 -15.801 -6.765 869 H THR 115 H THR 115 5.695 -13.799 -5.830 870 HA THR 115 HA THR 115 3.396 -15.199 -7.117 871 HB THR 115 HB THR 115 3.168 -15.020 -4.584 872 HG1 THR 115 1HG THR 115 1.034 -13.797 -4.962 873 HG21 THR 115 1HG2 THR 115 4.172 -12.540 -4.888 874 HG22 THR 115 2HG2 THR 115 3.130 -12.985 -3.536 875 HG23 THR 115 3HG2 THR 115 2.451 -12.159 -4.938 876 H ARG 116 H ARG 116 2.204 -13.913 -8.516 877 HA ARG 116 HA ARG 116 3.245 -11.149 -8.944 878 HB2 ARG 116 2HB ARG 116 2.639 -11.434 -11.280 879 HB3 ARG 116 1HB ARG 116 3.663 -12.782 -10.800 880 HG2 ARG 116 2HG ARG 116 1.536 -14.085 -10.331 881 HG3 ARG 116 1HG ARG 116 0.651 -12.772 -11.109 882 HD2 ARG 116 2HD ARG 116 2.059 -13.090 -13.150 883 HD3 ARG 116 1HD ARG 116 2.813 -14.481 -12.373 884 HE ARG 116 HE ARG 116 0.878 -15.724 -12.883 885 HH11 ARG 116 1HH1 ARG 116 -1.233 -15.954 -13.653 886 HH12 ARG 116 2HH1 ARG 116 -2.194 -14.541 -13.944 887 HH21 ARG 116 1HH2 ARG 116 0.287 -12.328 -12.960 888 HH22 ARG 116 2HH2 ARG 116 -1.333 -12.488 -13.551 889 H VAL 117 H VAL 117 1.750 -9.522 -8.792 890 HA VAL 117 HA VAL 117 -1.118 -10.330 -8.669 891 HB VAL 117 HB VAL 117 -0.710 -9.832 -6.437 892 HG11 VAL 117 1HG1 VAL 117 1.336 -8.005 -7.596 893 HG12 VAL 117 2HG1 VAL 117 1.458 -9.105 -6.222 894 HG13 VAL 117 3HG1 VAL 117 0.646 -7.550 -6.038 895 HG21 VAL 117 1HG2 VAL 117 -1.903 -7.840 -6.000 896 HG22 VAL 117 2HG2 VAL 117 -2.450 -8.299 -7.613 897 HG23 VAL 117 3HG2 VAL 117 -1.242 -7.029 -7.420 898 H GLU 118 H GLU 118 -2.594 -9.047 -9.680 899 HA GLU 118 HA GLU 118 -1.502 -6.805 -11.319 900 HB2 GLU 118 2HB GLU 118 -2.566 -8.633 -12.593 901 HB3 GLU 118 1HB GLU 118 -4.038 -8.449 -11.641 902 HG2 GLU 118 2HG GLU 118 -4.248 -6.107 -12.472 903 HG3 GLU 118 1HG GLU 118 -2.832 -6.364 -13.486 904 H LEU 119 H LEU 119 -2.026 -4.794 -10.612 905 HA LEU 119 HA LEU 119 -4.479 -4.497 -8.936 906 HB2 LEU 119 2HB LEU 119 -2.224 -4.071 -7.824 907 HB3 LEU 119 1HB LEU 119 -2.052 -2.688 -8.901 908 HG LEU 119 HG LEU 119 -4.616 -2.874 -7.396 909 HD11 LEU 119 1HD1 LEU 119 -2.026 -2.023 -6.069 910 HD12 LEU 119 2HD1 LEU 119 -2.882 -3.525 -5.715 911 HD13 LEU 119 3HD1 LEU 119 -3.637 -1.971 -5.355 912 HD21 LEU 119 1HD2 LEU 119 -4.190 -0.419 -7.227 913 HD22 LEU 119 2HD2 LEU 119 -4.167 -0.992 -8.894 914 HD23 LEU 119 3HD2 LEU 119 -2.652 -0.656 -8.056 915 H ALA 120 H ALA 120 -6.049 -3.259 -9.842 916 HA ALA 120 HA ALA 120 -5.232 -1.215 -11.858 917 HB1 ALA 120 1HB ALA 120 -7.841 -2.299 -12.449 918 HB2 ALA 120 2HB ALA 120 -6.645 -3.594 -12.405 919 HB3 ALA 120 3HB ALA 120 -6.416 -2.218 -13.484 920 H HIS 121 H HIS 121 -6.302 0.727 -11.673 921 HA HIS 121 HA HIS 121 -8.502 0.884 -9.647 922 HB2 HIS 121 2HB HIS 121 -7.326 2.451 -8.532 923 HB3 HIS 121 1HB HIS 121 -5.974 2.181 -9.627 924 HD1 HIS 121 1HD HIS 121 -9.342 3.961 -10.085 925 HD2 HIS 121 2HD HIS 121 -5.264 4.635 -10.653 926 HE1 HIS 121 1HE HIS 121 -9.133 6.261 -11.127 927 HE2 HIS 121 2HE HIS 121 -6.657 6.686 -11.464 928 H VAL 122 H VAL 122 -10.354 1.925 -10.332 929 HA VAL 122 HA VAL 122 -10.198 3.501 -12.852 930 HB VAL 122 HB VAL 122 -12.229 2.357 -13.699 931 HG11 VAL 122 1HG1 VAL 122 -10.370 0.104 -13.123 932 HG12 VAL 122 2HG1 VAL 122 -9.673 1.523 -13.903 933 HG13 VAL 122 3HG1 VAL 122 -11.012 0.665 -14.666 934 HG21 VAL 122 1HG2 VAL 122 -12.601 0.051 -12.475 935 HG22 VAL 122 2HG2 VAL 122 -13.362 1.509 -11.840 936 HG23 VAL 122 3HG2 VAL 122 -11.886 0.890 -11.098 937 H LYS 123 H LYS 123 -11.722 5.149 -12.998 938 HA LYS 123 HA LYS 123 -13.202 6.780 -12.214 939 HB2 LYS 123 2HB LYS 123 -14.425 4.396 -10.798 940 HB3 LYS 123 1HB LYS 123 -15.223 5.936 -11.120 941 HG2 LYS 123 2HG LYS 123 -14.897 5.576 -13.553 942 HG3 LYS 123 1HG LYS 123 -14.170 4.007 -13.207 943 HD2 LYS 123 2HD LYS 123 -16.293 3.365 -12.022 944 HD3 LYS 123 1HD LYS 123 -17.007 4.873 -12.597 945 HE2 LYS 123 2HE LYS 123 -16.378 4.144 -14.949 946 HE3 LYS 123 1HE LYS 123 -15.982 2.566 -14.267 947 HZ1 LYS 123 1HZ LYS 123 -18.310 2.666 -13.273 948 HZ2 LYS 123 2HZ LYS 123 -18.185 2.372 -14.942 949 HZ3 LYS 123 3HZ LYS 123 -18.607 3.917 -14.378 950 H LEU 124 H LEU 124 -10.773 6.178 -10.550 951 HA LEU 124 HA LEU 124 -11.517 6.360 -7.768 952 HB2 LEU 124 2HB LEU 124 -9.257 5.659 -8.544 953 HB3 LEU 124 1HB LEU 124 -8.962 7.309 -9.098 954 HG LEU 124 HG LEU 124 -9.405 8.093 -6.747 955 HD11 LEU 124 1HD1 LEU 124 -8.917 5.932 -5.165 956 HD12 LEU 124 2HD1 LEU 124 -9.882 5.182 -6.435 957 HD13 LEU 124 3HD1 LEU 124 -10.537 6.535 -5.516 958 HD21 LEU 124 1HD2 LEU 124 -7.222 6.342 -6.136 959 HD22 LEU 124 2HD2 LEU 124 -7.158 8.040 -6.610 960 HD23 LEU 124 3HD2 LEU 124 -7.120 6.778 -7.842 961 H HIS 125 H HIS 125 -10.915 8.733 -10.304 962 HA HIS 125 HA HIS 125 -10.814 11.063 -8.691 963 HB2 HIS 125 2HB HIS 125 -10.208 11.198 -11.019 964 HB3 HIS 125 1HB HIS 125 -11.821 10.686 -11.511 965 HD1 HIS 125 1HD HIS 125 -11.528 13.062 -8.665 966 HD2 HIS 125 2HD HIS 125 -12.259 13.258 -12.767 967 HE1 HIS 125 1HE HIS 125 -12.413 15.390 -9.123 968 HE2 HIS 125 2HE HIS 125 -12.851 15.525 -11.619 969 H ARG 126 H ARG 126 -13.544 9.066 -9.576 970 HA ARG 126 HA ARG 126 -15.684 10.827 -9.436 971 HB2 ARG 126 2HB ARG 126 -17.027 8.985 -8.708 972 HB3 ARG 126 1HB ARG 126 -15.759 8.290 -9.713 973 HG2 ARG 126 2HG ARG 126 -14.437 7.888 -7.588 974 HG3 ARG 126 1HG ARG 126 -15.883 8.347 -6.694 975 HD2 ARG 126 2HD ARG 126 -15.724 6.091 -8.711 976 HD3 ARG 126 1HD ARG 126 -15.744 5.896 -6.960 977 HE ARG 126 HE ARG 126 -18.062 6.492 -6.946 978 HH11 ARG 126 1HH1 ARG 126 -20.021 6.683 -8.044 979 HH12 ARG 126 2HH1 ARG 126 -20.023 6.868 -9.765 980 HH21 ARG 126 1HH2 ARG 126 -16.571 6.773 -10.053 981 HH22 ARG 126 2HH2 ARG 126 -18.074 6.919 -10.899 982 H HIS 127 H HIS 127 -13.487 9.859 -6.909 983 HA HIS 127 HA HIS 127 -14.993 10.598 -4.621 984 HB2 HIS 127 2HB HIS 127 -12.564 9.547 -4.928 985 HB3 HIS 127 1HB HIS 127 -12.074 11.230 -4.743 986 HD1 HIS 127 1HD HIS 127 -14.606 11.797 -2.752 987 HD2 HIS 127 2HD HIS 127 -11.609 8.929 -2.291 988 HE1 HIS 127 1HE HIS 127 -14.516 11.242 -0.279 989 HE2 HIS 127 2HE HIS 127 -12.697 9.500 0.011 990 H GLY 128 H GLY 128 -12.954 12.518 -6.788 991 HA2 GLY 128 2HA GLY 128 -12.567 14.854 -6.836 992 HA3 GLY 128 1HA GLY 128 -14.327 14.864 -6.901 993 H ASP 129 H ASP 129 -12.824 13.626 -4.023 994 HA ASP 129 HA ASP 129 -13.756 16.068 -2.579 995 HB2 ASP 129 2HB ASP 129 -13.254 13.242 -1.600 996 HB3 ASP 129 1HB ASP 129 -13.727 14.588 -0.562 997 H GLY 130 H GLY 130 -11.009 15.173 -3.922 998 HA2 GLY 130 2HA GLY 130 -8.876 16.192 -3.452 999 HA3 GLY 130 1HA GLY 130 -9.379 16.406 -1.772 1000 H ALA 131 H ALA 131 -10.143 13.349 -3.036 1001 HA ALA 131 HA ALA 131 -8.617 11.893 -1.156 1002 HB1 ALA 131 1HB ALA 131 -9.061 10.479 -3.689 1003 HB2 ALA 131 2HB ALA 131 -10.507 11.285 -3.078 1004 HB3 ALA 131 3HB ALA 131 -9.665 10.107 -2.073 1005 H TRP 132 H TRP 132 -7.758 13.071 -4.362 1006 HA TRP 132 HA TRP 132 -5.482 11.481 -4.861 1007 HB2 TRP 132 2HB TRP 132 -6.501 13.170 -6.433 1008 HB3 TRP 132 1HB TRP 132 -5.729 14.436 -5.479 1009 HD1 TRP 132 HD TRP 132 -3.524 15.183 -6.449 1010 HE1 TRP 132 1HE TRP 132 -1.628 14.096 -7.815 1011 HE3 TRP 132 3HE TRP 132 -5.326 10.411 -6.843 1012 HZ2 TRP 132 2HZ TRP 132 -0.963 11.548 -8.923 1013 HZ3 TRP 132 3HZ TRP 132 -4.034 8.681 -8.052 1014 HH2 TRP 132 HH TRP 132 -1.857 9.243 -9.094 1015 H ASN 133 H ASN 133 -5.829 14.348 -2.802 1016 HA ASN 133 HA ASN 133 -3.088 14.797 -2.241 1017 HB2 ASN 133 2HB ASN 133 -5.524 15.121 -0.463 1018 HB3 ASN 133 1HB ASN 133 -3.929 15.766 -0.092 1019 HD21 ASN 133 1HD2 ASN 133 -3.126 16.677 -2.655 1020 HD22 ASN 133 2HD2 ASN 133 -4.163 17.927 -3.147 1021 H ILE 134 H ILE 134 -5.424 12.589 -0.732 1022 HA ILE 134 HA ILE 134 -3.725 11.581 1.324 1023 HB ILE 134 HB ILE 134 -6.115 10.521 -0.141 1024 HG12 ILE 134 2HG1 ILE 134 -7.167 10.741 2.005 1025 HG13 ILE 134 1HG1 ILE 134 -5.613 10.935 2.813 1026 HG21 ILE 134 1HG2 ILE 134 -6.010 8.564 1.494 1027 HG22 ILE 134 2HG2 ILE 134 -4.319 8.994 1.747 1028 HG23 ILE 134 3HG2 ILE 134 -4.876 8.503 0.148 1029 HD11 ILE 134 1HD1 ILE 134 -5.289 13.103 1.922 1030 HD12 ILE 134 2HD1 ILE 134 -6.995 13.072 2.359 1031 HD13 ILE 134 3HD1 ILE 134 -6.513 12.865 0.676 1032 H HIS 135 H HIS 135 -4.157 10.614 -2.059 1033 HA HIS 135 HA HIS 135 -2.536 8.285 -2.020 1034 HB2 HIS 135 2HB HIS 135 -3.978 9.097 -3.941 1035 HB3 HIS 135 1HB HIS 135 -2.713 10.271 -4.301 1036 HD1 HIS 135 1HD HIS 135 -0.166 8.878 -4.238 1037 HD2 HIS 135 2HD HIS 135 -3.594 6.887 -5.535 1038 HE1 HIS 135 1HE HIS 135 0.628 6.910 -5.626 1039 HE2 HIS 135 2HE HIS 135 -1.450 5.692 -6.420 1040 H LYS 136 H LYS 136 -1.688 11.713 -2.367 1041 HA LYS 136 HA LYS 136 1.051 11.409 -3.014 1042 HB2 LYS 136 2HB LYS 136 -0.296 13.528 -1.333 1043 HB3 LYS 136 1HB LYS 136 1.331 13.658 -1.983 1044 HG2 LYS 136 2HG LYS 136 0.400 13.390 -4.268 1045 HG3 LYS 136 1HG LYS 136 -1.219 13.377 -3.577 1046 HD2 LYS 136 2HD LYS 136 -0.780 15.625 -2.592 1047 HD3 LYS 136 1HD LYS 136 0.787 15.642 -3.399 1048 HE2 LYS 136 2HE LYS 136 -0.132 15.968 -5.479 1049 HE3 LYS 136 1HE LYS 136 -1.587 15.047 -5.096 1050 HZ1 LYS 136 1HZ LYS 136 -2.635 16.863 -4.372 1051 HZ2 LYS 136 2HZ LYS 136 -1.441 17.736 -5.207 1052 HZ3 LYS 136 3HZ LYS 136 -1.278 17.449 -3.540 1053 H ALA 137 H ALA 137 -0.582 11.423 0.136 1054 HA ALA 137 HA ALA 137 1.833 11.243 1.696 1055 HB1 ALA 137 1HB ALA 137 0.179 11.773 3.163 1056 HB2 ALA 137 2HB ALA 137 -0.089 10.033 3.244 1057 HB3 ALA 137 3HB ALA 137 -1.066 11.028 2.163 1058 H LEU 138 H LEU 138 -0.435 8.815 0.441 1059 HA LEU 138 HA LEU 138 0.905 6.551 1.594 1060 HB2 LEU 138 2HB LEU 138 -0.820 6.682 -0.893 1061 HB3 LEU 138 1HB LEU 138 -0.440 5.234 0.026 1062 HG LEU 138 HG LEU 138 -1.977 7.637 1.044 1063 HD11 LEU 138 1HD1 LEU 138 -3.909 6.423 0.727 1064 HD12 LEU 138 2HD1 LEU 138 -3.095 4.874 0.956 1065 HD13 LEU 138 3HD1 LEU 138 -2.951 5.727 -0.581 1066 HD21 LEU 138 1HD2 LEU 138 -0.955 6.850 2.963 1067 HD22 LEU 138 2HD2 LEU 138 -0.799 5.213 2.329 1068 HD23 LEU 138 3HD2 LEU 138 -2.359 5.784 2.917 1069 H ASP 139 H ASP 139 1.305 8.378 -1.377 1070 HA ASP 139 HA ASP 139 2.937 6.558 -2.820 1071 HB2 ASP 139 2HB ASP 139 1.980 8.679 -3.739 1072 HB3 ASP 139 1HB ASP 139 3.163 9.581 -2.790 1073 H GLY 140 H GLY 140 5.047 8.992 -2.749 1074 HA2 GLY 140 2HA GLY 140 6.668 9.399 -0.774 1075 HA3 GLY 140 1HA GLY 140 6.757 7.638 -0.707 1076 HA PRO 141 HA PRO 141 10.295 9.148 -3.340 1077 HB2 PRO 141 2HB PRO 141 11.334 6.545 -2.345 1078 HB3 PRO 141 1HB PRO 141 12.126 8.132 -2.395 1079 HG2 PRO 141 2HG PRO 141 11.232 7.066 -0.112 1080 HG3 PRO 141 1HG PRO 141 11.196 8.811 -0.419 1081 HD2 PRO 141 2HD PRO 141 8.941 6.852 -0.426 1082 HD3 PRO 141 1HD PRO 141 8.940 8.577 0.005 1083 H SER 142 H SER 142 10.801 8.424 -5.434 1084 HA SER 142 HA SER 142 10.459 7.244 -7.434 1085 HB2 SER 142 2HB SER 142 11.757 5.561 -6.010 1086 HB3 SER 142 1HB SER 142 10.205 4.806 -5.660 1087 HG SER 142 HG SER 142 10.863 5.388 -8.319 1088 HA PRO 143 HA PRO 143 5.855 7.272 -6.362 1089 HB2 PRO 143 2HB PRO 143 5.890 8.904 -8.846 1090 HB3 PRO 143 1HB PRO 143 5.051 9.198 -7.312 1091 HG2 PRO 143 2HG PRO 143 7.219 10.588 -8.036 1092 HG3 PRO 143 1HG PRO 143 6.872 10.184 -6.346 1093 HD2 PRO 143 2HD PRO 143 8.903 8.999 -8.185 1094 HD3 PRO 143 1HD PRO 143 8.960 9.210 -6.422 1095 H GLY 144 H GLY 144 4.326 5.936 -7.371 1096 HA2 GLY 144 2HA GLY 144 4.170 5.237 -10.082 1097 HA3 GLY 144 1HA GLY 144 5.271 4.068 -9.353 1098 H GLU 145 H GLU 145 3.269 2.722 -10.173 1099 HA GLU 145 HA GLU 145 0.779 2.737 -8.868 1100 HB2 GLU 145 2HB GLU 145 0.797 0.230 -9.304 1101 HB3 GLU 145 1HB GLU 145 1.118 1.240 -10.715 1102 HG2 GLU 145 2HG GLU 145 3.565 0.935 -10.332 1103 HG3 GLU 145 1HG GLU 145 3.190 -0.165 -9.005 1104 H THR 146 H THR 146 0.000 1.420 -7.062 1105 HA THR 146 HA THR 146 1.550 1.662 -4.698 1106 HB THR 146 HB THR 146 -0.753 -0.197 -5.310 1107 HG1 THR 146 1HG THR 146 -1.894 1.454 -4.161 1108 HG21 THR 146 1HG2 THR 146 0.151 -1.134 -3.382 1109 HG22 THR 146 2HG2 THR 146 -0.967 0.053 -2.706 1110 HG23 THR 146 3HG2 THR 146 0.756 0.416 -2.795 1111 H LEU 147 H LEU 147 1.157 -1.034 -6.944 1112 HA LEU 147 HA LEU 147 2.466 -3.035 -5.433 1113 HB2 LEU 147 2HB LEU 147 2.550 -2.668 -8.439 1114 HB3 LEU 147 1HB LEU 147 2.783 -4.173 -7.547 1115 HG LEU 147 HG LEU 147 0.245 -2.521 -7.613 1116 HD11 LEU 147 1HD1 LEU 147 -0.289 -5.107 -8.457 1117 HD12 LEU 147 2HD1 LEU 147 1.277 -4.762 -9.189 1118 HD13 LEU 147 3HD1 LEU 147 -0.098 -3.704 -9.508 1119 HD21 LEU 147 1HD2 LEU 147 0.167 -3.475 -5.495 1120 HD22 LEU 147 2HD2 LEU 147 1.164 -4.852 -5.966 1121 HD23 LEU 147 3HD2 LEU 147 -0.530 -4.781 -6.454 1122 H ALA 148 H ALA 148 3.746 -0.375 -7.347 1123 HA ALA 148 HA ALA 148 6.435 -1.277 -7.591 1124 HB1 ALA 148 1HB ALA 148 5.401 1.560 -7.297 1125 HB2 ALA 148 2HB ALA 148 5.563 0.679 -8.816 1126 HB3 ALA 148 3HB ALA 148 7.000 1.111 -7.891 1127 H ARG 149 H ARG 149 5.089 0.982 -5.157 1128 HA ARG 149 HA ARG 149 7.449 0.981 -3.534 1129 HB2 ARG 149 2HB ARG 149 4.573 1.603 -2.846 1130 HB3 ARG 149 1HB ARG 149 5.941 1.938 -1.793 1131 HG2 ARG 149 2HG ARG 149 6.945 3.331 -3.610 1132 HG3 ARG 149 1HG ARG 149 5.483 3.073 -4.564 1133 HD2 ARG 149 2HD ARG 149 5.626 4.404 -1.843 1134 HD3 ARG 149 1HD ARG 149 5.333 5.213 -3.382 1135 HE ARG 149 HE ARG 149 3.373 3.690 -1.848 1136 HH11 ARG 149 1HH1 ARG 149 1.300 3.599 -2.747 1137 HH12 ARG 149 2HH1 ARG 149 1.068 4.053 -4.403 1138 HH21 ARG 149 1HH2 ARG 149 4.412 4.791 -4.946 1139 HH22 ARG 149 2HH2 ARG 149 2.831 4.727 -5.648 1140 H PHE 150 H PHE 150 4.466 -0.932 -3.426 1141 HA PHE 150 HA PHE 150 5.026 -2.311 -0.982 1142 HB2 PHE 150 2HB PHE 150 2.797 -2.296 -2.009 1143 HB3 PHE 150 1HB PHE 150 3.417 -3.185 -3.396 1144 HD1 PHE 150 1HD PHE 150 3.588 -5.535 -3.370 1145 HD2 PHE 150 2HD PHE 150 2.919 -3.402 0.299 1146 HE1 PHE 150 1HE PHE 150 3.187 -7.681 -2.197 1147 HE2 PHE 150 2HE PHE 150 2.518 -5.550 1.472 1148 HZ PHE 150 HZ PHE 150 2.656 -7.690 0.222 1149 H ALA 151 H ALA 151 5.803 -3.097 -4.371 1150 HA ALA 151 HA ALA 151 6.948 -5.667 -3.779 1151 HB1 ALA 151 1HB ALA 151 7.997 -5.441 -6.032 1152 HB2 ALA 151 2HB ALA 151 7.440 -3.769 -6.092 1153 HB3 ALA 151 3HB ALA 151 6.270 -5.088 -6.052 1154 H ASN 152 H ASN 152 8.375 -2.418 -4.071 1155 HA ASN 152 HA ASN 152 11.093 -3.243 -3.835 1156 HB2 ASN 152 2HB ASN 152 9.769 -0.653 -3.023 1157 HB3 ASN 152 1HB ASN 152 11.513 -0.893 -3.115 1158 HD21 ASN 152 1HD2 ASN 152 10.209 1.033 -4.784 1159 HD22 ASN 152 2HD2 ASN 152 10.301 0.500 -6.392 1160 H VAL 153 H VAL 153 8.847 -2.079 -1.306 1161 HA VAL 153 HA VAL 153 10.734 -2.544 0.823 1162 HB VAL 153 HB VAL 153 8.858 -2.129 2.311 1163 HG11 VAL 153 1HG1 VAL 153 7.970 0.006 1.192 1164 HG12 VAL 153 2HG1 VAL 153 8.977 -0.440 -0.186 1165 HG13 VAL 153 3HG1 VAL 153 9.719 -0.123 1.382 1166 HG21 VAL 153 1HG2 VAL 153 6.591 -1.691 1.074 1167 HG22 VAL 153 2HG2 VAL 153 7.044 -3.346 1.483 1168 HG23 VAL 153 3HG2 VAL 153 7.274 -2.748 -0.161 1169 H ILE 154 H ILE 154 8.406 -4.556 -0.838 1170 HA ILE 154 HA ILE 154 8.468 -6.650 1.209 1171 HB ILE 154 HB ILE 154 7.264 -6.424 -1.541 1172 HG12 ILE 154 2HG1 ILE 154 6.356 -5.377 0.724 1173 HG13 ILE 154 1HG1 ILE 154 5.259 -6.110 -0.439 1174 HG21 ILE 154 1HG2 ILE 154 7.782 -8.704 -1.464 1175 HG22 ILE 154 2HG2 ILE 154 6.138 -8.639 -0.828 1176 HG23 ILE 154 3HG2 ILE 154 7.508 -8.803 0.274 1177 HD11 ILE 154 1HD1 ILE 154 5.006 -6.837 2.019 1178 HD12 ILE 154 2HD1 ILE 154 6.511 -7.723 1.782 1179 HD13 ILE 154 3HD1 ILE 154 5.093 -8.119 0.812 Start of MODEL 16 1 H1 MET 1 1HT MET 1 3.534 5.061 -6.092 2 H2 MET 1 2HT MET 1 2.599 4.076 -5.072 3 H3 MET 1 3HT MET 1 2.819 5.720 -4.702 4 HA MET 1 HA MET 1 1.003 4.461 -6.586 5 HB2 MET 1 2HB MET 1 1.078 6.869 -4.775 6 HB3 MET 1 1HB MET 1 -0.179 6.710 -6.001 7 HG2 MET 1 2HG MET 1 0.350 4.340 -4.269 8 HG3 MET 1 1HG MET 1 -0.486 5.710 -3.538 9 HE1 MET 1 1HE MET 1 -3.934 5.529 -4.596 10 HE2 MET 1 2HE MET 1 -2.690 6.768 -4.451 11 HE3 MET 1 3HE MET 1 -2.789 5.485 -3.247 12 HA PRO 2 HA PRO 2 2.373 6.626 -10.184 13 HB2 PRO 2 2HB PRO 2 -0.065 7.338 -11.303 14 HB3 PRO 2 1HB PRO 2 0.689 5.740 -11.454 15 HG2 PRO 2 2HG PRO 2 -1.491 6.642 -9.654 16 HG3 PRO 2 1HG PRO 2 -1.256 5.080 -10.458 17 HD2 PRO 2 2HD PRO 2 -0.737 5.453 -7.811 18 HD3 PRO 2 1HD PRO 2 0.162 4.289 -8.806 19 H GLU 3 H GLU 3 2.744 8.765 -10.936 20 HA GLU 3 HA GLU 3 2.367 10.892 -9.067 21 HB2 GLU 3 2HB GLU 3 2.927 11.054 -12.037 22 HB3 GLU 3 1HB GLU 3 3.194 12.346 -10.869 23 HG2 GLU 3 2HG GLU 3 4.772 10.852 -9.635 24 HG3 GLU 3 1HG GLU 3 4.564 9.640 -10.902 25 H GLU 4 H GLU 4 0.558 9.874 -11.903 26 HA GLU 4 HA GLU 4 -1.491 11.967 -11.348 27 HB2 GLU 4 2HB GLU 4 -1.114 10.293 -13.853 28 HB3 GLU 4 1HB GLU 4 -2.222 11.651 -13.652 29 HG2 GLU 4 2HG GLU 4 -0.247 13.121 -13.190 30 HG3 GLU 4 1HG GLU 4 0.805 11.759 -13.572 31 H ILE 5 H ILE 5 -3.824 11.019 -11.983 32 HA ILE 5 HA ILE 5 -3.978 8.344 -10.669 33 HB ILE 5 HB ILE 5 -6.550 9.680 -11.022 34 HG12 ILE 5 2HG1 ILE 5 -4.470 11.078 -9.319 35 HG13 ILE 5 1HG1 ILE 5 -5.132 11.712 -10.823 36 HG21 ILE 5 1HG2 ILE 5 -6.850 9.006 -8.774 37 HG22 ILE 5 2HG2 ILE 5 -5.116 8.987 -8.461 38 HG23 ILE 5 3HG2 ILE 5 -5.840 7.748 -9.485 39 HD11 ILE 5 1HD1 ILE 5 -7.297 10.893 -9.114 40 HD12 ILE 5 2HD1 ILE 5 -6.935 12.506 -9.735 41 HD13 ILE 5 3HD1 ILE 5 -6.223 11.965 -8.214 42 HA PRO 6 HA PRO 6 -5.140 7.599 -15.127 43 HB2 PRO 6 2HB PRO 6 -3.717 5.340 -15.513 44 HB3 PRO 6 1HB PRO 6 -2.957 6.945 -15.592 45 HG2 PRO 6 2HG PRO 6 -2.977 4.973 -13.351 46 HG3 PRO 6 1HG PRO 6 -1.633 5.938 -13.990 47 HD2 PRO 6 2HD PRO 6 -3.018 6.649 -11.744 48 HD3 PRO 6 1HD PRO 6 -2.258 7.827 -12.838 49 H ASP 7 H ASP 7 -6.342 5.742 -16.078 50 HA ASP 7 HA ASP 7 -8.210 4.589 -14.229 51 HB2 ASP 7 2HB ASP 7 -7.574 3.914 -17.119 52 HB3 ASP 7 1HB ASP 7 -8.945 3.260 -16.226 53 H VAL 8 H VAL 8 -7.753 1.955 -16.017 54 HA VAL 8 HA VAL 8 -6.813 0.298 -13.965 55 HB VAL 8 HB VAL 8 -6.355 -0.120 -16.935 56 HG11 VAL 8 1HG1 VAL 8 -7.009 -2.445 -15.318 57 HG12 VAL 8 2HG1 VAL 8 -5.559 -1.640 -14.716 58 HG13 VAL 8 3HG1 VAL 8 -5.633 -2.186 -16.391 59 HG21 VAL 8 1HG2 VAL 8 -8.719 -0.915 -15.206 60 HG22 VAL 8 2HG2 VAL 8 -8.538 -1.213 -16.935 61 HG23 VAL 8 3HG2 VAL 8 -8.720 0.437 -16.338 62 H ARG 9 H ARG 9 -4.835 -0.125 -13.122 63 HA ARG 9 HA ARG 9 -2.518 1.366 -14.170 64 HB2 ARG 9 2HB ARG 9 -2.930 -0.227 -11.631 65 HB3 ARG 9 1HB ARG 9 -1.414 0.561 -12.053 66 HG2 ARG 9 2HG ARG 9 -2.641 2.732 -12.218 67 HG3 ARG 9 1HG ARG 9 -4.092 1.910 -11.639 68 HD2 ARG 9 2HD ARG 9 -2.873 1.237 -9.586 69 HD3 ARG 9 1HD ARG 9 -1.456 2.120 -10.153 70 HE ARG 9 HE ARG 9 -3.291 4.093 -10.195 71 HH11 ARG 9 1HH1 ARG 9 -4.016 5.309 -8.438 72 HH12 ARG 9 2HH1 ARG 9 -3.980 4.620 -6.849 73 HH21 ARG 9 1HH2 ARG 9 -2.655 1.594 -7.898 74 HH22 ARG 9 2HH2 ARG 9 -3.211 2.519 -6.544 75 H LYS 10 H LYS 10 -0.640 -0.649 -12.985 76 HA LYS 10 HA LYS 10 -0.780 -2.664 -15.180 77 HB2 LYS 10 2HB LYS 10 1.606 -1.267 -13.956 78 HB3 LYS 10 1HB LYS 10 1.721 -2.616 -15.075 79 HG2 LYS 10 2HG LYS 10 0.433 -1.315 -16.746 80 HG3 LYS 10 1HG LYS 10 0.414 0.054 -15.631 81 HD2 LYS 10 2HD LYS 10 2.912 0.025 -15.622 82 HD3 LYS 10 1HD LYS 10 2.870 -1.251 -16.840 83 HE2 LYS 10 2HE LYS 10 1.720 1.540 -17.138 84 HE3 LYS 10 1HE LYS 10 3.171 0.925 -17.928 85 HZ1 LYS 10 1HZ LYS 10 0.361 0.138 -18.375 86 HZ2 LYS 10 2HZ LYS 10 1.644 -0.875 -18.836 87 HZ3 LYS 10 3HZ LYS 10 1.501 0.679 -19.507 88 H SER 11 H SER 11 1.123 -4.368 -14.545 89 HA SER 11 HA SER 11 0.510 -5.306 -11.766 90 HB2 SER 11 2HB SER 11 -0.582 -6.646 -13.619 91 HB3 SER 11 1HB SER 11 1.031 -7.082 -14.159 92 HG SER 11 HG SER 11 -0.396 -8.221 -12.273 93 H VAL 12 H VAL 12 2.257 -6.202 -10.629 94 HA VAL 12 HA VAL 12 4.888 -6.242 -12.024 95 HB VAL 12 HB VAL 12 4.210 -4.821 -9.461 96 HG11 VAL 12 1HG1 VAL 12 6.863 -5.860 -10.458 97 HG12 VAL 12 2HG1 VAL 12 6.146 -6.063 -8.860 98 HG13 VAL 12 3HG1 VAL 12 6.760 -4.486 -9.358 99 HG21 VAL 12 1HG2 VAL 12 5.670 -4.041 -11.998 100 HG22 VAL 12 2HG2 VAL 12 5.445 -2.986 -10.601 101 HG23 VAL 12 3HG2 VAL 12 4.048 -3.524 -11.536 102 H VAL 13 H VAL 13 6.432 -7.682 -11.060 103 HA VAL 13 HA VAL 13 5.119 -9.854 -9.513 104 HB VAL 13 HB VAL 13 7.823 -9.818 -10.887 105 HG11 VAL 13 1HG1 VAL 13 6.148 -12.013 -9.640 106 HG12 VAL 13 2HG1 VAL 13 7.757 -11.488 -9.144 107 HG13 VAL 13 3HG1 VAL 13 7.536 -12.321 -10.683 108 HG21 VAL 13 1HG2 VAL 13 5.613 -11.463 -11.958 109 HG22 VAL 13 2HG2 VAL 13 6.813 -10.496 -12.816 110 HG23 VAL 13 3HG2 VAL 13 5.385 -9.722 -12.128 111 H VAL 14 H VAL 14 5.729 -10.323 -7.430 112 HA VAL 14 HA VAL 14 8.056 -8.813 -6.310 113 HB VAL 14 HB VAL 14 6.818 -8.462 -4.260 114 HG11 VAL 14 1HG1 VAL 14 6.212 -7.253 -6.662 115 HG12 VAL 14 2HG1 VAL 14 5.639 -6.709 -5.085 116 HG13 VAL 14 3HG1 VAL 14 4.623 -7.750 -6.082 117 HG21 VAL 14 1HG2 VAL 14 4.730 -10.189 -5.617 118 HG22 VAL 14 2HG2 VAL 14 4.383 -9.205 -4.196 119 HG23 VAL 14 3HG2 VAL 14 5.566 -10.508 -4.097 120 H ALA 15 H ALA 15 9.146 -9.913 -4.532 121 HA ALA 15 HA ALA 15 8.967 -12.851 -4.806 122 HB1 ALA 15 1HB ALA 15 11.128 -11.248 -4.640 123 HB2 ALA 15 2HB ALA 15 11.143 -12.921 -4.084 124 HB3 ALA 15 3HB ALA 15 10.912 -11.609 -2.928 125 H ALA 16 H ALA 16 7.100 -13.389 -3.629 126 HA ALA 16 HA ALA 16 7.421 -13.529 -0.747 127 HB1 ALA 16 1HB ALA 16 4.946 -12.313 -0.755 128 HB2 ALA 16 2HB ALA 16 5.833 -11.358 -1.944 129 HB3 ALA 16 3HB ALA 16 6.455 -11.521 -0.301 130 H SER 17 H SER 17 5.848 -14.984 0.182 131 HA SER 17 HA SER 17 4.762 -16.883 -1.732 132 HB2 SER 17 2HB SER 17 4.104 -18.163 0.177 133 HB3 SER 17 1HB SER 17 5.637 -17.413 0.612 134 HG SER 17 HG SER 17 3.712 -15.706 1.212 135 H VAL 18 H VAL 18 2.491 -17.370 -2.010 136 HA VAL 18 HA VAL 18 0.811 -15.117 -2.351 137 HB VAL 18 HB VAL 18 -0.651 -17.611 -1.805 138 HG11 VAL 18 1HG1 VAL 18 -1.801 -17.037 -3.727 139 HG12 VAL 18 2HG1 VAL 18 -0.370 -16.381 -4.517 140 HG13 VAL 18 3HG1 VAL 18 -1.191 -15.449 -3.269 141 HG21 VAL 18 1HG2 VAL 18 1.348 -18.752 -2.452 142 HG22 VAL 18 2HG2 VAL 18 1.676 -17.592 -3.742 143 HG23 VAL 18 3HG2 VAL 18 0.325 -18.716 -3.887 144 H GLU 19 H GLU 19 0.937 -17.501 0.284 145 HA GLU 19 HA GLU 19 -1.218 -16.465 1.825 146 HB2 GLU 19 2HB GLU 19 -0.059 -18.648 2.238 147 HB3 GLU 19 1HB GLU 19 1.320 -17.749 2.873 148 HG2 GLU 19 2HG GLU 19 -0.188 -16.698 4.559 149 HG3 GLU 19 1HG GLU 19 -1.509 -17.705 3.965 150 H HIS 20 H HIS 20 2.220 -15.586 1.728 151 HA HIS 20 HA HIS 20 2.217 -13.790 3.928 152 HB2 HIS 20 2HB HIS 20 4.239 -14.670 2.713 153 HB3 HIS 20 1HB HIS 20 3.858 -13.565 1.391 154 HD1 HIS 20 1HD HIS 20 4.258 -13.310 5.180 155 HD2 HIS 20 2HD HIS 20 5.127 -11.145 1.723 156 HE1 HIS 20 1HE HIS 20 5.469 -11.221 5.928 157 HE2 HIS 20 2HE HIS 20 6.004 -9.896 3.834 158 H CYS 21 H CYS 21 1.441 -13.304 0.495 159 HA CYS 21 HA CYS 21 1.262 -10.506 0.433 160 HB2 CYS 21 2HB CYS 21 -0.397 -12.616 -0.974 161 HB3 CYS 21 1HB CYS 21 -0.490 -10.899 -1.355 162 HG CYS 21 HG CYS 21 1.325 -12.110 -2.896 163 H PHE 22 H PHE 22 -1.457 -12.766 1.060 164 HA PHE 22 HA PHE 22 -3.247 -10.638 1.819 165 HB2 PHE 22 2HB PHE 22 -3.515 -13.512 2.694 166 HB3 PHE 22 1HB PHE 22 -4.797 -12.353 2.329 167 HD1 PHE 22 1HD PHE 22 -2.466 -14.774 0.983 168 HD2 PHE 22 2HD PHE 22 -5.148 -11.589 -0.054 169 HE1 PHE 22 1HE PHE 22 -2.426 -15.517 -1.375 170 HE2 PHE 22 2HE PHE 22 -5.110 -12.332 -2.422 171 HZ PHE 22 HZ PHE 22 -3.743 -14.296 -3.083 172 H GLU 23 H GLU 23 -1.109 -12.783 3.647 173 HA GLU 23 HA GLU 23 -2.079 -11.964 6.240 174 HB2 GLU 23 2HB GLU 23 0.537 -13.219 5.370 175 HB3 GLU 23 1HB GLU 23 0.099 -12.943 7.055 176 HG2 GLU 23 2HG GLU 23 -1.529 -14.586 5.093 177 HG3 GLU 23 1HG GLU 23 -0.443 -15.256 6.311 178 H VAL 24 H VAL 24 0.402 -10.731 4.052 179 HA VAL 24 HA VAL 24 1.756 -9.029 5.868 180 HB VAL 24 HB VAL 24 1.330 -9.042 2.904 181 HG11 VAL 24 1HG1 VAL 24 2.903 -6.990 2.919 182 HG12 VAL 24 2HG1 VAL 24 2.348 -6.749 4.576 183 HG13 VAL 24 3HG1 VAL 24 1.193 -6.709 3.245 184 HG21 VAL 24 1HG2 VAL 24 3.754 -9.271 2.917 185 HG22 VAL 24 2HG2 VAL 24 3.079 -10.422 4.070 186 HG23 VAL 24 3HG2 VAL 24 3.813 -8.925 4.645 187 H PHE 25 H PHE 25 -1.115 -8.359 3.830 188 HA PHE 25 HA PHE 25 -1.388 -5.629 4.679 189 HB2 PHE 25 2HB PHE 25 -3.789 -7.301 4.026 190 HB3 PHE 25 1HB PHE 25 -3.432 -5.637 3.566 191 HD1 PHE 25 1HD PHE 25 -4.043 -8.522 2.074 192 HD2 PHE 25 2HD PHE 25 -0.750 -5.792 2.433 193 HE1 PHE 25 1HE PHE 25 -3.137 -9.330 -0.095 194 HE2 PHE 25 2HE PHE 25 0.159 -6.597 0.269 195 HZ PHE 25 HZ PHE 25 -1.035 -8.367 -0.995 196 H THR 26 H THR 26 -2.800 -8.656 5.902 197 HA THR 26 HA THR 26 -4.158 -7.203 8.071 198 HB THR 26 HB THR 26 -5.111 -9.368 8.632 199 HG1 THR 26 1HG THR 26 -2.868 -10.239 7.522 200 HG21 THR 26 1HG2 THR 26 -6.059 -9.982 6.364 201 HG22 THR 26 2HG2 THR 26 -4.959 -8.791 5.669 202 HG23 THR 26 3HG2 THR 26 -6.213 -8.281 6.800 203 H SER 27 H SER 27 -1.066 -8.556 7.611 204 HA SER 27 HA SER 27 -0.721 -9.441 10.385 205 HB2 SER 27 2HB SER 27 1.183 -9.110 8.075 206 HB3 SER 27 1HB SER 27 1.723 -9.584 9.680 207 HG SER 27 HG SER 27 0.530 -11.423 9.533 208 H ARG 28 H ARG 28 1.049 -6.953 8.495 209 HA ARG 28 HA ARG 28 0.609 -4.908 10.494 210 HB2 ARG 28 2HB ARG 28 3.276 -4.920 10.883 211 HB3 ARG 28 1HB ARG 28 2.158 -5.772 11.951 212 HG2 ARG 28 2HG ARG 28 2.618 -7.860 10.985 213 HG3 ARG 28 1HG ARG 28 3.239 -7.141 9.500 214 HD2 ARG 28 2HD ARG 28 5.327 -6.933 10.341 215 HD3 ARG 28 1HD ARG 28 4.733 -6.341 11.894 216 HE ARG 28 HE ARG 28 4.103 -8.990 12.040 217 HH11 ARG 28 1HH1 ARG 28 5.519 -10.621 12.706 218 HH12 ARG 28 2HH1 ARG 28 7.227 -10.403 12.505 219 HH21 ARG 28 1HH2 ARG 28 6.924 -7.259 11.075 220 HH22 ARG 28 2HH2 ARG 28 8.021 -8.500 11.581 221 HA PRO 29 HA PRO 29 1.829 -3.561 6.200 222 HB2 PRO 29 2HB PRO 29 -0.040 -1.387 6.944 223 HB3 PRO 29 1HB PRO 29 0.006 -2.380 5.476 224 HG2 PRO 29 2HG PRO 29 -1.874 -2.697 7.361 225 HG3 PRO 29 1HG PRO 29 -1.249 -4.046 6.400 226 HD2 PRO 29 2HD PRO 29 -0.680 -3.341 9.246 227 HD3 PRO 29 1HD PRO 29 -0.755 -4.939 8.470 228 H ALA 30 H ALA 30 1.801 -2.044 9.336 229 HA ALA 30 HA ALA 30 3.099 0.419 8.656 230 HB1 ALA 30 1HB ALA 30 2.551 0.708 10.824 231 HB2 ALA 30 2HB ALA 30 3.957 -0.277 11.230 232 HB3 ALA 30 3HB ALA 30 2.370 -1.030 11.067 233 H ASP 31 H ASP 31 4.227 -2.812 8.756 234 HA ASP 31 HA ASP 31 6.923 -2.523 9.517 235 HB2 ASP 31 2HB ASP 31 5.740 -4.683 8.960 236 HB3 ASP 31 1HB ASP 31 5.928 -4.275 7.254 237 H TRP 32 H TRP 32 5.338 -1.601 6.495 238 HA TRP 32 HA TRP 32 7.908 -0.326 5.678 239 HB2 TRP 32 2HB TRP 32 7.092 -1.018 3.258 240 HB3 TRP 32 1HB TRP 32 8.020 -2.143 4.248 241 HD1 TRP 32 HD TRP 32 6.962 -4.401 4.691 242 HE1 TRP 32 1HE TRP 32 4.619 -5.432 4.428 243 HE3 TRP 32 3HE TRP 32 4.334 -0.254 3.323 244 HZ2 TRP 32 2HZ TRP 32 1.982 -4.606 3.728 245 HZ3 TRP 32 3HZ TRP 32 1.904 -0.400 2.865 246 HH2 TRP 32 HH TRP 32 0.724 -2.570 3.063 247 H TRP 33 H TRP 33 4.762 0.206 6.441 248 HA TRP 33 HA TRP 33 3.849 1.836 4.272 249 HB2 TRP 33 2HB TRP 33 2.634 0.948 6.490 250 HB3 TRP 33 1HB TRP 33 3.021 2.580 7.033 251 HD1 TRP 33 HD TRP 33 2.167 4.615 5.397 252 HE1 TRP 33 1HE TRP 33 0.027 4.766 3.968 253 HE3 TRP 33 3HE TRP 33 0.920 -0.326 5.158 254 HZ2 TRP 33 2HZ TRP 33 -1.954 3.018 2.868 255 HZ3 TRP 33 3HZ TRP 33 -1.096 -1.059 3.916 256 HH2 TRP 33 HH TRP 33 -2.534 0.606 2.771 257 HA PRO 34 HA PRO 34 5.778 5.430 7.058 258 HB2 PRO 34 2HB PRO 34 8.274 3.990 7.787 259 HB3 PRO 34 1HB PRO 34 7.292 5.112 8.749 260 HG2 PRO 34 2HG PRO 34 7.271 2.499 9.232 261 HG3 PRO 34 1HG PRO 34 5.802 3.479 9.380 262 HD2 PRO 34 2HD PRO 34 6.591 1.585 7.201 263 HD3 PRO 34 1HD PRO 34 4.983 1.905 7.885 264 HA PRO 35 HA PRO 35 8.360 5.680 3.281 265 HB2 PRO 35 2HB PRO 35 7.417 8.015 2.340 266 HB3 PRO 35 1HB PRO 35 6.464 6.522 2.224 267 HG2 PRO 35 2HG PRO 35 6.161 8.820 4.070 268 HG3 PRO 35 1HG PRO 35 4.928 7.763 3.365 269 HD2 PRO 35 2HD PRO 35 6.008 7.556 5.973 270 HD3 PRO 35 1HD PRO 35 5.006 6.346 5.148 271 H SER 36 H SER 36 10.043 7.285 2.566 272 HA SER 36 HA SER 36 11.609 8.285 4.703 273 HB2 SER 36 2HB SER 36 11.567 9.328 1.855 274 HB3 SER 36 1HB SER 36 12.893 9.478 3.005 275 HG SER 36 HG SER 36 13.449 7.487 2.598 276 H HIS 37 H HIS 37 9.125 9.856 2.729 277 HA HIS 37 HA HIS 37 9.147 12.127 4.676 278 HB2 HIS 37 2HB HIS 37 8.659 12.276 1.685 279 HB3 HIS 37 1HB HIS 37 8.517 13.627 2.808 280 HD1 HIS 37 1HD HIS 37 10.830 14.116 4.232 281 HD2 HIS 37 2HD HIS 37 11.218 11.970 0.676 282 HE1 HIS 37 1HE HIS 37 13.275 14.248 3.576 283 HE2 HIS 37 2HE HIS 37 13.521 12.945 1.414 284 H VAL 38 H VAL 38 7.149 12.504 5.576 285 HA VAL 38 HA VAL 38 4.757 11.405 4.165 286 HB VAL 38 HB VAL 38 5.576 9.868 6.010 287 HG11 VAL 38 1HG1 VAL 38 4.483 11.921 7.915 288 HG12 VAL 38 2HG1 VAL 38 6.181 11.972 7.439 289 HG13 VAL 38 3HG1 VAL 38 5.534 10.546 8.250 290 HG21 VAL 38 1HG2 VAL 38 2.882 11.088 5.756 291 HG22 VAL 38 2HG2 VAL 38 3.162 10.131 7.209 292 HG23 VAL 38 3HG2 VAL 38 3.369 9.400 5.619 293 H LEU 39 H LEU 39 2.937 12.713 4.326 294 HA LEU 39 HA LEU 39 3.367 15.398 5.459 295 HB2 LEU 39 2HB LEU 39 0.938 14.279 4.029 296 HB3 LEU 39 1HB LEU 39 1.277 15.981 4.347 297 HG LEU 39 HG LEU 39 2.907 14.123 2.591 298 HD11 LEU 39 1HD1 LEU 39 1.564 14.848 0.938 299 HD12 LEU 39 2HD1 LEU 39 2.038 16.509 1.295 300 HD13 LEU 39 3HD1 LEU 39 0.637 15.800 2.098 301 HD21 LEU 39 1HD2 LEU 39 3.983 16.477 2.069 302 HD22 LEU 39 2HD2 LEU 39 4.529 15.552 3.468 303 HD23 LEU 39 3HD2 LEU 39 3.388 16.881 3.680 304 H VAL 40 H VAL 40 2.222 12.472 6.615 305 HA VAL 40 HA VAL 40 -0.059 13.278 8.144 306 HB VAL 40 HB VAL 40 1.965 11.148 8.862 307 HG11 VAL 40 1HG1 VAL 40 0.481 11.594 10.699 308 HG12 VAL 40 2HG1 VAL 40 -0.092 10.118 9.922 309 HG13 VAL 40 3HG1 VAL 40 -0.919 11.649 9.628 310 HG21 VAL 40 1HG2 VAL 40 -0.607 10.549 7.458 311 HG22 VAL 40 2HG2 VAL 40 0.927 9.684 7.394 312 HG23 VAL 40 3HG2 VAL 40 0.722 11.185 6.493 313 H LYS 41 H LYS 41 -0.199 14.206 10.199 314 HA LYS 41 HA LYS 41 1.895 15.889 11.089 315 HB2 LYS 41 2HB LYS 41 -0.413 14.711 12.649 316 HB3 LYS 41 1HB LYS 41 0.606 16.030 13.221 317 HG2 LYS 41 2HG LYS 41 -0.032 17.341 11.190 318 HG3 LYS 41 1HG LYS 41 -1.142 16.045 10.743 319 HD2 LYS 41 2HD LYS 41 -2.301 16.337 12.937 320 HD3 LYS 41 1HD LYS 41 -1.248 17.711 13.274 321 HE2 LYS 41 2HE LYS 41 -3.437 18.423 12.333 322 HE3 LYS 41 1HE LYS 41 -2.089 18.877 11.291 323 HZ1 LYS 41 1HZ LYS 41 -2.942 17.670 9.662 324 HZ2 LYS 41 2HZ LYS 41 -4.299 17.336 10.629 325 HZ3 LYS 41 3HZ LYS 41 -2.968 16.281 10.634 326 H LYS 42 H LYS 42 1.045 12.573 12.044 327 HA LYS 42 HA LYS 42 3.705 12.412 13.380 328 HB2 LYS 42 2HB LYS 42 1.697 12.547 14.983 329 HB3 LYS 42 1HB LYS 42 1.265 10.944 14.386 330 HG2 LYS 42 2HG LYS 42 2.593 10.584 16.338 331 HG3 LYS 42 1HG LYS 42 3.636 10.222 14.964 332 HD2 LYS 42 2HD LYS 42 3.845 13.024 15.547 333 HD3 LYS 42 1HD LYS 42 4.072 12.121 17.043 334 HE2 LYS 42 2HE LYS 42 5.772 10.713 15.950 335 HE3 LYS 42 1HE LYS 42 5.547 11.602 14.444 336 HZ1 LYS 42 1HZ LYS 42 6.478 12.741 17.025 337 HZ2 LYS 42 2HZ LYS 42 6.217 13.628 15.599 338 HZ3 LYS 42 3HZ LYS 42 7.439 12.450 15.657 339 H GLU 43 H GLU 43 4.780 10.422 13.106 340 HA GLU 43 HA GLU 43 4.289 9.018 10.687 341 HB2 GLU 43 2HB GLU 43 6.482 9.110 11.884 342 HB3 GLU 43 1HB GLU 43 5.826 8.012 13.098 343 HG2 GLU 43 2HG GLU 43 5.363 6.351 11.294 344 HG3 GLU 43 1HG GLU 43 6.134 7.436 10.137 345 H ARG 44 H ARG 44 3.109 7.217 10.207 346 HA ARG 44 HA ARG 44 1.146 6.258 12.146 347 HB2 ARG 44 2HB ARG 44 0.721 6.520 9.669 348 HB3 ARG 44 1HB ARG 44 1.802 5.154 9.400 349 HG2 ARG 44 2HG ARG 44 0.348 3.758 10.869 350 HG3 ARG 44 1HG ARG 44 -0.765 5.121 11.010 351 HD2 ARG 44 2HD ARG 44 0.031 3.737 8.432 352 HD3 ARG 44 1HD ARG 44 -1.530 3.598 9.243 353 HE ARG 44 HE ARG 44 -1.410 6.272 8.875 354 HH11 ARG 44 1HH1 ARG 44 -1.888 7.400 6.978 355 HH12 ARG 44 2HH1 ARG 44 -1.703 6.612 5.447 356 HH21 ARG 44 1HH2 ARG 44 -0.627 3.615 6.815 357 HH22 ARG 44 2HH2 ARG 44 -0.992 4.471 5.356 358 H ALA 45 H ALA 45 1.243 4.304 13.290 359 HA ALA 45 HA ALA 45 3.576 2.525 12.712 360 HB1 ALA 45 1HB ALA 45 2.667 3.514 15.426 361 HB2 ALA 45 2HB ALA 45 4.185 3.904 14.619 362 HB3 ALA 45 3HB ALA 45 3.880 2.258 15.172 363 H GLY 46 H GLY 46 0.384 2.788 14.296 364 HA2 GLY 46 2HA GLY 46 0.224 -0.190 14.281 365 HA3 GLY 46 1HA GLY 46 -0.789 0.873 15.242 366 H LEU 47 H LEU 47 -1.573 -1.257 13.362 367 HA LEU 47 HA LEU 47 -3.539 0.327 11.828 368 HB2 LEU 47 2HB LEU 47 -1.662 -1.684 10.549 369 HB3 LEU 47 1HB LEU 47 -3.128 -1.078 9.784 370 HG LEU 47 HG LEU 47 -2.017 1.279 10.423 371 HD11 LEU 47 1HD1 LEU 47 0.465 -0.159 9.626 372 HD12 LEU 47 2HD1 LEU 47 -0.027 -0.306 11.312 373 HD13 LEU 47 3HD1 LEU 47 0.274 1.286 10.617 374 HD21 LEU 47 1HD2 LEU 47 -0.737 0.882 8.078 375 HD22 LEU 47 2HD2 LEU 47 -2.482 1.102 8.181 376 HD23 LEU 47 3HD2 LEU 47 -1.806 -0.519 8.058 377 H ALA 48 H ALA 48 -5.511 -0.678 11.942 378 HA ALA 48 HA ALA 48 -5.639 -3.616 12.208 379 HB1 ALA 48 1HB ALA 48 -6.734 -1.704 14.290 380 HB2 ALA 48 2HB ALA 48 -5.514 -2.954 14.533 381 HB3 ALA 48 3HB ALA 48 -7.183 -3.407 14.188 382 H PHE 49 H PHE 49 -7.304 -4.310 10.936 383 HA PHE 49 HA PHE 49 -9.708 -2.608 10.656 384 HB2 PHE 49 2HB PHE 49 -9.617 -2.743 8.183 385 HB3 PHE 49 1HB PHE 49 -8.250 -1.843 8.844 386 HD1 PHE 49 1HD PHE 49 -9.323 -4.850 7.079 387 HD2 PHE 49 2HD PHE 49 -6.007 -2.901 8.985 388 HE1 PHE 49 1HE PHE 49 -7.764 -6.417 5.963 389 HE2 PHE 49 2HE PHE 49 -4.443 -4.469 7.872 390 HZ PHE 49 HZ PHE 49 -5.317 -6.223 6.359 391 H GLU 50 H GLU 50 -11.555 -3.769 9.981 392 HA GLU 50 HA GLU 50 -11.354 -6.687 10.357 393 HB2 GLU 50 2HB GLU 50 -13.970 -5.524 9.649 394 HB3 GLU 50 1HB GLU 50 -13.536 -6.566 11.004 395 HG2 GLU 50 2HG GLU 50 -12.331 -4.493 11.964 396 HG3 GLU 50 1HG GLU 50 -13.263 -3.571 10.785 397 HA PRO 51 HA PRO 51 -11.235 -6.782 5.804 398 HB2 PRO 51 2HB PRO 51 -10.527 -9.390 5.519 399 HB3 PRO 51 1HB PRO 51 -9.372 -8.116 5.956 400 HG2 PRO 51 2HG PRO 51 -10.670 -10.164 7.666 401 HG3 PRO 51 1HG PRO 51 -9.040 -9.478 7.757 402 HD2 PRO 51 2HD PRO 51 -11.162 -8.727 9.387 403 HD3 PRO 51 1HD PRO 51 -9.719 -7.735 9.083 404 H PHE 52 H PHE 52 -13.478 -6.567 5.381 405 HA PHE 52 HA PHE 52 -14.813 -9.028 4.542 406 HB2 PHE 52 2HB PHE 52 -16.155 -7.316 6.659 407 HB3 PHE 52 1HB PHE 52 -16.775 -8.807 5.949 408 HD1 PHE 52 1HD PHE 52 -15.602 -10.984 6.393 409 HD2 PHE 52 2HD PHE 52 -14.548 -7.349 8.416 410 HE1 PHE 52 1HE PHE 52 -14.376 -12.294 8.107 411 HE2 PHE 52 2HE PHE 52 -13.326 -8.653 10.128 412 HZ PHE 52 HZ PHE 52 -13.233 -11.126 9.974 413 H VAL 53 H VAL 53 -17.157 -8.282 3.694 414 HA VAL 53 HA VAL 53 -16.613 -5.993 1.950 415 HB VAL 53 HB VAL 53 -19.237 -7.481 2.285 416 HG11 VAL 53 1HG1 VAL 53 -18.065 -5.595 0.258 417 HG12 VAL 53 2HG1 VAL 53 -19.682 -5.614 0.963 418 HG13 VAL 53 3HG1 VAL 53 -19.239 -6.806 -0.259 419 HG21 VAL 53 1HG2 VAL 53 -17.615 -8.241 -0.015 420 HG22 VAL 53 2HG2 VAL 53 -18.397 -9.267 1.186 421 HG23 VAL 53 3HG2 VAL 53 -16.796 -8.603 1.502 422 H GLY 54 H GLY 54 -17.063 -3.915 2.539 423 HA2 GLY 54 2HA GLY 54 -18.280 -2.128 3.514 424 HA3 GLY 54 1HA GLY 54 -19.452 -3.304 4.121 425 H GLY 55 H GLY 55 -16.160 -4.052 4.713 426 HA2 GLY 55 2HA GLY 55 -16.530 -3.941 7.584 427 HA3 GLY 55 1HA GLY 55 -15.017 -4.304 6.752 428 H ARG 56 H ARG 56 -14.583 -2.756 8.834 429 HA ARG 56 HA ARG 56 -14.463 0.038 7.752 430 HB2 ARG 56 2HB ARG 56 -14.620 -0.912 10.629 431 HB3 ARG 56 1HB ARG 56 -14.372 0.765 10.141 432 HG2 ARG 56 2HG ARG 56 -16.516 0.670 8.866 433 HG3 ARG 56 1HG ARG 56 -16.777 -0.961 9.486 434 HD2 ARG 56 2HD ARG 56 -17.995 0.548 10.917 435 HD3 ARG 56 1HD ARG 56 -16.584 -0.006 11.820 436 HE ARG 56 HE ARG 56 -15.712 2.198 11.725 437 HH11 ARG 56 1HH1 ARG 56 -15.914 4.395 11.236 438 HH12 ARG 56 2HH1 ARG 56 -17.153 4.916 10.143 439 HH21 ARG 56 1HH2 ARG 56 -18.385 1.720 9.601 440 HH22 ARG 56 2HH2 ARG 56 -18.552 3.400 9.217 441 H TYR 57 H TYR 57 -12.455 1.018 7.731 442 HA TYR 57 HA TYR 57 -10.176 -0.640 8.735 443 HB2 TYR 57 2HB TYR 57 -10.513 -0.153 6.174 444 HB3 TYR 57 1HB TYR 57 -9.885 1.441 6.588 445 HD1 TYR 57 1HD TYR 57 -9.030 -1.910 5.747 446 HD2 TYR 57 2HD TYR 57 -7.677 1.489 7.996 447 HE1 TYR 57 1HE TYR 57 -6.724 -2.821 5.733 448 HE2 TYR 57 2HE TYR 57 -5.371 0.578 7.978 449 HH TYR 57 HH TYR 57 -4.611 -2.498 7.354 450 H TYR 58 H TYR 58 -8.957 0.299 10.297 451 HA TYR 58 HA TYR 58 -8.976 3.267 10.500 452 HB2 TYR 58 2HB TYR 58 -9.002 2.784 13.085 453 HB3 TYR 58 1HB TYR 58 -10.519 2.819 12.186 454 HD1 TYR 58 1HD TYR 58 -8.448 0.884 14.345 455 HD2 TYR 58 2HD TYR 58 -11.311 0.547 11.160 456 HE1 TYR 58 1HE TYR 58 -8.895 -1.469 14.994 457 HE2 TYR 58 2HE TYR 58 -11.756 -1.805 11.809 458 HH TYR 58 HH TYR 58 -10.543 -3.156 14.761 459 H GLU 59 H GLU 59 -7.039 4.143 11.183 460 HA GLU 59 HA GLU 59 -4.846 2.205 11.803 461 HB2 GLU 59 2HB GLU 59 -4.732 4.755 10.165 462 HB3 GLU 59 1HB GLU 59 -3.320 3.813 10.647 463 HG2 GLU 59 2HG GLU 59 -4.223 1.847 9.468 464 HG3 GLU 59 1HG GLU 59 -5.631 2.789 8.973 465 H TRP 60 H TRP 60 -3.339 2.910 13.386 466 HA TRP 60 HA TRP 60 -4.325 5.207 15.022 467 HB2 TRP 60 2HB TRP 60 -2.531 2.907 15.843 468 HB3 TRP 60 1HB TRP 60 -3.208 4.144 16.906 469 HD1 TRP 60 HD TRP 60 -6.108 4.314 16.137 470 HE1 TRP 60 1HE TRP 60 -7.741 2.339 16.426 471 HE3 TRP 60 3HE TRP 60 -2.786 0.438 16.200 472 HZ2 TRP 60 2HZ TRP 60 -7.646 -0.509 16.650 473 HZ3 TRP 60 3HZ TRP 60 -3.586 -1.893 16.444 474 HH2 TRP 60 HH TRP 60 -6.008 -2.371 16.670 475 H ASP 61 H ASP 61 -3.024 6.955 15.266 476 HA ASP 61 HA ASP 61 -0.349 6.853 13.981 477 HB2 ASP 61 2HB ASP 61 -2.029 9.137 15.028 478 HB3 ASP 61 1HB ASP 61 -0.419 9.345 14.342 479 H ILE 62 H ILE 62 1.553 7.482 15.175 480 HA ILE 62 HA ILE 62 1.709 6.487 17.810 481 HB ILE 62 HB ILE 62 3.496 8.522 16.476 482 HG12 ILE 62 2HG1 ILE 62 3.806 5.535 16.762 483 HG13 ILE 62 1HG1 ILE 62 3.221 6.327 15.307 484 HG21 ILE 62 1HG2 ILE 62 4.589 8.613 18.435 485 HG22 ILE 62 2HG2 ILE 62 4.888 6.880 18.298 486 HG23 ILE 62 3HG2 ILE 62 3.456 7.462 19.145 487 HD11 ILE 62 1HD1 ILE 62 5.956 6.495 16.557 488 HD12 ILE 62 2HD1 ILE 62 5.389 7.731 15.435 489 HD13 ILE 62 3HD1 ILE 62 5.533 6.056 14.902 490 H ASP 63 H ASP 63 0.868 9.691 16.647 491 HA ASP 63 HA ASP 63 0.404 10.501 19.494 492 HB2 ASP 63 2HB ASP 63 2.316 11.721 18.452 493 HB3 ASP 63 1HB ASP 63 1.217 12.320 17.209 494 H GLY 64 H GLY 64 -0.809 10.358 16.222 495 HA2 GLY 64 2HA GLY 64 -3.110 12.082 16.807 496 HA3 GLY 64 1HA GLY 64 -2.845 11.196 15.305 497 H THR 65 H THR 65 -5.273 11.331 16.969 498 HA THR 65 HA THR 65 -5.647 8.935 18.470 499 HB THR 65 HB THR 65 -7.112 11.015 18.468 500 HG1 THR 65 1HG THR 65 -8.610 9.788 19.305 501 HG21 THR 65 1HG2 THR 65 -8.453 11.497 16.698 502 HG22 THR 65 2HG2 THR 65 -8.754 9.797 16.338 503 HG23 THR 65 3HG2 THR 65 -7.260 10.562 15.799 504 H GLU 66 H GLU 66 -8.148 8.149 17.096 505 HA GLU 66 HA GLU 66 -6.924 6.272 15.152 506 HB2 GLU 66 2HB GLU 66 -9.780 6.164 16.085 507 HB3 GLU 66 1HB GLU 66 -8.705 4.842 15.644 508 HG2 GLU 66 2HG GLU 66 -7.336 5.348 17.692 509 HG3 GLU 66 1HG GLU 66 -8.557 6.532 18.151 510 H ILE 67 H ILE 67 -7.417 6.418 12.973 511 HA ILE 67 HA ILE 67 -9.756 8.072 12.175 512 HB ILE 67 HB ILE 67 -8.422 9.167 10.411 513 HG12 ILE 67 2HG1 ILE 67 -5.970 8.068 11.790 514 HG13 ILE 67 1HG1 ILE 67 -6.695 7.247 10.409 515 HG21 ILE 67 1HG2 ILE 67 -6.956 9.600 13.002 516 HG22 ILE 67 2HG2 ILE 67 -8.668 10.005 12.876 517 HG23 ILE 67 3HG2 ILE 67 -7.495 10.793 11.820 518 HD11 ILE 67 1HD1 ILE 67 -5.612 10.072 10.487 519 HD12 ILE 67 2HD1 ILE 67 -6.542 9.419 9.137 520 HD13 ILE 67 3HD1 ILE 67 -4.979 8.715 9.555 521 H VAL 68 H VAL 68 -10.282 7.719 9.787 522 HA VAL 68 HA VAL 68 -10.039 4.821 9.230 523 HB VAL 68 HB VAL 68 -11.664 6.948 7.805 524 HG11 VAL 68 1HG1 VAL 68 -12.778 4.353 7.573 525 HG12 VAL 68 2HG1 VAL 68 -11.058 4.191 7.216 526 HG13 VAL 68 3HG1 VAL 68 -12.047 5.324 6.294 527 HG21 VAL 68 1HG2 VAL 68 -12.484 6.786 10.051 528 HG22 VAL 68 2HG2 VAL 68 -12.313 5.031 10.058 529 HG23 VAL 68 3HG2 VAL 68 -13.560 5.792 9.070 530 H TRP 69 H TRP 69 -8.791 4.013 7.588 531 HA TRP 69 HA TRP 69 -7.303 5.997 5.925 532 HB2 TRP 69 2HB TRP 69 -5.688 4.742 7.022 533 HB3 TRP 69 1HB TRP 69 -6.657 3.270 6.987 534 HD1 TRP 69 HD TRP 69 -4.129 5.238 5.003 535 HE1 TRP 69 1HE TRP 69 -3.472 3.912 2.891 536 HE3 TRP 69 3HE TRP 69 -7.629 1.522 5.163 537 HZ2 TRP 69 2HZ TRP 69 -4.315 1.580 1.462 538 HZ3 TRP 69 3HZ TRP 69 -7.679 -0.239 3.420 539 HH2 TRP 69 HH TRP 69 -6.027 -0.217 1.569 540 H GLY 70 H GLY 70 -9.872 3.852 5.686 541 HA2 GLY 70 2HA GLY 70 -10.376 4.170 2.992 542 HA3 GLY 70 1HA GLY 70 -9.283 2.789 3.039 543 H ARG 71 H ARG 71 -10.712 1.122 2.555 544 HA ARG 71 HA ARG 71 -12.523 0.296 4.684 545 HB2 ARG 71 2HB ARG 71 -13.707 1.990 2.942 546 HB3 ARG 71 1HB ARG 71 -13.921 0.481 2.059 547 HG2 ARG 71 2HG ARG 71 -14.919 -0.540 4.105 548 HG3 ARG 71 1HG ARG 71 -14.787 1.022 4.913 549 HD2 ARG 71 2HD ARG 71 -16.199 2.029 3.119 550 HD3 ARG 71 1HD ARG 71 -16.401 0.423 2.417 551 HE ARG 71 HE ARG 71 -17.157 0.324 5.171 552 HH11 ARG 71 1HH1 ARG 71 -19.361 0.331 5.675 553 HH12 ARG 71 2HH1 ARG 71 -20.502 0.906 4.505 554 HH21 ARG 71 1HH2 ARG 71 -18.092 1.629 2.120 555 HH22 ARG 71 2HH2 ARG 71 -19.784 1.639 2.492 556 H ILE 72 H ILE 72 -13.990 -1.550 3.016 557 HA ILE 72 HA ILE 72 -11.836 -3.132 1.713 558 HB ILE 72 HB ILE 72 -13.754 -4.154 3.827 559 HG12 ILE 72 2HG1 ILE 72 -11.191 -4.911 4.496 560 HG13 ILE 72 1HG1 ILE 72 -10.923 -3.326 3.775 561 HG21 ILE 72 1HG2 ILE 72 -12.512 -6.330 3.427 562 HG22 ILE 72 2HG2 ILE 72 -11.844 -5.597 1.968 563 HG23 ILE 72 3HG2 ILE 72 -13.585 -5.841 2.115 564 HD11 ILE 72 1HD1 ILE 72 -11.349 -3.166 6.213 565 HD12 ILE 72 2HD1 ILE 72 -12.924 -3.918 5.971 566 HD13 ILE 72 3HD1 ILE 72 -12.590 -2.334 5.276 567 H LEU 73 H LEU 73 -12.781 -4.878 0.306 568 HA LEU 73 HA LEU 73 -15.522 -4.127 -0.640 569 HB2 LEU 73 2HB LEU 73 -13.643 -3.444 -2.187 570 HB3 LEU 73 1HB LEU 73 -13.248 -5.155 -2.360 571 HG LEU 73 HG LEU 73 -15.820 -5.366 -2.938 572 HD11 LEU 73 1HD1 LEU 73 -16.320 -2.991 -2.442 573 HD12 LEU 73 2HD1 LEU 73 -16.648 -3.375 -4.132 574 HD13 LEU 73 3HD1 LEU 73 -15.181 -2.498 -3.696 575 HD21 LEU 73 1HD2 LEU 73 -15.126 -4.669 -5.377 576 HD22 LEU 73 2HD2 LEU 73 -14.323 -6.036 -4.605 577 HD23 LEU 73 3HD2 LEU 73 -13.528 -4.463 -4.660 578 H GLU 74 H GLU 74 -13.104 -6.747 -0.761 579 HA GLU 74 HA GLU 74 -14.876 -8.725 0.300 580 HB2 GLU 74 2HB GLU 74 -15.977 -8.382 -1.927 581 HB3 GLU 74 1HB GLU 74 -14.472 -8.884 -2.691 582 HG2 GLU 74 2HG GLU 74 -14.605 -11.048 -1.465 583 HG3 GLU 74 1HG GLU 74 -16.164 -10.548 -0.808 584 H TRP 75 H TRP 75 -13.670 -10.533 0.860 585 HA TRP 75 HA TRP 75 -10.847 -10.556 -0.103 586 HB2 TRP 75 2HB TRP 75 -10.231 -11.550 1.956 587 HB3 TRP 75 1HB TRP 75 -11.424 -10.332 2.409 588 HD1 TRP 75 HD TRP 75 -10.788 -14.027 2.412 589 HE1 TRP 75 1HE TRP 75 -12.786 -15.256 3.483 590 HE3 TRP 75 3HE TRP 75 -14.142 -10.186 2.685 591 HZ2 TRP 75 2HZ TRP 75 -15.453 -14.685 4.341 592 HZ3 TRP 75 3HZ TRP 75 -16.401 -10.556 3.632 593 HH2 TRP 75 HH TRP 75 -17.062 -12.798 4.460 594 H ASP 76 H ASP 76 -10.329 -12.178 -1.486 595 HA ASP 76 HA ASP 76 -12.085 -14.590 -1.520 596 HB2 ASP 76 2HB ASP 76 -11.521 -12.875 -3.593 597 HB3 ASP 76 1HB ASP 76 -10.343 -14.165 -3.845 598 HA PRO 77 HA PRO 77 -8.711 -16.930 0.325 599 HB2 PRO 77 2HB PRO 77 -9.577 -18.806 -1.868 600 HB3 PRO 77 1HB PRO 77 -9.159 -19.179 -0.185 601 HG2 PRO 77 2HG PRO 77 -11.697 -18.972 -0.985 602 HG3 PRO 77 1HG PRO 77 -11.173 -18.453 0.625 603 HD2 PRO 77 2HD PRO 77 -12.078 -16.813 -1.642 604 HD3 PRO 77 1HD PRO 77 -11.923 -16.364 0.072 605 HA PRO 78 HA PRO 78 -4.889 -16.225 -1.745 606 HB2 PRO 78 2HB PRO 78 -4.844 -19.198 -2.162 607 HB3 PRO 78 1HB PRO 78 -3.541 -18.123 -1.618 608 HG2 PRO 78 2HG PRO 78 -5.108 -19.624 0.058 609 HG3 PRO 78 1HG PRO 78 -4.244 -18.156 0.535 610 HD2 PRO 78 2HD PRO 78 -7.093 -18.546 0.407 611 HD3 PRO 78 1HD PRO 78 -6.223 -17.062 0.845 612 H HIS 79 H HIS 79 -5.903 -15.183 -3.568 613 HA HIS 79 HA HIS 79 -5.323 -16.160 -6.102 614 HB2 HIS 79 2HB HIS 79 -7.766 -17.357 -4.980 615 HB3 HIS 79 1HB HIS 79 -7.996 -16.626 -6.568 616 HD1 HIS 79 1HD HIS 79 -5.752 -17.287 -8.238 617 HD2 HIS 79 2HD HIS 79 -6.946 -19.969 -5.275 618 HE1 HIS 79 1HE HIS 79 -4.811 -19.548 -8.894 619 HE2 HIS 79 2HE HIS 79 -5.532 -21.186 -7.097 620 H ARG 80 H ARG 80 -7.949 -14.464 -4.303 621 HA ARG 80 HA ARG 80 -7.508 -12.195 -6.167 622 HB2 ARG 80 2HB ARG 80 -9.635 -13.872 -6.559 623 HB3 ARG 80 1HB ARG 80 -10.344 -12.636 -5.524 624 HG2 ARG 80 2HG ARG 80 -8.759 -12.024 -8.033 625 HG3 ARG 80 1HG ARG 80 -10.519 -12.118 -7.978 626 HD2 ARG 80 2HD ARG 80 -8.736 -10.181 -6.490 627 HD3 ARG 80 1HD ARG 80 -9.932 -9.800 -7.726 628 HE ARG 80 HE ARG 80 -10.489 -10.337 -4.906 629 HH11 ARG 80 1HH1 ARG 80 -12.660 -10.140 -4.308 630 HH12 ARG 80 2HH1 ARG 80 -13.881 -10.070 -5.535 631 HH21 ARG 80 1HH2 ARG 80 -11.629 -10.329 -8.159 632 HH22 ARG 80 2HH2 ARG 80 -13.297 -10.178 -7.716 633 H LEU 81 H LEU 81 -7.502 -10.269 -5.165 634 HA LEU 81 HA LEU 81 -8.702 -10.089 -2.429 635 HB2 LEU 81 2HB LEU 81 -6.189 -10.212 -2.365 636 HB3 LEU 81 1HB LEU 81 -6.138 -8.742 -3.338 637 HG LEU 81 HG LEU 81 -7.689 -7.752 -1.478 638 HD11 LEU 81 1HD1 LEU 81 -7.503 -10.325 -0.503 639 HD12 LEU 81 2HD1 LEU 81 -7.967 -8.913 0.447 640 HD13 LEU 81 3HD1 LEU 81 -6.293 -9.469 0.455 641 HD21 LEU 81 1HD2 LEU 81 -5.639 -6.702 -1.545 642 HD22 LEU 81 2HD2 LEU 81 -4.743 -8.221 -1.475 643 HD23 LEU 81 3HD2 LEU 81 -5.453 -7.547 -0.008 644 H ALA 82 H ALA 82 -10.106 -8.385 -2.232 645 HA ALA 82 HA ALA 82 -9.829 -6.106 -4.144 646 HB1 ALA 82 1HB ALA 82 -11.688 -7.920 -4.667 647 HB2 ALA 82 2HB ALA 82 -12.051 -6.202 -4.827 648 HB3 ALA 82 3HB ALA 82 -12.563 -7.081 -3.386 649 H MET 83 H MET 83 -10.161 -4.109 -3.153 650 HA MET 83 HA MET 83 -11.442 -4.093 -0.477 651 HB2 MET 83 2HB MET 83 -8.700 -2.937 -1.034 652 HB3 MET 83 1HB MET 83 -9.583 -2.806 0.487 653 HG2 MET 83 2HG MET 83 -9.626 -5.318 0.598 654 HG3 MET 83 1HG MET 83 -8.572 -5.344 -0.817 655 HE1 MET 83 1HE MET 83 -6.618 -4.001 -1.072 656 HE2 MET 83 2HE MET 83 -5.361 -3.798 0.144 657 HE3 MET 83 3HE MET 83 -6.623 -2.580 -0.018 658 H THR 84 H THR 84 -12.566 -2.194 -0.056 659 HA THR 84 HA THR 84 -12.494 -0.135 -2.220 660 HB THR 84 HB THR 84 -14.487 -0.450 0.051 661 HG1 THR 84 1HG THR 84 -15.495 -1.006 -2.334 662 HG21 THR 84 1HG2 THR 84 -14.033 1.543 -2.012 663 HG22 THR 84 2HG2 THR 84 -15.140 1.590 -0.640 664 HG23 THR 84 3HG2 THR 84 -15.640 0.832 -2.152 665 H TRP 85 H TRP 85 -11.710 1.940 -1.710 666 HA TRP 85 HA TRP 85 -10.753 2.249 1.096 667 HB2 TRP 85 2HB TRP 85 -8.980 3.554 0.312 668 HB3 TRP 85 1HB TRP 85 -9.153 2.332 -0.944 669 HD1 TRP 85 HD TRP 85 -11.383 3.355 -2.722 670 HE1 TRP 85 1HE TRP 85 -11.196 5.569 -4.028 671 HE3 TRP 85 3HE TRP 85 -7.776 5.691 0.029 672 HZ2 TRP 85 2HZ TRP 85 -9.703 8.009 -3.922 673 HZ3 TRP 85 3HZ TRP 85 -6.985 7.954 -0.597 674 HH2 TRP 85 HH TRP 85 -7.941 9.114 -2.566 675 H ARG 86 H ARG 86 -11.917 3.561 2.360 676 HA ARG 86 HA ARG 86 -13.409 5.818 1.068 677 HB2 ARG 86 2HB ARG 86 -14.814 4.055 2.173 678 HB3 ARG 86 1HB ARG 86 -14.003 4.420 3.697 679 HG2 ARG 86 2HG ARG 86 -14.800 6.735 3.588 680 HG3 ARG 86 1HG ARG 86 -15.579 6.410 2.040 681 HD2 ARG 86 2HD ARG 86 -17.276 6.245 3.747 682 HD3 ARG 86 1HD ARG 86 -16.919 4.607 3.198 683 HE ARG 86 HE ARG 86 -15.215 4.959 5.350 684 HH11 ARG 86 1HH1 ARG 86 -15.803 4.443 7.471 685 HH12 ARG 86 2HH1 ARG 86 -17.478 4.438 7.914 686 HH21 ARG 86 1HH2 ARG 86 -18.590 5.336 4.754 687 HH22 ARG 86 2HH2 ARG 86 -19.056 4.943 6.376 688 H ILE 87 H ILE 87 -12.219 7.660 1.392 689 HA ILE 87 HA ILE 87 -11.385 8.296 4.162 690 HB ILE 87 HB ILE 87 -9.431 7.212 2.985 691 HG12 ILE 87 2HG1 ILE 87 -8.851 10.130 3.480 692 HG13 ILE 87 1HG1 ILE 87 -9.349 9.081 4.806 693 HG21 ILE 87 1HG2 ILE 87 -9.459 9.751 1.331 694 HG22 ILE 87 2HG2 ILE 87 -10.039 8.196 0.735 695 HG23 ILE 87 3HG2 ILE 87 -8.345 8.392 1.183 696 HD11 ILE 87 1HD1 ILE 87 -7.257 7.914 3.101 697 HD12 ILE 87 2HD1 ILE 87 -7.355 8.006 4.859 698 HD13 ILE 87 3HD1 ILE 87 -6.757 9.382 3.936 699 H ASP 88 H ASP 88 -10.890 10.628 4.413 700 HA ASP 88 HA ASP 88 -12.422 12.242 2.421 701 HB2 ASP 88 2HB ASP 88 -13.134 12.281 4.840 702 HB3 ASP 88 1HB ASP 88 -11.582 13.021 5.231 703 H GLY 89 H GLY 89 -11.520 14.162 1.589 704 HA2 GLY 89 2HA GLY 89 -8.786 14.139 0.917 705 HA3 GLY 89 1HA GLY 89 -9.815 15.560 0.809 706 H HIS 90 H HIS 90 -10.339 15.426 3.785 707 HA HIS 90 HA HIS 90 -7.963 16.978 4.539 708 HB2 HIS 90 2HB HIS 90 -10.540 16.381 5.995 709 HB3 HIS 90 1HB HIS 90 -9.282 17.447 6.600 710 HD1 HIS 90 1HD HIS 90 -8.525 18.987 4.080 711 HD2 HIS 90 2HD HIS 90 -12.472 18.171 5.146 712 HE1 HIS 90 1HE HIS 90 -9.958 20.716 2.902 713 HE2 HIS 90 2HE HIS 90 -12.364 20.226 3.542 714 H TRP 91 H TRP 91 -8.151 13.866 4.320 715 HA TRP 91 HA TRP 91 -7.221 12.047 5.473 716 HB2 TRP 91 2HB TRP 91 -5.692 14.436 6.327 717 HB3 TRP 91 1HB TRP 91 -5.553 13.033 7.385 718 HD1 TRP 91 HD TRP 91 -4.029 14.462 4.416 719 HE1 TRP 91 1HE TRP 91 -2.696 12.692 3.097 720 HE3 TRP 91 3HE TRP 91 -5.810 10.207 6.604 721 HZ2 TRP 91 2HZ TRP 91 -2.424 9.843 2.986 722 HZ3 TRP 91 3HZ TRP 91 -4.998 7.983 5.871 723 HH2 TRP 91 HH TRP 91 -3.309 7.796 4.069 724 H GLN 92 H GLN 92 -9.667 13.526 6.547 725 HA GLN 92 HA GLN 92 -9.444 12.941 9.440 726 HB2 GLN 92 2HB GLN 92 -11.722 14.088 7.805 727 HB3 GLN 92 1HB GLN 92 -11.726 13.904 9.560 728 HG2 GLN 92 2HG GLN 92 -9.741 15.557 7.973 729 HG3 GLN 92 1HG GLN 92 -11.088 16.193 8.909 730 HE21 GLN 92 1HE2 GLN 92 -7.876 16.021 9.167 731 HE22 GLN 92 2HE2 GLN 92 -7.695 15.731 10.830 732 H SER 93 H SER 93 -12.572 12.462 8.205 733 HA SER 93 HA SER 93 -12.216 9.586 7.711 734 HB2 SER 93 2HB SER 93 -13.512 8.811 9.543 735 HB3 SER 93 1HB SER 93 -12.389 9.969 10.246 736 HG SER 93 HG SER 93 -14.080 11.024 10.880 737 H VAL 94 H VAL 94 -14.207 8.610 6.885 738 HA VAL 94 HA VAL 94 -16.258 10.610 6.027 739 HB VAL 94 HB VAL 94 -16.083 8.554 4.071 740 HG11 VAL 94 1HG1 VAL 94 -16.839 10.864 3.702 741 HG12 VAL 94 2HG1 VAL 94 -15.510 10.471 2.611 742 HG13 VAL 94 3HG1 VAL 94 -15.213 11.460 4.041 743 HG21 VAL 94 1HG2 VAL 94 -13.415 9.892 4.618 744 HG22 VAL 94 2HG2 VAL 94 -13.780 8.754 3.321 745 HG23 VAL 94 3HG2 VAL 94 -13.772 8.206 4.997 746 HA PRO 95 HA PRO 95 -18.341 7.280 8.476 747 HB2 PRO 95 2HB PRO 95 -20.544 9.246 8.027 748 HB3 PRO 95 1HB PRO 95 -20.067 8.404 9.515 749 HG2 PRO 95 2HG PRO 95 -19.481 10.971 9.118 750 HG3 PRO 95 1HG PRO 95 -18.373 9.881 9.969 751 HD2 PRO 95 2HD PRO 95 -18.156 11.011 7.220 752 HD3 PRO 95 1HD PRO 95 -16.870 10.534 8.351 753 H ASP 96 H ASP 96 -18.988 8.613 5.325 754 HA ASP 96 HA ASP 96 -20.394 6.106 4.619 755 HB2 ASP 96 2HB ASP 96 -22.147 7.797 5.231 756 HB3 ASP 96 1HB ASP 96 -21.542 8.813 3.925 757 H ASP 97 H ASP 97 -20.151 5.569 2.401 758 HA ASP 97 HA ASP 97 -17.984 7.057 1.052 759 HB2 ASP 97 2HB ASP 97 -18.091 5.147 -0.578 760 HB3 ASP 97 1HB ASP 97 -17.774 4.639 1.080 761 H ASP 98 H ASP 98 -18.837 8.890 0.101 762 HA ASP 98 HA ASP 98 -21.406 8.780 -1.309 763 HB2 ASP 98 2HB ASP 98 -20.536 10.795 -0.009 764 HB3 ASP 98 1HB ASP 98 -19.406 11.034 -1.338 765 H ARG 99 H ARG 99 -18.035 9.490 -2.188 766 HA ARG 99 HA ARG 99 -18.633 8.458 -4.928 767 HB2 ARG 99 2HB ARG 99 -16.899 10.823 -4.156 768 HB3 ARG 99 1HB ARG 99 -17.027 10.161 -5.785 769 HG2 ARG 99 2HG ARG 99 -19.489 10.583 -5.716 770 HG3 ARG 99 1HG ARG 99 -19.278 11.357 -4.145 771 HD2 ARG 99 2HD ARG 99 -17.638 12.935 -5.229 772 HD3 ARG 99 1HD ARG 99 -18.084 12.238 -6.787 773 HE ARG 99 HE ARG 99 -20.341 13.236 -5.190 774 HH11 ARG 99 1HH1 ARG 99 -21.478 14.939 -6.149 775 HH12 ARG 99 2HH1 ARG 99 -20.801 15.752 -7.519 776 HH21 ARG 99 1HH2 ARG 99 -17.933 13.804 -7.593 777 HH22 ARG 99 2HH2 ARG 99 -18.794 15.111 -8.337 778 H ALA 100 H ALA 100 -17.411 7.170 -2.489 779 HA ALA 100 HA ALA 100 -14.572 6.980 -2.854 780 HB1 ALA 100 1HB ALA 100 -16.217 4.692 -1.802 781 HB2 ALA 100 2HB ALA 100 -16.076 6.182 -0.869 782 HB3 ALA 100 3HB ALA 100 -14.632 5.254 -1.272 783 H SER 101 H SER 101 -13.343 5.340 -3.901 784 HA SER 101 HA SER 101 -14.796 4.004 -6.142 785 HB2 SER 101 2HB SER 101 -11.875 4.756 -5.850 786 HB3 SER 101 1HB SER 101 -12.569 3.935 -7.245 787 HG SER 101 HG SER 101 -14.120 5.910 -7.008 788 H GLU 102 H GLU 102 -13.825 1.865 -6.820 789 HA GLU 102 HA GLU 102 -13.057 0.299 -4.390 790 HB2 GLU 102 2HB GLU 102 -14.365 -0.628 -6.966 791 HB3 GLU 102 1HB GLU 102 -13.980 -1.656 -5.586 792 HG2 GLU 102 2HG GLU 102 -15.456 -0.256 -4.159 793 HG3 GLU 102 1HG GLU 102 -15.883 0.704 -5.575 794 H ILE 103 H ILE 103 -11.362 -1.219 -4.571 795 HA ILE 103 HA ILE 103 -9.566 -0.790 -6.929 796 HB ILE 103 HB ILE 103 -8.807 -1.593 -4.105 797 HG12 ILE 103 2HG1 ILE 103 -8.432 1.073 -5.506 798 HG13 ILE 103 1HG1 ILE 103 -9.679 0.754 -4.297 799 HG21 ILE 103 1HG2 ILE 103 -6.854 -2.157 -5.062 800 HG22 ILE 103 2HG2 ILE 103 -6.657 -0.476 -5.558 801 HG23 ILE 103 3HG2 ILE 103 -7.437 -1.630 -6.641 802 HD11 ILE 103 1HD1 ILE 103 -7.849 1.736 -3.108 803 HD12 ILE 103 2HD1 ILE 103 -6.677 0.697 -3.919 804 HD13 ILE 103 3HD1 ILE 103 -7.798 0.011 -2.742 805 H GLU 104 H GLU 104 -8.884 -2.622 -8.029 806 HA GLU 104 HA GLU 104 -9.817 -5.245 -6.921 807 HB2 GLU 104 2HB GLU 104 -10.838 -4.535 -9.101 808 HB3 GLU 104 1HB GLU 104 -9.223 -4.549 -9.811 809 HG2 GLU 104 2HG GLU 104 -8.991 -6.945 -9.156 810 HG3 GLU 104 1HG GLU 104 -10.651 -6.916 -8.562 811 H VAL 105 H VAL 105 -8.194 -6.515 -6.209 812 HA VAL 105 HA VAL 105 -5.536 -6.310 -7.551 813 HB VAL 105 HB VAL 105 -6.005 -6.744 -4.587 814 HG11 VAL 105 1HG1 VAL 105 -3.544 -6.376 -4.474 815 HG12 VAL 105 2HG1 VAL 105 -3.497 -6.303 -6.236 816 HG13 VAL 105 3HG1 VAL 105 -3.964 -7.800 -5.427 817 HG21 VAL 105 1HG2 VAL 105 -4.896 -4.438 -4.460 818 HG22 VAL 105 2HG2 VAL 105 -6.563 -4.463 -5.036 819 HG23 VAL 105 3HG2 VAL 105 -5.236 -4.293 -6.184 820 H ASP 106 H ASP 106 -4.769 -8.283 -8.216 821 HA ASP 106 HA ASP 106 -6.150 -10.705 -7.128 822 HB2 ASP 106 2HB ASP 106 -4.973 -10.212 -9.876 823 HB3 ASP 106 1HB ASP 106 -5.601 -11.766 -9.325 824 H PHE 107 H PHE 107 -4.851 -12.222 -6.185 825 HA PHE 107 HA PHE 107 -1.899 -11.901 -6.544 826 HB2 PHE 107 2HB PHE 107 -3.576 -12.287 -4.132 827 HB3 PHE 107 1HB PHE 107 -2.068 -13.205 -4.189 828 HD1 PHE 107 1HD PHE 107 -3.559 -9.986 -3.626 829 HD2 PHE 107 2HD PHE 107 0.083 -11.952 -4.771 830 HE1 PHE 107 1HE PHE 107 -2.284 -7.932 -3.078 831 HE2 PHE 107 2HE PHE 107 1.364 -9.898 -4.218 832 HZ PHE 107 HZ PHE 107 0.183 -7.890 -3.372 833 H VAL 108 H VAL 108 -0.995 -13.563 -7.568 834 HA VAL 108 HA VAL 108 -2.102 -16.287 -7.143 835 HB VAL 108 HB VAL 108 -2.023 -14.727 -9.600 836 HG11 VAL 108 1HG1 VAL 108 -1.215 -16.610 -11.045 837 HG12 VAL 108 2HG1 VAL 108 -0.620 -17.416 -9.600 838 HG13 VAL 108 3HG1 VAL 108 0.062 -15.864 -10.089 839 HG21 VAL 108 1HG2 VAL 108 -3.658 -16.322 -10.279 840 HG22 VAL 108 2HG2 VAL 108 -3.900 -16.084 -8.549 841 HG23 VAL 108 3HG2 VAL 108 -3.064 -17.523 -9.133 842 HA PRO 109 HA PRO 109 2.160 -17.206 -6.273 843 HB2 PRO 109 2HB PRO 109 2.242 -19.833 -7.202 844 HB3 PRO 109 1HB PRO 109 1.699 -19.334 -5.592 845 HG2 PRO 109 2HG PRO 109 0.112 -20.066 -7.978 846 HG3 PRO 109 1HG PRO 109 -0.240 -20.319 -6.260 847 HD2 PRO 109 2HD PRO 109 -1.461 -18.382 -7.738 848 HD3 PRO 109 1HD PRO 109 -1.152 -18.208 -5.996 849 H ASN 110 H ASN 110 3.945 -16.661 -7.443 850 HA ASN 110 HA ASN 110 3.940 -17.237 -10.372 851 HB2 ASN 110 2HB ASN 110 3.938 -14.800 -9.576 852 HB3 ASN 110 1HB ASN 110 5.574 -15.112 -9.000 853 HD21 ASN 110 1HD2 ASN 110 6.145 -13.413 -10.724 854 HD22 ASN 110 2HD2 ASN 110 6.364 -13.953 -12.319 855 H GLY 111 H GLY 111 5.320 -18.884 -10.856 856 HA2 GLY 111 2HA GLY 111 7.188 -20.305 -10.732 857 HA3 GLY 111 1HA GLY 111 8.076 -18.877 -10.191 858 H SER 112 H SER 112 9.136 -19.439 -8.341 859 HA SER 112 HA SER 112 7.533 -20.791 -6.207 860 HB2 SER 112 2HB SER 112 10.465 -21.195 -6.817 861 HB3 SER 112 1HB SER 112 9.587 -21.939 -5.487 862 HG SER 112 HG SER 112 8.243 -22.930 -7.059 863 H GLY 113 H GLY 113 7.627 -19.802 -4.218 864 HA2 GLY 113 2HA GLY 113 8.195 -18.217 -2.587 865 HA3 GLY 113 1HA GLY 113 9.810 -18.202 -3.295 866 H GLY 114 H GLY 114 7.138 -17.449 -5.389 867 HA2 GLY 114 2HA GLY 114 7.456 -14.548 -4.953 868 HA3 GLY 114 1HA GLY 114 7.979 -15.157 -6.522 869 H THR 115 H THR 115 5.590 -13.450 -5.472 870 HA THR 115 HA THR 115 3.455 -14.990 -6.884 871 HB THR 115 HB THR 115 1.916 -13.468 -5.527 872 HG1 THR 115 1HG THR 115 4.427 -12.929 -4.408 873 HG21 THR 115 1HG2 THR 115 1.687 -15.417 -4.442 874 HG22 THR 115 2HG2 THR 115 2.965 -14.892 -3.350 875 HG23 THR 115 3HG2 THR 115 3.363 -15.853 -4.773 876 H ARG 116 H ARG 116 2.272 -13.899 -8.455 877 HA ARG 116 HA ARG 116 3.300 -11.187 -9.205 878 HB2 ARG 116 2HB ARG 116 3.664 -12.971 -10.913 879 HB3 ARG 116 1HB ARG 116 1.923 -13.260 -10.951 880 HG2 ARG 116 2HG ARG 116 1.585 -10.872 -11.607 881 HG3 ARG 116 1HG ARG 116 3.337 -10.679 -11.683 882 HD2 ARG 116 2HD ARG 116 3.430 -12.511 -13.374 883 HD3 ARG 116 1HD ARG 116 1.671 -12.595 -13.341 884 HE ARG 116 HE ARG 116 1.580 -10.525 -14.525 885 HH11 ARG 116 1HH1 ARG 116 2.583 -8.973 -15.820 886 HH12 ARG 116 2HH1 ARG 116 4.310 -8.839 -15.812 887 HH21 ARG 116 1HH2 ARG 116 4.765 -11.398 -13.519 888 HH22 ARG 116 2HH2 ARG 116 5.543 -10.211 -14.511 889 H VAL 117 H VAL 117 1.834 -9.547 -8.950 890 HA VAL 117 HA VAL 117 -1.050 -10.309 -8.847 891 HB VAL 117 HB VAL 117 -0.643 -9.831 -6.612 892 HG11 VAL 117 1HG1 VAL 117 0.792 -7.631 -6.154 893 HG12 VAL 117 2HG1 VAL 117 1.444 -8.019 -7.745 894 HG13 VAL 117 3HG1 VAL 117 1.567 -9.191 -6.431 895 HG21 VAL 117 1HG2 VAL 117 -2.313 -8.204 -7.807 896 HG22 VAL 117 2HG2 VAL 117 -1.065 -6.991 -7.527 897 HG23 VAL 117 3HG2 VAL 117 -1.797 -7.833 -6.162 898 H GLU 118 H GLU 118 -2.495 -9.014 -9.858 899 HA GLU 118 HA GLU 118 -1.382 -6.761 -11.469 900 HB2 GLU 118 2HB GLU 118 -2.432 -8.538 -12.799 901 HB3 GLU 118 1HB GLU 118 -3.897 -8.428 -11.826 902 HG2 GLU 118 2HG GLU 118 -4.206 -6.081 -12.580 903 HG3 GLU 118 1HG GLU 118 -2.773 -6.230 -13.592 904 H LEU 119 H LEU 119 -1.828 -4.794 -10.600 905 HA LEU 119 HA LEU 119 -4.305 -4.514 -8.964 906 HB2 LEU 119 2HB LEU 119 -2.103 -4.063 -7.825 907 HB3 LEU 119 1HB LEU 119 -1.857 -2.728 -8.948 908 HG LEU 119 HG LEU 119 -4.492 -2.696 -7.635 909 HD11 LEU 119 1HD1 LEU 119 -3.059 -3.599 -5.801 910 HD12 LEU 119 2HD1 LEU 119 -3.652 -1.973 -5.458 911 HD13 LEU 119 3HD1 LEU 119 -1.988 -2.209 -5.993 912 HD21 LEU 119 1HD2 LEU 119 -2.233 -0.691 -7.933 913 HD22 LEU 119 2HD2 LEU 119 -3.852 -0.316 -7.342 914 HD23 LEU 119 3HD2 LEU 119 -3.622 -0.850 -9.008 915 H ALA 120 H ALA 120 -5.897 -3.280 -9.819 916 HA ALA 120 HA ALA 120 -5.138 -1.230 -11.842 917 HB1 ALA 120 1HB ALA 120 -7.443 -3.187 -12.019 918 HB2 ALA 120 2HB ALA 120 -6.018 -3.151 -13.060 919 HB3 ALA 120 3HB ALA 120 -7.190 -1.833 -13.121 920 H HIS 121 H HIS 121 -6.156 0.718 -11.585 921 HA HIS 121 HA HIS 121 -8.367 0.855 -9.570 922 HB2 HIS 121 2HB HIS 121 -7.207 2.401 -8.410 923 HB3 HIS 121 1HB HIS 121 -5.823 2.079 -9.450 924 HD1 HIS 121 1HD HIS 121 -9.089 4.000 -10.070 925 HD2 HIS 121 2HD HIS 121 -4.965 4.521 -10.385 926 HE1 HIS 121 1HE HIS 121 -8.729 6.306 -11.055 927 HE2 HIS 121 2HE HIS 121 -6.223 6.637 -11.240 928 H VAL 122 H VAL 122 -10.173 2.015 -10.195 929 HA VAL 122 HA VAL 122 -9.984 3.587 -12.718 930 HB VAL 122 HB VAL 122 -12.102 2.573 -13.507 931 HG11 VAL 122 1HG1 VAL 122 -11.154 0.446 -14.199 932 HG12 VAL 122 2HG1 VAL 122 -10.013 0.472 -12.855 933 HG13 VAL 122 3HG1 VAL 122 -9.860 1.643 -14.165 934 HG21 VAL 122 1HG2 VAL 122 -12.543 0.278 -12.228 935 HG22 VAL 122 2HG2 VAL 122 -13.273 1.783 -11.667 936 HG23 VAL 122 3HG2 VAL 122 -11.820 1.159 -10.882 937 H LYS 123 H LYS 123 -11.392 5.338 -12.808 938 HA LYS 123 HA LYS 123 -12.721 7.066 -11.954 939 HB2 LYS 123 2HB LYS 123 -14.091 4.750 -10.558 940 HB3 LYS 123 1HB LYS 123 -14.778 6.350 -10.840 941 HG2 LYS 123 2HG LYS 123 -14.525 6.002 -13.287 942 HG3 LYS 123 1HG LYS 123 -13.926 4.373 -12.972 943 HD2 LYS 123 2HD LYS 123 -16.073 3.903 -11.743 944 HD3 LYS 123 1HD LYS 123 -16.669 5.467 -12.303 945 HE2 LYS 123 2HE LYS 123 -16.164 4.704 -14.665 946 HE3 LYS 123 1HE LYS 123 -15.854 3.097 -14.002 947 HZ1 LYS 123 1HZ LYS 123 -18.357 4.465 -14.417 948 HZ2 LYS 123 2HZ LYS 123 -18.218 3.739 -12.886 949 HZ3 LYS 123 3HZ LYS 123 -18.036 2.804 -14.294 950 H LEU 124 H LEU 124 -10.310 6.218 -10.336 951 HA LEU 124 HA LEU 124 -10.988 6.361 -7.544 952 HB2 LEU 124 2HB LEU 124 -8.765 5.606 -8.374 953 HB3 LEU 124 1HB LEU 124 -8.422 7.258 -8.896 954 HG LEU 124 HG LEU 124 -8.782 7.999 -6.515 955 HD11 LEU 124 1HD1 LEU 124 -10.052 6.350 -5.460 956 HD12 LEU 124 2HD1 LEU 124 -8.432 5.949 -4.892 957 HD13 LEU 124 3HD1 LEU 124 -9.155 5.032 -6.213 958 HD21 LEU 124 1HD2 LEU 124 -6.582 6.542 -7.674 959 HD22 LEU 124 2HD2 LEU 124 -6.653 6.215 -5.942 960 HD23 LEU 124 3HD2 LEU 124 -6.532 7.877 -6.521 961 H HIS 125 H HIS 125 -10.193 8.815 -9.969 962 HA HIS 125 HA HIS 125 -10.113 11.042 -8.202 963 HB2 HIS 125 2HB HIS 125 -9.322 11.224 -10.509 964 HB3 HIS 125 1HB HIS 125 -10.964 10.964 -11.100 965 HD1 HIS 125 1HD HIS 125 -10.894 12.905 -8.027 966 HD2 HIS 125 2HD HIS 125 -10.658 13.771 -12.099 967 HE1 HIS 125 1HE HIS 125 -11.386 15.370 -8.256 968 HE2 HIS 125 2HE HIS 125 -11.233 15.920 -10.733 969 H ARG 126 H ARG 126 -12.821 9.293 -9.606 970 HA ARG 126 HA ARG 126 -14.890 11.135 -9.403 971 HB2 ARG 126 2HB ARG 126 -16.338 9.329 -9.379 972 HB3 ARG 126 1HB ARG 126 -14.868 8.511 -9.897 973 HG2 ARG 126 2HG ARG 126 -14.402 8.061 -7.427 974 HG3 ARG 126 1HG ARG 126 -16.053 8.598 -7.117 975 HD2 ARG 126 2HD ARG 126 -16.655 6.885 -9.026 976 HD3 ARG 126 1HD ARG 126 -15.105 6.166 -8.589 977 HE ARG 126 HE ARG 126 -16.064 5.457 -6.543 978 HH11 ARG 126 1HH1 ARG 126 -17.839 5.199 -5.157 979 HH12 ARG 126 2HH1 ARG 126 -19.264 6.148 -5.412 980 HH21 ARG 126 1HH2 ARG 126 -17.987 7.808 -8.174 981 HH22 ARG 126 2HH2 ARG 126 -19.348 7.625 -7.120 982 H HIS 127 H HIS 127 -13.078 9.577 -6.848 983 HA HIS 127 HA HIS 127 -14.763 10.211 -4.645 984 HB2 HIS 127 2HB HIS 127 -12.691 8.731 -4.623 985 HB3 HIS 127 1HB HIS 127 -11.738 10.213 -4.608 986 HD1 HIS 127 1HD HIS 127 -14.287 11.459 -2.756 987 HD2 HIS 127 2HD HIS 127 -11.604 8.382 -1.898 988 HE1 HIS 127 1HE HIS 127 -14.252 11.219 -0.231 989 HE2 HIS 127 2HE HIS 127 -12.626 9.347 0.299 990 H GLY 128 H GLY 128 -12.245 12.072 -6.294 991 HA2 GLY 128 2HA GLY 128 -11.571 14.316 -5.976 992 HA3 GLY 128 1HA GLY 128 -13.312 14.593 -6.066 993 H ASP 129 H ASP 129 -13.517 16.159 -4.484 994 HA ASP 129 HA ASP 129 -13.543 17.092 -2.329 995 HB2 ASP 129 2HB ASP 129 -13.786 14.142 -1.670 996 HB3 ASP 129 1HB ASP 129 -14.073 15.446 -0.518 997 H GLY 130 H GLY 130 -10.925 16.578 -3.464 998 HA2 GLY 130 2HA GLY 130 -8.728 16.869 -2.670 999 HA3 GLY 130 1HA GLY 130 -9.359 16.813 -1.028 1000 H ALA 131 H ALA 131 -10.262 14.131 -3.016 1001 HA ALA 131 HA ALA 131 -9.054 12.207 -1.313 1002 HB1 ALA 131 1HB ALA 131 -10.883 11.825 -3.066 1003 HB2 ALA 131 2HB ALA 131 -9.640 10.580 -2.968 1004 HB3 ALA 131 3HB ALA 131 -9.587 11.776 -4.263 1005 H TRP 132 H TRP 132 -7.891 13.722 -4.299 1006 HA TRP 132 HA TRP 132 -5.560 12.153 -4.660 1007 HB2 TRP 132 2HB TRP 132 -6.388 13.753 -6.348 1008 HB3 TRP 132 1HB TRP 132 -5.954 15.092 -5.284 1009 HD1 TRP 132 HD TRP 132 -3.717 16.115 -5.836 1010 HE1 TRP 132 1HE TRP 132 -1.491 15.287 -6.836 1011 HE3 TRP 132 3HE TRP 132 -4.844 11.176 -6.570 1012 HZ2 TRP 132 2HZ TRP 132 -0.347 12.861 -7.806 1013 HZ3 TRP 132 3HZ TRP 132 -3.157 9.640 -7.526 1014 HH2 TRP 132 HH TRP 132 -0.915 10.478 -8.148 1015 H ASN 133 H ASN 133 -6.190 14.865 -2.495 1016 HA ASN 133 HA ASN 133 -3.536 15.509 -1.772 1017 HB2 ASN 133 2HB ASN 133 -5.681 16.658 -0.998 1018 HB3 ASN 133 1HB ASN 133 -5.839 15.361 0.187 1019 HD21 ASN 133 1HD2 ASN 133 -5.562 17.733 1.405 1020 HD22 ASN 133 2HD2 ASN 133 -3.980 18.001 1.958 1021 H ILE 134 H ILE 134 -5.648 12.897 -0.629 1022 HA ILE 134 HA ILE 134 -3.898 11.907 1.409 1023 HB ILE 134 HB ILE 134 -6.098 10.679 -0.230 1024 HG12 ILE 134 2HG1 ILE 134 -7.287 10.722 1.859 1025 HG13 ILE 134 1HG1 ILE 134 -5.811 11.080 2.756 1026 HG21 ILE 134 1HG2 ILE 134 -4.936 8.713 0.076 1027 HG22 ILE 134 2HG2 ILE 134 -5.735 8.802 1.645 1028 HG23 ILE 134 3HG2 ILE 134 -4.061 9.326 1.478 1029 HD11 ILE 134 1HD1 ILE 134 -7.333 13.074 2.321 1030 HD12 ILE 134 2HD1 ILE 134 -6.904 12.917 0.620 1031 HD13 ILE 134 3HD1 ILE 134 -5.659 13.277 1.814 1032 H HIS 135 H HIS 135 -4.172 11.195 -2.062 1033 HA HIS 135 HA HIS 135 -2.292 9.072 -2.168 1034 HB2 HIS 135 2HB HIS 135 -3.324 9.364 -4.216 1035 HB3 HIS 135 1HB HIS 135 -3.256 11.124 -4.116 1036 HD1 HIS 135 1HD HIS 135 -1.247 8.138 -5.155 1037 HD2 HIS 135 2HD HIS 135 -0.759 12.273 -4.915 1038 HE1 HIS 135 1HE HIS 135 0.886 8.687 -6.412 1039 HE2 HIS 135 2HE HIS 135 1.190 11.199 -6.272 1040 H LYS 136 H LYS 136 -1.802 12.594 -2.221 1041 HA LYS 136 HA LYS 136 0.973 12.621 -2.752 1042 HB2 LYS 136 2HB LYS 136 -0.660 14.446 -0.982 1043 HB3 LYS 136 1HB LYS 136 0.980 14.790 -1.513 1044 HG2 LYS 136 2HG LYS 136 0.201 14.605 -3.872 1045 HG3 LYS 136 1HG LYS 136 -1.443 14.410 -3.277 1046 HD2 LYS 136 2HD LYS 136 -1.239 16.607 -2.107 1047 HD3 LYS 136 1HD LYS 136 0.352 16.812 -2.842 1048 HE2 LYS 136 2HE LYS 136 -1.229 16.165 -5.011 1049 HE3 LYS 136 1HE LYS 136 -2.311 17.154 -4.030 1050 HZ1 LYS 136 1HZ LYS 136 -1.114 18.977 -4.424 1051 HZ2 LYS 136 2HZ LYS 136 -0.422 18.106 -5.708 1052 HZ3 LYS 136 3HZ LYS 136 0.369 18.185 -4.206 1053 H ALA 137 H ALA 137 -0.762 12.218 0.319 1054 HA ALA 137 HA ALA 137 1.617 12.103 1.947 1055 HB1 ALA 137 1HB ALA 137 -1.262 11.684 2.304 1056 HB2 ALA 137 2HB ALA 137 -0.075 12.322 3.440 1057 HB3 ALA 137 3HB ALA 137 -0.285 10.581 3.273 1058 H LEU 138 H LEU 138 -0.244 9.732 0.131 1059 HA LEU 138 HA LEU 138 1.347 7.493 1.167 1060 HB2 LEU 138 2HB LEU 138 -0.699 7.549 -1.065 1061 HB3 LEU 138 1HB LEU 138 -0.074 6.121 -0.260 1062 HG LEU 138 HG LEU 138 -1.742 8.315 0.994 1063 HD11 LEU 138 1HD1 LEU 138 -3.037 6.736 -0.359 1064 HD12 LEU 138 2HD1 LEU 138 -3.340 6.438 1.352 1065 HD13 LEU 138 3HD1 LEU 138 -2.261 5.375 0.449 1066 HD21 LEU 138 1HD2 LEU 138 -1.645 6.513 2.916 1067 HD22 LEU 138 2HD2 LEU 138 -0.333 7.680 2.737 1068 HD23 LEU 138 3HD2 LEU 138 -0.145 6.042 2.117 1069 H ASP 139 H ASP 139 1.772 9.890 -1.115 1070 HA ASP 139 HA ASP 139 3.072 8.252 -3.163 1071 HB2 ASP 139 2HB ASP 139 1.930 10.415 -3.692 1072 HB3 ASP 139 1HB ASP 139 3.172 11.256 -2.766 1073 H GLY 140 H GLY 140 4.986 7.333 -2.672 1074 HA2 GLY 140 2HA GLY 140 6.893 8.832 -0.939 1075 HA3 GLY 140 1HA GLY 140 6.900 7.083 -1.147 1076 HA PRO 141 HA PRO 141 10.162 9.182 -3.874 1077 HB2 PRO 141 2HB PRO 141 11.595 6.743 -2.940 1078 HB3 PRO 141 1HB PRO 141 12.176 8.414 -3.069 1079 HG2 PRO 141 2HG PRO 141 11.586 7.297 -0.713 1080 HG3 PRO 141 1HG PRO 141 11.306 9.016 -1.040 1081 HD2 PRO 141 2HD PRO 141 9.327 6.792 -0.843 1082 HD3 PRO 141 1HD PRO 141 9.133 8.516 -0.457 1083 H SER 142 H SER 142 10.759 8.459 -5.967 1084 HA SER 142 HA SER 142 10.478 7.235 -7.947 1085 HB2 SER 142 2HB SER 142 11.914 5.556 -7.237 1086 HB3 SER 142 1HB SER 142 10.933 5.167 -5.827 1087 HG SER 142 HG SER 142 10.918 3.672 -7.725 1088 HA PRO 143 HA PRO 143 5.896 6.965 -6.810 1089 HB2 PRO 143 2HB PRO 143 5.779 8.627 -9.268 1090 HB3 PRO 143 1HB PRO 143 4.955 8.853 -7.714 1091 HG2 PRO 143 2HG PRO 143 7.013 10.385 -8.468 1092 HG3 PRO 143 1HG PRO 143 6.733 9.941 -6.776 1093 HD2 PRO 143 2HD PRO 143 8.787 8.902 -8.679 1094 HD3 PRO 143 1HD PRO 143 8.879 9.111 -6.916 1095 H GLY 144 H GLY 144 4.397 5.608 -7.862 1096 HA2 GLY 144 2HA GLY 144 4.312 4.913 -10.580 1097 HA3 GLY 144 1HA GLY 144 5.431 3.776 -9.828 1098 H GLU 145 H GLU 145 3.538 2.317 -10.634 1099 HA GLU 145 HA GLU 145 0.997 2.273 -9.443 1100 HB2 GLU 145 2HB GLU 145 2.763 -0.096 -10.131 1101 HB3 GLU 145 1HB GLU 145 1.026 -0.174 -9.837 1102 HG2 GLU 145 2HG GLU 145 1.070 0.009 -12.155 1103 HG3 GLU 145 1HG GLU 145 0.926 1.701 -11.686 1104 H THR 146 H THR 146 0.184 1.122 -7.572 1105 HA THR 146 HA THR 146 1.660 1.521 -5.187 1106 HB THR 146 HB THR 146 -0.598 -0.413 -5.731 1107 HG1 THR 146 1HG THR 146 -0.853 1.946 -6.035 1108 HG21 THR 146 1HG2 THR 146 0.831 0.416 -3.234 1109 HG22 THR 146 2HG2 THR 146 0.233 -1.177 -3.703 1110 HG23 THR 146 3HG2 THR 146 -0.896 0.064 -3.158 1111 H LEU 147 H LEU 147 1.369 -1.308 -7.279 1112 HA LEU 147 HA LEU 147 2.683 -3.176 -5.590 1113 HB2 LEU 147 2HB LEU 147 2.796 -3.064 -8.614 1114 HB3 LEU 147 1HB LEU 147 3.001 -4.486 -7.588 1115 HG LEU 147 HG LEU 147 0.477 -2.831 -7.834 1116 HD11 LEU 147 1HD1 LEU 147 0.592 -5.733 -8.475 1117 HD12 LEU 147 2HD1 LEU 147 1.362 -4.640 -9.624 1118 HD13 LEU 147 3HD1 LEU 147 -0.347 -4.449 -9.236 1119 HD21 LEU 147 1HD2 LEU 147 0.394 -3.617 -5.640 1120 HD22 LEU 147 2HD2 LEU 147 1.340 -5.058 -6.013 1121 HD23 LEU 147 3HD2 LEU 147 -0.350 -4.960 -6.507 1122 H ALA 148 H ALA 148 3.909 -0.628 -7.675 1123 HA ALA 148 HA ALA 148 6.615 -1.478 -7.885 1124 HB1 ALA 148 1HB ALA 148 7.131 0.842 -8.404 1125 HB2 ALA 148 2HB ALA 148 5.623 1.380 -7.664 1126 HB3 ALA 148 3HB ALA 148 5.587 0.432 -9.151 1127 H ARG 149 H ARG 149 5.245 0.884 -5.565 1128 HA ARG 149 HA ARG 149 7.614 0.994 -3.957 1129 HB2 ARG 149 2HB ARG 149 4.741 1.643 -3.297 1130 HB3 ARG 149 1HB ARG 149 6.106 2.030 -2.259 1131 HG2 ARG 149 2HG ARG 149 7.108 3.330 -4.152 1132 HG3 ARG 149 1HG ARG 149 5.631 3.042 -5.074 1133 HD2 ARG 149 2HD ARG 149 5.424 5.206 -4.013 1134 HD3 ARG 149 1HD ARG 149 4.340 4.089 -3.184 1135 HE ARG 149 HE ARG 149 7.043 4.461 -2.030 1136 HH11 ARG 149 1HH1 ARG 149 7.023 5.086 0.134 1137 HH12 ARG 149 2HH1 ARG 149 5.531 5.561 0.874 1138 HH21 ARG 149 1HH2 ARG 149 3.640 5.076 -1.986 1139 HH22 ARG 149 2HH2 ARG 149 3.623 5.553 -0.323 1140 H PHE 150 H PHE 150 4.643 -0.927 -3.728 1141 HA PHE 150 HA PHE 150 5.201 -2.127 -1.197 1142 HB2 PHE 150 2HB PHE 150 2.985 -2.205 -2.275 1143 HB3 PHE 150 1HB PHE 150 3.642 -3.233 -3.546 1144 HD1 PHE 150 1HD PHE 150 4.098 -5.564 -3.180 1145 HD2 PHE 150 2HD PHE 150 2.802 -3.056 0.058 1146 HE1 PHE 150 1HE PHE 150 3.690 -7.573 -1.789 1147 HE2 PHE 150 2HE PHE 150 2.392 -5.069 1.449 1148 HZ PHE 150 HZ PHE 150 2.838 -7.326 0.524 1149 H ALA 151 H ALA 151 5.997 -3.183 -4.514 1150 HA ALA 151 HA ALA 151 7.159 -5.682 -3.721 1151 HB1 ALA 151 1HB ALA 151 7.887 -5.877 -5.944 1152 HB2 ALA 151 2HB ALA 151 8.091 -4.135 -6.128 1153 HB3 ALA 151 3HB ALA 151 6.472 -4.834 -6.087 1154 H ASN 152 H ASN 152 8.584 -2.455 -4.202 1155 HA ASN 152 HA ASN 152 11.299 -3.244 -3.892 1156 HB2 ASN 152 2HB ASN 152 9.950 -0.634 -3.193 1157 HB3 ASN 152 1HB ASN 152 11.695 -0.864 -3.267 1158 HD21 ASN 152 1HD2 ASN 152 10.367 0.981 -5.014 1159 HD22 ASN 152 2HD2 ASN 152 10.478 0.389 -6.602 1160 H VAL 153 H VAL 153 8.993 -2.042 -1.443 1161 HA VAL 153 HA VAL 153 10.855 -2.345 0.733 1162 HB VAL 153 HB VAL 153 8.917 -1.967 2.167 1163 HG11 VAL 153 1HG1 VAL 153 7.976 -0.065 0.299 1164 HG12 VAL 153 2HG1 VAL 153 9.687 -0.304 -0.055 1165 HG13 VAL 153 3HG1 VAL 153 9.181 0.184 1.562 1166 HG21 VAL 153 1HG2 VAL 153 7.318 -3.428 1.011 1167 HG22 VAL 153 2HG2 VAL 153 7.321 -2.344 -0.380 1168 HG23 VAL 153 3HG2 VAL 153 6.655 -1.802 1.159 1169 H ILE 154 H ILE 154 8.389 -4.452 -0.681 1170 HA ILE 154 HA ILE 154 8.772 -6.491 1.391 1171 HB ILE 154 HB ILE 154 7.104 -6.242 -1.088 1172 HG12 ILE 154 2HG1 ILE 154 6.702 -5.554 1.541 1173 HG13 ILE 154 1HG1 ILE 154 5.419 -5.857 0.378 1174 HG21 ILE 154 1HG2 ILE 154 7.643 -8.751 0.496 1175 HG22 ILE 154 2HG2 ILE 154 7.823 -8.504 -1.242 1176 HG23 ILE 154 3HG2 ILE 154 6.216 -8.544 -0.522 1177 HD11 ILE 154 1HD1 ILE 154 5.183 -8.138 1.113 1178 HD12 ILE 154 2HD1 ILE 154 5.207 -7.130 2.559 1179 HD13 ILE 154 3HD1 ILE 154 6.648 -8.032 2.091 Start of MODEL 17 1 H1 MET 1 1HT MET 1 4.378 14.546 -7.084 2 H2 MET 1 2HT MET 1 5.270 13.414 -6.186 3 H3 MET 1 3HT MET 1 4.347 14.596 -5.388 4 HA MET 1 HA MET 1 3.131 12.592 -5.240 5 HB2 MET 1 2HB MET 1 1.636 13.644 -7.536 6 HB3 MET 1 1HB MET 1 1.164 13.558 -5.839 7 HG2 MET 1 2HG MET 1 2.788 15.511 -5.458 8 HG3 MET 1 1HG MET 1 2.804 15.691 -7.212 9 HE1 MET 1 1HE MET 1 1.268 16.759 -8.548 10 HE2 MET 1 2HE MET 1 1.744 18.046 -7.444 11 HE3 MET 1 3HE MET 1 0.058 17.888 -7.925 12 HA PRO 2 HA PRO 2 3.529 9.640 -8.529 13 HB2 PRO 2 2HB PRO 2 1.054 8.439 -8.618 14 HB3 PRO 2 1HB PRO 2 2.232 8.184 -7.322 15 HG2 PRO 2 2HG PRO 2 -0.299 9.579 -7.239 16 HG3 PRO 2 1HG PRO 2 0.760 9.101 -5.907 17 HD2 PRO 2 2HD PRO 2 0.467 11.725 -7.155 18 HD3 PRO 2 1HD PRO 2 1.341 11.289 -5.668 19 H GLU 3 H GLU 3 2.695 8.866 -10.722 20 HA GLU 3 HA GLU 3 2.276 10.925 -12.541 21 HB2 GLU 3 2HB GLU 3 1.058 8.158 -12.726 22 HB3 GLU 3 1HB GLU 3 1.368 9.244 -14.077 23 HG2 GLU 3 2HG GLU 3 3.802 9.190 -13.504 24 HG3 GLU 3 1HG GLU 3 3.446 7.999 -12.251 25 H GLU 4 H GLU 4 0.308 11.800 -13.530 26 HA GLU 4 HA GLU 4 -1.707 12.583 -11.760 27 HB2 GLU 4 2HB GLU 4 -2.003 12.093 -14.744 28 HB3 GLU 4 1HB GLU 4 -3.098 13.059 -13.753 29 HG2 GLU 4 2HG GLU 4 -1.202 14.554 -13.158 30 HG3 GLU 4 1HG GLU 4 -0.155 13.618 -14.226 31 H ILE 5 H ILE 5 -3.863 11.768 -11.364 32 HA ILE 5 HA ILE 5 -4.122 9.102 -10.748 33 HB ILE 5 HB ILE 5 -6.569 10.323 -11.917 34 HG12 ILE 5 2HG1 ILE 5 -4.908 11.559 -9.728 35 HG13 ILE 5 1HG1 ILE 5 -5.709 12.347 -11.082 36 HG21 ILE 5 1HG2 ILE 5 -6.194 9.406 -9.088 37 HG22 ILE 5 2HG2 ILE 5 -6.219 8.202 -10.377 38 HG23 ILE 5 3HG2 ILE 5 -7.608 9.261 -10.132 39 HD11 ILE 5 1HD1 ILE 5 -7.197 12.868 -9.380 40 HD12 ILE 5 2HD1 ILE 5 -6.869 11.376 -8.500 41 HD13 ILE 5 3HD1 ILE 5 -7.888 11.346 -9.939 42 HA PRO 6 HA PRO 6 -4.244 7.599 -15.066 43 HB2 PRO 6 2HB PRO 6 -2.967 5.265 -14.687 44 HB3 PRO 6 1HB PRO 6 -2.086 6.806 -14.684 45 HG2 PRO 6 2HG PRO 6 -2.869 5.070 -12.412 46 HG3 PRO 6 1HG PRO 6 -1.438 6.092 -12.617 47 HD2 PRO 6 2HD PRO 6 -3.763 6.756 -11.149 48 HD3 PRO 6 1HD PRO 6 -2.454 7.862 -11.608 49 H ASP 7 H ASP 7 -5.595 6.011 -16.097 50 HA ASP 7 HA ASP 7 -7.803 5.031 -14.534 51 HB2 ASP 7 2HB ASP 7 -6.857 4.329 -17.334 52 HB3 ASP 7 1HB ASP 7 -8.389 3.800 -16.643 53 H VAL 8 H VAL 8 -7.395 2.368 -16.280 54 HA VAL 8 HA VAL 8 -6.766 0.664 -14.117 55 HB VAL 8 HB VAL 8 -6.185 0.126 -17.049 56 HG11 VAL 8 1HG1 VAL 8 -7.172 -2.060 -15.388 57 HG12 VAL 8 2HG1 VAL 8 -5.658 -1.399 -14.771 58 HG13 VAL 8 3HG1 VAL 8 -5.748 -2.001 -16.427 59 HG21 VAL 8 1HG2 VAL 8 -8.724 -0.293 -15.438 60 HG22 VAL 8 2HG2 VAL 8 -8.476 -0.803 -17.107 61 HG23 VAL 8 3HG2 VAL 8 -8.502 0.913 -16.704 62 H ARG 9 H ARG 9 -4.836 0.062 -13.185 63 HA ARG 9 HA ARG 9 -2.402 1.411 -14.168 64 HB2 ARG 9 2HB ARG 9 -2.937 -0.189 -11.657 65 HB3 ARG 9 1HB ARG 9 -1.406 0.596 -12.029 66 HG2 ARG 9 2HG ARG 9 -2.606 2.775 -12.193 67 HG3 ARG 9 1HG ARG 9 -4.092 1.960 -11.703 68 HD2 ARG 9 2HD ARG 9 -2.907 1.207 -9.614 69 HD3 ARG 9 1HD ARG 9 -1.544 2.221 -10.087 70 HE ARG 9 HE ARG 9 -4.140 3.173 -9.085 71 HH11 ARG 9 1HH1 ARG 9 -4.219 5.395 -8.680 72 HH12 ARG 9 2HH1 ARG 9 -2.949 6.415 -9.268 73 HH21 ARG 9 1HH2 ARG 9 -1.182 3.820 -10.736 74 HH22 ARG 9 2HH2 ARG 9 -1.230 5.524 -10.432 75 H LYS 10 H LYS 10 -0.673 -0.709 -12.946 76 HA LYS 10 HA LYS 10 -0.991 -2.801 -15.055 77 HB2 LYS 10 2HB LYS 10 1.371 -2.747 -15.514 78 HB3 LYS 10 1HB LYS 10 0.767 -1.094 -15.624 79 HG2 LYS 10 2HG LYS 10 1.493 -0.730 -13.250 80 HG3 LYS 10 1HG LYS 10 2.222 -2.335 -13.276 81 HD2 LYS 10 2HD LYS 10 3.943 -0.697 -13.785 82 HD3 LYS 10 1HD LYS 10 3.601 -1.632 -15.240 83 HE2 LYS 10 2HE LYS 10 2.764 0.169 -16.346 84 HE3 LYS 10 1HE LYS 10 1.909 0.762 -14.921 85 HZ1 LYS 10 1HZ LYS 10 3.702 2.250 -15.609 86 HZ2 LYS 10 2HZ LYS 10 4.833 1.002 -15.382 87 HZ3 LYS 10 3HZ LYS 10 3.972 1.624 -14.056 88 H SER 11 H SER 11 0.906 -4.556 -14.504 89 HA SER 11 HA SER 11 0.441 -5.305 -11.641 90 HB2 SER 11 2HB SER 11 0.441 -7.604 -12.316 91 HB3 SER 11 1HB SER 11 -0.601 -6.762 -13.454 92 HG SER 11 HG SER 11 0.979 -8.191 -14.420 93 H VAL 12 H VAL 12 2.205 -6.310 -10.533 94 HA VAL 12 HA VAL 12 4.846 -6.180 -11.892 95 HB VAL 12 HB VAL 12 4.062 -4.843 -9.320 96 HG11 VAL 12 1HG1 VAL 12 6.760 -5.884 -10.175 97 HG12 VAL 12 2HG1 VAL 12 5.961 -6.072 -8.615 98 HG13 VAL 12 3HG1 VAL 12 6.615 -4.504 -9.088 99 HG21 VAL 12 1HG2 VAL 12 4.007 -3.458 -11.311 100 HG22 VAL 12 2HG2 VAL 12 5.606 -4.028 -11.796 101 HG23 VAL 12 3HG2 VAL 12 5.429 -3.009 -10.367 102 H VAL 13 H VAL 13 6.404 -7.645 -11.008 103 HA VAL 13 HA VAL 13 5.146 -9.864 -9.473 104 HB VAL 13 HB VAL 13 7.786 -9.791 -10.966 105 HG11 VAL 13 1HG1 VAL 13 6.221 -11.944 -9.545 106 HG12 VAL 13 2HG1 VAL 13 7.923 -11.521 -9.358 107 HG13 VAL 13 3HG1 VAL 13 7.374 -12.341 -10.820 108 HG21 VAL 13 1HG2 VAL 13 6.700 -10.674 -12.826 109 HG22 VAL 13 2HG2 VAL 13 5.458 -9.580 -12.215 110 HG23 VAL 13 3HG2 VAL 13 5.360 -11.307 -11.869 111 H VAL 14 H VAL 14 5.834 -10.357 -7.421 112 HA VAL 14 HA VAL 14 8.225 -8.887 -6.376 113 HB VAL 14 HB VAL 14 7.071 -8.536 -4.278 114 HG11 VAL 14 1HG1 VAL 14 6.400 -7.283 -6.630 115 HG12 VAL 14 2HG1 VAL 14 5.861 -6.767 -5.032 116 HG13 VAL 14 3HG1 VAL 14 4.821 -7.785 -6.028 117 HG21 VAL 14 1HG2 VAL 14 4.930 -10.248 -5.563 118 HG22 VAL 14 2HG2 VAL 14 4.612 -9.239 -4.152 119 HG23 VAL 14 3HG2 VAL 14 5.793 -10.545 -4.053 120 H ALA 15 H ALA 15 9.344 -10.022 -4.627 121 HA ALA 15 HA ALA 15 9.136 -12.951 -4.948 122 HB1 ALA 15 1HB ALA 15 11.361 -12.857 -4.645 123 HB2 ALA 15 2HB ALA 15 11.120 -12.203 -3.024 124 HB3 ALA 15 3HB ALA 15 11.249 -11.113 -4.405 125 H ALA 16 H ALA 16 7.277 -13.497 -3.769 126 HA ALA 16 HA ALA 16 7.611 -13.752 -0.906 127 HB1 ALA 16 1HB ALA 16 5.730 -11.660 -2.005 128 HB2 ALA 16 2HB ALA 16 6.901 -11.503 -0.695 129 HB3 ALA 16 3HB ALA 16 5.424 -12.435 -0.449 130 H SER 17 H SER 17 6.003 -15.198 -0.034 131 HA SER 17 HA SER 17 4.819 -16.958 -2.008 132 HB2 SER 17 2HB SER 17 4.090 -18.269 -0.148 133 HB3 SER 17 1HB SER 17 5.648 -17.601 0.327 134 HG SER 17 HG SER 17 4.666 -16.595 1.879 135 H VAL 18 H VAL 18 2.509 -17.361 -2.262 136 HA VAL 18 HA VAL 18 0.953 -14.992 -2.524 137 HB VAL 18 HB VAL 18 -0.520 -17.549 -2.194 138 HG11 VAL 18 1HG1 VAL 18 -1.138 -15.185 -3.310 139 HG12 VAL 18 2HG1 VAL 18 -1.806 -16.702 -3.907 140 HG13 VAL 18 3HG1 VAL 18 -0.426 -15.967 -4.719 141 HG21 VAL 18 1HG2 VAL 18 1.319 -18.631 -3.152 142 HG22 VAL 18 2HG2 VAL 18 1.807 -17.203 -4.067 143 HG23 VAL 18 3HG2 VAL 18 0.410 -18.145 -4.583 144 H GLU 19 H GLU 19 1.005 -17.504 -0.013 145 HA GLU 19 HA GLU 19 -1.175 -16.521 1.536 146 HB2 GLU 19 2HB GLU 19 1.352 -17.946 2.427 147 HB3 GLU 19 1HB GLU 19 -0.077 -17.713 3.434 148 HG2 GLU 19 2HG GLU 19 -1.437 -18.939 1.754 149 HG3 GLU 19 1HG GLU 19 0.025 -19.224 0.807 150 H HIS 20 H HIS 20 2.240 -15.625 1.420 151 HA HIS 20 HA HIS 20 2.298 -13.914 3.688 152 HB2 HIS 20 2HB HIS 20 4.270 -14.745 2.324 153 HB3 HIS 20 1HB HIS 20 3.841 -13.543 1.108 154 HD1 HIS 20 1HD HIS 20 4.415 -13.581 4.882 155 HD2 HIS 20 2HD HIS 20 5.135 -11.154 1.566 156 HE1 HIS 20 1HE HIS 20 5.683 -11.566 5.731 157 HE2 HIS 20 2HE HIS 20 6.129 -10.084 3.723 158 H CYS 21 H CYS 21 1.393 -13.337 0.305 159 HA CYS 21 HA CYS 21 1.171 -10.539 0.329 160 HB2 CYS 21 2HB CYS 21 -0.539 -12.608 -1.085 161 HB3 CYS 21 1HB CYS 21 -0.573 -10.885 -1.444 162 HG CYS 21 HG CYS 21 1.565 -12.818 -2.376 163 H PHE 22 H PHE 22 -1.519 -12.847 0.921 164 HA PHE 22 HA PHE 22 -3.297 -10.760 1.815 165 HB2 PHE 22 2HB PHE 22 -3.562 -13.668 2.563 166 HB3 PHE 22 1HB PHE 22 -4.842 -12.491 2.257 167 HD1 PHE 22 1HD PHE 22 -5.188 -11.616 -0.096 168 HD2 PHE 22 2HD PHE 22 -2.558 -14.886 0.802 169 HE1 PHE 22 1HE PHE 22 -5.180 -12.270 -2.490 170 HE2 PHE 22 2HE PHE 22 -2.551 -15.543 -1.581 171 HZ PHE 22 HZ PHE 22 -3.856 -14.234 -3.232 172 H GLU 23 H GLU 23 -1.142 -13.000 3.503 173 HA GLU 23 HA GLU 23 -2.081 -12.325 6.144 174 HB2 GLU 23 2HB GLU 23 0.524 -13.533 5.177 175 HB3 GLU 23 1HB GLU 23 0.095 -13.362 6.880 176 HG2 GLU 23 2HG GLU 23 -1.558 -14.866 4.829 177 HG3 GLU 23 1HG GLU 23 -0.462 -15.622 5.985 178 H VAL 24 H VAL 24 0.426 -10.995 4.034 179 HA VAL 24 HA VAL 24 1.752 -9.399 5.968 180 HB VAL 24 HB VAL 24 1.452 -9.314 2.998 181 HG11 VAL 24 1HG1 VAL 24 2.389 -7.055 4.763 182 HG12 VAL 24 2HG1 VAL 24 1.299 -6.991 3.377 183 HG13 VAL 24 3HG1 VAL 24 3.024 -7.266 3.132 184 HG21 VAL 24 1HG2 VAL 24 3.167 -10.731 4.018 185 HG22 VAL 24 2HG2 VAL 24 3.784 -9.361 4.943 186 HG23 VAL 24 3HG2 VAL 24 3.942 -9.382 3.187 187 H PHE 25 H PHE 25 -1.036 -8.574 3.865 188 HA PHE 25 HA PHE 25 -1.273 -5.871 4.748 189 HB2 PHE 25 2HB PHE 25 -3.703 -7.536 4.157 190 HB3 PHE 25 1HB PHE 25 -3.380 -5.857 3.731 191 HD1 PHE 25 1HD PHE 25 -4.063 -8.640 2.148 192 HD2 PHE 25 2HD PHE 25 -0.690 -6.015 2.538 193 HE1 PHE 25 1HE PHE 25 -3.233 -9.376 -0.076 194 HE2 PHE 25 2HE PHE 25 0.144 -6.749 0.319 195 HZ PHE 25 HZ PHE 25 -1.128 -8.431 -0.989 196 H THR 26 H THR 26 -2.809 -8.842 5.956 197 HA THR 26 HA THR 26 -4.085 -7.408 8.158 198 HB THR 26 HB THR 26 -4.994 -9.575 8.752 199 HG1 THR 26 1HG THR 26 -4.263 -11.413 7.556 200 HG21 THR 26 1HG2 THR 26 -4.855 -9.051 5.777 201 HG22 THR 26 2HG2 THR 26 -6.124 -8.559 6.899 202 HG23 THR 26 3HG2 THR 26 -5.921 -10.263 6.490 203 H SER 27 H SER 27 -1.066 -9.097 7.688 204 HA SER 27 HA SER 27 -0.607 -9.807 10.437 205 HB2 SER 27 2HB SER 27 0.742 -10.823 8.702 206 HB3 SER 27 1HB SER 27 1.339 -9.247 8.198 207 HG SER 27 HG SER 27 1.906 -10.743 10.503 208 H ARG 28 H ARG 28 0.738 -7.061 8.546 209 HA ARG 28 HA ARG 28 0.262 -5.088 10.512 210 HB2 ARG 28 2HB ARG 28 2.761 -4.946 11.294 211 HB3 ARG 28 1HB ARG 28 1.670 -6.069 12.103 212 HG2 ARG 28 2HG ARG 28 2.626 -7.932 11.111 213 HG3 ARG 28 1HG ARG 28 3.154 -7.033 9.690 214 HD2 ARG 28 2HD ARG 28 5.112 -7.595 10.995 215 HD3 ARG 28 1HD ARG 28 4.841 -5.860 11.143 216 HE ARG 28 HE ARG 28 4.376 -7.879 13.270 217 HH11 ARG 28 1HH1 ARG 28 4.193 -6.999 15.333 218 HH12 ARG 28 2HH1 ARG 28 4.087 -5.281 15.526 219 HH21 ARG 28 1HH2 ARG 28 4.269 -4.609 12.135 220 HH22 ARG 28 2HH2 ARG 28 4.131 -3.935 13.722 221 HA PRO 29 HA PRO 29 1.833 -3.727 6.344 222 HB2 PRO 29 2HB PRO 29 -0.055 -1.534 7.007 223 HB3 PRO 29 1HB PRO 29 0.098 -2.475 5.513 224 HG2 PRO 29 2HG PRO 29 -1.931 -2.851 7.209 225 HG3 PRO 29 1HG PRO 29 -1.213 -4.183 6.290 226 HD2 PRO 29 2HD PRO 29 -0.895 -3.512 9.187 227 HD3 PRO 29 1HD PRO 29 -0.910 -5.101 8.390 228 H ALA 30 H ALA 30 1.673 -2.288 9.498 229 HA ALA 30 HA ALA 30 3.000 0.190 8.975 230 HB1 ALA 30 1HB ALA 30 3.777 -0.774 11.539 231 HB2 ALA 30 2HB ALA 30 2.115 -1.295 11.261 232 HB3 ALA 30 3HB ALA 30 2.530 0.416 11.162 233 H ASP 31 H ASP 31 4.145 -3.061 9.026 234 HA ASP 31 HA ASP 31 6.838 -2.738 9.806 235 HB2 ASP 31 2HB ASP 31 5.689 -4.913 9.229 236 HB3 ASP 31 1HB ASP 31 5.878 -4.490 7.528 237 H TRP 32 H TRP 32 5.224 -1.824 6.808 238 HA TRP 32 HA TRP 32 7.746 -0.466 5.986 239 HB2 TRP 32 2HB TRP 32 6.963 -1.171 3.563 240 HB3 TRP 32 1HB TRP 32 7.920 -2.281 4.544 241 HD1 TRP 32 HD TRP 32 6.895 -4.558 5.043 242 HE1 TRP 32 1HE TRP 32 4.581 -5.641 4.734 243 HE3 TRP 32 3HE TRP 32 4.228 -0.490 3.533 244 HZ2 TRP 32 2HZ TRP 32 1.947 -4.878 3.949 245 HZ3 TRP 32 3HZ TRP 32 1.813 -0.691 3.009 246 HH2 TRP 32 HH TRP 32 0.668 -2.881 3.214 247 H TRP 33 H TRP 33 4.727 0.078 6.905 248 HA TRP 33 HA TRP 33 3.607 1.585 4.727 249 HB2 TRP 33 2HB TRP 33 2.411 0.731 6.852 250 HB3 TRP 33 1HB TRP 33 3.031 2.190 7.625 251 HD1 TRP 33 HD TRP 33 2.112 4.536 6.781 252 HE1 TRP 33 1HE TRP 33 0.018 5.177 5.423 253 HE3 TRP 33 3HE TRP 33 0.800 -0.052 4.955 254 HZ2 TRP 33 2HZ TRP 33 -1.951 3.915 3.780 255 HZ3 TRP 33 3HZ TRP 33 -1.187 -0.303 3.497 256 HH2 TRP 33 HH TRP 33 -2.564 1.674 2.907 257 HA PRO 34 HA PRO 34 5.698 5.299 7.173 258 HB2 PRO 34 2HB PRO 34 8.278 4.009 7.836 259 HB3 PRO 34 1HB PRO 34 7.263 5.078 8.821 260 HG2 PRO 34 2HG PRO 34 7.456 2.469 9.332 261 HG3 PRO 34 1HG PRO 34 5.942 3.359 9.569 262 HD2 PRO 34 2HD PRO 34 6.713 1.511 7.338 263 HD3 PRO 34 1HD PRO 34 5.145 1.698 8.151 264 HA PRO 35 HA PRO 35 8.025 5.420 3.231 265 HB2 PRO 35 2HB PRO 35 7.122 7.814 2.365 266 HB3 PRO 35 1HB PRO 35 6.128 6.348 2.275 267 HG2 PRO 35 2HG PRO 35 5.964 8.625 4.155 268 HG3 PRO 35 1HG PRO 35 4.680 7.596 3.510 269 HD2 PRO 35 2HD PRO 35 5.872 7.361 6.055 270 HD3 PRO 35 1HD PRO 35 4.830 6.161 5.269 271 H SER 36 H SER 36 9.709 6.953 2.366 272 HA SER 36 HA SER 36 11.502 7.865 4.359 273 HB2 SER 36 2HB SER 36 12.071 7.443 1.940 274 HB3 SER 36 1HB SER 36 11.275 8.962 1.540 275 HG SER 36 HG SER 36 13.747 8.627 2.305 276 H HIS 37 H HIS 37 8.987 9.615 2.565 277 HA HIS 37 HA HIS 37 9.352 11.901 4.468 278 HB2 HIS 37 2HB HIS 37 8.389 11.942 1.587 279 HB3 HIS 37 1HB HIS 37 8.408 13.340 2.662 280 HD1 HIS 37 1HD HIS 37 10.663 11.077 0.697 281 HD2 HIS 37 2HD HIS 37 11.014 14.383 3.219 282 HE1 HIS 37 1HE HIS 37 13.048 11.907 0.467 283 HE2 HIS 37 2HE HIS 37 13.271 13.917 1.998 284 H VAL 38 H VAL 38 7.575 12.283 5.735 285 HA VAL 38 HA VAL 38 5.041 10.885 4.974 286 HB VAL 38 HB VAL 38 5.927 11.833 7.711 287 HG11 VAL 38 1HG1 VAL 38 3.422 10.939 6.643 288 HG12 VAL 38 2HG1 VAL 38 3.810 11.372 8.308 289 HG13 VAL 38 3HG1 VAL 38 4.027 9.711 7.756 290 HG21 VAL 38 1HG2 VAL 38 6.669 9.504 6.145 291 HG22 VAL 38 2HG2 VAL 38 5.815 9.027 7.612 292 HG23 VAL 38 3HG2 VAL 38 7.268 10.020 7.721 293 H LEU 39 H LEU 39 3.263 12.098 4.585 294 HA LEU 39 HA LEU 39 3.454 15.034 4.977 295 HB2 LEU 39 2HB LEU 39 1.308 13.419 3.565 296 HB3 LEU 39 1HB LEU 39 1.526 15.166 3.493 297 HG LEU 39 HG LEU 39 3.471 13.075 2.474 298 HD11 LEU 39 1HD1 LEU 39 1.243 13.851 1.218 299 HD12 LEU 39 2HD1 LEU 39 2.750 13.585 0.342 300 HD13 LEU 39 3HD1 LEU 39 2.264 15.222 0.784 301 HD21 LEU 39 1HD2 LEU 39 4.519 15.292 1.528 302 HD22 LEU 39 2HD2 LEU 39 4.867 14.811 3.189 303 HD23 LEU 39 3HD2 LEU 39 3.655 16.051 2.865 304 H VAL 40 H VAL 40 2.597 12.498 6.795 305 HA VAL 40 HA VAL 40 0.091 13.641 7.903 306 HB VAL 40 HB VAL 40 1.581 11.155 8.765 307 HG11 VAL 40 1HG1 VAL 40 -1.368 11.539 9.012 308 HG12 VAL 40 2HG1 VAL 40 -0.329 12.429 10.127 309 HG13 VAL 40 3HG1 VAL 40 -0.256 10.668 10.068 310 HG21 VAL 40 1HG2 VAL 40 0.299 11.617 6.294 311 HG22 VAL 40 2HG2 VAL 40 -0.839 10.671 7.252 312 HG23 VAL 40 3HG2 VAL 40 0.789 10.058 6.960 313 H LYS 41 H LYS 41 0.032 14.552 9.989 314 HA LYS 41 HA LYS 41 2.375 15.770 11.005 315 HB2 LYS 41 2HB LYS 41 -0.184 15.043 12.446 316 HB3 LYS 41 1HB LYS 41 1.047 16.129 13.088 317 HG2 LYS 41 2HG LYS 41 0.764 17.571 11.067 318 HG3 LYS 41 1HG LYS 41 -0.557 16.525 10.545 319 HD2 LYS 41 2HD LYS 41 -1.731 17.002 12.698 320 HD3 LYS 41 1HD LYS 41 -0.448 18.140 13.109 321 HE2 LYS 41 2HE LYS 41 -1.707 19.690 12.043 322 HE3 LYS 41 1HE LYS 41 -1.156 18.922 10.554 323 HZ1 LYS 41 1HZ LYS 41 -3.729 19.159 11.294 324 HZ2 LYS 41 2HZ LYS 41 -3.369 17.590 11.839 325 HZ3 LYS 41 3HZ LYS 41 -3.145 17.996 10.205 326 H LYS 42 H LYS 42 0.885 12.652 11.745 327 HA LYS 42 HA LYS 42 3.312 11.976 13.355 328 HB2 LYS 42 2HB LYS 42 0.512 10.922 13.768 329 HB3 LYS 42 1HB LYS 42 1.918 10.552 14.759 330 HG2 LYS 42 2HG LYS 42 1.424 13.434 14.452 331 HG3 LYS 42 1HG LYS 42 0.114 12.579 15.263 332 HD2 LYS 42 2HD LYS 42 1.744 13.331 16.918 333 HD3 LYS 42 1HD LYS 42 1.779 11.570 16.817 334 HE2 LYS 42 2HE LYS 42 3.794 11.577 15.554 335 HE3 LYS 42 1HE LYS 42 3.649 13.296 15.189 336 HZ1 LYS 42 1HZ LYS 42 5.077 12.212 17.236 337 HZ2 LYS 42 2HZ LYS 42 3.664 12.764 18.000 338 HZ3 LYS 42 3HZ LYS 42 4.621 13.839 17.097 339 H GLU 43 H GLU 43 4.319 10.061 12.773 340 HA GLU 43 HA GLU 43 3.599 8.864 10.239 341 HB2 GLU 43 2HB GLU 43 5.564 7.953 12.351 342 HB3 GLU 43 1HB GLU 43 5.467 7.311 10.713 343 HG2 GLU 43 2HG GLU 43 5.900 9.596 9.825 344 HG3 GLU 43 1HG GLU 43 6.086 10.180 11.479 345 H ARG 44 H ARG 44 2.426 7.006 9.847 346 HA ARG 44 HA ARG 44 0.719 5.945 11.894 347 HB2 ARG 44 2HB ARG 44 1.504 4.771 9.207 348 HB3 ARG 44 1HB ARG 44 0.185 4.180 10.217 349 HG2 ARG 44 2HG ARG 44 0.380 7.014 9.157 350 HG3 ARG 44 1HG ARG 44 -0.580 5.737 8.408 351 HD2 ARG 44 2HD ARG 44 -1.602 5.479 10.817 352 HD3 ARG 44 1HD ARG 44 -1.000 7.122 11.039 353 HE ARG 44 HE ARG 44 -3.307 6.393 9.487 354 HH11 ARG 44 1HH1 ARG 44 -4.283 8.027 8.266 355 HH12 ARG 44 2HH1 ARG 44 -3.396 9.472 7.912 356 HH21 ARG 44 1HH2 ARG 44 -0.545 8.453 9.605 357 HH22 ARG 44 2HH2 ARG 44 -1.281 9.713 8.671 358 H ALA 45 H ALA 45 0.921 4.080 13.150 359 HA ALA 45 HA ALA 45 3.469 2.547 12.861 360 HB1 ALA 45 1HB ALA 45 2.869 2.580 15.603 361 HB2 ALA 45 2HB ALA 45 2.670 4.247 15.062 362 HB3 ALA 45 3HB ALA 45 4.201 3.412 14.800 363 H GLY 46 H GLY 46 0.214 2.598 14.349 364 HA2 GLY 46 2HA GLY 46 0.284 -0.393 14.322 365 HA3 GLY 46 1HA GLY 46 -0.747 0.572 15.371 366 H LEU 47 H LEU 47 -1.517 -1.535 13.443 367 HA LEU 47 HA LEU 47 -3.545 0.064 11.987 368 HB2 LEU 47 2HB LEU 47 -1.762 -2.010 10.682 369 HB3 LEU 47 1HB LEU 47 -3.195 -1.306 9.935 370 HG LEU 47 HG LEU 47 -1.973 0.973 10.596 371 HD11 LEU 47 1HD1 LEU 47 0.461 -0.572 9.849 372 HD12 LEU 47 2HD1 LEU 47 -0.084 -0.711 11.520 373 HD13 LEU 47 3HD1 LEU 47 0.308 0.872 10.850 374 HD21 LEU 47 1HD2 LEU 47 -2.370 0.852 8.343 375 HD22 LEU 47 2HD2 LEU 47 -1.817 -0.816 8.228 376 HD23 LEU 47 3HD2 LEU 47 -0.645 0.500 8.276 377 H ALA 48 H ALA 48 -5.527 -0.934 11.965 378 HA ALA 48 HA ALA 48 -5.726 -3.845 12.359 379 HB1 ALA 48 1HB ALA 48 -6.649 -1.820 14.400 380 HB2 ALA 48 2HB ALA 48 -5.700 -3.284 14.661 381 HB3 ALA 48 3HB ALA 48 -7.415 -3.403 14.268 382 H PHE 49 H PHE 49 -7.365 -4.519 11.041 383 HA PHE 49 HA PHE 49 -9.730 -2.781 10.687 384 HB2 PHE 49 2HB PHE 49 -9.572 -2.899 8.221 385 HB3 PHE 49 1HB PHE 49 -8.197 -2.044 8.921 386 HD1 PHE 49 1HD PHE 49 -9.296 -4.990 7.077 387 HD2 PHE 49 2HD PHE 49 -5.994 -3.178 9.141 388 HE1 PHE 49 1HE PHE 49 -7.741 -6.585 5.988 389 HE2 PHE 49 2HE PHE 49 -4.438 -4.772 8.055 390 HZ PHE 49 HZ PHE 49 -5.308 -6.471 6.475 391 H GLU 50 H GLU 50 -11.576 -3.918 9.968 392 HA GLU 50 HA GLU 50 -11.425 -6.836 10.363 393 HB2 GLU 50 2HB GLU 50 -14.000 -5.620 9.574 394 HB3 GLU 50 1HB GLU 50 -13.632 -6.695 10.924 395 HG2 GLU 50 2HG GLU 50 -12.406 -4.656 11.947 396 HG3 GLU 50 1HG GLU 50 -13.303 -3.702 10.764 397 HA PRO 51 HA PRO 51 -11.199 -6.982 5.817 398 HB2 PRO 51 2HB PRO 51 -10.524 -9.604 5.578 399 HB3 PRO 51 1HB PRO 51 -9.360 -8.341 6.023 400 HG2 PRO 51 2HG PRO 51 -10.719 -10.350 7.729 401 HG3 PRO 51 1HG PRO 51 -9.083 -9.682 7.849 402 HD2 PRO 51 2HD PRO 51 -11.234 -8.888 9.420 403 HD3 PRO 51 1HD PRO 51 -9.772 -7.919 9.143 404 H PHE 52 H PHE 52 -13.462 -6.725 5.423 405 HA PHE 52 HA PHE 52 -14.804 -9.167 4.540 406 HB2 PHE 52 2HB PHE 52 -16.148 -7.474 6.671 407 HB3 PHE 52 1HB PHE 52 -16.762 -8.964 5.950 408 HD1 PHE 52 1HD PHE 52 -14.618 -7.523 8.479 409 HD2 PHE 52 2HD PHE 52 -15.506 -11.132 6.332 410 HE1 PHE 52 1HE PHE 52 -13.389 -8.834 10.182 411 HE2 PHE 52 2HE PHE 52 -14.278 -12.448 8.039 412 HZ PHE 52 HZ PHE 52 -13.213 -11.298 9.962 413 H VAL 53 H VAL 53 -17.174 -8.368 3.743 414 HA VAL 53 HA VAL 53 -16.598 -6.103 1.981 415 HB VAL 53 HB VAL 53 -19.252 -7.523 2.374 416 HG11 VAL 53 1HG1 VAL 53 -18.137 -5.555 0.431 417 HG12 VAL 53 2HG1 VAL 53 -19.789 -5.754 1.016 418 HG13 VAL 53 3HG1 VAL 53 -19.159 -6.833 -0.227 419 HG21 VAL 53 1HG2 VAL 53 -18.532 -9.294 1.148 420 HG22 VAL 53 2HG2 VAL 53 -16.914 -8.766 1.600 421 HG23 VAL 53 3HG2 VAL 53 -17.603 -8.275 0.054 422 H GLY 54 H GLY 54 -16.989 -4.006 2.557 423 HA2 GLY 54 2HA GLY 54 -18.115 -2.177 3.556 424 HA3 GLY 54 1HA GLY 54 -19.338 -3.306 4.151 425 H GLY 55 H GLY 55 -16.038 -4.112 4.746 426 HA2 GLY 55 2HA GLY 55 -16.435 -4.068 7.614 427 HA3 GLY 55 1HA GLY 55 -14.913 -4.410 6.788 428 H ARG 56 H ARG 56 -14.490 -2.923 8.911 429 HA ARG 56 HA ARG 56 -14.387 -0.092 7.929 430 HB2 ARG 56 2HB ARG 56 -14.491 -1.158 10.768 431 HB3 ARG 56 1HB ARG 56 -14.277 0.540 10.342 432 HG2 ARG 56 2HG ARG 56 -16.440 0.456 9.094 433 HG3 ARG 56 1HG ARG 56 -16.665 -1.200 9.660 434 HD2 ARG 56 2HD ARG 56 -16.407 1.266 11.406 435 HD3 ARG 56 1HD ARG 56 -17.881 0.338 11.123 436 HE ARG 56 HE ARG 56 -16.094 -1.536 12.112 437 HH11 ARG 56 1HH1 ARG 56 -15.896 -1.979 14.319 438 HH12 ARG 56 2HH1 ARG 56 -16.349 -0.770 15.476 439 HH21 ARG 56 1HH2 ARG 56 -17.276 1.555 13.076 440 HH22 ARG 56 2HH2 ARG 56 -17.130 1.230 14.771 441 H TYR 57 H TYR 57 -12.371 0.841 7.810 442 HA TYR 57 HA TYR 57 -10.081 -0.781 8.854 443 HB2 TYR 57 2HB TYR 57 -10.426 -0.471 6.281 444 HB3 TYR 57 1HB TYR 57 -9.839 1.166 6.572 445 HD1 TYR 57 1HD TYR 57 -8.877 -2.178 5.896 446 HD2 TYR 57 2HD TYR 57 -7.640 1.341 8.025 447 HE1 TYR 57 1HE TYR 57 -6.545 -3.023 5.931 448 HE2 TYR 57 2HE TYR 57 -5.307 0.500 8.056 449 HH TYR 57 HH TYR 57 -4.461 -2.593 7.525 450 H TYR 58 H TYR 58 -8.826 0.241 10.330 451 HA TYR 58 HA TYR 58 -8.690 3.196 10.310 452 HB2 TYR 58 2HB TYR 58 -9.137 3.277 12.758 453 HB3 TYR 58 1HB TYR 58 -10.532 2.717 11.834 454 HD1 TYR 58 1HD TYR 58 -10.735 0.144 11.491 455 HD2 TYR 58 2HD TYR 58 -8.346 1.981 14.545 456 HE1 TYR 58 1HE TYR 58 -10.774 -1.971 12.789 457 HE2 TYR 58 2HE TYR 58 -8.384 -0.131 15.845 458 HH TYR 58 HH TYR 58 -10.078 -2.200 15.941 459 H GLU 59 H GLU 59 -6.858 4.003 11.569 460 HA GLU 59 HA GLU 59 -4.840 1.907 12.250 461 HB2 GLU 59 2HB GLU 59 -4.295 4.479 10.733 462 HB3 GLU 59 1HB GLU 59 -3.102 3.255 11.170 463 HG2 GLU 59 2HG GLU 59 -4.314 1.592 9.798 464 HG3 GLU 59 1HG GLU 59 -5.484 2.831 9.340 465 H TRP 60 H TRP 60 -3.192 2.701 13.800 466 HA TRP 60 HA TRP 60 -4.310 4.883 15.508 467 HB2 TRP 60 2HB TRP 60 -2.322 2.680 16.125 468 HB3 TRP 60 1HB TRP 60 -2.719 3.987 17.238 469 HD1 TRP 60 HD TRP 60 -5.394 4.164 17.923 470 HE1 TRP 60 1HE TRP 60 -7.054 2.249 18.393 471 HE3 TRP 60 3HE TRP 60 -2.979 0.311 15.594 472 HZ2 TRP 60 2HZ TRP 60 -7.319 -0.546 17.858 473 HZ3 TRP 60 3HZ TRP 60 -3.956 -1.965 15.594 474 HH2 TRP 60 HH TRP 60 -6.122 -2.398 16.722 475 H ASP 61 H ASP 61 -3.191 6.765 15.690 476 HA ASP 61 HA ASP 61 -0.639 7.007 14.205 477 HB2 ASP 61 2HB ASP 61 -2.441 9.059 15.514 478 HB3 ASP 61 1HB ASP 61 -0.954 9.454 14.662 479 H ILE 62 H ILE 62 1.219 8.088 15.288 480 HA ILE 62 HA ILE 62 1.972 6.889 17.699 481 HB ILE 62 HB ILE 62 2.850 9.573 16.631 482 HG12 ILE 62 2HG1 ILE 62 4.130 6.853 16.366 483 HG13 ILE 62 1HG1 ILE 62 3.141 7.596 15.120 484 HG21 ILE 62 1HG2 ILE 62 4.907 8.252 18.031 485 HG22 ILE 62 2HG2 ILE 62 3.481 8.175 19.065 486 HG23 ILE 62 3HG2 ILE 62 4.081 9.736 18.503 487 HD11 ILE 62 1HD1 ILE 62 5.190 9.417 16.109 488 HD12 ILE 62 2HD1 ILE 62 4.823 8.944 14.449 489 HD13 ILE 62 3HD1 ILE 62 5.883 7.940 15.439 490 H ASP 63 H ASP 63 0.430 10.056 17.225 491 HA ASP 63 HA ASP 63 -0.303 10.004 20.127 492 HB2 ASP 63 2HB ASP 63 1.471 11.708 19.606 493 HB3 ASP 63 1HB ASP 63 0.332 12.486 18.506 494 H GLY 64 H GLY 64 -1.275 10.435 16.846 495 HA2 GLY 64 2HA GLY 64 -3.782 11.795 17.452 496 HA3 GLY 64 1HA GLY 64 -3.330 11.111 15.891 497 H THR 65 H THR 65 -5.866 10.850 17.352 498 HA THR 65 HA THR 65 -6.122 8.248 18.521 499 HB THR 65 HB THR 65 -8.354 8.756 18.700 500 HG1 THR 65 1HG THR 65 -9.538 9.221 17.001 501 HG21 THR 65 1HG2 THR 65 -7.674 11.501 17.713 502 HG22 THR 65 2HG2 THR 65 -6.835 10.868 19.130 503 HG23 THR 65 3HG2 THR 65 -8.591 11.023 19.141 504 H GLU 66 H GLU 66 -8.447 7.475 16.823 505 HA GLU 66 HA GLU 66 -6.887 6.017 14.778 506 HB2 GLU 66 2HB GLU 66 -9.716 5.668 15.802 507 HB3 GLU 66 1HB GLU 66 -8.961 4.647 14.584 508 HG2 GLU 66 2HG GLU 66 -7.177 4.060 16.196 509 HG3 GLU 66 1HG GLU 66 -7.979 5.042 17.422 510 H ILE 67 H ILE 67 -7.099 6.427 12.623 511 HA ILE 67 HA ILE 67 -9.328 8.229 11.753 512 HB ILE 67 HB ILE 67 -6.507 8.138 10.639 513 HG12 ILE 67 2HG1 ILE 67 -7.911 10.245 12.314 514 HG13 ILE 67 1HG1 ILE 67 -6.596 9.203 12.863 515 HG21 ILE 67 1HG2 ILE 67 -8.045 10.461 9.932 516 HG22 ILE 67 2HG2 ILE 67 -8.966 9.016 9.517 517 HG23 ILE 67 3HG2 ILE 67 -7.343 9.243 8.868 518 HD11 ILE 67 1HD1 ILE 67 -5.394 10.180 10.695 519 HD12 ILE 67 2HD1 ILE 67 -5.371 11.060 12.225 520 HD13 ILE 67 3HD1 ILE 67 -6.521 11.511 10.965 521 H VAL 68 H VAL 68 -10.433 7.547 9.906 522 HA VAL 68 HA VAL 68 -10.140 4.801 9.097 523 HB VAL 68 HB VAL 68 -11.559 7.048 7.629 524 HG11 VAL 68 1HG1 VAL 68 -12.066 4.059 7.630 525 HG12 VAL 68 2HG1 VAL 68 -11.164 4.904 6.373 526 HG13 VAL 68 3HG1 VAL 68 -12.870 5.268 6.630 527 HG21 VAL 68 1HG2 VAL 68 -12.595 5.124 9.738 528 HG22 VAL 68 2HG2 VAL 68 -13.554 6.330 8.880 529 HG23 VAL 68 3HG2 VAL 68 -12.287 6.842 9.994 530 H TRP 69 H TRP 69 -8.734 3.965 7.625 531 HA TRP 69 HA TRP 69 -7.172 5.879 5.961 532 HB2 TRP 69 2HB TRP 69 -5.599 4.587 7.056 533 HB3 TRP 69 1HB TRP 69 -6.645 3.169 7.105 534 HD1 TRP 69 HD TRP 69 -3.972 4.830 5.065 535 HE1 TRP 69 1HE TRP 69 -3.430 3.384 3.000 536 HE3 TRP 69 3HE TRP 69 -7.813 1.473 5.301 537 HZ2 TRP 69 2HZ TRP 69 -4.481 1.103 1.633 538 HZ3 TRP 69 3HZ TRP 69 -8.019 -0.324 3.607 539 HH2 TRP 69 HH TRP 69 -6.359 -0.514 1.774 540 H GLY 70 H GLY 70 -9.777 3.782 5.719 541 HA2 GLY 70 2HA GLY 70 -10.337 4.090 3.044 542 HA3 GLY 70 1HA GLY 70 -9.222 2.723 3.057 543 H ARG 71 H ARG 71 -10.664 1.048 2.596 544 HA ARG 71 HA ARG 71 -12.370 0.185 4.791 545 HB2 ARG 71 2HB ARG 71 -13.628 1.905 3.132 546 HB3 ARG 71 1HB ARG 71 -13.905 0.406 2.256 547 HG2 ARG 71 2HG ARG 71 -14.792 -0.618 4.348 548 HG3 ARG 71 1HG ARG 71 -14.609 0.941 5.151 549 HD2 ARG 71 2HD ARG 71 -16.897 0.797 4.413 550 HD3 ARG 71 1HD ARG 71 -16.076 1.934 3.343 551 HE ARG 71 HE ARG 71 -16.157 -0.863 2.413 552 HH11 ARG 71 1HH1 ARG 71 -17.215 -1.150 0.441 553 HH12 ARG 71 2HH1 ARG 71 -18.148 0.148 -0.225 554 HH21 ARG 71 1HH2 ARG 71 -17.486 2.324 2.391 555 HH22 ARG 71 2HH2 ARG 71 -18.299 2.112 0.878 556 H ILE 72 H ILE 72 -13.933 -1.617 3.177 557 HA ILE 72 HA ILE 72 -11.850 -3.218 1.776 558 HB ILE 72 HB ILE 72 -13.772 -4.252 3.884 559 HG12 ILE 72 2HG1 ILE 72 -11.296 -5.014 4.666 560 HG13 ILE 72 1HG1 ILE 72 -10.889 -3.519 3.824 561 HG21 ILE 72 1HG2 ILE 72 -11.813 -5.670 2.053 562 HG22 ILE 72 2HG2 ILE 72 -13.561 -5.896 2.115 563 HG23 ILE 72 3HG2 ILE 72 -12.556 -6.422 3.465 564 HD11 ILE 72 1HD1 ILE 72 -12.732 -2.398 5.175 565 HD12 ILE 72 2HD1 ILE 72 -11.321 -2.910 6.100 566 HD13 ILE 72 3HD1 ILE 72 -12.799 -3.870 6.142 567 H LEU 73 H LEU 73 -12.849 -4.873 0.324 568 HA LEU 73 HA LEU 73 -15.607 -4.073 -0.525 569 HB2 LEU 73 2HB LEU 73 -13.787 -3.367 -2.117 570 HB3 LEU 73 1HB LEU 73 -13.374 -5.068 -2.321 571 HG LEU 73 HG LEU 73 -15.942 -5.326 -2.864 572 HD11 LEU 73 1HD1 LEU 73 -15.401 -2.401 -3.451 573 HD12 LEU 73 2HD1 LEU 73 -16.581 -3.036 -2.304 574 HD13 LEU 73 3HD1 LEU 73 -16.803 -3.297 -4.032 575 HD21 LEU 73 1HD2 LEU 73 -13.668 -4.386 -4.559 576 HD22 LEU 73 2HD2 LEU 73 -15.273 -4.415 -5.291 577 HD23 LEU 73 3HD2 LEU 73 -14.575 -5.897 -4.636 578 H GLU 74 H GLU 74 -13.224 -6.723 -0.732 579 HA GLU 74 HA GLU 74 -15.050 -8.675 0.307 580 HB2 GLU 74 2HB GLU 74 -16.097 -8.293 -1.934 581 HB3 GLU 74 1HB GLU 74 -14.592 -8.827 -2.674 582 HG2 GLU 74 2HG GLU 74 -14.795 -10.993 -1.463 583 HG3 GLU 74 1HG GLU 74 -16.354 -10.461 -0.832 584 H TRP 75 H TRP 75 -13.902 -10.504 0.881 585 HA TRP 75 HA TRP 75 -11.046 -10.558 0.049 586 HB2 TRP 75 2HB TRP 75 -10.964 -10.597 2.354 587 HB3 TRP 75 1HB TRP 75 -12.534 -11.388 2.500 588 HD1 TRP 75 HD TRP 75 -8.835 -12.102 2.099 589 HE1 TRP 75 1HE TRP 75 -8.433 -14.639 2.340 590 HE3 TRP 75 3HE TRP 75 -13.663 -13.763 2.118 591 HZ2 TRP 75 2HZ TRP 75 -9.961 -17.053 2.518 592 HZ3 TRP 75 3HZ TRP 75 -14.163 -16.178 2.321 593 HH2 TRP 75 HH TRP 75 -12.319 -17.827 2.522 594 H ASP 76 H ASP 76 -10.476 -12.090 -1.409 595 HA ASP 76 HA ASP 76 -12.241 -14.479 -1.684 596 HB2 ASP 76 2HB ASP 76 -11.447 -12.609 -3.607 597 HB3 ASP 76 1HB ASP 76 -10.459 -14.037 -3.926 598 HA PRO 77 HA PRO 77 -8.891 -16.860 0.195 599 HB2 PRO 77 2HB PRO 77 -9.790 -18.699 -2.018 600 HB3 PRO 77 1HB PRO 77 -9.365 -19.099 -0.342 601 HG2 PRO 77 2HG PRO 77 -11.903 -18.856 -1.109 602 HG3 PRO 77 1HG PRO 77 -11.359 -18.341 0.495 603 HD2 PRO 77 2HD PRO 77 -12.252 -16.694 -1.776 604 HD3 PRO 77 1HD PRO 77 -12.104 -16.249 -0.061 605 HA PRO 78 HA PRO 78 -5.066 -16.171 -1.868 606 HB2 PRO 78 2HB PRO 78 -5.040 -19.142 -2.302 607 HB3 PRO 78 1HB PRO 78 -3.732 -18.080 -1.747 608 HG2 PRO 78 2HG PRO 78 -5.312 -19.583 -0.087 609 HG3 PRO 78 1HG PRO 78 -4.441 -18.123 0.403 610 HD2 PRO 78 2HD PRO 78 -7.293 -18.495 0.261 611 HD3 PRO 78 1HD PRO 78 -6.414 -17.022 0.717 612 H HIS 79 H HIS 79 -6.090 -15.115 -3.676 613 HA HIS 79 HA HIS 79 -5.509 -16.084 -6.221 614 HB2 HIS 79 2HB HIS 79 -7.966 -17.254 -5.103 615 HB3 HIS 79 1HB HIS 79 -8.186 -16.514 -6.689 616 HD1 HIS 79 1HD HIS 79 -7.299 -19.644 -5.264 617 HD2 HIS 79 2HD HIS 79 -5.834 -17.439 -8.488 618 HE1 HIS 79 1HE HIS 79 -6.030 -21.274 -6.732 619 HE2 HIS 79 2HE HIS 79 -5.134 -19.942 -8.696 620 H ARG 80 H ARG 80 -8.172 -14.406 -4.450 621 HA ARG 80 HA ARG 80 -7.660 -12.094 -6.244 622 HB2 ARG 80 2HB ARG 80 -9.755 -13.725 -6.794 623 HB3 ARG 80 1HB ARG 80 -10.518 -12.597 -5.679 624 HG2 ARG 80 2HG ARG 80 -8.908 -11.766 -8.107 625 HG3 ARG 80 1HG ARG 80 -10.668 -11.861 -8.065 626 HD2 ARG 80 2HD ARG 80 -8.867 -10.020 -6.489 627 HD3 ARG 80 1HD ARG 80 -10.145 -9.581 -7.618 628 HE ARG 80 HE ARG 80 -10.514 -10.329 -4.817 629 HH11 ARG 80 1HH1 ARG 80 -12.646 -10.230 -4.073 630 HH12 ARG 80 2HH1 ARG 80 -13.943 -10.110 -5.216 631 HH21 ARG 80 1HH2 ARG 80 -11.857 -10.132 -7.985 632 HH22 ARG 80 2HH2 ARG 80 -13.496 -10.055 -7.431 633 H LEU 81 H LEU 81 -7.602 -10.222 -5.152 634 HA LEU 81 HA LEU 81 -8.872 -10.121 -2.443 635 HB2 LEU 81 2HB LEU 81 -6.371 -10.252 -2.343 636 HB3 LEU 81 1HB LEU 81 -6.292 -8.771 -3.294 637 HG LEU 81 HG LEU 81 -7.722 -7.671 -1.501 638 HD11 LEU 81 1HD1 LEU 81 -8.704 -9.409 -0.282 639 HD12 LEU 81 2HD1 LEU 81 -7.375 -8.932 0.773 640 HD13 LEU 81 3HD1 LEU 81 -7.219 -10.360 -0.247 641 HD21 LEU 81 1HD2 LEU 81 -5.486 -8.254 0.148 642 HD22 LEU 81 2HD2 LEU 81 -5.701 -6.867 -0.920 643 HD23 LEU 81 3HD2 LEU 81 -4.919 -8.330 -1.520 644 H ALA 82 H ALA 82 -10.345 -8.486 -2.270 645 HA ALA 82 HA ALA 82 -10.067 -6.150 -4.123 646 HB1 ALA 82 1HB ALA 82 -12.772 -7.073 -3.224 647 HB2 ALA 82 2HB ALA 82 -11.979 -7.943 -4.537 648 HB3 ALA 82 3HB ALA 82 -12.316 -6.220 -4.697 649 H MET 83 H MET 83 -10.402 -4.137 -3.144 650 HA MET 83 HA MET 83 -11.433 -4.132 -0.354 651 HB2 MET 83 2HB MET 83 -8.847 -2.796 -1.191 652 HB3 MET 83 1HB MET 83 -9.558 -2.778 0.423 653 HG2 MET 83 2HG MET 83 -9.398 -5.296 0.430 654 HG3 MET 83 1HG MET 83 -8.490 -5.180 -1.077 655 HE1 MET 83 1HE MET 83 -7.338 -4.040 3.153 656 HE2 MET 83 2HE MET 83 -8.922 -4.405 2.473 657 HE3 MET 83 3HE MET 83 -8.246 -2.788 2.295 658 H THR 84 H THR 84 -12.599 -2.278 0.148 659 HA THR 84 HA THR 84 -12.848 -0.266 -2.041 660 HB THR 84 HB THR 84 -14.589 -0.679 0.413 661 HG1 THR 84 1HG THR 84 -14.799 -2.412 -0.958 662 HG21 THR 84 1HG2 THR 84 -16.142 0.629 -1.338 663 HG22 THR 84 2HG2 THR 84 -14.572 1.243 -1.859 664 HG23 THR 84 3HG2 THR 84 -15.102 1.476 -0.193 665 H TRP 85 H TRP 85 -12.104 1.843 -1.661 666 HA TRP 85 HA TRP 85 -10.761 2.247 0.965 667 HB2 TRP 85 2HB TRP 85 -10.395 3.404 -1.778 668 HB3 TRP 85 1HB TRP 85 -9.817 4.296 -0.373 669 HD1 TRP 85 HD TRP 85 -9.758 0.481 -0.486 670 HE1 TRP 85 1HE TRP 85 -7.307 -0.312 -0.465 671 HE3 TRP 85 3HE TRP 85 -7.376 4.971 -0.970 672 HZ2 TRP 85 2HZ TRP 85 -4.681 0.810 -0.632 673 HZ3 TRP 85 3HZ TRP 85 -4.901 5.080 -1.036 674 HH2 TRP 85 HH TRP 85 -3.552 3.007 -0.868 675 H ARG 86 H ARG 86 -11.856 3.415 2.458 676 HA ARG 86 HA ARG 86 -13.664 5.594 1.476 677 HB2 ARG 86 2HB ARG 86 -14.845 3.764 2.683 678 HB3 ARG 86 1HB ARG 86 -13.823 4.060 4.091 679 HG2 ARG 86 2HG ARG 86 -14.657 6.414 4.146 680 HG3 ARG 86 1HG ARG 86 -15.751 6.025 2.817 681 HD2 ARG 86 2HD ARG 86 -15.723 4.657 5.525 682 HD3 ARG 86 1HD ARG 86 -16.900 5.861 5.002 683 HE ARG 86 HE ARG 86 -16.726 3.572 3.200 684 HH11 ARG 86 1HH1 ARG 86 -18.566 2.256 3.139 685 HH12 ARG 86 2HH1 ARG 86 -19.766 2.410 4.377 686 HH21 ARG 86 1HH2 ARG 86 -18.075 4.916 6.073 687 HH22 ARG 86 2HH2 ARG 86 -19.488 3.916 6.039 688 H ILE 87 H ILE 87 -12.103 7.251 1.499 689 HA ILE 87 HA ILE 87 -11.250 8.101 4.214 690 HB ILE 87 HB ILE 87 -9.360 6.833 3.127 691 HG12 ILE 87 2HG1 ILE 87 -8.718 9.777 3.376 692 HG13 ILE 87 1HG1 ILE 87 -9.151 8.806 4.782 693 HG21 ILE 87 1HG2 ILE 87 -8.251 7.780 1.208 694 HG22 ILE 87 2HG2 ILE 87 -9.292 9.204 1.241 695 HG23 ILE 87 3HG2 ILE 87 -9.959 7.633 0.799 696 HD11 ILE 87 1HD1 ILE 87 -6.603 9.045 3.656 697 HD12 ILE 87 2HD1 ILE 87 -7.164 7.456 3.141 698 HD13 ILE 87 3HD1 ILE 87 -7.108 7.860 4.855 699 H ASP 88 H ASP 88 -10.746 10.416 4.301 700 HA ASP 88 HA ASP 88 -12.244 11.913 2.216 701 HB2 ASP 88 2HB ASP 88 -12.753 12.253 4.660 702 HB3 ASP 88 1HB ASP 88 -11.133 12.924 4.850 703 H GLY 89 H GLY 89 -11.294 13.646 1.076 704 HA2 GLY 89 2HA GLY 89 -8.527 13.371 0.406 705 HA3 GLY 89 1HA GLY 89 -9.550 14.723 -0.064 706 H HIS 90 H HIS 90 -10.151 15.198 2.888 707 HA HIS 90 HA HIS 90 -7.836 16.949 3.348 708 HB2 HIS 90 2HB HIS 90 -10.433 16.581 4.846 709 HB3 HIS 90 1HB HIS 90 -9.221 17.787 5.244 710 HD1 HIS 90 1HD HIS 90 -8.446 18.815 2.484 711 HD2 HIS 90 2HD HIS 90 -12.394 18.088 3.609 712 HE1 HIS 90 1HE HIS 90 -9.898 20.219 0.951 713 HE2 HIS 90 2HE HIS 90 -12.304 19.781 1.626 714 H TRP 91 H TRP 91 -7.965 13.852 3.753 715 HA TRP 91 HA TRP 91 -7.035 12.314 5.259 716 HB2 TRP 91 2HB TRP 91 -5.528 14.830 5.576 717 HB3 TRP 91 1HB TRP 91 -5.421 13.741 6.959 718 HD1 TRP 91 HD TRP 91 -3.569 14.427 4.017 719 HE1 TRP 91 1HE TRP 91 -2.304 12.364 3.128 720 HE3 TRP 91 3HE TRP 91 -6.007 10.735 6.564 721 HZ2 TRP 91 2HZ TRP 91 -2.327 9.519 3.455 722 HZ3 TRP 91 3HZ TRP 91 -5.367 8.362 6.255 723 HH2 TRP 91 HH TRP 91 -3.532 7.750 4.707 724 H GLN 92 H GLN 92 -9.515 13.931 5.992 725 HA GLN 92 HA GLN 92 -9.323 13.946 8.946 726 HB2 GLN 92 2HB GLN 92 -11.603 14.688 7.093 727 HB3 GLN 92 1HB GLN 92 -11.620 14.869 8.848 728 HG2 GLN 92 2HG GLN 92 -9.657 16.203 6.962 729 HG3 GLN 92 1HG GLN 92 -11.021 16.988 7.748 730 HE21 GLN 92 1HE2 GLN 92 -7.802 16.922 8.039 731 HE22 GLN 92 2HE2 GLN 92 -7.625 16.989 9.725 732 H SER 93 H SER 93 -12.425 13.166 7.808 733 HA SER 93 HA SER 93 -12.012 10.252 7.932 734 HB2 SER 93 2HB SER 93 -13.336 9.861 9.860 735 HB3 SER 93 1HB SER 93 -12.276 11.187 10.322 736 HG SER 93 HG SER 93 -14.966 11.123 10.139 737 H VAL 94 H VAL 94 -13.955 9.087 7.245 738 HA VAL 94 HA VAL 94 -16.019 10.832 5.965 739 HB VAL 94 HB VAL 94 -15.834 8.567 4.351 740 HG11 VAL 94 1HG1 VAL 94 -14.699 10.252 2.773 741 HG12 VAL 94 2HG1 VAL 94 -14.803 11.398 4.110 742 HG13 VAL 94 3HG1 VAL 94 -16.274 10.709 3.421 743 HG21 VAL 94 1HG2 VAL 94 -13.052 9.645 4.890 744 HG22 VAL 94 2HG2 VAL 94 -13.496 8.344 3.787 745 HG23 VAL 94 3HG2 VAL 94 -13.645 8.112 5.527 746 HA PRO 95 HA PRO 95 -18.045 7.848 8.884 747 HB2 PRO 95 2HB PRO 95 -20.240 9.784 8.313 748 HB3 PRO 95 1HB PRO 95 -19.693 9.123 9.866 749 HG2 PRO 95 2HG PRO 95 -19.125 11.622 9.123 750 HG3 PRO 95 1HG PRO 95 -17.992 10.642 10.069 751 HD2 PRO 95 2HD PRO 95 -17.865 11.406 7.190 752 HD3 PRO 95 1HD PRO 95 -16.544 11.075 8.332 753 H ASP 96 H ASP 96 -18.843 8.951 5.665 754 HA ASP 96 HA ASP 96 -20.242 6.384 5.192 755 HB2 ASP 96 2HB ASP 96 -21.979 8.112 5.776 756 HB3 ASP 96 1HB ASP 96 -21.456 9.022 4.362 757 H ASP 97 H ASP 97 -20.102 5.707 3.002 758 HA ASP 97 HA ASP 97 -17.975 7.048 1.476 759 HB2 ASP 97 2HB ASP 97 -18.269 5.101 -0.082 760 HB3 ASP 97 1HB ASP 97 -17.917 4.623 1.578 761 H ASP 98 H ASP 98 -18.746 8.897 0.492 762 HA ASP 98 HA ASP 98 -21.373 8.838 -0.853 763 HB2 ASP 98 2HB ASP 98 -20.530 10.812 0.523 764 HB3 ASP 98 1HB ASP 98 -19.395 11.111 -0.789 765 H ARG 99 H ARG 99 -18.013 9.641 -1.712 766 HA ARG 99 HA ARG 99 -18.594 8.683 -4.480 767 HB2 ARG 99 2HB ARG 99 -16.901 11.053 -3.631 768 HB3 ARG 99 1HB ARG 99 -17.007 10.435 -5.281 769 HG2 ARG 99 2HG ARG 99 -19.473 10.820 -5.223 770 HG3 ARG 99 1HG ARG 99 -19.294 11.539 -3.623 771 HD2 ARG 99 2HD ARG 99 -17.666 13.181 -4.634 772 HD3 ARG 99 1HD ARG 99 -18.094 12.539 -6.220 773 HE ARG 99 HE ARG 99 -20.464 13.310 -4.770 774 HH11 ARG 99 1HH1 ARG 99 -21.504 15.203 -5.439 775 HH12 ARG 99 2HH1 ARG 99 -20.648 16.345 -6.420 776 HH21 ARG 99 1HH2 ARG 99 -17.724 14.484 -6.501 777 HH22 ARG 99 2HH2 ARG 99 -18.506 15.938 -7.021 778 H ALA 100 H ALA 100 -17.408 7.305 -2.119 779 HA ALA 100 HA ALA 100 -14.555 7.172 -2.416 780 HB1 ALA 100 1HB ALA 100 -16.318 6.164 -0.612 781 HB2 ALA 100 2HB ALA 100 -14.657 5.595 -0.769 782 HB3 ALA 100 3HB ALA 100 -15.968 4.715 -1.553 783 H SER 101 H SER 101 -13.288 5.596 -3.517 784 HA SER 101 HA SER 101 -14.697 4.316 -5.820 785 HB2 SER 101 2HB SER 101 -12.958 6.034 -6.351 786 HB3 SER 101 1HB SER 101 -11.761 5.019 -5.552 787 HG SER 101 HG SER 101 -12.649 3.337 -7.074 788 H GLU 102 H GLU 102 -13.853 2.188 -6.503 789 HA GLU 102 HA GLU 102 -12.903 0.612 -4.148 790 HB2 GLU 102 2HB GLU 102 -14.393 -0.305 -6.626 791 HB3 GLU 102 1HB GLU 102 -13.938 -1.327 -5.262 792 HG2 GLU 102 2HG GLU 102 -15.303 0.101 -3.758 793 HG3 GLU 102 1HG GLU 102 -15.795 1.068 -5.149 794 H ILE 103 H ILE 103 -11.265 -0.950 -4.465 795 HA ILE 103 HA ILE 103 -9.623 -0.538 -6.935 796 HB ILE 103 HB ILE 103 -8.681 -1.346 -4.170 797 HG12 ILE 103 2HG1 ILE 103 -8.351 1.325 -5.567 798 HG13 ILE 103 1HG1 ILE 103 -9.579 1.012 -4.340 799 HG21 ILE 103 1HG2 ILE 103 -6.612 -0.241 -5.713 800 HG22 ILE 103 2HG2 ILE 103 -7.478 -1.322 -6.805 801 HG23 ILE 103 3HG2 ILE 103 -6.823 -1.939 -5.289 802 HD11 ILE 103 1HD1 ILE 103 -7.630 0.196 -2.859 803 HD12 ILE 103 2HD1 ILE 103 -7.768 1.935 -3.124 804 HD13 ILE 103 3HD1 ILE 103 -6.578 0.998 -4.026 805 H GLU 104 H GLU 104 -8.945 -2.400 -8.027 806 HA GLU 104 HA GLU 104 -9.908 -4.993 -6.872 807 HB2 GLU 104 2HB GLU 104 -10.951 -4.297 -9.045 808 HB3 GLU 104 1HB GLU 104 -9.347 -4.345 -9.780 809 HG2 GLU 104 2HG GLU 104 -9.143 -6.736 -9.095 810 HG3 GLU 104 1HG GLU 104 -10.793 -6.672 -8.477 811 H VAL 105 H VAL 105 -8.305 -6.299 -6.182 812 HA VAL 105 HA VAL 105 -5.656 -6.138 -7.547 813 HB VAL 105 HB VAL 105 -6.091 -6.612 -4.586 814 HG11 VAL 105 1HG1 VAL 105 -3.583 -6.024 -4.624 815 HG12 VAL 105 2HG1 VAL 105 -3.672 -6.292 -6.364 816 HG13 VAL 105 3HG1 VAL 105 -4.044 -7.608 -5.251 817 HG21 VAL 105 1HG2 VAL 105 -5.636 -4.122 -6.186 818 HG22 VAL 105 2HG2 VAL 105 -4.852 -4.260 -4.613 819 HG23 VAL 105 3HG2 VAL 105 -6.608 -4.355 -4.734 820 H ASP 106 H ASP 106 -4.957 -8.122 -8.252 821 HA ASP 106 HA ASP 106 -6.342 -10.523 -7.125 822 HB2 ASP 106 2HB ASP 106 -5.264 -10.047 -9.916 823 HB3 ASP 106 1HB ASP 106 -5.903 -11.587 -9.342 824 H PHE 107 H PHE 107 -5.038 -12.058 -6.229 825 HA PHE 107 HA PHE 107 -2.097 -11.801 -6.704 826 HB2 PHE 107 2HB PHE 107 -3.690 -12.191 -4.230 827 HB3 PHE 107 1HB PHE 107 -2.209 -13.141 -4.361 828 HD1 PHE 107 1HD PHE 107 -0.022 -12.041 -4.590 829 HD2 PHE 107 2HD PHE 107 -3.623 -9.771 -4.044 830 HE1 PHE 107 1HE PHE 107 1.329 -10.046 -4.017 831 HE2 PHE 107 2HE PHE 107 -2.274 -7.771 -3.470 832 HZ PHE 107 HZ PHE 107 0.208 -7.913 -3.458 833 H VAL 108 H VAL 108 -1.274 -13.494 -7.791 834 HA VAL 108 HA VAL 108 -2.450 -16.193 -7.321 835 HB VAL 108 HB VAL 108 -2.775 -16.624 -9.563 836 HG11 VAL 108 1HG1 VAL 108 -2.833 -13.593 -9.615 837 HG12 VAL 108 2HG1 VAL 108 -4.119 -14.602 -8.951 838 HG13 VAL 108 3HG1 VAL 108 -3.734 -14.682 -10.670 839 HG21 VAL 108 1HG2 VAL 108 -0.535 -16.420 -10.349 840 HG22 VAL 108 2HG2 VAL 108 -0.494 -14.688 -10.011 841 HG23 VAL 108 3HG2 VAL 108 -1.470 -15.303 -11.345 842 HA PRO 109 HA PRO 109 1.756 -17.362 -6.659 843 HB2 PRO 109 2HB PRO 109 1.755 -19.887 -7.831 844 HB3 PRO 109 1HB PRO 109 1.212 -19.529 -6.187 845 HG2 PRO 109 2HG PRO 109 -0.374 -19.962 -8.647 846 HG3 PRO 109 1HG PRO 109 -0.749 -20.382 -6.968 847 HD2 PRO 109 2HD PRO 109 -1.895 -18.258 -8.235 848 HD3 PRO 109 1HD PRO 109 -1.588 -18.276 -6.483 849 H ASN 110 H ASN 110 3.568 -16.773 -7.764 850 HA ASN 110 HA ASN 110 3.592 -17.138 -10.728 851 HB2 ASN 110 2HB ASN 110 3.490 -14.746 -9.819 852 HB3 ASN 110 1HB ASN 110 5.124 -15.025 -9.226 853 HD21 ASN 110 1HD2 ASN 110 5.703 -13.244 -10.843 854 HD22 ASN 110 2HD2 ASN 110 5.955 -13.689 -12.461 855 H GLY 111 H GLY 111 5.028 -18.710 -11.265 856 HA2 GLY 111 2HA GLY 111 6.926 -20.089 -11.182 857 HA3 GLY 111 1HA GLY 111 7.775 -18.650 -10.613 858 H SER 112 H SER 112 8.955 -19.461 -8.900 859 HA SER 112 HA SER 112 7.372 -20.707 -6.689 860 HB2 SER 112 2HB SER 112 10.209 -21.367 -7.496 861 HB3 SER 112 1HB SER 112 9.350 -22.058 -6.125 862 HG SER 112 HG SER 112 8.239 -23.286 -7.445 863 H GLY 113 H GLY 113 7.719 -19.815 -4.677 864 HA2 GLY 113 2HA GLY 113 8.623 -18.403 -3.032 865 HA3 GLY 113 1HA GLY 113 10.104 -18.346 -3.985 866 H GLY 114 H GLY 114 7.353 -17.477 -5.813 867 HA2 GLY 114 2HA GLY 114 7.584 -14.614 -5.110 868 HA3 GLY 114 1HA GLY 114 8.035 -15.066 -6.752 869 H THR 115 H THR 115 5.703 -13.460 -5.590 870 HA THR 115 HA THR 115 3.533 -14.990 -6.973 871 HB THR 115 HB THR 115 3.085 -12.987 -4.752 872 HG1 THR 115 1HG THR 115 3.496 -15.786 -4.654 873 HG21 THR 115 1HG2 THR 115 1.405 -15.243 -5.873 874 HG22 THR 115 2HG2 THR 115 1.195 -13.537 -6.265 875 HG23 THR 115 3HG2 THR 115 0.909 -14.107 -4.622 876 H ARG 116 H ARG 116 2.303 -13.822 -8.449 877 HA ARG 116 HA ARG 116 3.241 -11.025 -8.973 878 HB2 ARG 116 2HB ARG 116 3.694 -12.688 -10.788 879 HB3 ARG 116 1HB ARG 116 1.957 -12.975 -10.913 880 HG2 ARG 116 2HG ARG 116 1.615 -10.566 -11.412 881 HG3 ARG 116 1HG ARG 116 3.360 -10.323 -11.351 882 HD2 ARG 116 2HD ARG 116 3.616 -12.014 -13.175 883 HD3 ARG 116 1HD ARG 116 1.859 -12.111 -13.284 884 HE ARG 116 HE ARG 116 2.316 -9.424 -13.587 885 HH11 ARG 116 1HH1 ARG 116 2.775 -8.434 -15.567 886 HH12 ARG 116 2HH1 ARG 116 3.511 -9.359 -16.833 887 HH21 ARG 116 1HH2 ARG 116 3.649 -12.284 -14.977 888 HH22 ARG 116 2HH2 ARG 116 4.005 -11.538 -16.498 889 H VAL 117 H VAL 117 1.735 -9.437 -8.785 890 HA VAL 117 HA VAL 117 -1.133 -10.263 -8.698 891 HB VAL 117 HB VAL 117 -0.795 -9.754 -6.468 892 HG11 VAL 117 1HG1 VAL 117 1.298 -7.884 -7.536 893 HG12 VAL 117 2HG1 VAL 117 1.461 -9.165 -6.335 894 HG13 VAL 117 3HG1 VAL 117 0.669 -7.649 -5.906 895 HG21 VAL 117 1HG2 VAL 117 -1.899 -7.704 -6.047 896 HG22 VAL 117 2HG2 VAL 117 -2.432 -8.131 -7.671 897 HG23 VAL 117 3HG2 VAL 117 -1.170 -6.924 -7.448 898 H GLU 118 H GLU 118 -2.596 -8.970 -9.738 899 HA GLU 118 HA GLU 118 -1.466 -6.725 -11.347 900 HB2 GLU 118 2HB GLU 118 -2.523 -8.526 -12.658 901 HB3 GLU 118 1HB GLU 118 -4.003 -8.353 -11.718 902 HG2 GLU 118 2HG GLU 118 -4.216 -6.008 -12.520 903 HG3 GLU 118 1HG GLU 118 -2.775 -6.232 -13.509 904 H LEU 119 H LEU 119 -1.986 -4.718 -10.644 905 HA LEU 119 HA LEU 119 -4.446 -4.408 -8.980 906 HB2 LEU 119 2HB LEU 119 -2.246 -4.008 -7.815 907 HB3 LEU 119 1HB LEU 119 -1.962 -2.674 -8.932 908 HG LEU 119 HG LEU 119 -4.595 -2.642 -7.572 909 HD11 LEU 119 1HD1 LEU 119 -3.683 -1.810 -5.463 910 HD12 LEU 119 2HD1 LEU 119 -2.038 -2.026 -6.062 911 HD13 LEU 119 3HD1 LEU 119 -3.061 -3.433 -5.767 912 HD21 LEU 119 1HD2 LEU 119 -3.857 -0.822 -9.041 913 HD22 LEU 119 2HD2 LEU 119 -2.401 -0.603 -8.071 914 HD23 LEU 119 3HD2 LEU 119 -3.983 -0.233 -7.384 915 H ALA 120 H ALA 120 -5.998 -3.116 -9.845 916 HA ALA 120 HA ALA 120 -5.159 -1.080 -11.862 917 HB1 ALA 120 1HB ALA 120 -7.478 -3.020 -12.075 918 HB2 ALA 120 2HB ALA 120 -6.066 -2.940 -13.128 919 HB3 ALA 120 3HB ALA 120 -7.248 -1.632 -13.140 920 H HIS 121 H HIS 121 -6.210 0.878 -11.667 921 HA HIS 121 HA HIS 121 -8.374 1.055 -9.604 922 HB2 HIS 121 2HB HIS 121 -7.175 2.618 -8.509 923 HB3 HIS 121 1HB HIS 121 -5.834 2.319 -9.611 924 HD1 HIS 121 1HD HIS 121 -9.175 4.160 -10.044 925 HD2 HIS 121 2HD HIS 121 -5.094 4.749 -10.671 926 HE1 HIS 121 1HE HIS 121 -8.937 6.441 -11.120 927 HE2 HIS 121 2HE HIS 121 -6.457 6.817 -11.488 928 H VAL 122 H VAL 122 -10.223 2.124 -10.253 929 HA VAL 122 HA VAL 122 -10.093 3.690 -12.781 930 HB VAL 122 HB VAL 122 -12.167 2.582 -13.573 931 HG11 VAL 122 1HG1 VAL 122 -11.037 0.801 -14.528 932 HG12 VAL 122 2HG1 VAL 122 -10.264 0.343 -13.011 933 HG13 VAL 122 3HG1 VAL 122 -9.668 1.732 -13.919 934 HG21 VAL 122 1HG2 VAL 122 -13.258 1.761 -11.673 935 HG22 VAL 122 2HG2 VAL 122 -11.774 1.099 -10.986 936 HG23 VAL 122 3HG2 VAL 122 -12.557 0.288 -12.343 937 H LYS 123 H LYS 123 -11.588 5.363 -12.902 938 HA LYS 123 HA LYS 123 -13.021 7.024 -12.097 939 HB2 LYS 123 2HB LYS 123 -14.251 4.677 -10.629 940 HB3 LYS 123 1HB LYS 123 -15.028 6.228 -10.947 941 HG2 LYS 123 2HG LYS 123 -14.767 5.840 -13.384 942 HG3 LYS 123 1HG LYS 123 -14.058 4.262 -13.041 943 HD2 LYS 123 2HD LYS 123 -16.163 3.665 -11.803 944 HD3 LYS 123 1HD LYS 123 -16.865 5.180 -12.373 945 HE2 LYS 123 2HE LYS 123 -16.358 4.445 -14.728 946 HE3 LYS 123 1HE LYS 123 -15.875 2.878 -14.076 947 HZ1 LYS 123 1HZ LYS 123 -18.547 4.148 -13.812 948 HZ2 LYS 123 2HZ LYS 123 -18.092 2.684 -13.081 949 HZ3 LYS 123 3HZ LYS 123 -18.162 2.805 -14.774 950 H LEU 124 H LEU 124 -10.560 6.396 -10.489 951 HA LEU 124 HA LEU 124 -11.218 6.610 -7.692 952 HB2 LEU 124 2HB LEU 124 -8.984 5.901 -8.506 953 HB3 LEU 124 1HB LEU 124 -8.709 7.530 -9.127 954 HG LEU 124 HG LEU 124 -9.053 8.396 -6.788 955 HD11 LEU 124 1HD1 LEU 124 -9.671 5.561 -6.377 956 HD12 LEU 124 2HD1 LEU 124 -10.038 6.948 -5.353 957 HD13 LEU 124 3HD1 LEU 124 -8.464 6.163 -5.242 958 HD21 LEU 124 1HD2 LEU 124 -6.803 8.337 -6.756 959 HD22 LEU 124 2HD2 LEU 124 -6.823 7.021 -7.931 960 HD23 LEU 124 3HD2 LEU 124 -6.854 6.663 -6.204 961 H HIS 125 H HIS 125 -10.663 8.967 -10.255 962 HA HIS 125 HA HIS 125 -10.573 11.303 -8.639 963 HB2 HIS 125 2HB HIS 125 -9.933 11.434 -10.960 964 HB3 HIS 125 1HB HIS 125 -11.541 10.923 -11.473 965 HD1 HIS 125 1HD HIS 125 -11.261 13.304 -8.626 966 HD2 HIS 125 2HD HIS 125 -11.981 13.490 -12.730 967 HE1 HIS 125 1HE HIS 125 -12.142 15.631 -9.091 968 HE2 HIS 125 2HE HIS 125 -12.575 15.761 -11.589 969 H ARG 126 H ARG 126 -13.271 9.275 -9.520 970 HA ARG 126 HA ARG 126 -15.429 11.019 -9.450 971 HB2 ARG 126 2HB ARG 126 -16.767 9.181 -8.733 972 HB3 ARG 126 1HB ARG 126 -15.454 8.463 -9.662 973 HG2 ARG 126 2HG ARG 126 -14.217 8.156 -7.466 974 HG3 ARG 126 1HG ARG 126 -15.713 8.614 -6.656 975 HD2 ARG 126 2HD ARG 126 -15.364 6.284 -8.561 976 HD3 ARG 126 1HD ARG 126 -15.580 6.175 -6.815 977 HE ARG 126 HE ARG 126 -17.747 7.624 -8.101 978 HH11 ARG 126 1HH1 ARG 126 -19.751 6.579 -8.126 979 HH12 ARG 126 2HH1 ARG 126 -19.831 4.881 -7.799 980 HH21 ARG 126 1HH2 ARG 126 -16.412 4.540 -7.332 981 HH22 ARG 126 2HH2 ARG 126 -17.940 3.725 -7.349 982 H HIS 127 H HIS 127 -13.309 10.053 -6.837 983 HA HIS 127 HA HIS 127 -14.871 10.900 -4.622 984 HB2 HIS 127 2HB HIS 127 -12.450 9.770 -4.838 985 HB3 HIS 127 1HB HIS 127 -11.937 11.442 -4.616 986 HD1 HIS 127 1HD HIS 127 -14.473 12.131 -2.732 987 HD2 HIS 127 2HD HIS 127 -11.727 9.038 -2.182 988 HE1 HIS 127 1HE HIS 127 -14.543 11.537 -0.267 989 HE2 HIS 127 2HE HIS 127 -12.875 9.658 0.077 990 H GLY 128 H GLY 128 -12.686 12.686 -6.761 991 HA2 GLY 128 2HA GLY 128 -12.230 15.002 -6.885 992 HA3 GLY 128 1HA GLY 128 -13.990 15.084 -6.932 993 H ASP 129 H ASP 129 -12.624 13.794 -4.037 994 HA ASP 129 HA ASP 129 -13.389 16.309 -2.631 995 HB2 ASP 129 2HB ASP 129 -13.013 13.476 -1.616 996 HB3 ASP 129 1HB ASP 129 -13.414 14.856 -0.593 997 H GLY 130 H GLY 130 -10.685 15.170 -3.949 998 HA2 GLY 130 2HA GLY 130 -8.516 16.160 -3.513 999 HA3 GLY 130 1HA GLY 130 -8.992 16.385 -1.828 1000 H ALA 131 H ALA 131 -9.838 13.346 -3.147 1001 HA ALA 131 HA ALA 131 -8.383 11.826 -1.265 1002 HB1 ALA 131 1HB ALA 131 -8.940 10.708 -3.994 1003 HB2 ALA 131 2HB ALA 131 -10.295 11.162 -2.961 1004 HB3 ALA 131 3HB ALA 131 -9.141 9.947 -2.415 1005 H TRP 132 H TRP 132 -7.420 13.047 -4.429 1006 HA TRP 132 HA TRP 132 -5.142 11.459 -4.901 1007 HB2 TRP 132 2HB TRP 132 -6.130 13.252 -6.414 1008 HB3 TRP 132 1HB TRP 132 -5.274 14.435 -5.424 1009 HD1 TRP 132 HD TRP 132 -2.973 15.030 -6.295 1010 HE1 TRP 132 1HE TRP 132 -1.183 13.869 -7.744 1011 HE3 TRP 132 3HE TRP 132 -5.230 10.510 -7.028 1012 HZ2 TRP 132 2HZ TRP 132 -0.766 11.352 -9.042 1013 HZ3 TRP 132 3HZ TRP 132 -4.117 8.750 -8.372 1014 HH2 TRP 132 HH TRP 132 -1.889 9.166 -9.378 1015 H ASN 133 H ASN 133 -5.501 14.330 -2.838 1016 HA ASN 133 HA ASN 133 -2.770 14.677 -2.160 1017 HB2 ASN 133 2HB ASN 133 -5.278 15.141 -0.518 1018 HB3 ASN 133 1HB ASN 133 -3.677 15.713 -0.064 1019 HD21 ASN 133 1HD2 ASN 133 -5.821 17.548 -0.582 1020 HD22 ASN 133 2HD2 ASN 133 -5.449 18.419 -1.992 1021 H ILE 134 H ILE 134 -5.270 12.593 -0.725 1022 HA ILE 134 HA ILE 134 -3.704 11.569 1.424 1023 HB ILE 134 HB ILE 134 -6.093 10.628 -0.100 1024 HG12 ILE 134 2HG1 ILE 134 -7.140 10.786 2.066 1025 HG13 ILE 134 1HG1 ILE 134 -5.576 10.914 2.869 1026 HG21 ILE 134 1HG2 ILE 134 -4.987 8.535 0.104 1027 HG22 ILE 134 2HG2 ILE 134 -6.085 8.603 1.481 1028 HG23 ILE 134 3HG2 ILE 134 -4.367 8.932 1.706 1029 HD11 ILE 134 1HD1 ILE 134 -6.971 13.090 2.403 1030 HD12 ILE 134 2HD1 ILE 134 -6.324 12.926 0.772 1031 HD13 ILE 134 3HD1 ILE 134 -5.229 13.103 2.142 1032 H HIS 135 H HIS 135 -4.113 10.438 -1.924 1033 HA HIS 135 HA HIS 135 -2.411 8.148 -1.683 1034 HB2 HIS 135 2HB HIS 135 -3.902 8.405 -3.600 1035 HB3 HIS 135 1HB HIS 135 -3.058 9.874 -4.092 1036 HD1 HIS 135 1HD HIS 135 -1.008 7.066 -2.781 1037 HD2 HIS 135 2HD HIS 135 -2.192 8.521 -6.504 1038 HE1 HIS 135 1HE HIS 135 0.466 5.935 -4.497 1039 HE2 HIS 135 2HE HIS 135 -0.251 6.801 -6.768 1040 H LYS 136 H LYS 136 -1.794 11.536 -2.467 1041 HA LYS 136 HA LYS 136 0.905 11.355 -3.263 1042 HB2 LYS 136 2HB LYS 136 -0.488 13.425 -3.345 1043 HB3 LYS 136 1HB LYS 136 -0.343 13.546 -1.599 1044 HG2 LYS 136 2HG LYS 136 2.127 13.618 -1.848 1045 HG3 LYS 136 1HG LYS 136 1.919 13.617 -3.593 1046 HD2 LYS 136 2HD LYS 136 0.569 15.695 -3.415 1047 HD3 LYS 136 1HD LYS 136 0.869 15.715 -1.677 1048 HE2 LYS 136 2HE LYS 136 2.954 16.550 -1.944 1049 HE3 LYS 136 1HE LYS 136 3.326 15.413 -3.240 1050 HZ1 LYS 136 1HZ LYS 136 3.176 17.158 -4.587 1051 HZ2 LYS 136 2HZ LYS 136 2.457 18.135 -3.398 1052 HZ3 LYS 136 3HZ LYS 136 1.498 17.100 -4.345 1053 H ALA 137 H ALA 137 -0.493 11.573 0.000 1054 HA ALA 137 HA ALA 137 2.034 11.675 1.374 1055 HB1 ALA 137 1HB ALA 137 -0.553 10.514 2.435 1056 HB2 ALA 137 2HB ALA 137 -0.235 12.247 2.359 1057 HB3 ALA 137 3HB ALA 137 0.770 11.208 3.371 1058 H LEU 138 H LEU 138 -0.141 9.009 0.502 1059 HA LEU 138 HA LEU 138 1.503 6.950 1.677 1060 HB2 LEU 138 2HB LEU 138 -0.507 6.723 -0.578 1061 HB3 LEU 138 1HB LEU 138 0.081 5.408 0.427 1062 HG LEU 138 HG LEU 138 -1.547 7.790 1.350 1063 HD11 LEU 138 1HD1 LEU 138 -3.314 6.230 1.698 1064 HD12 LEU 138 2HD1 LEU 138 -2.240 4.848 1.485 1065 HD13 LEU 138 3HD1 LEU 138 -2.675 5.848 0.100 1066 HD21 LEU 138 1HD2 LEU 138 -0.020 5.645 2.778 1067 HD22 LEU 138 2HD2 LEU 138 -1.527 6.229 3.483 1068 HD23 LEU 138 3HD2 LEU 138 -0.198 7.350 3.190 1069 H ASP 139 H ASP 139 1.381 8.581 -1.418 1070 HA ASP 139 HA ASP 139 3.152 6.717 -2.772 1071 HB2 ASP 139 2HB ASP 139 1.471 8.267 -3.890 1072 HB3 ASP 139 1HB ASP 139 2.585 9.588 -3.539 1073 H GLY 140 H GLY 140 4.513 9.369 -3.794 1074 HA2 GLY 140 2HA GLY 140 6.217 10.834 -2.723 1075 HA3 GLY 140 1HA GLY 140 6.593 9.492 -1.646 1076 HA PRO 141 HA PRO 141 9.610 7.727 -4.356 1077 HB2 PRO 141 2HB PRO 141 7.896 5.350 -4.915 1078 HB3 PRO 141 1HB PRO 141 9.550 5.424 -4.278 1079 HG2 PRO 141 2HG PRO 141 7.507 4.851 -2.694 1080 HG3 PRO 141 1HG PRO 141 8.845 5.869 -2.131 1081 HD2 PRO 141 2HD PRO 141 6.084 6.678 -2.970 1082 HD3 PRO 141 1HD PRO 141 7.110 7.335 -1.675 1083 H SER 142 H SER 142 10.158 7.557 -6.582 1084 HA SER 142 HA SER 142 8.627 8.927 -8.465 1085 HB2 SER 142 2HB SER 142 11.017 7.336 -8.493 1086 HB3 SER 142 1HB SER 142 10.047 6.942 -9.909 1087 HG SER 142 HG SER 142 11.087 9.429 -9.074 1088 HA PRO 143 HA PRO 143 7.111 4.475 -10.113 1089 HB2 PRO 143 2HB PRO 143 6.781 3.374 -7.350 1090 HB3 PRO 143 1HB PRO 143 7.171 2.532 -8.863 1091 HG2 PRO 143 2HG PRO 143 9.041 3.053 -7.040 1092 HG3 PRO 143 1HG PRO 143 9.388 3.116 -8.777 1093 HD2 PRO 143 2HD PRO 143 9.113 5.350 -6.838 1094 HD3 PRO 143 1HD PRO 143 10.043 5.276 -8.348 1095 H GLY 144 H GLY 144 4.880 4.218 -10.420 1096 HA2 GLY 144 2HA GLY 144 3.164 5.972 -8.756 1097 HA3 GLY 144 1HA GLY 144 2.761 5.382 -10.366 1098 H GLU 145 H GLU 145 2.587 2.852 -10.447 1099 HA GLU 145 HA GLU 145 0.419 1.993 -8.948 1100 HB2 GLU 145 2HB GLU 145 1.087 -0.309 -9.502 1101 HB3 GLU 145 1HB GLU 145 1.326 0.759 -10.887 1102 HG2 GLU 145 2HG GLU 145 3.718 0.992 -10.277 1103 HG3 GLU 145 1HG GLU 145 3.469 -0.125 -8.934 1104 H THR 146 H THR 146 0.102 0.996 -6.984 1105 HA THR 146 HA THR 146 1.941 1.517 -4.858 1106 HB THR 146 HB THR 146 -0.474 -0.276 -5.060 1107 HG1 THR 146 1HG THR 146 0.059 2.346 -4.368 1108 HG21 THR 146 1HG2 THR 146 0.701 -1.282 -3.306 1109 HG22 THR 146 2HG2 THR 146 -0.297 -0.094 -2.466 1110 HG23 THR 146 3HG2 THR 146 1.406 0.245 -2.776 1111 H LEU 147 H LEU 147 1.363 -1.343 -6.843 1112 HA LEU 147 HA LEU 147 2.695 -3.278 -5.311 1113 HB2 LEU 147 2HB LEU 147 2.812 -3.026 -8.324 1114 HB3 LEU 147 1HB LEU 147 2.991 -4.499 -7.367 1115 HG LEU 147 HG LEU 147 0.500 -2.784 -7.544 1116 HD11 LEU 147 1HD1 LEU 147 0.539 -5.661 -8.275 1117 HD12 LEU 147 2HD1 LEU 147 1.370 -4.567 -9.380 1118 HD13 LEU 147 3HD1 LEU 147 -0.337 -4.323 -9.017 1119 HD21 LEU 147 1HD2 LEU 147 -0.373 -4.937 -6.289 1120 HD22 LEU 147 2HD2 LEU 147 0.403 -3.643 -5.375 1121 HD23 LEU 147 3HD2 LEU 147 1.316 -5.092 -5.801 1122 H ALA 148 H ALA 148 4.060 -0.789 -7.429 1123 HA ALA 148 HA ALA 148 6.733 -1.791 -7.460 1124 HB1 ALA 148 1HB ALA 148 5.736 0.135 -8.850 1125 HB2 ALA 148 2HB ALA 148 7.381 0.352 -8.253 1126 HB3 ALA 148 3HB ALA 148 6.036 1.149 -7.437 1127 H ARG 149 H ARG 149 5.164 0.565 -5.287 1128 HA ARG 149 HA ARG 149 7.457 0.897 -3.589 1129 HB2 ARG 149 2HB ARG 149 4.516 1.299 -3.021 1130 HB3 ARG 149 1HB ARG 149 5.829 1.883 -2.005 1131 HG2 ARG 149 2HG ARG 149 6.705 3.160 -3.981 1132 HG3 ARG 149 1HG ARG 149 5.258 2.684 -4.868 1133 HD2 ARG 149 2HD ARG 149 5.325 4.295 -2.298 1134 HD3 ARG 149 1HD ARG 149 4.940 4.912 -3.903 1135 HE ARG 149 HE ARG 149 2.812 3.823 -3.780 1136 HH11 ARG 149 1HH1 ARG 149 1.160 2.947 -2.518 1137 HH12 ARG 149 2HH1 ARG 149 1.523 2.341 -0.937 1138 HH21 ARG 149 1HH2 ARG 149 4.898 3.101 -1.121 1139 HH22 ARG 149 2HH2 ARG 149 3.634 2.429 -0.148 1140 H PHE 150 H PHE 150 4.617 -1.213 -3.465 1141 HA PHE 150 HA PHE 150 5.173 -2.398 -0.917 1142 HB2 PHE 150 2HB PHE 150 2.980 -2.554 -2.038 1143 HB3 PHE 150 1HB PHE 150 3.700 -3.537 -3.310 1144 HD1 PHE 150 1HD PHE 150 3.835 -5.864 -3.085 1145 HD2 PHE 150 2HD PHE 150 3.191 -3.431 0.395 1146 HE1 PHE 150 1HE PHE 150 3.478 -7.908 -1.726 1147 HE2 PHE 150 2HE PHE 150 2.834 -5.472 1.755 1148 HZ PHE 150 HZ PHE 150 2.982 -7.713 0.694 1149 H ALA 151 H ALA 151 6.078 -3.355 -4.228 1150 HA ALA 151 HA ALA 151 7.318 -5.829 -3.490 1151 HB1 ALA 151 1HB ALA 151 6.679 -4.800 -5.845 1152 HB2 ALA 151 2HB ALA 151 8.007 -5.952 -5.700 1153 HB3 ALA 151 3HB ALA 151 8.345 -4.225 -5.798 1154 H ASN 152 H ASN 152 8.682 -2.549 -3.851 1155 HA ASN 152 HA ASN 152 11.399 -3.348 -3.451 1156 HB2 ASN 152 2HB ASN 152 11.889 -1.124 -3.582 1157 HB3 ASN 152 1HB ASN 152 10.221 -1.014 -4.146 1158 HD21 ASN 152 1HD2 ASN 152 8.644 -0.084 -2.716 1159 HD22 ASN 152 2HD2 ASN 152 9.068 0.653 -1.249 1160 H VAL 153 H VAL 153 9.031 -2.030 -1.110 1161 HA VAL 153 HA VAL 153 10.824 -2.315 1.125 1162 HB VAL 153 HB VAL 153 8.862 -1.869 2.501 1163 HG11 VAL 153 1HG1 VAL 153 8.792 0.296 1.845 1164 HG12 VAL 153 2HG1 VAL 153 8.134 -0.123 0.263 1165 HG13 VAL 153 3HG1 VAL 153 9.874 -0.202 0.544 1166 HG21 VAL 153 1HG2 VAL 153 7.120 -3.171 1.648 1167 HG22 VAL 153 2HG2 VAL 153 7.426 -2.658 -0.012 1168 HG23 VAL 153 3HG2 VAL 153 6.656 -1.553 1.124 1169 H ILE 154 H ILE 154 8.656 -4.490 -0.524 1170 HA ILE 154 HA ILE 154 8.651 -6.456 1.648 1171 HB ILE 154 HB ILE 154 7.600 -6.416 -1.172 1172 HG12 ILE 154 2HG1 ILE 154 6.554 -5.273 0.987 1173 HG13 ILE 154 1HG1 ILE 154 5.533 -6.083 -0.192 1174 HG21 ILE 154 1HG2 ILE 154 6.484 -8.621 -0.384 1175 HG22 ILE 154 2HG2 ILE 154 7.813 -8.688 0.777 1176 HG23 ILE 154 3HG2 ILE 154 8.152 -8.673 -0.954 1177 HD11 ILE 154 1HD1 ILE 154 5.339 -8.034 1.149 1178 HD12 ILE 154 2HD1 ILE 154 5.154 -6.691 2.278 1179 HD13 ILE 154 3HD1 ILE 154 6.690 -7.551 2.177 Start of MODEL 18 1 H1 MET 1 1HT MET 1 -2.801 7.455 -9.696 2 H2 MET 1 2HT MET 1 -4.039 6.732 -8.783 3 H3 MET 1 3HT MET 1 -2.776 5.784 -9.412 4 HA MET 1 HA MET 1 -2.814 7.535 -7.079 5 HB2 MET 1 2HB MET 1 -2.376 4.792 -7.676 6 HB3 MET 1 1HB MET 1 -0.850 5.441 -7.078 7 HG2 MET 1 2HG MET 1 -2.162 6.473 -5.164 8 HG3 MET 1 1HG MET 1 -3.549 5.529 -5.708 9 HE1 MET 1 1HE MET 1 -2.937 5.277 -3.008 10 HE2 MET 1 2HE MET 1 -1.194 5.529 -2.959 11 HE3 MET 1 3HE MET 1 -1.871 4.001 -2.404 12 HA PRO 2 HA PRO 2 1.636 8.127 -8.665 13 HB2 PRO 2 2HB PRO 2 2.422 7.029 -10.999 14 HB3 PRO 2 1HB PRO 2 2.345 6.084 -9.501 15 HG2 PRO 2 2HG PRO 2 0.510 6.096 -11.824 16 HG3 PRO 2 1HG PRO 2 0.951 4.770 -10.736 17 HD2 PRO 2 2HD PRO 2 -1.400 6.327 -10.612 18 HD3 PRO 2 1HD PRO 2 -0.820 5.206 -9.363 19 H GLU 3 H GLU 3 2.506 9.901 -9.859 20 HA GLU 3 HA GLU 3 2.177 11.929 -11.048 21 HB2 GLU 3 2HB GLU 3 1.458 9.937 -13.208 22 HB3 GLU 3 1HB GLU 3 2.131 11.549 -13.442 23 HG2 GLU 3 2HG GLU 3 4.165 10.833 -12.172 24 HG3 GLU 3 1HG GLU 3 3.501 9.200 -12.095 25 H GLU 4 H GLU 4 0.215 11.825 -13.454 26 HA GLU 4 HA GLU 4 -2.056 12.894 -12.019 27 HB2 GLU 4 2HB GLU 4 -1.877 11.943 -14.896 28 HB3 GLU 4 1HB GLU 4 -3.110 13.011 -14.224 29 HG2 GLU 4 2HG GLU 4 -1.557 14.476 -15.249 30 HG3 GLU 4 1HG GLU 4 -1.156 14.544 -13.536 31 H ILE 5 H ILE 5 -3.870 11.766 -11.307 32 HA ILE 5 HA ILE 5 -3.861 9.028 -10.859 33 HB ILE 5 HB ILE 5 -6.514 10.182 -11.561 34 HG12 ILE 5 2HG1 ILE 5 -4.673 11.288 -9.423 35 HG13 ILE 5 1HG1 ILE 5 -5.515 12.180 -10.690 36 HG21 ILE 5 1HG2 ILE 5 -7.167 9.061 -9.546 37 HG22 ILE 5 2HG2 ILE 5 -5.494 8.925 -9.004 38 HG23 ILE 5 3HG2 ILE 5 -6.057 7.971 -10.377 39 HD11 ILE 5 1HD1 ILE 5 -6.733 10.815 -8.278 40 HD12 ILE 5 2HD1 ILE 5 -7.694 11.390 -9.640 41 HD13 ILE 5 3HD1 ILE 5 -6.764 12.535 -8.671 42 HA PRO 6 HA PRO 6 -4.465 7.844 -15.231 43 HB2 PRO 6 2HB PRO 6 -3.099 5.533 -15.187 44 HB3 PRO 6 1HB PRO 6 -2.257 7.096 -15.142 45 HG2 PRO 6 2HG PRO 6 -2.776 5.164 -12.951 46 HG3 PRO 6 1HG PRO 6 -1.377 6.213 -13.228 47 HD2 PRO 6 2HD PRO 6 -3.514 6.738 -11.460 48 HD3 PRO 6 1HD PRO 6 -2.291 7.903 -12.003 49 H ASP 7 H ASP 7 -5.677 6.063 -16.273 50 HA ASP 7 HA ASP 7 -7.842 5.073 -14.660 51 HB2 ASP 7 2HB ASP 7 -6.890 4.285 -17.433 52 HB3 ASP 7 1HB ASP 7 -8.406 3.751 -16.711 53 H VAL 8 H VAL 8 -7.378 2.364 -16.300 54 HA VAL 8 HA VAL 8 -6.782 0.706 -14.134 55 HB VAL 8 HB VAL 8 -6.481 -1.037 -15.695 56 HG11 VAL 8 1HG1 VAL 8 -8.325 -0.789 -17.078 57 HG12 VAL 8 2HG1 VAL 8 -7.894 0.860 -17.528 58 HG13 VAL 8 3HG1 VAL 8 -8.603 0.535 -15.947 59 HG21 VAL 8 1HG2 VAL 8 -5.303 1.137 -17.413 60 HG22 VAL 8 2HG2 VAL 8 -5.880 -0.359 -18.147 61 HG23 VAL 8 3HG2 VAL 8 -4.591 -0.407 -16.944 62 H ARG 9 H ARG 9 -4.900 0.043 -13.129 63 HA ARG 9 HA ARG 9 -2.447 1.524 -13.836 64 HB2 ARG 9 2HB ARG 9 -3.124 -0.249 -11.478 65 HB3 ARG 9 1HB ARG 9 -1.580 0.573 -11.688 66 HG2 ARG 9 2HG ARG 9 -2.798 2.748 -11.803 67 HG3 ARG 9 1HG ARG 9 -4.302 1.889 -11.469 68 HD2 ARG 9 2HD ARG 9 -3.223 1.010 -9.361 69 HD3 ARG 9 1HD ARG 9 -1.880 2.108 -9.665 70 HE ARG 9 HE ARG 9 -3.911 3.860 -9.723 71 HH11 ARG 9 1HH1 ARG 9 -5.023 4.755 -7.976 72 HH12 ARG 9 2HH1 ARG 9 -5.130 3.874 -6.489 73 HH21 ARG 9 1HH2 ARG 9 -3.306 1.164 -7.645 74 HH22 ARG 9 2HH2 ARG 9 -4.161 1.845 -6.304 75 H LYS 10 H LYS 10 -0.657 -0.522 -12.712 76 HA LYS 10 HA LYS 10 -0.726 -2.478 -14.969 77 HB2 LYS 10 2HB LYS 10 1.601 -1.038 -13.688 78 HB3 LYS 10 1HB LYS 10 1.786 -2.402 -14.784 79 HG2 LYS 10 2HG LYS 10 0.492 -1.157 -16.505 80 HG3 LYS 10 1HG LYS 10 0.427 0.228 -15.414 81 HD2 LYS 10 2HD LYS 10 2.925 0.254 -15.367 82 HD3 LYS 10 1HD LYS 10 2.929 -1.044 -16.561 83 HE2 LYS 10 2HE LYS 10 1.395 1.492 -17.087 84 HE3 LYS 10 1HE LYS 10 3.130 1.420 -17.397 85 HZ1 LYS 10 1HZ LYS 10 2.611 0.494 -19.329 86 HZ2 LYS 10 2HZ LYS 10 0.982 0.296 -18.892 87 HZ3 LYS 10 3HZ LYS 10 2.127 -0.887 -18.474 88 H SER 11 H SER 11 1.153 -4.199 -14.366 89 HA SER 11 HA SER 11 0.519 -5.221 -11.622 90 HB2 SER 11 2HB SER 11 -0.562 -6.504 -13.507 91 HB3 SER 11 1HB SER 11 1.048 -6.900 -14.084 92 HG SER 11 HG SER 11 -0.170 -8.352 -12.488 93 H VAL 12 H VAL 12 2.260 -6.192 -10.508 94 HA VAL 12 HA VAL 12 4.894 -6.194 -11.891 95 HB VAL 12 HB VAL 12 4.247 -4.805 -9.300 96 HG11 VAL 12 1HG1 VAL 12 6.846 -5.876 -10.366 97 HG12 VAL 12 2HG1 VAL 12 6.222 -5.930 -8.717 98 HG13 VAL 12 3HG1 VAL 12 6.833 -4.414 -9.381 99 HG21 VAL 12 1HG2 VAL 12 5.457 -2.946 -10.470 100 HG22 VAL 12 2HG2 VAL 12 3.987 -3.449 -11.304 101 HG23 VAL 12 3HG2 VAL 12 5.562 -3.977 -11.898 102 H VAL 13 H VAL 13 6.442 -7.622 -10.944 103 HA VAL 13 HA VAL 13 5.166 -9.777 -9.331 104 HB VAL 13 HB VAL 13 7.791 -9.815 -10.854 105 HG11 VAL 13 1HG1 VAL 13 6.186 -11.859 -9.330 106 HG12 VAL 13 2HG1 VAL 13 7.915 -11.521 -9.240 107 HG13 VAL 13 3HG1 VAL 13 7.250 -12.359 -10.643 108 HG21 VAL 13 1HG2 VAL 13 5.411 -11.362 -11.757 109 HG22 VAL 13 2HG2 VAL 13 6.679 -10.594 -12.711 110 HG23 VAL 13 3HG2 VAL 13 5.373 -9.622 -12.037 111 H VAL 14 H VAL 14 5.873 -10.180 -7.263 112 HA VAL 14 HA VAL 14 8.320 -8.725 -6.339 113 HB VAL 14 HB VAL 14 7.209 -8.253 -4.229 114 HG11 VAL 14 1HG1 VAL 14 6.776 -6.859 -6.396 115 HG12 VAL 14 2HG1 VAL 14 5.765 -6.563 -4.982 116 HG13 VAL 14 3HG1 VAL 14 5.153 -7.545 -6.311 117 HG21 VAL 14 1HG2 VAL 14 4.756 -8.836 -4.011 118 HG22 VAL 14 2HG2 VAL 14 5.837 -10.230 -3.991 119 HG23 VAL 14 3HG2 VAL 14 4.931 -9.837 -5.452 120 H ALA 15 H ALA 15 9.428 -9.786 -4.532 121 HA ALA 15 HA ALA 15 9.190 -12.719 -4.725 122 HB1 ALA 15 1HB ALA 15 11.370 -11.154 -4.579 123 HB2 ALA 15 2HB ALA 15 11.356 -12.808 -3.966 124 HB3 ALA 15 3HB ALA 15 11.134 -11.455 -2.857 125 H ALA 16 H ALA 16 7.308 -13.208 -3.562 126 HA ALA 16 HA ALA 16 7.599 -13.326 -0.675 127 HB1 ALA 16 1HB ALA 16 5.838 -11.270 -1.947 128 HB2 ALA 16 2HB ALA 16 6.740 -11.189 -0.434 129 HB3 ALA 16 3HB ALA 16 5.231 -12.099 -0.514 130 H SER 17 H SER 17 6.043 -14.805 0.227 131 HA SER 17 HA SER 17 4.950 -16.679 -1.705 132 HB2 SER 17 2HB SER 17 4.295 -17.982 0.185 133 HB3 SER 17 1HB SER 17 5.822 -17.230 0.640 134 HG SER 17 HG SER 17 3.531 -15.765 1.164 135 H VAL 18 H VAL 18 2.649 -17.206 -1.898 136 HA VAL 18 HA VAL 18 0.982 -14.933 -2.264 137 HB VAL 18 HB VAL 18 -0.502 -17.402 -1.695 138 HG11 VAL 18 1HG1 VAL 18 -1.581 -16.869 -3.703 139 HG12 VAL 18 2HG1 VAL 18 -0.149 -16.096 -4.381 140 HG13 VAL 18 3HG1 VAL 18 -1.079 -15.282 -3.125 141 HG21 VAL 18 1HG2 VAL 18 1.494 -18.571 -2.329 142 HG22 VAL 18 2HG2 VAL 18 1.820 -17.437 -3.642 143 HG23 VAL 18 3HG2 VAL 18 0.459 -18.551 -3.756 144 H GLU 19 H GLU 19 1.166 -17.274 0.406 145 HA GLU 19 HA GLU 19 -0.976 -16.211 1.960 146 HB2 GLU 19 2HB GLU 19 1.575 -17.591 2.847 147 HB3 GLU 19 1HB GLU 19 0.179 -17.301 3.885 148 HG2 GLU 19 2HG GLU 19 -1.234 -18.612 2.315 149 HG3 GLU 19 1HG GLU 19 0.198 -18.951 1.340 150 H HIS 20 H HIS 20 2.433 -15.323 1.698 151 HA HIS 20 HA HIS 20 2.553 -13.507 3.877 152 HB2 HIS 20 2HB HIS 20 4.492 -14.393 2.513 153 HB3 HIS 20 1HB HIS 20 4.024 -13.265 1.239 154 HD1 HIS 20 1HD HIS 20 4.479 -12.954 5.020 155 HD2 HIS 20 2HD HIS 20 5.527 -10.976 1.501 156 HE1 HIS 20 1HE HIS 20 5.811 -10.920 5.711 157 HE2 HIS 20 2HE HIS 20 6.454 -9.708 3.579 158 H CYS 21 H CYS 21 1.537 -13.075 0.499 159 HA CYS 21 HA CYS 21 1.307 -10.267 0.453 160 HB2 CYS 21 2HB CYS 21 -0.345 -12.416 -0.903 161 HB3 CYS 21 1HB CYS 21 -0.503 -10.700 -1.267 162 HG CYS 21 HG CYS 21 1.453 -12.301 -2.628 163 H PHE 22 H PHE 22 -1.364 -12.584 1.111 164 HA PHE 22 HA PHE 22 -3.133 -10.489 2.011 165 HB2 PHE 22 2HB PHE 22 -3.402 -13.374 2.827 166 HB3 PHE 22 1HB PHE 22 -4.675 -12.205 2.467 167 HD1 PHE 22 1HD PHE 22 -2.351 -14.632 1.114 168 HD2 PHE 22 2HD PHE 22 -5.048 -11.457 0.086 169 HE1 PHE 22 1HE PHE 22 -2.335 -15.389 -1.239 170 HE2 PHE 22 2HE PHE 22 -5.034 -12.213 -2.277 171 HZ PHE 22 HZ PHE 22 -3.675 -14.184 -2.936 172 H GLU 23 H GLU 23 -0.941 -12.715 3.663 173 HA GLU 23 HA GLU 23 -1.802 -12.013 6.323 174 HB2 GLU 23 2HB GLU 23 0.764 -13.231 5.276 175 HB3 GLU 23 1HB GLU 23 0.429 -13.006 6.992 176 HG2 GLU 23 2HG GLU 23 -1.337 -14.574 5.090 177 HG3 GLU 23 1HG GLU 23 -0.165 -15.297 6.192 178 H VAL 24 H VAL 24 0.571 -10.666 4.085 179 HA VAL 24 HA VAL 24 2.000 -9.037 5.903 180 HB VAL 24 HB VAL 24 1.360 -8.838 2.975 181 HG11 VAL 24 1HG1 VAL 24 1.370 -6.541 3.528 182 HG12 VAL 24 2HG1 VAL 24 3.031 -6.870 3.038 183 HG13 VAL 24 3HG1 VAL 24 2.623 -6.752 4.749 184 HG21 VAL 24 1HG2 VAL 24 3.529 -9.565 2.708 185 HG22 VAL 24 2HG2 VAL 24 3.219 -10.256 4.301 186 HG23 VAL 24 3HG2 VAL 24 4.096 -8.733 4.155 187 H PHE 25 H PHE 25 -0.977 -8.309 4.057 188 HA PHE 25 HA PHE 25 -1.234 -5.633 5.082 189 HB2 PHE 25 2HB PHE 25 -3.645 -7.261 4.364 190 HB3 PHE 25 1HB PHE 25 -3.287 -5.575 3.997 191 HD1 PHE 25 1HD PHE 25 -3.922 -8.384 2.357 192 HD2 PHE 25 2HD PHE 25 -0.640 -5.652 2.798 193 HE1 PHE 25 1HE PHE 25 -3.057 -9.065 0.130 194 HE2 PHE 25 2HE PHE 25 0.228 -6.331 0.574 195 HZ PHE 25 HZ PHE 25 -0.982 -8.037 -0.759 196 H THR 26 H THR 26 -2.487 -8.765 6.190 197 HA THR 26 HA THR 26 -3.832 -7.420 8.460 198 HB THR 26 HB THR 26 -4.888 -9.573 8.853 199 HG1 THR 26 1HG THR 26 -2.735 -10.418 7.429 200 HG21 THR 26 1HG2 THR 26 -6.088 -8.445 7.193 201 HG22 THR 26 2HG2 THR 26 -5.752 -9.996 6.426 202 HG23 THR 26 3HG2 THR 26 -4.781 -8.583 6.016 203 H SER 27 H SER 27 -0.779 -8.748 7.882 204 HA SER 27 HA SER 27 -0.510 -9.568 10.747 205 HB2 SER 27 2HB SER 27 0.020 -11.260 8.917 206 HB3 SER 27 1HB SER 27 1.412 -10.251 8.533 207 HG SER 27 HG SER 27 0.809 -11.355 11.080 208 H ARG 28 H ARG 28 1.417 -7.985 8.159 209 HA ARG 28 HA ARG 28 2.666 -6.329 10.327 210 HB2 ARG 28 2HB ARG 28 4.727 -6.319 8.946 211 HB3 ARG 28 1HB ARG 28 4.276 -7.951 9.435 212 HG2 ARG 28 2HG ARG 28 4.047 -8.596 7.290 213 HG3 ARG 28 1HG ARG 28 2.956 -7.251 6.957 214 HD2 ARG 28 2HD ARG 28 5.075 -7.250 5.577 215 HD3 ARG 28 1HD ARG 28 4.798 -5.769 6.495 216 HE ARG 28 HE ARG 28 6.351 -7.142 8.232 217 HH11 ARG 28 1HH1 ARG 28 8.601 -7.328 8.176 218 HH12 ARG 28 2HH1 ARG 28 9.432 -7.188 6.663 219 HH21 ARG 28 1HH2 ARG 28 6.542 -6.682 4.816 220 HH22 ARG 28 2HH2 ARG 28 8.267 -6.824 4.763 221 HA PRO 29 HA PRO 29 0.700 -3.785 6.826 222 HB2 PRO 29 2HB PRO 29 -1.095 -2.455 8.456 223 HB3 PRO 29 1HB PRO 29 -1.485 -3.899 7.508 224 HG2 PRO 29 2HG PRO 29 -0.864 -3.644 10.398 225 HG3 PRO 29 1HG PRO 29 -2.000 -4.724 9.574 226 HD2 PRO 29 2HD PRO 29 0.434 -5.561 10.497 227 HD3 PRO 29 1HD PRO 29 -0.371 -6.293 9.091 228 H ALA 30 H ALA 30 1.516 -3.008 10.184 229 HA ALA 30 HA ALA 30 2.078 -0.206 9.651 230 HB1 ALA 30 1HB ALA 30 2.771 -0.107 11.939 231 HB2 ALA 30 2HB ALA 30 3.018 -1.852 12.001 232 HB3 ALA 30 3HB ALA 30 1.386 -1.198 11.878 233 H ASP 31 H ASP 31 3.931 -3.154 9.499 234 HA ASP 31 HA ASP 31 6.536 -2.114 9.874 235 HB2 ASP 31 2HB ASP 31 5.927 -4.539 9.713 236 HB3 ASP 31 1HB ASP 31 5.772 -4.332 7.968 237 H TRP 32 H TRP 32 4.463 -1.966 7.000 238 HA TRP 32 HA TRP 32 6.693 -0.497 5.634 239 HB2 TRP 32 2HB TRP 32 6.413 -1.754 3.794 240 HB3 TRP 32 1HB TRP 32 5.425 -2.823 4.787 241 HD1 TRP 32 HD TRP 32 5.080 0.210 2.448 242 HE1 TRP 32 1HE TRP 32 2.707 0.208 1.453 243 HE3 TRP 32 3HE TRP 32 3.065 -3.695 5.021 244 HZ2 TRP 32 2HZ TRP 32 0.278 -1.260 1.713 245 HZ3 TRP 32 3HZ TRP 32 0.714 -4.384 4.627 246 HH2 TRP 32 HH TRP 32 -0.683 -3.168 2.976 247 H TRP 33 H TRP 33 3.546 -0.171 6.894 248 HA TRP 33 HA TRP 33 2.275 1.547 5.070 249 HB2 TRP 33 2HB TRP 33 1.733 0.754 7.636 250 HB3 TRP 33 1HB TRP 33 2.084 2.465 7.864 251 HD1 TRP 33 HD TRP 33 0.314 4.160 7.129 252 HE1 TRP 33 1HE TRP 33 -1.985 3.997 5.971 253 HE3 TRP 33 3HE TRP 33 0.362 -0.759 5.761 254 HZ2 TRP 33 2HZ TRP 33 -3.589 2.038 4.638 255 HZ3 TRP 33 3HZ TRP 33 -1.561 -1.747 4.549 256 HH2 TRP 33 HH TRP 33 -3.535 -0.356 3.987 257 HA PRO 34 HA PRO 34 4.860 5.177 6.663 258 HB2 PRO 34 2HB PRO 34 6.751 4.728 8.590 259 HB3 PRO 34 1HB PRO 34 5.041 5.027 8.944 260 HG2 PRO 34 2HG PRO 34 6.571 2.583 9.241 261 HG3 PRO 34 1HG PRO 34 4.953 2.972 9.838 262 HD2 PRO 34 2HD PRO 34 5.709 1.427 7.468 263 HD3 PRO 34 1HD PRO 34 4.116 1.577 8.237 264 HA PRO 35 HA PRO 35 8.387 3.828 4.063 265 HB2 PRO 35 2HB PRO 35 8.376 5.972 2.377 266 HB3 PRO 35 1HB PRO 35 7.286 4.586 2.191 267 HG2 PRO 35 2HG PRO 35 6.732 7.298 3.210 268 HG3 PRO 35 1HG PRO 35 5.668 6.163 2.367 269 HD2 PRO 35 2HD PRO 35 5.681 6.655 5.136 270 HD3 PRO 35 1HD PRO 35 4.896 5.285 4.325 271 H SER 36 H SER 36 10.237 5.593 3.075 272 HA SER 36 HA SER 36 11.819 6.262 5.321 273 HB2 SER 36 2HB SER 36 11.929 7.548 2.579 274 HB3 SER 36 1HB SER 36 13.231 7.504 3.765 275 HG SER 36 HG SER 36 13.652 5.518 3.202 276 H HIS 37 H HIS 37 9.538 8.266 3.471 277 HA HIS 37 HA HIS 37 9.799 10.340 5.618 278 HB2 HIS 37 2HB HIS 37 9.269 10.779 2.663 279 HB3 HIS 37 1HB HIS 37 9.294 12.042 3.894 280 HD1 HIS 37 1HD HIS 37 11.682 12.114 5.311 281 HD2 HIS 37 2HD HIS 37 11.753 10.348 1.532 282 HE1 HIS 37 1HE HIS 37 14.111 12.059 4.589 283 HE2 HIS 37 2HE HIS 37 14.165 10.986 2.291 284 H VAL 38 H VAL 38 7.875 10.957 6.551 285 HA VAL 38 HA VAL 38 5.364 9.940 5.272 286 HB VAL 38 HB VAL 38 5.938 10.244 8.233 287 HG11 VAL 38 1HG1 VAL 38 3.577 9.197 6.652 288 HG12 VAL 38 2HG1 VAL 38 3.590 10.531 7.805 289 HG13 VAL 38 3HG1 VAL 38 3.802 8.875 8.372 290 HG21 VAL 38 1HG2 VAL 38 5.378 7.559 7.331 291 HG22 VAL 38 2HG2 VAL 38 6.797 8.160 8.186 292 HG23 VAL 38 3HG2 VAL 38 6.740 8.218 6.426 293 H LEU 39 H LEU 39 3.870 11.478 4.842 294 HA LEU 39 HA LEU 39 4.413 14.264 5.348 295 HB2 LEU 39 2HB LEU 39 1.987 12.780 4.323 296 HB3 LEU 39 1HB LEU 39 2.004 14.533 4.521 297 HG LEU 39 HG LEU 39 4.042 14.632 3.073 298 HD11 LEU 39 1HD1 LEU 39 4.159 12.391 1.620 299 HD12 LEU 39 2HD1 LEU 39 3.595 11.677 3.130 300 HD13 LEU 39 3HD1 LEU 39 5.107 12.584 3.094 301 HD21 LEU 39 1HD2 LEU 39 2.449 13.361 1.112 302 HD22 LEU 39 2HD2 LEU 39 2.482 15.078 1.510 303 HD23 LEU 39 3HD2 LEU 39 1.327 14.011 2.307 304 H VAL 40 H VAL 40 2.509 11.810 6.996 305 HA VAL 40 HA VAL 40 0.872 13.448 8.616 306 HB VAL 40 HB VAL 40 2.239 10.973 9.658 307 HG11 VAL 40 1HG1 VAL 40 0.494 12.584 10.884 308 HG12 VAL 40 2HG1 VAL 40 0.462 10.836 11.115 309 HG13 VAL 40 3HG1 VAL 40 -0.658 11.597 9.986 310 HG21 VAL 40 1HG2 VAL 40 0.600 11.243 7.273 311 HG22 VAL 40 2HG2 VAL 40 -0.200 10.226 8.471 312 HG23 VAL 40 3HG2 VAL 40 1.416 9.811 7.901 313 H LYS 41 H LYS 41 1.259 14.608 10.516 314 HA LYS 41 HA LYS 41 3.858 15.618 11.020 315 HB2 LYS 41 2HB LYS 41 1.716 16.647 11.836 316 HB3 LYS 41 1HB LYS 41 1.617 15.361 13.037 317 HG2 LYS 41 2HG LYS 41 3.826 16.049 13.934 318 HG3 LYS 41 1HG LYS 41 3.867 17.372 12.769 319 HD2 LYS 41 2HD LYS 41 1.712 18.216 13.743 320 HD3 LYS 41 1HD LYS 41 1.843 16.973 14.989 321 HE2 LYS 41 2HE LYS 41 3.842 17.923 15.871 322 HE3 LYS 41 1HE LYS 41 4.059 18.960 14.461 323 HZ1 LYS 41 1HZ LYS 41 1.688 19.783 15.221 324 HZ2 LYS 41 2HZ LYS 41 3.114 20.442 15.867 325 HZ3 LYS 41 3HZ LYS 41 2.250 19.263 16.734 326 H LYS 42 H LYS 42 2.157 12.803 12.241 327 HA LYS 42 HA LYS 42 4.662 11.971 13.640 328 HB2 LYS 42 2HB LYS 42 1.830 11.244 14.394 329 HB3 LYS 42 1HB LYS 42 3.283 10.789 15.268 330 HG2 LYS 42 2HG LYS 42 2.306 13.628 14.831 331 HG3 LYS 42 1HG LYS 42 2.140 12.721 16.329 332 HD2 LYS 42 2HD LYS 42 4.693 13.713 15.037 333 HD3 LYS 42 1HD LYS 42 4.045 14.135 16.615 334 HE2 LYS 42 2HE LYS 42 4.266 11.595 17.140 335 HE3 LYS 42 1HE LYS 42 5.357 11.566 15.754 336 HZ1 LYS 42 1HZ LYS 42 5.633 13.440 18.037 337 HZ2 LYS 42 2HZ LYS 42 6.740 13.190 16.771 338 HZ3 LYS 42 3HZ LYS 42 6.467 11.968 17.918 339 H GLU 43 H GLU 43 5.405 9.920 13.140 340 HA GLU 43 HA GLU 43 4.425 8.652 10.763 341 HB2 GLU 43 2HB GLU 43 6.219 7.553 12.934 342 HB3 GLU 43 1HB GLU 43 6.006 6.843 11.336 343 HG2 GLU 43 2HG GLU 43 6.821 8.967 10.320 344 HG3 GLU 43 1HG GLU 43 7.118 9.598 11.940 345 H ARG 44 H ARG 44 2.923 7.015 10.511 346 HA ARG 44 HA ARG 44 1.232 6.368 12.786 347 HB2 ARG 44 2HB ARG 44 1.289 5.324 9.947 348 HB3 ARG 44 1HB ARG 44 0.093 4.830 11.146 349 HG2 ARG 44 2HG ARG 44 -0.374 7.330 11.474 350 HG3 ARG 44 1HG ARG 44 0.541 7.580 9.986 351 HD2 ARG 44 2HD ARG 44 -1.818 5.707 10.234 352 HD3 ARG 44 1HD ARG 44 -1.930 7.352 9.610 353 HE ARG 44 HE ARG 44 -0.724 5.051 8.224 354 HH11 ARG 44 1HH1 ARG 44 -0.179 5.458 6.064 355 HH12 ARG 44 2HH1 ARG 44 -0.167 7.088 5.481 356 HH21 ARG 44 1HH2 ARG 44 -1.118 8.465 8.517 357 HH22 ARG 44 2HH2 ARG 44 -0.700 8.788 6.867 358 H ALA 45 H ALA 45 1.112 4.425 13.907 359 HA ALA 45 HA ALA 45 3.174 2.376 13.235 360 HB1 ALA 45 1HB ALA 45 2.541 3.545 15.953 361 HB2 ALA 45 2HB ALA 45 4.056 3.703 15.063 362 HB3 ALA 45 3HB ALA 45 3.565 2.131 15.695 363 H GLY 46 H GLY 46 0.079 3.114 14.789 364 HA2 GLY 46 2HA GLY 46 -0.424 0.249 15.271 365 HA3 GLY 46 1HA GLY 46 -1.504 1.575 15.701 366 H LEU 47 H LEU 47 -2.130 -0.914 14.243 367 HA LEU 47 HA LEU 47 -3.604 0.335 12.033 368 HB2 LEU 47 2HB LEU 47 -1.154 -1.237 11.638 369 HB3 LEU 47 1HB LEU 47 -2.526 -1.866 10.728 370 HG LEU 47 HG LEU 47 -2.068 1.094 10.644 371 HD11 LEU 47 1HD1 LEU 47 -0.637 0.204 8.467 372 HD12 LEU 47 2HD1 LEU 47 -0.102 -0.897 9.731 373 HD13 LEU 47 3HD1 LEU 47 0.069 0.841 9.949 374 HD21 LEU 47 1HD2 LEU 47 -2.805 -0.951 8.530 375 HD22 LEU 47 2HD2 LEU 47 -2.956 0.799 8.399 376 HD23 LEU 47 3HD2 LEU 47 -3.980 -0.094 9.524 377 H ALA 48 H ALA 48 -5.577 -0.623 11.973 378 HA ALA 48 HA ALA 48 -5.856 -3.502 12.484 379 HB1 ALA 48 1HB ALA 48 -6.998 -1.407 14.343 380 HB2 ALA 48 2HB ALA 48 -5.972 -2.778 14.763 381 HB3 ALA 48 3HB ALA 48 -7.640 -3.046 14.254 382 H PHE 49 H PHE 49 -7.406 -4.225 11.076 383 HA PHE 49 HA PHE 49 -9.735 -2.501 10.519 384 HB2 PHE 49 2HB PHE 49 -9.454 -2.624 8.089 385 HB3 PHE 49 1HB PHE 49 -8.064 -1.831 8.828 386 HD1 PHE 49 1HD PHE 49 -5.922 -3.070 9.119 387 HD2 PHE 49 2HD PHE 49 -9.247 -4.733 6.969 388 HE1 PHE 49 1HE PHE 49 -4.415 -4.747 8.089 389 HE2 PHE 49 2HE PHE 49 -7.741 -6.412 5.938 390 HZ PHE 49 HZ PHE 49 -5.323 -6.416 6.496 391 H GLU 50 H GLU 50 -11.537 -3.677 9.741 392 HA GLU 50 HA GLU 50 -11.340 -6.590 10.207 393 HB2 GLU 50 2HB GLU 50 -13.898 -5.194 9.504 394 HB3 GLU 50 1HB GLU 50 -13.634 -6.548 10.601 395 HG2 GLU 50 2HG GLU 50 -12.836 -3.665 11.093 396 HG3 GLU 50 1HG GLU 50 -14.135 -4.542 11.902 397 HA PRO 51 HA PRO 51 -11.219 -6.777 5.661 398 HB2 PRO 51 2HB PRO 51 -10.553 -9.408 5.435 399 HB3 PRO 51 1HB PRO 51 -9.376 -8.137 5.814 400 HG2 PRO 51 2HG PRO 51 -10.654 -10.125 7.600 401 HG3 PRO 51 1HG PRO 51 -9.025 -9.433 7.655 402 HD2 PRO 51 2HD PRO 51 -11.138 -8.645 9.282 403 HD3 PRO 51 1HD PRO 51 -9.695 -7.665 8.951 404 H PHE 52 H PHE 52 -13.491 -6.520 5.356 405 HA PHE 52 HA PHE 52 -14.875 -8.952 4.519 406 HB2 PHE 52 2HB PHE 52 -16.113 -7.274 6.725 407 HB3 PHE 52 1HB PHE 52 -16.781 -8.741 6.007 408 HD1 PHE 52 1HD PHE 52 -15.550 -10.935 6.307 409 HD2 PHE 52 2HD PHE 52 -14.518 -7.374 8.475 410 HE1 PHE 52 1HE PHE 52 -14.292 -12.300 7.952 411 HE2 PHE 52 2HE PHE 52 -13.264 -8.738 10.119 412 HZ PHE 52 HZ PHE 52 -13.147 -11.202 9.858 413 H VAL 53 H VAL 53 -17.250 -8.164 3.795 414 HA VAL 53 HA VAL 53 -16.765 -5.833 2.085 415 HB VAL 53 HB VAL 53 -19.386 -7.305 2.496 416 HG11 VAL 53 1HG1 VAL 53 -19.588 -6.569 0.029 417 HG12 VAL 53 2HG1 VAL 53 -18.237 -5.487 0.374 418 HG13 VAL 53 3HG1 VAL 53 -19.753 -5.318 1.261 419 HG21 VAL 53 1HG2 VAL 53 -16.975 -8.418 1.569 420 HG22 VAL 53 2HG2 VAL 53 -17.898 -8.049 0.113 421 HG23 VAL 53 3HG2 VAL 53 -18.592 -9.086 1.358 422 H GLY 54 H GLY 54 -17.162 -3.773 2.759 423 HA2 GLY 54 2HA GLY 54 -18.339 -2.007 3.826 424 HA3 GLY 54 1HA GLY 54 -19.465 -3.198 4.486 425 H GLY 55 H GLY 55 -16.133 -3.935 4.867 426 HA2 GLY 55 2HA GLY 55 -16.333 -3.863 7.757 427 HA3 GLY 55 1HA GLY 55 -14.871 -4.208 6.832 428 H ARG 56 H ARG 56 -14.303 -2.685 8.901 429 HA ARG 56 HA ARG 56 -14.243 0.119 7.838 430 HB2 ARG 56 2HB ARG 56 -14.325 -0.835 10.716 431 HB3 ARG 56 1HB ARG 56 -14.105 0.844 10.221 432 HG2 ARG 56 2HG ARG 56 -16.279 0.717 8.989 433 HG3 ARG 56 1HG ARG 56 -16.511 -0.908 9.639 434 HD2 ARG 56 2HD ARG 56 -16.224 1.642 11.255 435 HD3 ARG 56 1HD ARG 56 -17.701 0.704 11.039 436 HE ARG 56 HE ARG 56 -15.599 0.109 12.925 437 HH11 ARG 56 1HH1 ARG 56 -15.776 -1.829 14.073 438 HH12 ARG 56 2HH1 ARG 56 -16.836 -3.071 13.492 439 HH21 ARG 56 1HH2 ARG 56 -17.883 -1.253 10.730 440 HH22 ARG 56 2HH2 ARG 56 -18.028 -2.744 11.600 441 H TYR 57 H TYR 57 -12.241 1.060 7.681 442 HA TYR 57 HA TYR 57 -9.921 -0.501 8.757 443 HB2 TYR 57 2HB TYR 57 -10.293 -0.271 6.174 444 HB3 TYR 57 1HB TYR 57 -9.722 1.380 6.414 445 HD1 TYR 57 1HD TYR 57 -8.753 -2.019 5.930 446 HD2 TYR 57 2HD TYR 57 -7.494 1.667 7.740 447 HE1 TYR 57 1HE TYR 57 -6.413 -2.843 5.975 448 HE2 TYR 57 2HE TYR 57 -5.155 0.846 7.783 449 HH TYR 57 HH TYR 57 -4.092 -1.768 6.012 450 H TYR 58 H TYR 58 -8.681 0.617 10.211 451 HA TYR 58 HA TYR 58 -8.651 3.578 10.068 452 HB2 TYR 58 2HB TYR 58 -8.931 3.517 12.655 453 HB3 TYR 58 1HB TYR 58 -10.371 3.372 11.646 454 HD1 TYR 58 1HD TYR 58 -8.372 1.811 14.192 455 HD2 TYR 58 2HD TYR 58 -11.169 1.007 11.036 456 HE1 TYR 58 1HE TYR 58 -8.868 -0.403 15.194 457 HE2 TYR 58 2HE TYR 58 -11.665 -1.208 12.036 458 HH TYR 58 HH TYR 58 -11.513 -2.347 14.140 459 H GLU 59 H GLU 59 -6.874 4.520 11.287 460 HA GLU 59 HA GLU 59 -4.762 2.565 12.085 461 HB2 GLU 59 2HB GLU 59 -4.322 5.086 10.452 462 HB3 GLU 59 1HB GLU 59 -3.079 3.941 10.960 463 HG2 GLU 59 2HG GLU 59 -4.257 2.154 9.682 464 HG3 GLU 59 1HG GLU 59 -5.405 3.360 9.105 465 H TRP 60 H TRP 60 -3.421 3.309 13.810 466 HA TRP 60 HA TRP 60 -4.506 5.709 15.216 467 HB2 TRP 60 2HB TRP 60 -2.913 3.345 16.240 468 HB3 TRP 60 1HB TRP 60 -3.324 4.755 17.217 469 HD1 TRP 60 HD TRP 60 -6.082 5.323 17.230 470 HE1 TRP 60 1HE TRP 60 -8.018 3.644 17.528 471 HE3 TRP 60 3HE TRP 60 -3.695 0.996 15.955 472 HZ2 TRP 60 2HZ TRP 60 -8.486 0.833 17.263 473 HZ3 TRP 60 3HZ TRP 60 -4.904 -1.165 15.988 474 HH2 TRP 60 HH TRP 60 -7.294 -1.253 16.639 475 H ASP 61 H ASP 61 -3.183 7.433 15.639 476 HA ASP 61 HA ASP 61 -0.466 7.348 14.442 477 HB2 ASP 61 2HB ASP 61 -2.158 9.645 15.455 478 HB3 ASP 61 1HB ASP 61 -0.559 9.825 14.735 479 H ILE 62 H ILE 62 1.350 8.235 15.708 480 HA ILE 62 HA ILE 62 1.603 7.138 18.286 481 HB ILE 62 HB ILE 62 3.046 9.538 17.153 482 HG12 ILE 62 2HG1 ILE 62 3.857 6.633 17.179 483 HG13 ILE 62 1HG1 ILE 62 3.128 7.428 15.794 484 HG21 ILE 62 1HG2 ILE 62 4.157 9.606 19.100 485 HG22 ILE 62 2HG2 ILE 62 4.641 7.927 18.865 486 HG23 ILE 62 3HG2 ILE 62 3.146 8.302 19.722 487 HD11 ILE 62 1HD1 ILE 62 4.971 8.923 15.551 488 HD12 ILE 62 2HD1 ILE 62 5.683 7.331 15.807 489 HD13 ILE 62 3HD1 ILE 62 5.616 8.491 17.134 490 H ASP 63 H ASP 63 0.653 10.430 17.337 491 HA ASP 63 HA ASP 63 -0.299 10.843 20.148 492 HB2 ASP 63 2HB ASP 63 0.887 12.869 18.230 493 HB3 ASP 63 1HB ASP 63 0.143 13.277 19.776 494 H GLY 64 H GLY 64 -1.006 10.999 16.750 495 HA2 GLY 64 2HA GLY 64 -3.404 12.633 17.049 496 HA3 GLY 64 1HA GLY 64 -2.936 11.748 15.596 497 H THR 65 H THR 65 -5.567 11.863 16.936 498 HA THR 65 HA THR 65 -6.095 9.442 18.357 499 HB THR 65 HB THR 65 -7.573 11.509 18.222 500 HG1 THR 65 1HG THR 65 -9.419 9.729 17.684 501 HG21 THR 65 1HG2 THR 65 -8.701 12.013 16.313 502 HG22 THR 65 2HG2 THR 65 -8.929 10.318 15.886 503 HG23 THR 65 3HG2 THR 65 -7.393 11.113 15.547 504 H GLU 66 H GLU 66 -8.406 8.654 16.682 505 HA GLU 66 HA GLU 66 -6.918 6.841 14.855 506 HB2 GLU 66 2HB GLU 66 -8.458 5.868 16.551 507 HB3 GLU 66 1HB GLU 66 -9.797 6.740 15.806 508 HG2 GLU 66 2HG GLU 66 -9.308 5.559 13.657 509 HG3 GLU 66 1HG GLU 66 -8.080 4.612 14.499 510 H ILE 67 H ILE 67 -7.154 6.974 12.661 511 HA ILE 67 HA ILE 67 -9.303 8.757 11.584 512 HB ILE 67 HB ILE 67 -6.480 8.464 10.513 513 HG12 ILE 67 2HG1 ILE 67 -7.812 10.815 11.896 514 HG13 ILE 67 1HG1 ILE 67 -6.619 9.752 12.644 515 HG21 ILE 67 1HG2 ILE 67 -7.397 9.248 8.608 516 HG22 ILE 67 2HG2 ILE 67 -7.757 10.742 9.473 517 HG23 ILE 67 3HG2 ILE 67 -8.964 9.461 9.388 518 HD11 ILE 67 1HD1 ILE 67 -5.447 10.497 10.221 519 HD12 ILE 67 2HD1 ILE 67 -5.034 11.132 11.816 520 HD13 ILE 67 3HD1 ILE 67 -6.210 11.976 10.806 521 H VAL 68 H VAL 68 -10.145 8.100 9.502 522 HA VAL 68 HA VAL 68 -9.911 5.191 9.054 523 HB VAL 68 HB VAL 68 -11.612 7.237 7.593 524 HG11 VAL 68 1HG1 VAL 68 -11.021 4.614 6.929 525 HG12 VAL 68 2HG1 VAL 68 -12.448 5.504 6.400 526 HG13 VAL 68 3HG1 VAL 68 -12.535 4.462 7.819 527 HG21 VAL 68 1HG2 VAL 68 -13.436 6.400 9.076 528 HG22 VAL 68 2HG2 VAL 68 -12.162 7.219 9.979 529 HG23 VAL 68 3HG2 VAL 68 -12.243 5.458 9.970 530 H TRP 69 H TRP 69 -8.678 4.326 7.436 531 HA TRP 69 HA TRP 69 -7.299 6.233 5.614 532 HB2 TRP 69 2HB TRP 69 -5.631 4.960 6.578 533 HB3 TRP 69 1HB TRP 69 -6.658 3.536 6.726 534 HD1 TRP 69 HD TRP 69 -4.248 5.261 4.398 535 HE1 TRP 69 1HE TRP 69 -3.846 3.780 2.326 536 HE3 TRP 69 3HE TRP 69 -7.866 1.728 5.119 537 HZ2 TRP 69 2HZ TRP 69 -4.916 1.410 1.133 538 HZ3 TRP 69 3HZ TRP 69 -8.152 -0.128 3.503 539 HH2 TRP 69 HH TRP 69 -6.682 -0.295 1.512 540 H GLY 70 H GLY 70 -9.906 4.094 5.567 541 HA2 GLY 70 2HA GLY 70 -10.637 4.407 2.932 542 HA3 GLY 70 1HA GLY 70 -9.502 3.059 2.867 543 H ARG 71 H ARG 71 -10.914 1.353 2.492 544 HA ARG 71 HA ARG 71 -12.518 0.465 4.757 545 HB2 ARG 71 2HB ARG 71 -13.881 2.117 3.100 546 HB3 ARG 71 1HB ARG 71 -14.133 0.588 2.263 547 HG2 ARG 71 2HG ARG 71 -14.968 -0.425 4.351 548 HG3 ARG 71 1HG ARG 71 -14.726 1.107 5.189 549 HD2 ARG 71 2HD ARG 71 -17.049 1.002 4.561 550 HD3 ARG 71 1HD ARG 71 -16.272 2.170 3.491 551 HE ARG 71 HE ARG 71 -16.190 -0.411 2.262 552 HH11 ARG 71 1HH1 ARG 71 -17.671 -0.856 0.614 553 HH12 ARG 71 2HH1 ARG 71 -19.105 0.106 0.474 554 HH21 ARG 71 1HH2 ARG 71 -18.339 2.120 3.191 555 HH22 ARG 71 2HH2 ARG 71 -19.483 1.791 1.933 556 H ILE 72 H ILE 72 -14.060 -1.423 3.215 557 HA ILE 72 HA ILE 72 -11.951 -2.970 1.789 558 HB ILE 72 HB ILE 72 -13.784 -4.032 3.961 559 HG12 ILE 72 2HG1 ILE 72 -11.270 -4.713 4.686 560 HG13 ILE 72 1HG1 ILE 72 -10.921 -3.226 3.805 561 HG21 ILE 72 1HG2 ILE 72 -11.858 -5.413 2.071 562 HG22 ILE 72 2HG2 ILE 72 -13.589 -5.708 2.236 563 HG23 ILE 72 3HG2 ILE 72 -12.490 -6.167 3.535 564 HD11 ILE 72 1HD1 ILE 72 -12.706 -2.090 5.183 565 HD12 ILE 72 2HD1 ILE 72 -11.304 -2.626 6.108 566 HD13 ILE 72 3HD1 ILE 72 -12.799 -3.557 6.154 567 H LEU 73 H LEU 73 -12.911 -4.704 0.407 568 HA LEU 73 HA LEU 73 -15.705 -4.023 -0.423 569 HB2 LEU 73 2HB LEU 73 -13.917 -3.298 -2.051 570 HB3 LEU 73 1HB LEU 73 -13.475 -4.996 -2.229 571 HG LEU 73 HG LEU 73 -16.052 -5.304 -2.712 572 HD11 LEU 73 1HD1 LEU 73 -15.553 -2.395 -3.413 573 HD12 LEU 73 2HD1 LEU 73 -16.686 -2.992 -2.200 574 HD13 LEU 73 3HD1 LEU 73 -16.968 -3.325 -3.906 575 HD21 LEU 73 1HD2 LEU 73 -13.900 -4.257 -4.543 576 HD22 LEU 73 2HD2 LEU 73 -15.509 -4.613 -5.171 577 HD23 LEU 73 3HD2 LEU 73 -14.552 -5.892 -4.425 578 H GLU 74 H GLU 74 -13.230 -6.587 -0.609 579 HA GLU 74 HA GLU 74 -14.985 -8.585 0.486 580 HB2 GLU 74 2HB GLU 74 -16.020 -8.298 -1.774 581 HB3 GLU 74 1HB GLU 74 -14.483 -8.784 -2.487 582 HG2 GLU 74 2HG GLU 74 -14.612 -10.932 -1.231 583 HG3 GLU 74 1HG GLU 74 -16.199 -10.451 -0.628 584 H TRP 75 H TRP 75 -13.772 -10.368 1.105 585 HA TRP 75 HA TRP 75 -10.905 -10.333 0.287 586 HB2 TRP 75 2HB TRP 75 -11.821 -10.213 2.790 587 HB3 TRP 75 1HB TRP 75 -11.893 -11.964 2.591 588 HD1 TRP 75 HD TRP 75 -9.626 -13.281 2.344 589 HE1 TRP 75 1HE TRP 75 -7.169 -12.623 2.776 590 HE3 TRP 75 3HE TRP 75 -10.115 -8.209 2.667 591 HZ2 TRP 75 2HZ TRP 75 -5.619 -10.255 3.202 592 HZ3 TRP 75 3HZ TRP 75 -8.137 -6.778 3.086 593 HH2 TRP 75 HH TRP 75 -5.892 -7.793 3.354 594 H ASP 76 H ASP 76 -10.236 -11.977 -1.029 595 HA ASP 76 HA ASP 76 -11.943 -14.425 -1.152 596 HB2 ASP 76 2HB ASP 76 -10.924 -12.664 -3.221 597 HB3 ASP 76 1HB ASP 76 -10.440 -14.341 -3.494 598 HA PRO 77 HA PRO 77 -8.390 -16.521 0.745 599 HB2 PRO 77 2HB PRO 77 -9.448 -18.604 -1.163 600 HB3 PRO 77 1HB PRO 77 -8.881 -18.812 0.505 601 HG2 PRO 77 2HG PRO 77 -11.472 -18.683 -0.057 602 HG3 PRO 77 1HG PRO 77 -10.805 -17.958 1.417 603 HD2 PRO 77 2HD PRO 77 -11.895 -16.630 -0.983 604 HD3 PRO 77 1HD PRO 77 -11.666 -15.976 0.655 605 HA PRO 78 HA PRO 78 -4.734 -16.128 -1.698 606 HB2 PRO 78 2HB PRO 78 -4.875 -19.113 -1.984 607 HB3 PRO 78 1HB PRO 78 -3.473 -18.087 -1.626 608 HG2 PRO 78 2HG PRO 78 -4.961 -19.425 0.266 609 HG3 PRO 78 1HG PRO 78 -3.941 -18.015 0.587 610 HD2 PRO 78 2HD PRO 78 -6.790 -18.166 0.816 611 HD3 PRO 78 1HD PRO 78 -5.776 -16.722 1.008 612 H HIS 79 H HIS 79 -5.869 -15.096 -3.452 613 HA HIS 79 HA HIS 79 -5.585 -16.195 -5.994 614 HB2 HIS 79 2HB HIS 79 -7.985 -17.187 -4.602 615 HB3 HIS 79 1HB HIS 79 -8.304 -16.518 -6.202 616 HD1 HIS 79 1HD HIS 79 -7.433 -19.609 -4.676 617 HD2 HIS 79 2HD HIS 79 -6.178 -17.660 -8.144 618 HE1 HIS 79 1HE HIS 79 -6.375 -21.378 -6.151 619 HE2 HIS 79 2HE HIS 79 -5.608 -20.203 -8.263 620 H ARG 80 H ARG 80 -8.146 -14.403 -4.162 621 HA ARG 80 HA ARG 80 -7.623 -12.135 -6.016 622 HB2 ARG 80 2HB ARG 80 -9.579 -13.334 -6.906 623 HB3 ARG 80 1HB ARG 80 -10.387 -13.173 -5.361 624 HG2 ARG 80 2HG ARG 80 -11.190 -11.423 -6.830 625 HG3 ARG 80 1HG ARG 80 -10.221 -10.686 -5.569 626 HD2 ARG 80 2HD ARG 80 -8.424 -10.274 -7.015 627 HD3 ARG 80 1HD ARG 80 -8.960 -11.485 -8.182 628 HE ARG 80 HE ARG 80 -9.788 -8.721 -8.130 629 HH11 ARG 80 1HH1 ARG 80 -11.445 -8.116 -9.549 630 HH12 ARG 80 2HH1 ARG 80 -12.446 -9.338 -10.260 631 HH21 ARG 80 1HH2 ARG 80 -10.826 -11.963 -8.679 632 HH22 ARG 80 2HH2 ARG 80 -12.096 -11.513 -9.769 633 H LEU 81 H LEU 81 -8.136 -10.086 -5.181 634 HA LEU 81 HA LEU 81 -9.056 -9.910 -2.373 635 HB2 LEU 81 2HB LEU 81 -6.562 -10.137 -2.280 636 HB3 LEU 81 1HB LEU 81 -6.428 -8.701 -3.294 637 HG LEU 81 HG LEU 81 -7.788 -7.459 -1.546 638 HD11 LEU 81 1HD1 LEU 81 -7.161 -9.008 0.717 639 HD12 LEU 81 2HD1 LEU 81 -7.872 -10.137 -0.434 640 HD13 LEU 81 3HD1 LEU 81 -8.767 -8.700 0.057 641 HD21 LEU 81 1HD2 LEU 81 -5.222 -7.501 -1.769 642 HD22 LEU 81 2HD2 LEU 81 -5.240 -8.614 -0.402 643 HD23 LEU 81 3HD2 LEU 81 -5.877 -6.979 -0.217 644 H ALA 82 H ALA 82 -10.390 -8.159 -2.178 645 HA ALA 82 HA ALA 82 -10.024 -5.886 -4.076 646 HB1 ALA 82 1HB ALA 82 -11.910 -7.587 -4.700 647 HB2 ALA 82 2HB ALA 82 -12.284 -5.864 -4.717 648 HB3 ALA 82 3HB ALA 82 -12.779 -6.861 -3.348 649 H MET 83 H MET 83 -10.466 -3.860 -3.127 650 HA MET 83 HA MET 83 -11.601 -3.881 -0.379 651 HB2 MET 83 2HB MET 83 -8.981 -2.562 -1.129 652 HB3 MET 83 1HB MET 83 -9.770 -2.463 0.446 653 HG2 MET 83 2HG MET 83 -9.643 -4.971 0.589 654 HG3 MET 83 1HG MET 83 -8.684 -4.955 -0.892 655 HE1 MET 83 1HE MET 83 -6.859 -2.058 -0.250 656 HE2 MET 83 2HE MET 83 -6.855 -3.478 -1.292 657 HE3 MET 83 3HE MET 83 -5.520 -3.212 -0.173 658 H THR 84 H THR 84 -12.794 -2.037 0.107 659 HA THR 84 HA THR 84 -13.030 -0.033 -2.094 660 HB THR 84 HB THR 84 -14.794 -0.424 0.348 661 HG1 THR 84 1HG THR 84 -15.994 -1.061 -1.910 662 HG21 THR 84 1HG2 THR 84 -15.207 1.122 -2.225 663 HG22 THR 84 2HG2 THR 84 -14.873 1.832 -0.646 664 HG23 THR 84 3HG2 THR 84 -16.384 0.965 -0.921 665 H TRP 85 H TRP 85 -12.278 2.066 -1.719 666 HA TRP 85 HA TRP 85 -11.009 2.507 0.933 667 HB2 TRP 85 2HB TRP 85 -10.633 3.743 -1.788 668 HB3 TRP 85 1HB TRP 85 -10.008 4.529 -0.342 669 HD1 TRP 85 HD TRP 85 -9.967 0.796 -0.133 670 HE1 TRP 85 1HE TRP 85 -7.561 -0.072 -0.422 671 HE3 TRP 85 3HE TRP 85 -7.668 5.074 -1.716 672 HZ2 TRP 85 2HZ TRP 85 -4.998 0.913 -1.219 673 HZ3 TRP 85 3HZ TRP 85 -5.245 5.079 -2.232 674 HH2 TRP 85 HH TRP 85 -3.908 3.006 -1.985 675 H ARG 86 H ARG 86 -12.156 3.655 2.396 676 HA ARG 86 HA ARG 86 -13.962 5.819 1.372 677 HB2 ARG 86 2HB ARG 86 -15.129 3.948 2.566 678 HB3 ARG 86 1HB ARG 86 -14.169 4.315 4.001 679 HG2 ARG 86 2HG ARG 86 -15.092 6.591 4.059 680 HG3 ARG 86 1HG ARG 86 -16.023 6.263 2.597 681 HD2 ARG 86 2HD ARG 86 -17.506 5.962 4.476 682 HD3 ARG 86 1HD ARG 86 -17.135 4.362 3.834 683 HE ARG 86 HE ARG 86 -15.361 5.223 6.002 684 HH11 ARG 86 1HH1 ARG 86 -15.497 3.980 7.884 685 HH12 ARG 86 2HH1 ARG 86 -16.821 2.881 8.086 686 HH21 ARG 86 1HH2 ARG 86 -18.278 3.659 5.037 687 HH22 ARG 86 2HH2 ARG 86 -18.395 2.700 6.475 688 H ILE 87 H ILE 87 -12.544 7.565 1.481 689 HA ILE 87 HA ILE 87 -11.698 8.362 4.204 690 HB ILE 87 HB ILE 87 -9.773 7.124 3.191 691 HG12 ILE 87 2HG1 ILE 87 -9.230 10.099 3.378 692 HG13 ILE 87 1HG1 ILE 87 -9.557 9.099 4.793 693 HG21 ILE 87 1HG2 ILE 87 -9.716 9.423 1.217 694 HG22 ILE 87 2HG2 ILE 87 -10.352 7.824 0.828 695 HG23 ILE 87 3HG2 ILE 87 -8.651 8.017 1.252 696 HD11 ILE 87 1HD1 ILE 87 -7.435 8.365 4.810 697 HD12 ILE 87 2HD1 ILE 87 -7.078 9.453 3.471 698 HD13 ILE 87 3HD1 ILE 87 -7.588 7.797 3.147 699 H ASP 88 H ASP 88 -11.099 10.674 4.288 700 HA ASP 88 HA ASP 88 -12.557 12.207 2.192 701 HB2 ASP 88 2HB ASP 88 -13.163 12.529 4.616 702 HB3 ASP 88 1HB ASP 88 -11.542 13.169 4.883 703 H GLY 89 H GLY 89 -11.519 13.947 1.113 704 HA2 GLY 89 2HA GLY 89 -8.778 13.614 0.470 705 HA3 GLY 89 1HA GLY 89 -9.708 15.073 0.139 706 H HIS 90 H HIS 90 -10.277 15.283 3.131 707 HA HIS 90 HA HIS 90 -7.864 16.844 3.737 708 HB2 HIS 90 2HB HIS 90 -10.482 16.498 5.200 709 HB3 HIS 90 1HB HIS 90 -9.198 17.581 5.711 710 HD1 HIS 90 1HD HIS 90 -8.342 18.812 3.058 711 HD2 HIS 90 2HD HIS 90 -12.334 18.240 4.113 712 HE1 HIS 90 1HE HIS 90 -9.693 20.444 1.665 713 HE2 HIS 90 2HE HIS 90 -12.126 20.102 2.297 714 H TRP 91 H TRP 91 -8.093 13.726 3.881 715 HA TRP 91 HA TRP 91 -7.209 12.051 5.278 716 HB2 TRP 91 2HB TRP 91 -5.682 14.510 5.829 717 HB3 TRP 91 1HB TRP 91 -5.641 13.337 7.143 718 HD1 TRP 91 HD TRP 91 -3.665 14.198 4.340 719 HE1 TRP 91 1HE TRP 91 -2.368 12.191 3.376 720 HE3 TRP 91 3HE TRP 91 -6.227 10.359 6.524 721 HZ2 TRP 91 2HZ TRP 91 -2.413 9.328 3.513 722 HZ3 TRP 91 3HZ TRP 91 -5.578 8.009 6.087 723 HH2 TRP 91 HH TRP 91 -3.677 7.489 4.589 724 H GLN 92 H GLN 92 -9.692 13.666 6.107 725 HA GLN 92 HA GLN 92 -9.536 13.407 9.051 726 HB2 GLN 92 2HB GLN 92 -11.774 14.383 7.262 727 HB3 GLN 92 1HB GLN 92 -11.792 14.416 9.026 728 HG2 GLN 92 2HG GLN 92 -9.770 15.832 7.265 729 HG3 GLN 92 1HG GLN 92 -11.111 16.598 8.107 730 HE21 GLN 92 1HE2 GLN 92 -7.893 16.364 8.405 731 HE22 GLN 92 2HE2 GLN 92 -7.730 16.295 10.093 732 H SER 93 H SER 93 -12.174 12.561 6.827 733 HA SER 93 HA SER 93 -12.202 9.828 6.820 734 HB2 SER 93 2HB SER 93 -12.090 9.315 9.053 735 HB3 SER 93 1HB SER 93 -12.783 10.856 9.550 736 HG SER 93 HG SER 93 -14.678 9.952 9.554 737 H VAL 94 H VAL 94 -14.114 9.092 5.881 738 HA VAL 94 HA VAL 94 -16.216 11.162 5.510 739 HB VAL 94 HB VAL 94 -16.314 8.661 3.927 740 HG11 VAL 94 1HG1 VAL 94 -16.470 11.625 3.305 741 HG12 VAL 94 2HG1 VAL 94 -17.815 10.486 3.395 742 HG13 VAL 94 3HG1 VAL 94 -16.635 10.355 2.094 743 HG21 VAL 94 1HG2 VAL 94 -13.899 8.956 4.039 744 HG22 VAL 94 2HG2 VAL 94 -14.060 10.668 3.646 745 HG23 VAL 94 3HG2 VAL 94 -14.463 9.445 2.441 746 HA PRO 95 HA PRO 95 -18.746 8.646 8.247 747 HB2 PRO 95 2HB PRO 95 -21.207 9.722 7.592 748 HB3 PRO 95 1HB PRO 95 -20.073 10.442 8.747 749 HG2 PRO 95 2HG PRO 95 -20.629 11.175 5.933 750 HG3 PRO 95 1HG PRO 95 -20.197 12.203 7.309 751 HD2 PRO 95 2HD PRO 95 -18.428 11.497 5.338 752 HD3 PRO 95 1HD PRO 95 -17.933 11.898 6.996 753 H ASP 96 H ASP 96 -19.291 8.924 4.813 754 HA ASP 96 HA ASP 96 -20.159 6.118 4.713 755 HB2 ASP 96 2HB ASP 96 -22.225 6.583 3.479 756 HB3 ASP 96 1HB ASP 96 -22.285 7.367 5.057 757 H ASP 97 H ASP 97 -20.300 5.397 2.366 758 HA ASP 97 HA ASP 97 -18.182 6.794 0.839 759 HB2 ASP 97 2HB ASP 97 -18.279 4.760 -0.620 760 HB3 ASP 97 1HB ASP 97 -17.931 4.388 1.069 761 H ASP 98 H ASP 98 -19.076 8.519 -0.253 762 HA ASP 98 HA ASP 98 -21.639 8.131 -1.687 763 HB2 ASP 98 2HB ASP 98 -21.150 10.201 -0.288 764 HB3 ASP 98 1HB ASP 98 -19.981 10.644 -1.527 765 H ARG 99 H ARG 99 -18.376 9.377 -2.365 766 HA ARG 99 HA ARG 99 -18.715 8.477 -5.196 767 HB2 ARG 99 2HB ARG 99 -17.063 10.768 -4.087 768 HB3 ARG 99 1HB ARG 99 -17.093 10.268 -5.779 769 HG2 ARG 99 2HG ARG 99 -19.553 10.685 -5.818 770 HG3 ARG 99 1HG ARG 99 -19.447 11.288 -4.164 771 HD2 ARG 99 2HD ARG 99 -17.748 12.970 -4.975 772 HD3 ARG 99 1HD ARG 99 -18.110 12.449 -6.621 773 HE ARG 99 HE ARG 99 -20.102 13.697 -6.497 774 HH11 ARG 99 1HH1 ARG 99 -21.653 14.936 -5.414 775 HH12 ARG 99 2HH1 ARG 99 -21.618 15.024 -3.685 776 HH21 ARG 99 1HH2 ARG 99 -18.849 12.960 -3.371 777 HH22 ARG 99 2HH2 ARG 99 -20.030 13.905 -2.528 778 H ALA 100 H ALA 100 -17.645 7.080 -2.722 779 HA ALA 100 HA ALA 100 -14.790 6.903 -2.939 780 HB1 ALA 100 1HB ALA 100 -16.485 4.592 -2.030 781 HB2 ALA 100 2HB ALA 100 -16.410 6.062 -1.058 782 HB3 ALA 100 3HB ALA 100 -14.938 5.152 -1.395 783 H SER 101 H SER 101 -13.511 5.366 -4.024 784 HA SER 101 HA SER 101 -14.886 3.980 -6.285 785 HB2 SER 101 2HB SER 101 -13.188 5.694 -6.903 786 HB3 SER 101 1HB SER 101 -11.972 4.780 -6.013 787 HG SER 101 HG SER 101 -12.102 4.342 -8.322 788 H GLU 102 H GLU 102 -13.974 1.843 -6.882 789 HA GLU 102 HA GLU 102 -13.038 0.385 -4.447 790 HB2 GLU 102 2HB GLU 102 -14.446 -0.660 -6.924 791 HB3 GLU 102 1HB GLU 102 -13.979 -1.628 -5.523 792 HG2 GLU 102 2HG GLU 102 -15.414 -0.199 -4.084 793 HG3 GLU 102 1HG GLU 102 -15.922 0.699 -5.514 794 H ILE 103 H ILE 103 -11.327 -1.091 -4.643 795 HA ILE 103 HA ILE 103 -9.639 -0.718 -7.084 796 HB ILE 103 HB ILE 103 -8.777 -1.417 -4.262 797 HG12 ILE 103 2HG1 ILE 103 -8.453 1.193 -5.773 798 HG13 ILE 103 1HG1 ILE 103 -9.690 0.914 -4.546 799 HG21 ILE 103 1HG2 ILE 103 -6.893 -2.065 -5.314 800 HG22 ILE 103 2HG2 ILE 103 -6.649 -0.370 -5.736 801 HG23 ILE 103 3HG2 ILE 103 -7.471 -1.449 -6.862 802 HD11 ILE 103 1HD1 ILE 103 -7.899 0.360 -2.908 803 HD12 ILE 103 2HD1 ILE 103 -7.760 2.008 -3.520 804 HD13 ILE 103 3HD1 ILE 103 -6.690 0.747 -4.133 805 H GLU 104 H GLU 104 -8.850 -2.572 -8.096 806 HA GLU 104 HA GLU 104 -9.839 -5.168 -6.978 807 HB2 GLU 104 2HB GLU 104 -10.750 -4.524 -9.212 808 HB3 GLU 104 1HB GLU 104 -9.103 -4.497 -9.842 809 HG2 GLU 104 2HG GLU 104 -8.843 -6.887 -9.153 810 HG3 GLU 104 1HG GLU 104 -10.539 -6.894 -8.665 811 H VAL 105 H VAL 105 -8.277 -6.472 -6.195 812 HA VAL 105 HA VAL 105 -5.543 -6.277 -7.374 813 HB VAL 105 HB VAL 105 -6.169 -6.745 -4.446 814 HG11 VAL 105 1HG1 VAL 105 -3.581 -6.177 -5.925 815 HG12 VAL 105 2HG1 VAL 105 -4.058 -7.734 -5.249 816 HG13 VAL 105 3HG1 VAL 105 -3.742 -6.369 -4.178 817 HG21 VAL 105 1HG2 VAL 105 -4.899 -4.372 -4.473 818 HG22 VAL 105 2HG2 VAL 105 -6.655 -4.500 -4.560 819 HG23 VAL 105 3HG2 VAL 105 -5.715 -4.265 -6.033 820 H ASP 106 H ASP 106 -4.824 -8.241 -8.076 821 HA ASP 106 HA ASP 106 -6.192 -10.677 -6.997 822 HB2 ASP 106 2HB ASP 106 -4.930 -10.328 -9.732 823 HB3 ASP 106 1HB ASP 106 -5.852 -11.721 -9.167 824 H PHE 107 H PHE 107 -4.866 -12.183 -6.074 825 HA PHE 107 HA PHE 107 -1.923 -11.832 -6.478 826 HB2 PHE 107 2HB PHE 107 -3.559 -12.218 -4.039 827 HB3 PHE 107 1HB PHE 107 -2.047 -13.129 -4.114 828 HD1 PHE 107 1HD PHE 107 0.094 -11.897 -4.631 829 HD2 PHE 107 2HD PHE 107 -3.556 -9.881 -3.633 830 HE1 PHE 107 1HE PHE 107 1.382 -9.847 -4.093 831 HE2 PHE 107 2HE PHE 107 -2.277 -7.824 -3.098 832 HZ PHE 107 HZ PHE 107 0.198 -7.810 -3.328 833 H VAL 108 H VAL 108 -1.027 -13.494 -7.523 834 HA VAL 108 HA VAL 108 -2.111 -16.224 -7.065 835 HB VAL 108 HB VAL 108 -2.048 -14.673 -9.541 836 HG11 VAL 108 1HG1 VAL 108 -0.028 -15.887 -10.069 837 HG12 VAL 108 2HG1 VAL 108 -1.352 -16.632 -10.960 838 HG13 VAL 108 3HG1 VAL 108 -0.733 -17.404 -9.506 839 HG21 VAL 108 1HG2 VAL 108 -3.770 -16.192 -10.153 840 HG22 VAL 108 2HG2 VAL 108 -3.948 -15.956 -8.414 841 HG23 VAL 108 3HG2 VAL 108 -3.185 -17.422 -9.032 842 HA PRO 109 HA PRO 109 2.180 -17.102 -6.259 843 HB2 PRO 109 2HB PRO 109 2.240 -19.753 -7.117 844 HB3 PRO 109 1HB PRO 109 1.752 -19.207 -5.507 845 HG2 PRO 109 2HG PRO 109 0.089 -20.016 -7.811 846 HG3 PRO 109 1HG PRO 109 -0.208 -20.208 -6.076 847 HD2 PRO 109 2HD PRO 109 -1.477 -18.327 -7.584 848 HD3 PRO 109 1HD PRO 109 -1.118 -18.092 -5.859 849 H ASN 110 H ASN 110 3.955 -16.627 -7.466 850 HA ASN 110 HA ASN 110 3.919 -17.328 -10.368 851 HB2 ASN 110 2HB ASN 110 3.781 -14.854 -9.746 852 HB3 ASN 110 1HB ASN 110 5.430 -15.025 -9.148 853 HD21 ASN 110 1HD2 ASN 110 6.987 -14.524 -10.688 854 HD22 ASN 110 2HD2 ASN 110 6.792 -14.691 -12.366 855 H GLY 111 H GLY 111 5.381 -18.915 -10.767 856 HA2 GLY 111 2HA GLY 111 7.349 -20.191 -10.633 857 HA3 GLY 111 1HA GLY 111 8.142 -18.709 -10.090 858 H SER 112 H SER 112 9.199 -19.186 -8.216 859 HA SER 112 HA SER 112 7.619 -20.539 -6.070 860 HB2 SER 112 2HB SER 112 9.597 -21.783 -5.384 861 HB3 SER 112 1HB SER 112 9.277 -22.118 -7.084 862 HG SER 112 HG SER 112 11.156 -21.304 -7.513 863 H GLY 113 H GLY 113 7.924 -19.663 -4.013 864 HA2 GLY 113 2HA GLY 113 8.538 -18.055 -2.424 865 HA3 GLY 113 1HA GLY 113 10.103 -18.002 -3.235 866 H GLY 114 H GLY 114 7.462 -17.325 -5.317 867 HA2 GLY 114 2HA GLY 114 7.662 -14.410 -4.814 868 HA3 GLY 114 1HA GLY 114 8.120 -14.996 -6.410 869 H THR 115 H THR 115 5.772 -13.317 -5.325 870 HA THR 115 HA THR 115 3.614 -14.915 -6.648 871 HB THR 115 HB THR 115 3.181 -12.822 -4.505 872 HG1 THR 115 1HG THR 115 3.433 -15.638 -4.299 873 HG21 THR 115 1HG2 THR 115 1.457 -15.047 -5.620 874 HG22 THR 115 2HG2 THR 115 1.263 -13.330 -5.960 875 HG23 THR 115 3HG2 THR 115 0.988 -13.947 -4.329 876 H ARG 116 H ARG 116 2.428 -13.834 -8.216 877 HA ARG 116 HA ARG 116 3.343 -11.055 -8.850 878 HB2 ARG 116 2HB ARG 116 3.841 -12.745 -10.599 879 HB3 ARG 116 1HB ARG 116 2.123 -13.136 -10.693 880 HG2 ARG 116 2HG ARG 116 1.643 -10.778 -11.313 881 HG3 ARG 116 1HG ARG 116 3.372 -10.437 -11.285 882 HD2 ARG 116 2HD ARG 116 3.704 -12.210 -13.019 883 HD3 ARG 116 1HD ARG 116 1.953 -12.404 -13.103 884 HE ARG 116 HE ARG 116 2.351 -9.691 -13.528 885 HH11 ARG 116 1HH1 ARG 116 2.629 -8.821 -15.596 886 HH12 ARG 116 2HH1 ARG 116 3.231 -9.827 -16.871 887 HH21 ARG 116 1HH2 ARG 116 3.514 -12.645 -14.870 888 HH22 ARG 116 2HH2 ARG 116 3.732 -11.993 -16.460 889 H VAL 117 H VAL 117 1.827 -9.464 -8.750 890 HA VAL 117 HA VAL 117 -1.035 -10.308 -8.654 891 HB VAL 117 HB VAL 117 -0.722 -9.725 -6.445 892 HG11 VAL 117 1HG1 VAL 117 0.775 -7.830 -5.755 893 HG12 VAL 117 2HG1 VAL 117 1.232 -7.639 -7.448 894 HG13 VAL 117 3HG1 VAL 117 1.623 -9.130 -6.591 895 HG21 VAL 117 1HG2 VAL 117 -1.098 -6.929 -7.509 896 HG22 VAL 117 2HG2 VAL 117 -1.840 -7.674 -6.094 897 HG23 VAL 117 3HG2 VAL 117 -2.356 -8.147 -7.711 898 H GLU 118 H GLU 118 -2.498 -9.088 -9.741 899 HA GLU 118 HA GLU 118 -1.429 -6.869 -11.426 900 HB2 GLU 118 2HB GLU 118 -2.428 -8.739 -12.682 901 HB3 GLU 118 1HB GLU 118 -3.906 -8.604 -11.733 902 HG2 GLU 118 2HG GLU 118 -4.224 -6.291 -12.602 903 HG3 GLU 118 1HG GLU 118 -2.790 -6.492 -13.603 904 H LEU 119 H LEU 119 -1.953 -4.874 -10.662 905 HA LEU 119 HA LEU 119 -4.481 -4.603 -9.098 906 HB2 LEU 119 2HB LEU 119 -2.312 -4.204 -7.854 907 HB3 LEU 119 1HB LEU 119 -2.037 -2.825 -8.915 908 HG LEU 119 HG LEU 119 -4.700 -2.946 -7.593 909 HD11 LEU 119 1HD1 LEU 119 -2.170 -2.243 -6.077 910 HD12 LEU 119 2HD1 LEU 119 -3.163 -3.670 -5.786 911 HD13 LEU 119 3HD1 LEU 119 -3.819 -2.061 -5.480 912 HD21 LEU 119 1HD2 LEU 119 -4.100 -1.060 -9.017 913 HD22 LEU 119 2HD2 LEU 119 -2.623 -0.790 -8.091 914 HD23 LEU 119 3HD2 LEU 119 -4.195 -0.505 -7.347 915 H ALA 120 H ALA 120 -6.001 -3.309 -9.983 916 HA ALA 120 HA ALA 120 -5.125 -1.248 -11.954 917 HB1 ALA 120 1HB ALA 120 -6.528 -2.011 -13.585 918 HB2 ALA 120 2HB ALA 120 -7.763 -2.505 -12.426 919 HB3 ALA 120 3HB ALA 120 -6.369 -3.544 -12.727 920 H HIS 121 H HIS 121 -6.194 0.709 -11.768 921 HA HIS 121 HA HIS 121 -8.368 0.867 -9.715 922 HB2 HIS 121 2HB HIS 121 -7.181 2.434 -8.612 923 HB3 HIS 121 1HB HIS 121 -5.835 2.142 -9.711 924 HD1 HIS 121 1HD HIS 121 -9.181 3.977 -10.131 925 HD2 HIS 121 2HD HIS 121 -5.105 4.568 -10.788 926 HE1 HIS 121 1HE HIS 121 -8.949 6.259 -11.207 927 HE2 HIS 121 2HE HIS 121 -6.474 6.636 -11.590 928 H VAL 122 H VAL 122 -10.218 1.939 -10.357 929 HA VAL 122 HA VAL 122 -10.093 3.505 -12.885 930 HB VAL 122 HB VAL 122 -12.164 2.394 -13.676 931 HG11 VAL 122 1HG1 VAL 122 -9.945 1.572 -14.408 932 HG12 VAL 122 2HG1 VAL 122 -11.114 0.255 -14.296 933 HG13 VAL 122 3HG1 VAL 122 -9.906 0.472 -13.030 934 HG21 VAL 122 1HG2 VAL 122 -12.548 0.102 -12.431 935 HG22 VAL 122 2HG2 VAL 122 -13.267 1.578 -11.786 936 HG23 VAL 122 3HG2 VAL 122 -11.784 0.936 -11.077 937 H LYS 123 H LYS 123 -11.587 5.177 -13.005 938 HA LYS 123 HA LYS 123 -13.021 6.839 -12.204 939 HB2 LYS 123 2HB LYS 123 -14.248 4.493 -10.731 940 HB3 LYS 123 1HB LYS 123 -15.026 6.044 -11.048 941 HG2 LYS 123 2HG LYS 123 -14.765 5.656 -13.486 942 HG3 LYS 123 1HG LYS 123 -14.063 4.074 -13.141 943 HD2 LYS 123 2HD LYS 123 -16.170 3.489 -11.902 944 HD3 LYS 123 1HD LYS 123 -16.866 5.006 -12.473 945 HE2 LYS 123 2HE LYS 123 -16.320 4.249 -14.831 946 HE3 LYS 123 1HE LYS 123 -15.919 2.671 -14.152 947 HZ1 LYS 123 1HZ LYS 123 -18.186 2.665 -14.880 948 HZ2 LYS 123 2HZ LYS 123 -18.537 4.064 -13.982 949 HZ3 LYS 123 3HZ LYS 123 -18.168 2.610 -13.185 950 H LEU 124 H LEU 124 -10.559 6.203 -10.586 951 HA LEU 124 HA LEU 124 -11.231 6.450 -7.790 952 HB2 LEU 124 2HB LEU 124 -8.994 5.715 -8.596 953 HB3 LEU 124 1HB LEU 124 -8.703 7.343 -9.214 954 HG LEU 124 HG LEU 124 -9.078 8.204 -6.871 955 HD11 LEU 124 1HD1 LEU 124 -8.626 6.275 -5.141 956 HD12 LEU 124 2HD1 LEU 124 -9.301 5.242 -6.400 957 HD13 LEU 124 3HD1 LEU 124 -10.267 6.553 -5.722 958 HD21 LEU 124 1HD2 LEU 124 -6.826 8.173 -6.855 959 HD22 LEU 124 2HD2 LEU 124 -6.830 6.834 -8.004 960 HD23 LEU 124 3HD2 LEU 124 -6.863 6.509 -6.270 961 H HIS 125 H HIS 125 -10.577 8.774 -10.370 962 HA HIS 125 HA HIS 125 -10.535 11.121 -8.764 963 HB2 HIS 125 2HB HIS 125 -9.795 11.224 -11.064 964 HB3 HIS 125 1HB HIS 125 -11.393 10.744 -11.634 965 HD1 HIS 125 1HD HIS 125 -11.289 13.074 -8.763 966 HD2 HIS 125 2HD HIS 125 -11.622 13.361 -12.912 967 HE1 HIS 125 1HE HIS 125 -12.086 15.425 -9.254 968 HE2 HIS 125 2HE HIS 125 -12.281 15.618 -11.778 969 H ARG 126 H ARG 126 -13.204 9.138 -9.860 970 HA ARG 126 HA ARG 126 -15.348 10.902 -9.816 971 HB2 ARG 126 2HB ARG 126 -16.718 9.055 -9.468 972 HB3 ARG 126 1HB ARG 126 -15.243 8.257 -10.009 973 HG2 ARG 126 2HG ARG 126 -14.580 8.107 -7.547 974 HG3 ARG 126 1HG ARG 126 -16.237 8.587 -7.176 975 HD2 ARG 126 2HD ARG 126 -15.412 6.163 -8.796 976 HD3 ARG 126 1HD ARG 126 -16.058 6.145 -7.155 977 HE ARG 126 HE ARG 126 -17.867 7.504 -8.944 978 HH11 ARG 126 1HH1 ARG 126 -19.760 6.406 -9.510 979 HH12 ARG 126 2HH1 ARG 126 -19.855 4.693 -9.272 980 HH21 ARG 126 1HH2 ARG 126 -16.651 4.429 -7.972 981 HH22 ARG 126 2HH2 ARG 126 -18.095 3.573 -8.402 982 H HIS 127 H HIS 127 -13.340 9.831 -7.172 983 HA HIS 127 HA HIS 127 -14.977 10.574 -4.974 984 HB2 HIS 127 2HB HIS 127 -12.590 9.432 -5.107 985 HB3 HIS 127 1HB HIS 127 -12.022 11.091 -4.939 986 HD1 HIS 127 1HD HIS 127 -14.859 11.537 -3.133 987 HD2 HIS 127 2HD HIS 127 -11.534 9.134 -2.364 988 HE1 HIS 127 1HE HIS 127 -14.843 11.111 -0.633 989 HE2 HIS 127 2HE HIS 127 -12.824 9.651 -0.155 990 H GLY 128 H GLY 128 -12.734 12.451 -6.966 991 HA2 GLY 128 2HA GLY 128 -12.260 14.771 -6.949 992 HA3 GLY 128 1HA GLY 128 -14.010 14.843 -7.153 993 H ASP 129 H ASP 129 -12.776 13.518 -4.192 994 HA ASP 129 HA ASP 129 -13.783 15.937 -2.772 995 HB2 ASP 129 2HB ASP 129 -13.293 13.101 -1.816 996 HB3 ASP 129 1HB ASP 129 -13.830 14.421 -0.775 997 H GLY 130 H GLY 130 -10.983 15.174 -4.007 998 HA2 GLY 130 2HA GLY 130 -8.896 16.211 -3.414 999 HA3 GLY 130 1HA GLY 130 -9.464 16.343 -1.748 1000 H ALA 131 H ALA 131 -10.095 13.320 -3.189 1001 HA ALA 131 HA ALA 131 -8.607 11.833 -1.299 1002 HB1 ALA 131 1HB ALA 131 -9.320 9.958 -2.446 1003 HB2 ALA 131 2HB ALA 131 -9.018 10.681 -4.026 1004 HB3 ALA 131 3HB ALA 131 -10.450 11.142 -3.105 1005 H TRP 132 H TRP 132 -7.666 13.162 -4.431 1006 HA TRP 132 HA TRP 132 -5.278 11.724 -4.865 1007 HB2 TRP 132 2HB TRP 132 -6.126 13.312 -6.521 1008 HB3 TRP 132 1HB TRP 132 -5.854 14.654 -5.408 1009 HD1 TRP 132 HD TRP 132 -3.651 15.853 -5.715 1010 HE1 TRP 132 1HE TRP 132 -1.339 15.270 -6.696 1011 HE3 TRP 132 3HE TRP 132 -4.427 10.962 -6.953 1012 HZ2 TRP 132 2HZ TRP 132 0.001 13.022 -7.847 1013 HZ3 TRP 132 3HZ TRP 132 -2.617 9.624 -7.984 1014 HH2 TRP 132 HH TRP 132 -0.405 10.646 -8.429 1015 H ASN 133 H ASN 133 -5.923 14.475 -2.729 1016 HA ASN 133 HA ASN 133 -3.249 15.032 -1.956 1017 HB2 ASN 133 2HB ASN 133 -5.351 16.347 -1.342 1018 HB3 ASN 133 1HB ASN 133 -5.631 15.134 -0.092 1019 HD21 ASN 133 1HD2 ASN 133 -4.762 15.707 1.897 1020 HD22 ASN 133 2HD2 ASN 133 -3.398 16.693 2.123 1021 H ILE 134 H ILE 134 -5.559 12.619 -0.801 1022 HA ILE 134 HA ILE 134 -4.064 11.627 1.408 1023 HB ILE 134 HB ILE 134 -5.883 10.101 -0.466 1024 HG12 ILE 134 2HG1 ILE 134 -7.063 12.035 0.382 1025 HG13 ILE 134 1HG1 ILE 134 -7.623 10.623 1.278 1026 HG21 ILE 134 1HG2 ILE 134 -6.249 8.646 1.496 1027 HG22 ILE 134 2HG2 ILE 134 -5.067 9.590 2.403 1028 HG23 ILE 134 3HG2 ILE 134 -4.555 8.650 1.002 1029 HD11 ILE 134 1HD1 ILE 134 -5.699 11.259 2.945 1030 HD12 ILE 134 2HD1 ILE 134 -7.219 12.145 3.001 1031 HD13 ILE 134 3HD1 ILE 134 -5.822 12.848 2.192 1032 H HIS 135 H HIS 135 -3.945 10.829 -2.048 1033 HA HIS 135 HA HIS 135 -2.182 8.612 -1.870 1034 HB2 HIS 135 2HB HIS 135 -3.191 9.013 -3.980 1035 HB3 HIS 135 1HB HIS 135 -2.618 10.682 -4.018 1036 HD1 HIS 135 1HD HIS 135 -0.972 7.245 -3.673 1037 HD2 HIS 135 2HD HIS 135 -0.375 10.899 -5.592 1038 HE1 HIS 135 1HE HIS 135 1.183 7.022 -4.987 1039 HE2 HIS 135 2HE HIS 135 1.555 9.238 -6.162 1040 H LYS 136 H LYS 136 -1.418 12.100 -2.198 1041 HA LYS 136 HA LYS 136 1.380 11.838 -2.410 1042 HB2 LYS 136 2HB LYS 136 -0.186 13.981 -0.964 1043 HB3 LYS 136 1HB LYS 136 1.509 14.108 -1.409 1044 HG2 LYS 136 2HG LYS 136 0.698 13.583 -3.807 1045 HG3 LYS 136 1HG LYS 136 -0.899 14.007 -3.202 1046 HD2 LYS 136 2HD LYS 136 1.543 15.793 -3.025 1047 HD3 LYS 136 1HD LYS 136 0.261 15.957 -4.225 1048 HE2 LYS 136 2HE LYS 136 -0.745 17.324 -2.727 1049 HE3 LYS 136 1HE LYS 136 -1.138 15.854 -1.838 1050 HZ1 LYS 136 1HZ LYS 136 0.079 17.688 -0.596 1051 HZ2 LYS 136 2HZ LYS 136 1.453 17.226 -1.483 1052 HZ3 LYS 136 3HZ LYS 136 0.692 16.114 -0.448 1053 H ALA 137 H ALA 137 -0.691 11.811 0.458 1054 HA ALA 137 HA ALA 137 1.452 11.725 2.369 1055 HB1 ALA 137 1HB ALA 137 -1.466 11.064 2.395 1056 HB2 ALA 137 2HB ALA 137 -0.576 12.220 3.386 1057 HB3 ALA 137 3HB ALA 137 -0.465 10.494 3.731 1058 H LEU 138 H LEU 138 -0.276 9.270 0.521 1059 HA LEU 138 HA LEU 138 1.224 7.093 1.820 1060 HB2 LEU 138 2HB LEU 138 -0.722 6.965 -0.496 1061 HB3 LEU 138 1HB LEU 138 -0.175 5.624 0.497 1062 HG LEU 138 HG LEU 138 -1.884 7.962 1.368 1063 HD11 LEU 138 1HD1 LEU 138 -2.333 4.991 1.029 1064 HD12 LEU 138 2HD1 LEU 138 -3.229 6.318 0.289 1065 HD13 LEU 138 3HD1 LEU 138 -3.398 5.993 2.014 1066 HD21 LEU 138 1HD2 LEU 138 -0.375 5.861 2.895 1067 HD22 LEU 138 2HD2 LEU 138 -1.883 6.505 3.544 1068 HD23 LEU 138 3HD2 LEU 138 -0.522 7.584 3.234 1069 H ASP 139 H ASP 139 1.740 9.308 -0.615 1070 HA ASP 139 HA ASP 139 3.032 7.552 -2.548 1071 HB2 ASP 139 2HB ASP 139 2.009 9.751 -3.163 1072 HB3 ASP 139 1HB ASP 139 3.274 10.558 -2.237 1073 H GLY 140 H GLY 140 4.910 6.580 -2.055 1074 HA2 GLY 140 2HA GLY 140 6.808 7.930 -0.212 1075 HA3 GLY 140 1HA GLY 140 6.840 6.216 -0.628 1076 HA PRO 141 HA PRO 141 10.094 8.665 -3.062 1077 HB2 PRO 141 2HB PRO 141 11.559 6.155 -2.409 1078 HB3 PRO 141 1HB PRO 141 12.115 7.838 -2.336 1079 HG2 PRO 141 2HG PRO 141 11.533 6.444 -0.132 1080 HG3 PRO 141 1HG PRO 141 11.230 8.184 -0.256 1081 HD2 PRO 141 2HD PRO 141 9.280 5.928 -0.332 1082 HD3 PRO 141 1HD PRO 141 9.061 7.593 0.250 1083 H SER 142 H SER 142 10.651 8.217 -5.236 1084 HA SER 142 HA SER 142 10.441 7.188 -7.333 1085 HB2 SER 142 2HB SER 142 11.010 4.912 -7.451 1086 HB3 SER 142 1HB SER 142 11.748 5.412 -5.932 1087 HG SER 142 HG SER 142 9.387 3.939 -6.393 1088 HA PRO 143 HA PRO 143 5.830 6.973 -6.310 1089 HB2 PRO 143 2HB PRO 143 5.867 8.766 -8.686 1090 HB3 PRO 143 1HB PRO 143 4.969 8.925 -7.166 1091 HG2 PRO 143 2HG PRO 143 7.104 10.435 -7.712 1092 HG3 PRO 143 1HG PRO 143 6.726 9.892 -6.069 1093 HD2 PRO 143 2HD PRO 143 8.857 8.932 -7.925 1094 HD3 PRO 143 1HD PRO 143 8.846 8.992 -6.148 1095 H GLY 144 H GLY 144 4.338 5.688 -7.431 1096 HA2 GLY 144 2HA GLY 144 4.305 5.132 -10.198 1097 HA3 GLY 144 1HA GLY 144 5.331 3.908 -9.449 1098 H GLU 145 H GLU 145 3.376 2.609 -10.401 1099 HA GLU 145 HA GLU 145 0.798 2.650 -9.301 1100 HB2 GLU 145 2HB GLU 145 2.463 0.209 -10.001 1101 HB3 GLU 145 1HB GLU 145 0.710 0.227 -9.802 1102 HG2 GLU 145 2HG GLU 145 0.916 0.475 -12.115 1103 HG3 GLU 145 1HG GLU 145 0.802 2.153 -11.586 1104 H THR 146 H THR 146 -0.131 1.329 -7.534 1105 HA THR 146 HA THR 146 1.219 1.648 -5.065 1106 HB THR 146 HB THR 146 -0.939 -0.343 -5.789 1107 HG1 THR 146 1HG THR 146 -1.271 2.086 -4.422 1108 HG21 THR 146 1HG2 THR 146 0.310 0.490 -3.194 1109 HG22 THR 146 2HG2 THR 146 -0.160 -1.120 -3.738 1110 HG23 THR 146 3HG2 THR 146 -1.392 0.034 -3.230 1111 H LEU 147 H LEU 147 1.057 -1.108 -7.271 1112 HA LEU 147 HA LEU 147 2.413 -2.988 -5.626 1113 HB2 LEU 147 2HB LEU 147 2.535 -2.763 -8.646 1114 HB3 LEU 147 1HB LEU 147 2.808 -4.211 -7.674 1115 HG LEU 147 HG LEU 147 0.208 -2.667 -7.841 1116 HD11 LEU 147 1HD1 LEU 147 1.295 -5.099 -9.189 1117 HD12 LEU 147 2HD1 LEU 147 0.190 -3.872 -9.806 1118 HD13 LEU 147 3HD1 LEU 147 -0.402 -5.119 -8.712 1119 HD21 LEU 147 1HD2 LEU 147 -0.512 -4.900 -6.631 1120 HD22 LEU 147 2HD2 LEU 147 0.182 -3.579 -5.692 1121 HD23 LEU 147 3HD2 LEU 147 1.185 -4.954 -6.154 1122 H ALA 148 H ALA 148 3.556 -0.357 -7.660 1123 HA ALA 148 HA ALA 148 6.309 -1.093 -7.796 1124 HB1 ALA 148 1HB ALA 148 6.707 1.109 -8.552 1125 HB2 ALA 148 2HB ALA 148 5.380 1.770 -7.596 1126 HB3 ALA 148 3HB ALA 148 5.036 0.808 -9.033 1127 H ARG 149 H ARG 149 4.714 1.207 -5.561 1128 HA ARG 149 HA ARG 149 7.016 1.523 -3.884 1129 HB2 ARG 149 2HB ARG 149 4.078 1.921 -3.301 1130 HB3 ARG 149 1HB ARG 149 5.382 2.451 -2.247 1131 HG2 ARG 149 2HG ARG 149 6.297 3.809 -4.137 1132 HG3 ARG 149 1HG ARG 149 4.884 3.360 -5.093 1133 HD2 ARG 149 2HD ARG 149 4.859 4.868 -2.462 1134 HD3 ARG 149 1HD ARG 149 4.511 5.544 -4.053 1135 HE ARG 149 HE ARG 149 2.681 3.957 -2.432 1136 HH11 ARG 149 1HH1 ARG 149 0.642 3.595 -3.339 1137 HH12 ARG 149 2HH1 ARG 149 0.395 3.891 -5.028 1138 HH21 ARG 149 1HH2 ARG 149 3.661 4.908 -5.599 1139 HH22 ARG 149 2HH2 ARG 149 2.104 4.635 -6.307 1140 H PHE 150 H PHE 150 4.207 -0.632 -3.732 1141 HA PHE 150 HA PHE 150 4.804 -1.806 -1.193 1142 HB2 PHE 150 2HB PHE 150 2.618 -2.036 -2.324 1143 HB3 PHE 150 1HB PHE 150 3.379 -3.004 -3.584 1144 HD1 PHE 150 1HD PHE 150 2.404 -2.917 -0.017 1145 HD2 PHE 150 2HD PHE 150 4.035 -5.292 -3.204 1146 HE1 PHE 150 1HE PHE 150 2.105 -4.964 1.353 1147 HE2 PHE 150 2HE PHE 150 3.737 -7.336 -1.834 1148 HZ PHE 150 HZ PHE 150 2.774 -7.172 0.441 1149 H ALA 151 H ALA 151 5.721 -2.737 -4.509 1150 HA ALA 151 HA ALA 151 7.078 -5.147 -3.758 1151 HB1 ALA 151 1HB ALA 151 6.381 -4.627 -6.083 1152 HB2 ALA 151 2HB ALA 151 8.094 -5.035 -5.985 1153 HB3 ALA 151 3HB ALA 151 7.597 -3.351 -6.144 1154 H ASN 152 H ASN 152 8.193 -1.790 -4.083 1155 HA ASN 152 HA ASN 152 10.976 -2.303 -3.817 1156 HB2 ASN 152 2HB ASN 152 9.367 0.082 -2.893 1157 HB3 ASN 152 1HB ASN 152 11.125 0.045 -3.016 1158 HD21 ASN 152 1HD2 ASN 152 9.523 1.865 -4.574 1159 HD22 ASN 152 2HD2 ASN 152 9.673 1.430 -6.207 1160 H VAL 153 H VAL 153 8.572 -1.520 -1.296 1161 HA VAL 153 HA VAL 153 10.448 -1.839 0.867 1162 HB VAL 153 HB VAL 153 8.400 -1.852 2.288 1163 HG11 VAL 153 1HG1 VAL 153 9.341 0.289 1.627 1164 HG12 VAL 153 2HG1 VAL 153 7.583 0.402 1.545 1165 HG13 VAL 153 3HG1 VAL 153 8.525 0.206 0.065 1166 HG21 VAL 153 1HG2 VAL 153 6.920 -3.112 0.798 1167 HG22 VAL 153 2HG2 VAL 153 7.012 -1.830 -0.409 1168 HG23 VAL 153 3HG2 VAL 153 6.212 -1.533 1.133 1169 H ILE 154 H ILE 154 8.104 -3.995 -0.683 1170 HA ILE 154 HA ILE 154 8.712 -6.179 1.174 1171 HB ILE 154 HB ILE 154 6.940 -5.852 -1.231 1172 HG12 ILE 154 2HG1 ILE 154 6.595 -5.284 1.426 1173 HG13 ILE 154 1HG1 ILE 154 5.286 -5.626 0.304 1174 HG21 ILE 154 1HG2 ILE 154 6.181 -8.220 -0.730 1175 HG22 ILE 154 2HG2 ILE 154 7.648 -8.395 0.236 1176 HG23 ILE 154 3HG2 ILE 154 7.763 -8.076 -1.493 1177 HD11 ILE 154 1HD1 ILE 154 5.239 -6.973 2.452 1178 HD12 ILE 154 2HD1 ILE 154 6.701 -7.780 1.891 1179 HD13 ILE 154 3HD1 ILE 154 5.201 -7.933 0.974 Start of MODEL 19 1 H1 MET 1 1HT MET 1 2.208 14.266 -7.931 2 H2 MET 1 2HT MET 1 2.789 15.603 -7.059 3 H3 MET 1 3HT MET 1 2.140 14.266 -6.236 4 HA MET 1 HA MET 1 4.789 14.671 -7.305 5 HB2 MET 1 2HB MET 1 3.620 13.915 -4.903 6 HB3 MET 1 1HB MET 1 4.265 12.399 -5.533 7 HG2 MET 1 2HG MET 1 5.998 13.474 -4.221 8 HG3 MET 1 1HG MET 1 6.455 13.562 -5.923 9 HE1 MET 1 1HE MET 1 7.805 16.796 -4.274 10 HE2 MET 1 2HE MET 1 8.056 15.065 -4.487 11 HE3 MET 1 3HE MET 1 7.166 15.654 -3.084 12 HA PRO 2 HA PRO 2 3.932 10.288 -8.945 13 HB2 PRO 2 2HB PRO 2 1.336 9.356 -8.782 14 HB3 PRO 2 1HB PRO 2 2.573 9.087 -7.546 15 HG2 PRO 2 2HG PRO 2 0.206 10.722 -7.413 16 HG3 PRO 2 1HG PRO 2 1.347 10.308 -6.127 17 HD2 PRO 2 2HD PRO 2 1.152 12.783 -7.683 18 HD3 PRO 2 1HD PRO 2 2.078 12.467 -6.198 19 H GLU 3 H GLU 3 2.927 9.361 -10.995 20 HA GLU 3 HA GLU 3 2.558 11.252 -13.009 21 HB2 GLU 3 2HB GLU 3 1.175 8.561 -12.832 22 HB3 GLU 3 1HB GLU 3 1.444 9.485 -14.308 23 HG2 GLU 3 2HG GLU 3 3.903 9.348 -13.900 24 HG3 GLU 3 1HG GLU 3 3.584 8.323 -12.500 25 H GLU 4 H GLU 4 0.593 12.170 -13.972 26 HA GLU 4 HA GLU 4 -1.248 13.242 -12.166 27 HB2 GLU 4 2HB GLU 4 -1.771 12.517 -15.066 28 HB3 GLU 4 1HB GLU 4 -2.738 13.635 -14.104 29 HG2 GLU 4 2HG GLU 4 -0.720 15.048 -13.761 30 HG3 GLU 4 1HG GLU 4 0.197 13.956 -14.799 31 H ILE 5 H ILE 5 -3.323 12.606 -11.452 32 HA ILE 5 HA ILE 5 -3.783 10.015 -10.654 33 HB ILE 5 HB ILE 5 -5.145 11.999 -10.017 34 HG12 ILE 5 2HG1 ILE 5 -7.013 9.907 -11.128 35 HG13 ILE 5 1HG1 ILE 5 -5.931 9.535 -9.784 36 HG21 ILE 5 1HG2 ILE 5 -6.920 11.627 -12.364 37 HG22 ILE 5 2HG2 ILE 5 -5.386 12.444 -12.667 38 HG23 ILE 5 3HG2 ILE 5 -6.512 13.097 -11.479 39 HD11 ILE 5 1HD1 ILE 5 -8.031 11.722 -9.869 40 HD12 ILE 5 2HD1 ILE 5 -6.860 11.529 -8.566 41 HD13 ILE 5 3HD1 ILE 5 -8.060 10.271 -8.868 42 HA PRO 6 HA PRO 6 -4.490 8.373 -14.872 43 HB2 PRO 6 2HB PRO 6 -3.267 6.007 -14.568 44 HB3 PRO 6 1HB PRO 6 -2.336 7.512 -14.710 45 HG2 PRO 6 2HG PRO 6 -2.918 5.867 -12.314 46 HG3 PRO 6 1HG PRO 6 -1.482 6.823 -12.710 47 HD2 PRO 6 2HD PRO 6 -3.612 7.615 -11.016 48 HD3 PRO 6 1HD PRO 6 -2.308 8.649 -11.631 49 H ASP 7 H ASP 7 -5.694 6.497 -15.721 50 HA ASP 7 HA ASP 7 -7.918 5.725 -13.999 51 HB2 ASP 7 2HB ASP 7 -7.148 4.929 -16.825 52 HB3 ASP 7 1HB ASP 7 -8.647 4.453 -16.031 53 H VAL 8 H VAL 8 -7.636 3.034 -15.720 54 HA VAL 8 HA VAL 8 -7.043 1.282 -13.624 55 HB VAL 8 HB VAL 8 -6.427 0.868 -16.567 56 HG11 VAL 8 1HG1 VAL 8 -5.927 -0.766 -14.300 57 HG12 VAL 8 2HG1 VAL 8 -5.787 -1.212 -16.000 58 HG13 VAL 8 3HG1 VAL 8 -7.306 -1.472 -15.144 59 HG21 VAL 8 1HG2 VAL 8 -8.661 0.098 -16.808 60 HG22 VAL 8 2HG2 VAL 8 -8.805 1.578 -15.860 61 HG23 VAL 8 3HG2 VAL 8 -8.904 0.008 -15.064 62 H ARG 9 H ARG 9 -5.152 0.478 -12.722 63 HA ARG 9 HA ARG 9 -2.672 1.887 -13.471 64 HB2 ARG 9 2HB ARG 9 -3.336 0.059 -11.154 65 HB3 ARG 9 1HB ARG 9 -1.756 0.801 -11.402 66 HG2 ARG 9 2HG ARG 9 -2.864 3.044 -11.407 67 HG3 ARG 9 1HG ARG 9 -4.389 2.251 -11.007 68 HD2 ARG 9 2HD ARG 9 -3.274 1.280 -8.976 69 HD3 ARG 9 1HD ARG 9 -1.857 2.261 -9.344 70 HE ARG 9 HE ARG 9 -4.062 4.020 -9.282 71 HH11 ARG 9 1HH1 ARG 9 -4.516 5.196 -7.406 72 HH12 ARG 9 2HH1 ARG 9 -3.921 4.629 -5.880 73 HH21 ARG 9 1HH2 ARG 9 -2.364 1.838 -7.224 74 HH22 ARG 9 2HH2 ARG 9 -2.704 2.727 -5.778 75 H LYS 10 H LYS 10 -0.847 -0.166 -12.577 76 HA LYS 10 HA LYS 10 -1.100 -2.084 -14.852 77 HB2 LYS 10 2HB LYS 10 1.336 -0.740 -13.670 78 HB3 LYS 10 1HB LYS 10 1.411 -2.053 -14.837 79 HG2 LYS 10 2HG LYS 10 0.042 -0.698 -16.407 80 HG3 LYS 10 1HG LYS 10 0.092 0.637 -15.253 81 HD2 LYS 10 2HD LYS 10 2.587 0.591 -15.372 82 HD3 LYS 10 1HD LYS 10 2.472 -0.648 -16.623 83 HE2 LYS 10 2HE LYS 10 1.597 2.235 -16.752 84 HE3 LYS 10 1HE LYS 10 2.665 1.361 -17.849 85 HZ1 LYS 10 1HZ LYS 10 -0.266 1.039 -17.545 86 HZ2 LYS 10 2HZ LYS 10 0.705 -0.050 -18.418 87 HZ3 LYS 10 3HZ LYS 10 0.580 1.570 -18.916 88 H SER 11 H SER 11 0.872 -3.800 -14.357 89 HA SER 11 HA SER 11 0.300 -4.905 -11.629 90 HB2 SER 11 2HB SER 11 0.337 -7.131 -12.575 91 HB3 SER 11 1HB SER 11 -0.786 -6.163 -13.520 92 HG SER 11 HG SER 11 1.266 -5.730 -14.814 93 H VAL 12 H VAL 12 2.068 -6.015 -10.626 94 HA VAL 12 HA VAL 12 4.686 -5.864 -12.013 95 HB VAL 12 HB VAL 12 4.015 -4.562 -9.387 96 HG11 VAL 12 1HG1 VAL 12 5.969 -5.812 -8.855 97 HG12 VAL 12 2HG1 VAL 12 6.559 -4.205 -9.278 98 HG13 VAL 12 3HG1 VAL 12 6.675 -5.523 -10.445 99 HG21 VAL 12 1HG2 VAL 12 5.442 -3.664 -11.904 100 HG22 VAL 12 2HG2 VAL 12 5.230 -2.671 -10.462 101 HG23 VAL 12 3HG2 VAL 12 3.824 -3.178 -11.398 102 H VAL 13 H VAL 13 6.265 -7.316 -11.126 103 HA VAL 13 HA VAL 13 5.016 -9.559 -9.614 104 HB VAL 13 HB VAL 13 7.654 -9.462 -11.115 105 HG11 VAL 13 1HG1 VAL 13 6.680 -12.085 -10.907 106 HG12 VAL 13 2HG1 VAL 13 6.421 -11.378 -9.311 107 HG13 VAL 13 3HG1 VAL 13 8.037 -11.395 -10.017 108 HG21 VAL 13 1HG2 VAL 13 5.341 -11.059 -12.089 109 HG22 VAL 13 2HG2 VAL 13 6.566 -10.180 -13.005 110 HG23 VAL 13 3HG2 VAL 13 5.215 -9.310 -12.280 111 H VAL 14 H VAL 14 5.703 -10.046 -7.562 112 HA VAL 14 HA VAL 14 8.098 -8.576 -6.525 113 HB VAL 14 HB VAL 14 6.950 -8.213 -4.430 114 HG11 VAL 14 1HG1 VAL 14 6.272 -6.963 -6.761 115 HG12 VAL 14 2HG1 VAL 14 5.668 -6.481 -5.176 116 HG13 VAL 14 3HG1 VAL 14 4.692 -7.522 -6.212 117 HG21 VAL 14 1HG2 VAL 14 4.530 -8.954 -4.230 118 HG22 VAL 14 2HG2 VAL 14 5.707 -10.267 -4.221 119 HG23 VAL 14 3HG2 VAL 14 4.782 -9.922 -5.682 120 H ALA 15 H ALA 15 9.235 -9.710 -4.792 121 HA ALA 15 HA ALA 15 9.035 -12.639 -5.118 122 HB1 ALA 15 1HB ALA 15 10.994 -11.430 -3.226 123 HB2 ALA 15 2HB ALA 15 11.201 -11.054 -4.937 124 HB3 ALA 15 3HB ALA 15 11.215 -12.732 -4.396 125 H ALA 16 H ALA 16 7.174 -13.190 -3.954 126 HA ALA 16 HA ALA 16 7.500 -13.440 -1.082 127 HB1 ALA 16 1HB ALA 16 6.015 -11.873 -0.292 128 HB2 ALA 16 2HB ALA 16 5.012 -11.945 -1.740 129 HB3 ALA 16 3HB ALA 16 6.511 -11.016 -1.751 130 H SER 17 H SER 17 5.991 -14.987 -0.248 131 HA SER 17 HA SER 17 4.838 -16.735 -2.250 132 HB2 SER 17 2HB SER 17 4.215 -18.136 -0.433 133 HB3 SER 17 1HB SER 17 5.726 -17.389 0.076 134 HG SER 17 HG SER 17 3.216 -16.229 0.657 135 H VAL 18 H VAL 18 2.558 -17.169 -2.536 136 HA VAL 18 HA VAL 18 0.922 -14.839 -2.661 137 HB VAL 18 HB VAL 18 -0.602 -17.335 -2.476 138 HG11 VAL 18 1HG1 VAL 18 -1.561 -16.548 -4.472 139 HG12 VAL 18 2HG1 VAL 18 -0.098 -15.684 -4.944 140 HG13 VAL 18 3HG1 VAL 18 -1.109 -15.059 -3.644 141 HG21 VAL 18 1HG2 VAL 18 0.447 -18.207 -4.646 142 HG22 VAL 18 2HG2 VAL 18 1.375 -18.478 -3.172 143 HG23 VAL 18 3HG2 VAL 18 1.826 -17.175 -4.275 144 H GLU 19 H GLU 19 0.996 -17.518 -0.320 145 HA GLU 19 HA GLU 19 -1.193 -16.684 1.285 146 HB2 GLU 19 2HB GLU 19 0.009 -18.871 1.503 147 HB3 GLU 19 1HB GLU 19 1.357 -18.011 2.246 148 HG2 GLU 19 2HG GLU 19 -0.198 -17.164 4.003 149 HG3 GLU 19 1HG GLU 19 -1.486 -18.136 3.291 150 H HIS 20 H HIS 20 2.213 -15.707 1.315 151 HA HIS 20 HA HIS 20 2.157 -14.156 3.693 152 HB2 HIS 20 2HB HIS 20 4.197 -14.856 2.374 153 HB3 HIS 20 1HB HIS 20 3.793 -13.598 1.205 154 HD1 HIS 20 1HD HIS 20 3.941 -13.677 5.020 155 HD2 HIS 20 2HD HIS 20 5.289 -11.367 1.818 156 HE1 HIS 20 1HE HIS 20 5.206 -11.730 6.022 157 HE2 HIS 20 2HE HIS 20 6.031 -10.319 4.084 158 H CYS 21 H CYS 21 1.357 -13.335 0.330 159 HA CYS 21 HA CYS 21 1.098 -10.550 0.574 160 HB2 CYS 21 2HB CYS 21 -0.399 -12.572 -1.098 161 HB3 CYS 21 1HB CYS 21 -0.692 -10.842 -1.242 162 HG CYS 21 HG CYS 21 2.139 -12.082 -1.736 163 H PHE 22 H PHE 22 -1.561 -12.947 0.936 164 HA PHE 22 HA PHE 22 -3.421 -10.951 1.872 165 HB2 PHE 22 2HB PHE 22 -3.612 -13.894 2.499 166 HB3 PHE 22 1HB PHE 22 -4.922 -12.746 2.217 167 HD1 PHE 22 1HD PHE 22 -5.445 -11.957 -0.066 168 HD2 PHE 22 2HD PHE 22 -2.351 -14.833 0.678 169 HE1 PHE 22 1HE PHE 22 -5.372 -12.506 -2.485 170 HE2 PHE 22 2HE PHE 22 -2.277 -15.388 -1.732 171 HZ PHE 22 HZ PHE 22 -3.786 -14.223 -3.317 172 H GLU 23 H GLU 23 -1.245 -13.197 3.525 173 HA GLU 23 HA GLU 23 -2.269 -12.643 6.167 174 HB2 GLU 23 2HB GLU 23 0.402 -13.732 5.233 175 HB3 GLU 23 1HB GLU 23 -0.096 -13.658 6.923 176 HG2 GLU 23 2HG GLU 23 -1.610 -15.116 4.736 177 HG3 GLU 23 1HG GLU 23 -0.542 -15.888 5.908 178 H VAL 24 H VAL 24 0.276 -11.208 4.172 179 HA VAL 24 HA VAL 24 1.548 -9.636 6.136 180 HB VAL 24 HB VAL 24 1.057 -9.181 3.190 181 HG11 VAL 24 1HG1 VAL 24 2.946 -7.485 3.473 182 HG12 VAL 24 2HG1 VAL 24 2.598 -7.539 5.201 183 HG13 VAL 24 3HG1 VAL 24 1.362 -6.994 4.068 184 HG21 VAL 24 1HG2 VAL 24 2.979 -10.345 2.890 185 HG22 VAL 24 2HG2 VAL 24 2.720 -10.928 4.534 186 HG23 VAL 24 3HG2 VAL 24 3.778 -9.546 4.245 187 H PHE 25 H PHE 25 -1.274 -8.811 4.093 188 HA PHE 25 HA PHE 25 -1.581 -6.161 5.136 189 HB2 PHE 25 2HB PHE 25 -3.927 -7.822 4.258 190 HB3 PHE 25 1HB PHE 25 -3.630 -6.104 4.003 191 HD1 PHE 25 1HD PHE 25 -0.895 -6.048 2.957 192 HD2 PHE 25 2HD PHE 25 -4.098 -8.791 2.160 193 HE1 PHE 25 1HE PHE 25 0.101 -6.560 0.741 194 HE2 PHE 25 2HE PHE 25 -3.106 -9.306 -0.060 195 HZ PHE 25 HZ PHE 25 -1.006 -8.190 -0.768 196 H THR 26 H THR 26 -2.989 -9.272 6.127 197 HA THR 26 HA THR 26 -4.359 -7.905 8.368 198 HB THR 26 HB THR 26 -5.611 -9.954 8.610 199 HG1 THR 26 1HG THR 26 -4.528 -11.695 8.208 200 HG21 THR 26 1HG2 THR 26 -6.658 -10.077 6.434 201 HG22 THR 26 2HG2 THR 26 -5.209 -9.441 5.653 202 HG23 THR 26 3HG2 THR 26 -6.169 -8.404 6.710 203 H SER 27 H SER 27 -1.351 -9.365 7.927 204 HA SER 27 HA SER 27 -1.345 -10.596 10.626 205 HB2 SER 27 2HB SER 27 0.960 -11.310 10.049 206 HB3 SER 27 1HB SER 27 -0.212 -11.839 8.849 207 HG SER 27 HG SER 27 1.813 -10.770 8.102 208 H ARG 28 H ARG 28 0.941 -8.383 8.949 209 HA ARG 28 HA ARG 28 0.896 -6.624 11.324 210 HB2 ARG 28 2HB ARG 28 2.628 -8.439 11.707 211 HB3 ARG 28 1HB ARG 28 3.503 -7.786 10.321 212 HG2 ARG 28 2HG ARG 28 2.825 -5.585 11.978 213 HG3 ARG 28 1HG ARG 28 3.487 -6.833 13.026 214 HD2 ARG 28 2HD ARG 28 5.391 -7.056 11.379 215 HD3 ARG 28 1HD ARG 28 4.771 -5.609 10.589 216 HE ARG 28 HE ARG 28 5.582 -4.323 12.405 217 HH11 ARG 28 1HH1 ARG 28 6.734 -4.109 14.337 218 HH12 ARG 28 2HH1 ARG 28 7.100 -5.519 15.273 219 HH21 ARG 28 1HH2 ARG 28 5.544 -7.705 13.076 220 HH22 ARG 28 2HH2 ARG 28 6.427 -7.555 14.558 221 HA PRO 29 HA PRO 29 1.148 -4.388 7.250 222 HB2 PRO 29 2HB PRO 29 -0.205 -2.346 8.917 223 HB3 PRO 29 1HB PRO 29 -0.649 -2.970 7.320 224 HG2 PRO 29 2HG PRO 29 -2.007 -3.612 9.539 225 HG3 PRO 29 1HG PRO 29 -1.811 -4.733 8.183 226 HD2 PRO 29 2HD PRO 29 -0.458 -4.746 10.845 227 HD3 PRO 29 1HD PRO 29 -0.905 -6.111 9.797 228 H ALA 30 H ALA 30 1.999 -3.494 10.539 229 HA ALA 30 HA ALA 30 3.433 -1.080 9.925 230 HB1 ALA 30 1HB ALA 30 4.696 -2.011 12.150 231 HB2 ALA 30 2HB ALA 30 3.189 -2.923 12.231 232 HB3 ALA 30 3HB ALA 30 3.151 -1.159 12.189 233 H ASP 31 H ASP 31 4.066 -4.252 9.063 234 HA ASP 31 HA ASP 31 6.841 -4.570 9.413 235 HB2 ASP 31 2HB ASP 31 5.238 -6.272 8.454 236 HB3 ASP 31 1HB ASP 31 5.301 -5.380 6.934 237 H TRP 32 H TRP 32 5.093 -2.552 7.110 238 HA TRP 32 HA TRP 32 7.648 -1.244 6.415 239 HB2 TRP 32 2HB TRP 32 6.878 -1.437 3.911 240 HB3 TRP 32 1HB TRP 32 7.745 -2.780 4.658 241 HD1 TRP 32 HD TRP 32 6.554 -5.037 4.735 242 HE1 TRP 32 1HE TRP 32 4.182 -5.878 4.199 243 HE3 TRP 32 3HE TRP 32 4.219 -0.584 3.931 244 HZ2 TRP 32 2HZ TRP 32 1.631 -4.799 3.520 245 HZ3 TRP 32 3HZ TRP 32 1.814 -0.513 3.336 246 HH2 TRP 32 HH TRP 32 0.517 -2.616 3.126 247 H TRP 33 H TRP 33 4.499 -0.930 7.287 248 HA TRP 33 HA TRP 33 3.454 1.027 5.523 249 HB2 TRP 33 2HB TRP 33 2.585 -0.134 7.881 250 HB3 TRP 33 1HB TRP 33 2.815 1.556 8.333 251 HD1 TRP 33 HD TRP 33 1.396 3.399 7.049 252 HE1 TRP 33 1HE TRP 33 -0.798 3.247 5.705 253 HE3 TRP 33 3HE TRP 33 1.161 -1.650 6.301 254 HZ2 TRP 33 2HZ TRP 33 -2.436 1.252 4.475 255 HZ3 TRP 33 3HZ TRP 33 -0.726 -2.646 5.042 256 HH2 TRP 33 HH TRP 33 -2.523 -1.204 4.127 257 HA PRO 34 HA PRO 34 5.672 4.220 8.552 258 HB2 PRO 34 2HB PRO 34 8.114 2.622 9.095 259 HB3 PRO 34 1HB PRO 34 7.180 3.665 10.184 260 HG2 PRO 34 2HG PRO 34 7.087 1.012 10.380 261 HG3 PRO 34 1HG PRO 34 5.659 2.019 10.678 262 HD2 PRO 34 2HD PRO 34 6.321 0.347 8.285 263 HD3 PRO 34 1HD PRO 34 4.744 0.651 9.045 264 HA PRO 35 HA PRO 35 8.147 4.651 4.724 265 HB2 PRO 35 2HB PRO 35 7.451 7.244 4.191 266 HB3 PRO 35 1HB PRO 35 6.462 5.847 3.731 267 HG2 PRO 35 2HG PRO 35 6.016 7.841 5.825 268 HG3 PRO 35 1HG PRO 35 4.867 6.768 5.022 269 HD2 PRO 35 2HD PRO 35 6.016 6.446 7.625 270 HD3 PRO 35 1HD PRO 35 4.925 5.338 6.772 271 H SER 36 H SER 36 10.095 5.846 4.220 272 HA SER 36 HA SER 36 11.730 6.567 6.412 273 HB2 SER 36 2HB SER 36 11.982 7.574 3.563 274 HB3 SER 36 1HB SER 36 13.267 7.505 4.764 275 HG SER 36 HG SER 36 12.486 5.617 3.083 276 H HIS 37 H HIS 37 9.555 8.503 4.435 277 HA HIS 37 HA HIS 37 10.236 10.901 6.086 278 HB2 HIS 37 2HB HIS 37 8.735 10.757 3.450 279 HB3 HIS 37 1HB HIS 37 9.222 12.227 4.294 280 HD1 HIS 37 1HD HIS 37 11.953 12.390 4.708 281 HD2 HIS 37 2HD HIS 37 10.645 9.863 1.658 282 HE1 HIS 37 1HE HIS 37 13.957 11.970 3.214 283 HE2 HIS 37 2HE HIS 37 13.172 10.433 1.356 284 H VAL 38 H VAL 38 7.959 12.357 5.997 285 HA VAL 38 HA VAL 38 5.967 10.532 7.281 286 HB VAL 38 HB VAL 38 6.200 13.541 7.561 287 HG11 VAL 38 1HG1 VAL 38 4.050 12.059 8.104 288 HG12 VAL 38 2HG1 VAL 38 4.543 13.379 9.164 289 HG13 VAL 38 3HG1 VAL 38 4.957 11.715 9.576 290 HG21 VAL 38 1HG2 VAL 38 8.006 13.150 8.855 291 HG22 VAL 38 2HG2 VAL 38 7.817 11.407 8.678 292 HG23 VAL 38 3HG2 VAL 38 6.950 12.262 9.954 293 H LEU 39 H LEU 39 4.130 10.169 6.147 294 HA LEU 39 HA LEU 39 3.464 12.004 3.898 295 HB2 LEU 39 2HB LEU 39 2.322 9.271 4.557 296 HB3 LEU 39 1HB LEU 39 2.062 10.186 3.071 297 HG LEU 39 HG LEU 39 4.716 9.106 4.068 298 HD11 LEU 39 1HD1 LEU 39 4.158 7.262 2.906 299 HD12 LEU 39 2HD1 LEU 39 4.040 8.242 1.446 300 HD13 LEU 39 3HD1 LEU 39 2.616 7.989 2.454 301 HD21 LEU 39 1HD2 LEU 39 5.280 9.891 1.595 302 HD22 LEU 39 2HD2 LEU 39 5.361 11.033 2.937 303 HD23 LEU 39 3HD2 LEU 39 3.947 11.010 1.882 304 H VAL 40 H VAL 40 2.624 11.444 7.092 305 HA VAL 40 HA VAL 40 0.005 12.829 6.698 306 HB VAL 40 HB VAL 40 0.146 11.049 9.032 307 HG11 VAL 40 1HG1 VAL 40 -1.845 11.165 6.751 308 HG12 VAL 40 2HG1 VAL 40 -1.864 12.299 8.103 309 HG13 VAL 40 3HG1 VAL 40 -2.122 10.578 8.391 310 HG21 VAL 40 1HG2 VAL 40 -0.291 9.002 7.594 311 HG22 VAL 40 2HG2 VAL 40 1.373 9.585 7.550 312 HG23 VAL 40 3HG2 VAL 40 0.280 9.936 6.211 313 H LYS 41 H LYS 41 -0.688 13.475 9.192 314 HA LYS 41 HA LYS 41 1.157 15.483 9.987 315 HB2 LYS 41 2HB LYS 41 -0.983 14.090 11.614 316 HB3 LYS 41 1HB LYS 41 -0.162 15.571 12.102 317 HG2 LYS 41 2HG LYS 41 -0.967 16.658 10.001 318 HG3 LYS 41 1HG LYS 41 -1.880 15.195 9.632 319 HD2 LYS 41 2HD LYS 41 -3.081 15.446 11.811 320 HD3 LYS 41 1HD LYS 41 -2.240 16.977 12.057 321 HE2 LYS 41 2HE LYS 41 -3.211 17.356 9.548 322 HE3 LYS 41 1HE LYS 41 -4.471 16.324 10.223 323 HZ1 LYS 41 1HZ LYS 41 -4.036 19.046 10.684 324 HZ2 LYS 41 2HZ LYS 41 -3.760 18.226 12.147 325 HZ3 LYS 41 3HZ LYS 41 -5.244 18.052 11.340 326 H LYS 42 H LYS 42 0.733 12.136 11.022 327 HA LYS 42 HA LYS 42 3.365 12.316 12.415 328 HB2 LYS 42 2HB LYS 42 1.020 10.653 13.348 329 HB3 LYS 42 1HB LYS 42 2.561 10.856 14.171 330 HG2 LYS 42 2HG LYS 42 0.827 13.240 13.554 331 HG3 LYS 42 1HG LYS 42 0.532 12.263 14.989 332 HD2 LYS 42 2HD LYS 42 2.528 12.878 15.992 333 HD3 LYS 42 1HD LYS 42 3.331 13.192 14.456 334 HE2 LYS 42 2HE LYS 42 1.885 15.183 14.133 335 HE3 LYS 42 1HE LYS 42 1.168 14.891 15.718 336 HZ1 LYS 42 1HZ LYS 42 2.981 16.529 15.775 337 HZ2 LYS 42 2HZ LYS 42 4.063 15.339 15.229 338 HZ3 LYS 42 3HZ LYS 42 3.306 15.173 16.740 339 H GLU 43 H GLU 43 4.662 10.413 12.215 340 HA GLU 43 HA GLU 43 4.327 8.920 9.807 341 HB2 GLU 43 2HB GLU 43 5.946 8.250 12.273 342 HB3 GLU 43 1HB GLU 43 6.119 7.459 10.709 343 HG2 GLU 43 2HG GLU 43 6.662 9.661 9.686 344 HG3 GLU 43 1HG GLU 43 6.565 10.404 11.283 345 H ARG 44 H ARG 44 3.237 7.003 9.405 346 HA ARG 44 HA ARG 44 1.290 6.102 11.331 347 HB2 ARG 44 2HB ARG 44 2.257 4.937 8.717 348 HB3 ARG 44 1HB ARG 44 0.970 4.207 9.679 349 HG2 ARG 44 2HG ARG 44 -0.217 6.433 9.620 350 HG3 ARG 44 1HG ARG 44 0.999 6.979 8.463 351 HD2 ARG 44 2HD ARG 44 0.327 5.404 6.839 352 HD3 ARG 44 1HD ARG 44 -0.564 4.442 8.019 353 HE ARG 44 HE ARG 44 -1.947 6.751 8.145 354 HH11 ARG 44 1HH1 ARG 44 -3.536 7.469 6.711 355 HH12 ARG 44 2HH1 ARG 44 -3.504 6.935 5.063 356 HH21 ARG 44 1HH2 ARG 44 -0.667 4.986 5.468 357 HH22 ARG 44 2HH2 ARG 44 -1.880 5.532 4.361 358 H ALA 45 H ALA 45 1.330 4.354 12.698 359 HA ALA 45 HA ALA 45 3.789 2.666 12.677 360 HB1 ALA 45 1HB ALA 45 4.423 3.305 14.736 361 HB2 ALA 45 2HB ALA 45 2.775 3.206 15.357 362 HB3 ALA 45 3HB ALA 45 3.320 4.665 14.530 363 H GLY 46 H GLY 46 0.498 3.013 14.084 364 HA2 GLY 46 2HA GLY 46 0.403 0.027 14.246 365 HA3 GLY 46 1HA GLY 46 -0.609 1.116 15.183 366 H LEU 47 H LEU 47 -1.407 -1.102 13.411 367 HA LEU 47 HA LEU 47 -3.388 0.409 11.819 368 HB2 LEU 47 2HB LEU 47 -1.500 -1.653 10.656 369 HB3 LEU 47 1HB LEU 47 -2.983 -1.141 9.857 370 HG LEU 47 HG LEU 47 -1.900 1.284 10.369 371 HD11 LEU 47 1HD1 LEU 47 0.125 -0.185 11.285 372 HD12 LEU 47 2HD1 LEU 47 0.412 1.315 10.404 373 HD13 LEU 47 3HD1 LEU 47 0.549 -0.235 9.574 374 HD21 LEU 47 1HD2 LEU 47 -1.090 -0.456 8.021 375 HD22 LEU 47 2HD2 LEU 47 -1.191 1.304 8.046 376 HD23 LEU 47 3HD2 LEU 47 -2.658 0.334 8.172 377 H ALA 48 H ALA 48 -5.365 -0.559 11.977 378 HA ALA 48 HA ALA 48 -5.550 -3.472 12.404 379 HB1 ALA 48 1HB ALA 48 -7.161 -3.027 14.359 380 HB2 ALA 48 2HB ALA 48 -6.458 -1.412 14.422 381 HB3 ALA 48 3HB ALA 48 -5.441 -2.827 14.693 382 H PHE 49 H PHE 49 -7.234 -4.185 11.167 383 HA PHE 49 HA PHE 49 -9.602 -2.445 10.820 384 HB2 PHE 49 2HB PHE 49 -9.507 -2.673 8.354 385 HB3 PHE 49 1HB PHE 49 -8.122 -1.781 8.988 386 HD1 PHE 49 1HD PHE 49 -9.242 -4.786 7.270 387 HD2 PHE 49 2HD PHE 49 -5.915 -2.923 9.243 388 HE1 PHE 49 1HE PHE 49 -7.707 -6.428 6.227 389 HE2 PHE 49 2HE PHE 49 -4.377 -4.564 8.202 390 HZ PHE 49 HZ PHE 49 -5.270 -6.313 6.693 391 H GLU 50 H GLU 50 -11.473 -3.591 10.190 392 HA GLU 50 HA GLU 50 -11.340 -6.499 10.665 393 HB2 GLU 50 2HB GLU 50 -13.689 -4.640 10.175 394 HB3 GLU 50 1HB GLU 50 -13.821 -6.341 10.611 395 HG2 GLU 50 2HG GLU 50 -14.064 -5.047 12.635 396 HG3 GLU 50 1HG GLU 50 -12.486 -5.837 12.687 397 HA PRO 51 HA PRO 51 -11.188 -6.749 6.118 398 HB2 PRO 51 2HB PRO 51 -10.519 -9.374 5.923 399 HB3 PRO 51 1HB PRO 51 -9.349 -8.107 6.339 400 HG2 PRO 51 2HG PRO 51 -10.711 -10.077 8.092 401 HG3 PRO 51 1HG PRO 51 -9.067 -9.426 8.183 402 HD2 PRO 51 2HD PRO 51 -11.185 -8.576 9.764 403 HD3 PRO 51 1HD PRO 51 -9.720 -7.625 9.441 404 H PHE 52 H PHE 52 -13.408 -6.519 5.623 405 HA PHE 52 HA PHE 52 -14.773 -8.979 4.847 406 HB2 PHE 52 2HB PHE 52 -16.117 -7.187 6.896 407 HB3 PHE 52 1HB PHE 52 -16.771 -8.668 6.196 408 HD1 PHE 52 1HD PHE 52 -14.507 -7.240 8.653 409 HD2 PHE 52 2HD PHE 52 -15.735 -10.877 6.736 410 HE1 PHE 52 1HE PHE 52 -13.373 -8.552 10.422 411 HE2 PHE 52 2HE PHE 52 -14.600 -12.195 8.505 412 HZ PHE 52 HZ PHE 52 -13.415 -11.031 10.348 413 H VAL 53 H VAL 53 -17.124 -8.197 3.996 414 HA VAL 53 HA VAL 53 -16.525 -5.998 2.154 415 HB VAL 53 HB VAL 53 -19.175 -7.418 2.569 416 HG11 VAL 53 1HG1 VAL 53 -18.005 -5.602 0.485 417 HG12 VAL 53 2HG1 VAL 53 -19.626 -5.608 1.181 418 HG13 VAL 53 3HG1 VAL 53 -19.173 -6.829 -0.009 419 HG21 VAL 53 1HG2 VAL 53 -18.370 -9.255 1.532 420 HG22 VAL 53 2HG2 VAL 53 -16.756 -8.595 1.790 421 HG23 VAL 53 3HG2 VAL 53 -17.604 -8.285 0.275 422 H GLY 54 H GLY 54 -16.911 -3.884 2.675 423 HA2 GLY 54 2HA GLY 54 -18.068 -2.030 3.593 424 HA3 GLY 54 1HA GLY 54 -19.284 -3.145 4.222 425 H GLY 55 H GLY 55 -16.002 -3.943 4.866 426 HA2 GLY 55 2HA GLY 55 -16.401 -3.770 7.732 427 HA3 GLY 55 1HA GLY 55 -14.883 -4.163 6.922 428 H ARG 56 H ARG 56 -14.451 -2.581 8.979 429 HA ARG 56 HA ARG 56 -14.300 0.195 7.855 430 HB2 ARG 56 2HB ARG 56 -14.430 -0.714 10.747 431 HB3 ARG 56 1HB ARG 56 -14.203 0.956 10.227 432 HG2 ARG 56 2HG ARG 56 -16.361 0.824 8.981 433 HG3 ARG 56 1HG ARG 56 -16.601 -0.800 9.629 434 HD2 ARG 56 2HD ARG 56 -16.401 0.184 11.944 435 HD3 ARG 56 1HD ARG 56 -16.406 1.783 11.200 436 HE ARG 56 HE ARG 56 -18.674 0.663 10.158 437 HH11 ARG 56 1HH1 ARG 56 -20.691 0.677 11.178 438 HH12 ARG 56 2HH1 ARG 56 -20.773 0.772 12.905 439 HH21 ARG 56 1HH2 ARG 56 -17.332 0.872 13.326 440 HH22 ARG 56 2HH2 ARG 56 -18.871 0.884 14.122 441 H TYR 57 H TYR 57 -12.266 1.104 7.727 442 HA TYR 57 HA TYR 57 -10.013 -0.525 8.837 443 HB2 TYR 57 2HB TYR 57 -10.332 -0.295 6.258 444 HB3 TYR 57 1HB TYR 57 -9.736 1.348 6.496 445 HD1 TYR 57 1HD TYR 57 -8.802 -2.038 5.967 446 HD2 TYR 57 2HD TYR 57 -7.533 1.571 7.920 447 HE1 TYR 57 1HE TYR 57 -6.477 -2.900 6.039 448 HE2 TYR 57 2HE TYR 57 -5.206 0.713 7.991 449 HH TYR 57 HH TYR 57 -3.803 -0.884 6.902 450 H TYR 58 H TYR 58 -8.763 0.511 10.301 451 HA TYR 58 HA TYR 58 -8.554 3.460 10.195 452 HB2 TYR 58 2HB TYR 58 -9.077 3.668 12.595 453 HB3 TYR 58 1HB TYR 58 -10.448 3.007 11.701 454 HD1 TYR 58 1HD TYR 58 -8.277 2.526 14.477 455 HD2 TYR 58 2HD TYR 58 -10.560 0.408 11.527 456 HE1 TYR 58 1HE TYR 58 -8.258 0.504 15.913 457 HE2 TYR 58 2HE TYR 58 -10.543 -1.616 12.959 458 HH TYR 58 HH TYR 58 -9.303 -2.581 14.759 459 H GLU 59 H GLU 59 -6.725 4.258 11.468 460 HA GLU 59 HA GLU 59 -4.781 2.137 12.264 461 HB2 GLU 59 2HB GLU 59 -4.151 4.591 10.596 462 HB3 GLU 59 1HB GLU 59 -2.989 3.377 11.130 463 HG2 GLU 59 2HG GLU 59 -4.196 1.647 9.857 464 HG3 GLU 59 1HG GLU 59 -5.371 2.852 9.327 465 H TRP 60 H TRP 60 -3.081 2.995 13.754 466 HA TRP 60 HA TRP 60 -4.183 5.254 15.369 467 HB2 TRP 60 2HB TRP 60 -2.187 3.086 16.077 468 HB3 TRP 60 1HB TRP 60 -2.622 4.421 17.143 469 HD1 TRP 60 HD TRP 60 -5.324 4.585 17.755 470 HE1 TRP 60 1HE TRP 60 -6.965 2.660 18.252 471 HE3 TRP 60 3HE TRP 60 -2.790 0.694 15.630 472 HZ2 TRP 60 2HZ TRP 60 -7.171 -0.158 17.811 473 HZ3 TRP 60 3HZ TRP 60 -3.729 -1.597 15.685 474 HH2 TRP 60 HH TRP 60 -5.915 -2.026 16.770 475 H ASP 61 H ASP 61 -3.072 7.140 15.481 476 HA ASP 61 HA ASP 61 -0.495 7.319 14.017 477 HB2 ASP 61 2HB ASP 61 -2.376 9.425 15.112 478 HB3 ASP 61 1HB ASP 61 -0.857 9.793 14.302 479 H ILE 62 H ILE 62 1.310 8.515 15.050 480 HA ILE 62 HA ILE 62 2.049 7.521 17.564 481 HB ILE 62 HB ILE 62 2.889 10.126 16.290 482 HG12 ILE 62 2HG1 ILE 62 4.214 7.416 16.229 483 HG13 ILE 62 1HG1 ILE 62 3.222 8.052 14.927 484 HG21 ILE 62 1HG2 ILE 62 4.110 10.456 18.140 485 HG22 ILE 62 2HG2 ILE 62 4.961 8.951 17.791 486 HG23 ILE 62 3HG2 ILE 62 3.531 8.936 18.823 487 HD11 ILE 62 1HD1 ILE 62 5.647 8.449 14.535 488 HD12 ILE 62 2HD1 ILE 62 5.702 9.402 16.017 489 HD13 ILE 62 3HD1 ILE 62 4.732 9.953 14.651 490 H ASP 63 H ASP 63 0.523 10.649 16.814 491 HA ASP 63 HA ASP 63 -0.230 10.843 19.706 492 HB2 ASP 63 2HB ASP 63 0.553 13.064 17.796 493 HB3 ASP 63 1HB ASP 63 -0.128 13.331 19.401 494 H GLY 64 H GLY 64 -1.231 10.873 16.419 495 HA2 GLY 64 2HA GLY 64 -3.772 12.236 16.931 496 HA3 GLY 64 1HA GLY 64 -3.299 11.466 15.415 497 H THR 65 H THR 65 -5.820 11.209 16.932 498 HA THR 65 HA THR 65 -5.923 8.640 18.217 499 HB THR 65 HB THR 65 -7.616 10.526 18.442 500 HG1 THR 65 1HG THR 65 -8.708 8.943 19.242 501 HG21 THR 65 1HG2 THR 65 -9.084 9.421 16.132 502 HG22 THR 65 2HG2 THR 65 -7.679 10.409 15.735 503 HG23 THR 65 3HG2 THR 65 -8.982 11.082 16.713 504 H GLU 66 H GLU 66 -8.317 7.761 16.668 505 HA GLU 66 HA GLU 66 -6.838 6.215 14.647 506 HB2 GLU 66 2HB GLU 66 -9.689 6.032 15.652 507 HB3 GLU 66 1HB GLU 66 -8.957 4.921 14.499 508 HG2 GLU 66 2HG GLU 66 -7.223 4.347 16.173 509 HG3 GLU 66 1HG GLU 66 -8.010 5.416 17.333 510 H ILE 67 H ILE 67 -6.982 6.603 12.485 511 HA ILE 67 HA ILE 67 -9.151 8.433 11.526 512 HB ILE 67 HB ILE 67 -6.313 8.250 10.469 513 HG12 ILE 67 2HG1 ILE 67 -7.695 10.428 12.071 514 HG13 ILE 67 1HG1 ILE 67 -6.422 9.363 12.671 515 HG21 ILE 67 1HG2 ILE 67 -8.033 8.799 8.766 516 HG22 ILE 67 2HG2 ILE 67 -6.973 10.170 9.086 517 HG23 ILE 67 3HG2 ILE 67 -8.594 10.129 9.779 518 HD11 ILE 67 1HD1 ILE 67 -5.347 10.371 10.321 519 HD12 ILE 67 2HD1 ILE 67 -4.967 10.938 11.947 520 HD13 ILE 67 3HD1 ILE 67 -6.209 11.754 10.996 521 H VAL 68 H VAL 68 -10.193 7.776 9.624 522 HA VAL 68 HA VAL 68 -9.945 4.988 8.893 523 HB VAL 68 HB VAL 68 -11.352 7.218 7.391 524 HG11 VAL 68 1HG1 VAL 68 -11.028 5.132 6.106 525 HG12 VAL 68 2HG1 VAL 68 -12.729 5.373 6.508 526 HG13 VAL 68 3HG1 VAL 68 -11.762 4.212 7.419 527 HG21 VAL 68 1HG2 VAL 68 -12.179 5.480 9.720 528 HG22 VAL 68 2HG2 VAL 68 -13.370 6.213 8.646 529 HG23 VAL 68 3HG2 VAL 68 -12.278 7.235 9.579 530 H TRP 69 H TRP 69 -8.551 4.119 7.430 531 HA TRP 69 HA TRP 69 -6.989 5.999 5.718 532 HB2 TRP 69 2HB TRP 69 -5.413 4.742 6.864 533 HB3 TRP 69 1HB TRP 69 -6.446 3.316 6.931 534 HD1 TRP 69 HD TRP 69 -3.788 4.978 4.868 535 HE1 TRP 69 1HE TRP 69 -3.211 3.498 2.838 536 HE3 TRP 69 3HE TRP 69 -7.567 1.555 5.167 537 HZ2 TRP 69 2HZ TRP 69 -4.217 1.170 1.517 538 HZ3 TRP 69 3HZ TRP 69 -7.732 -0.283 3.513 539 HH2 TRP 69 HH TRP 69 -6.065 -0.482 1.688 540 H GLY 70 H GLY 70 -9.581 3.878 5.551 541 HA2 GLY 70 2HA GLY 70 -10.147 4.101 2.868 542 HA3 GLY 70 1HA GLY 70 -9.031 2.736 2.924 543 H ARG 71 H ARG 71 -10.478 1.047 2.520 544 HA ARG 71 HA ARG 71 -12.186 0.266 4.746 545 HB2 ARG 71 2HB ARG 71 -13.439 1.917 3.009 546 HB3 ARG 71 1HB ARG 71 -13.716 0.379 2.200 547 HG2 ARG 71 2HG ARG 71 -14.609 -0.549 4.331 548 HG3 ARG 71 1HG ARG 71 -14.422 1.042 5.069 549 HD2 ARG 71 2HD ARG 71 -16.708 0.873 4.332 550 HD3 ARG 71 1HD ARG 71 -15.881 1.963 3.219 551 HE ARG 71 HE ARG 71 -15.997 -0.881 2.423 552 HH11 ARG 71 1HH1 ARG 71 -16.997 -1.233 0.433 553 HH12 ARG 71 2HH1 ARG 71 -17.862 0.058 -0.330 554 HH21 ARG 71 1HH2 ARG 71 -17.219 2.344 2.194 555 HH22 ARG 71 2HH2 ARG 71 -17.984 2.079 0.664 556 H ILE 72 H ILE 72 -13.743 -1.599 3.211 557 HA ILE 72 HA ILE 72 -11.665 -3.258 1.869 558 HB ILE 72 HB ILE 72 -13.572 -4.191 4.034 559 HG12 ILE 72 2HG1 ILE 72 -11.018 -4.946 4.722 560 HG13 ILE 72 1HG1 ILE 72 -10.736 -3.387 3.947 561 HG21 ILE 72 1HG2 ILE 72 -13.412 -5.915 2.350 562 HG22 ILE 72 2HG2 ILE 72 -12.367 -6.387 3.690 563 HG23 ILE 72 3HG2 ILE 72 -11.666 -5.700 2.224 564 HD11 ILE 72 1HD1 ILE 72 -11.162 -3.174 6.395 565 HD12 ILE 72 2HD1 ILE 72 -12.762 -3.870 6.147 566 HD13 ILE 72 3HD1 ILE 72 -12.356 -2.316 5.422 567 H LEU 73 H LEU 73 -12.671 -4.971 0.491 568 HA LEU 73 HA LEU 73 -15.440 -4.213 -0.360 569 HB2 LEU 73 2HB LEU 73 -13.644 -3.550 -1.994 570 HB3 LEU 73 1HB LEU 73 -13.221 -5.254 -2.144 571 HG LEU 73 HG LEU 73 -15.794 -5.543 -2.650 572 HD11 LEU 73 1HD1 LEU 73 -15.279 -2.650 -3.406 573 HD12 LEU 73 2HD1 LEU 73 -16.395 -3.206 -2.157 574 HD13 LEU 73 3HD1 LEU 73 -16.708 -3.582 -3.851 575 HD21 LEU 73 1HD2 LEU 73 -15.162 -4.744 -5.115 576 HD22 LEU 73 2HD2 LEU 73 -14.422 -6.176 -4.401 577 HD23 LEU 73 3HD2 LEU 73 -13.549 -4.643 -4.410 578 H GLU 74 H GLU 74 -13.046 -6.855 -0.520 579 HA GLU 74 HA GLU 74 -14.816 -8.792 0.624 580 HB2 GLU 74 2HB GLU 74 -15.952 -8.481 -1.590 581 HB3 GLU 74 1HB GLU 74 -14.469 -9.024 -2.368 582 HG2 GLU 74 2HG GLU 74 -14.609 -11.157 -1.090 583 HG3 GLU 74 1HG GLU 74 -16.147 -10.618 -0.415 584 H TRP 75 H TRP 75 -13.655 -10.645 1.146 585 HA TRP 75 HA TRP 75 -10.816 -10.665 0.250 586 HB2 TRP 75 2HB TRP 75 -10.688 -10.698 2.556 587 HB3 TRP 75 1HB TRP 75 -12.237 -11.522 2.731 588 HD1 TRP 75 HD TRP 75 -8.536 -12.161 2.238 589 HE1 TRP 75 1HE TRP 75 -8.076 -14.688 2.470 590 HE3 TRP 75 3HE TRP 75 -13.327 -13.917 2.387 591 HZ2 TRP 75 2HZ TRP 75 -9.550 -17.133 2.689 592 HZ3 TRP 75 3HZ TRP 75 -13.772 -16.343 2.605 593 HH2 TRP 75 HH TRP 75 -11.892 -17.953 2.758 594 H ASP 76 H ASP 76 -10.279 -12.179 -1.241 595 HA ASP 76 HA ASP 76 -12.032 -14.580 -1.485 596 HB2 ASP 76 2HB ASP 76 -11.243 -12.713 -3.414 597 HB3 ASP 76 1HB ASP 76 -10.264 -14.145 -3.738 598 HA PRO 77 HA PRO 77 -8.684 -16.979 0.369 599 HB2 PRO 77 2HB PRO 77 -9.580 -18.800 -1.860 600 HB3 PRO 77 1HB PRO 77 -9.155 -19.213 -0.187 601 HG2 PRO 77 2HG PRO 77 -11.694 -18.964 -0.956 602 HG3 PRO 77 1HG PRO 77 -11.150 -18.465 0.654 603 HD2 PRO 77 2HD PRO 77 -12.046 -16.794 -1.597 604 HD3 PRO 77 1HD PRO 77 -11.891 -16.366 0.123 605 HA PRO 78 HA PRO 78 -4.861 -16.266 -1.689 606 HB2 PRO 78 2HB PRO 78 -4.809 -19.238 -2.112 607 HB3 PRO 78 1HB PRO 78 -3.513 -18.162 -1.553 608 HG2 PRO 78 2HG PRO 78 -5.084 -19.676 0.104 609 HG3 PRO 78 1HG PRO 78 -4.234 -18.202 0.592 610 HD2 PRO 78 2HD PRO 78 -7.082 -18.613 0.428 611 HD3 PRO 78 1HD PRO 78 -6.224 -17.131 0.899 612 H HIS 79 H HIS 79 -5.939 -15.235 -3.504 613 HA HIS 79 HA HIS 79 -5.321 -16.217 -6.041 614 HB2 HIS 79 2HB HIS 79 -7.779 -17.390 -4.923 615 HB3 HIS 79 1HB HIS 79 -7.989 -16.673 -6.520 616 HD1 HIS 79 1HD HIS 79 -7.106 -19.780 -5.049 617 HD2 HIS 79 2HD HIS 79 -5.610 -17.608 -8.281 618 HE1 HIS 79 1HE HIS 79 -5.812 -21.423 -6.481 619 HE2 HIS 79 2HE HIS 79 -4.898 -20.111 -8.450 620 H ARG 80 H ARG 80 -7.966 -14.523 -4.267 621 HA ARG 80 HA ARG 80 -7.488 -12.240 -6.108 622 HB2 ARG 80 2HB ARG 80 -9.598 -13.900 -6.577 623 HB3 ARG 80 1HB ARG 80 -10.338 -12.721 -5.498 624 HG2 ARG 80 2HG ARG 80 -8.737 -11.962 -7.955 625 HG3 ARG 80 1HG ARG 80 -10.494 -12.119 -7.941 626 HD2 ARG 80 2HD ARG 80 -8.815 -10.189 -6.328 627 HD3 ARG 80 1HD ARG 80 -9.984 -9.794 -7.583 628 HE ARG 80 HE ARG 80 -10.608 -10.462 -4.807 629 HH11 ARG 80 1HH1 ARG 80 -12.801 -10.359 -4.269 630 HH12 ARG 80 2HH1 ARG 80 -13.987 -10.285 -5.530 631 HH21 ARG 80 1HH2 ARG 80 -11.651 -10.367 -8.092 632 HH22 ARG 80 2HH2 ARG 80 -13.335 -10.289 -7.694 633 H LEU 81 H LEU 81 -7.418 -10.353 -5.048 634 HA LEU 81 HA LEU 81 -8.642 -10.211 -2.319 635 HB2 LEU 81 2HB LEU 81 -6.144 -10.295 -2.259 636 HB3 LEU 81 1HB LEU 81 -6.101 -8.847 -3.263 637 HG LEU 81 HG LEU 81 -7.480 -7.679 -1.495 638 HD11 LEU 81 1HD1 LEU 81 -8.504 -9.330 -0.213 639 HD12 LEU 81 2HD1 LEU 81 -7.139 -8.900 0.817 640 HD13 LEU 81 3HD1 LEU 81 -7.066 -10.348 -0.186 641 HD21 LEU 81 1HD2 LEU 81 -4.703 -8.326 -1.535 642 HD22 LEU 81 2HD2 LEU 81 -5.225 -8.333 0.150 643 HD23 LEU 81 3HD2 LEU 81 -5.473 -6.896 -0.845 644 H ALA 82 H ALA 82 -10.142 -8.599 -2.150 645 HA ALA 82 HA ALA 82 -9.937 -6.292 -4.048 646 HB1 ALA 82 1HB ALA 82 -12.167 -6.446 -4.641 647 HB2 ALA 82 2HB ALA 82 -12.624 -7.224 -3.126 648 HB3 ALA 82 3HB ALA 82 -11.819 -8.156 -4.388 649 H MET 83 H MET 83 -10.231 -4.286 -3.080 650 HA MET 83 HA MET 83 -11.324 -4.230 -0.317 651 HB2 MET 83 2HB MET 83 -8.686 -2.970 -1.111 652 HB3 MET 83 1HB MET 83 -9.443 -2.884 0.481 653 HG2 MET 83 2HG MET 83 -9.353 -5.401 0.570 654 HG3 MET 83 1HG MET 83 -8.405 -5.360 -0.915 655 HE1 MET 83 1HE MET 83 -8.180 -2.873 2.386 656 HE2 MET 83 2HE MET 83 -7.325 -4.108 3.305 657 HE3 MET 83 3HE MET 83 -8.897 -4.476 2.602 658 H THR 84 H THR 84 -12.466 -2.344 0.138 659 HA THR 84 HA THR 84 -12.638 -0.371 -2.093 660 HB THR 84 HB THR 84 -14.426 -0.683 0.341 661 HG1 THR 84 1HG THR 84 -14.726 -2.452 -0.905 662 HG21 THR 84 1HG2 THR 84 -15.962 0.607 -1.360 663 HG22 THR 84 2HG2 THR 84 -14.425 1.085 -2.080 664 HG23 THR 84 3HG2 THR 84 -14.778 1.495 -0.402 665 H TRP 85 H TRP 85 -11.903 1.747 -1.741 666 HA TRP 85 HA TRP 85 -10.594 2.193 0.896 667 HB2 TRP 85 2HB TRP 85 -10.150 3.272 -1.866 668 HB3 TRP 85 1HB TRP 85 -9.597 4.199 -0.473 669 HD1 TRP 85 HD TRP 85 -9.550 0.441 -0.154 670 HE1 TRP 85 1HE TRP 85 -7.113 -0.392 -0.176 671 HE3 TRP 85 3HE TRP 85 -7.159 4.755 -1.475 672 HZ2 TRP 85 2HZ TRP 85 -4.492 0.636 -0.687 673 HZ3 TRP 85 3HZ TRP 85 -4.694 4.799 -1.721 674 HH2 TRP 85 HH TRP 85 -3.358 2.748 -1.328 675 H ARG 86 H ARG 86 -11.689 3.420 2.334 676 HA ARG 86 HA ARG 86 -13.465 5.585 1.267 677 HB2 ARG 86 2HB ARG 86 -14.656 3.774 2.518 678 HB3 ARG 86 1HB ARG 86 -13.669 4.145 3.932 679 HG2 ARG 86 2HG ARG 86 -14.526 6.488 3.864 680 HG3 ARG 86 1HG ARG 86 -15.583 6.031 2.529 681 HD2 ARG 86 2HD ARG 86 -15.610 4.802 5.302 682 HD3 ARG 86 1HD ARG 86 -16.798 5.943 4.673 683 HE ARG 86 HE ARG 86 -16.637 3.708 2.900 684 HH11 ARG 86 1HH1 ARG 86 -18.274 2.151 3.003 685 HH12 ARG 86 2HH1 ARG 86 -19.258 2.041 4.423 686 HH21 ARG 86 1HH2 ARG 86 -17.648 4.636 6.062 687 HH22 ARG 86 2HH2 ARG 86 -18.904 3.448 6.155 688 H ILE 87 H ILE 87 -11.937 7.269 1.289 689 HA ILE 87 HA ILE 87 -11.015 8.080 4.002 690 HB ILE 87 HB ILE 87 -9.168 6.903 2.716 691 HG12 ILE 87 2HG1 ILE 87 -8.568 9.831 3.190 692 HG13 ILE 87 1HG1 ILE 87 -8.889 8.721 4.521 693 HG21 ILE 87 1HG2 ILE 87 -10.069 8.224 0.561 694 HG22 ILE 87 2HG2 ILE 87 -8.383 7.727 0.713 695 HG23 ILE 87 3HG2 ILE 87 -8.852 9.385 1.090 696 HD11 ILE 87 1HD1 ILE 87 -6.427 9.127 3.212 697 HD12 ILE 87 2HD1 ILE 87 -6.992 7.544 2.679 698 HD13 ILE 87 3HD1 ILE 87 -6.804 7.880 4.400 699 H ASP 88 H ASP 88 -10.729 10.383 4.220 700 HA ASP 88 HA ASP 88 -12.367 11.915 2.299 701 HB2 ASP 88 2HB ASP 88 -12.643 12.164 4.788 702 HB3 ASP 88 1HB ASP 88 -11.029 12.876 4.844 703 H GLY 89 H GLY 89 -11.590 13.708 1.129 704 HA2 GLY 89 2HA GLY 89 -8.902 13.549 0.167 705 HA3 GLY 89 1HA GLY 89 -10.008 14.884 -0.140 706 H HIS 90 H HIS 90 -10.344 15.361 2.803 707 HA HIS 90 HA HIS 90 -7.963 17.057 3.105 708 HB2 HIS 90 2HB HIS 90 -10.526 16.789 4.679 709 HB3 HIS 90 1HB HIS 90 -9.225 17.879 5.139 710 HD1 HIS 90 1HD HIS 90 -8.388 18.962 2.398 711 HD2 HIS 90 2HD HIS 90 -12.364 18.543 3.577 712 HE1 HIS 90 1HE HIS 90 -9.733 20.561 0.963 713 HE2 HIS 90 2HE HIS 90 -12.157 20.312 1.671 714 H TRP 91 H TRP 91 -8.070 13.978 3.517 715 HA TRP 91 HA TRP 91 -7.067 12.438 4.979 716 HB2 TRP 91 2HB TRP 91 -5.605 15.000 5.406 717 HB3 TRP 91 1HB TRP 91 -5.361 13.730 6.607 718 HD1 TRP 91 HD TRP 91 -3.980 14.878 3.465 719 HE1 TRP 91 1HE TRP 91 -2.652 13.016 2.273 720 HE3 TRP 91 3HE TRP 91 -5.595 10.817 6.103 721 HZ2 TRP 91 2HZ TRP 91 -2.322 10.177 2.420 722 HZ3 TRP 91 3HZ TRP 91 -4.761 8.548 5.558 723 HH2 TRP 91 HH TRP 91 -3.127 8.223 3.722 724 H GLN 92 H GLN 92 -9.525 14.020 5.777 725 HA GLN 92 HA GLN 92 -9.286 14.119 8.718 726 HB2 GLN 92 2HB GLN 92 -11.636 14.640 6.866 727 HB3 GLN 92 1HB GLN 92 -11.627 14.932 8.607 728 HG2 GLN 92 2HG GLN 92 -9.800 16.542 8.348 729 HG3 GLN 92 1HG GLN 92 -9.730 16.219 6.630 730 HE21 GLN 92 1HE2 GLN 92 -12.953 16.003 7.369 731 HE22 GLN 92 2HE2 GLN 92 -13.424 17.609 7.083 732 H SER 93 H SER 93 -12.359 13.127 7.668 733 HA SER 93 HA SER 93 -11.800 10.246 7.869 734 HB2 SER 93 2HB SER 93 -13.046 9.843 9.849 735 HB3 SER 93 1HB SER 93 -12.018 11.215 10.243 736 HG SER 93 HG SER 93 -14.386 11.931 9.081 737 H VAL 94 H VAL 94 -13.694 8.972 7.261 738 HA VAL 94 HA VAL 94 -15.921 10.575 6.078 739 HB VAL 94 HB VAL 94 -15.648 8.415 4.369 740 HG11 VAL 94 1HG1 VAL 94 -14.594 10.212 2.850 741 HG12 VAL 94 2HG1 VAL 94 -14.737 11.291 4.238 742 HG13 VAL 94 3HG1 VAL 94 -16.182 10.566 3.530 743 HG21 VAL 94 1HG2 VAL 94 -13.283 8.397 3.713 744 HG22 VAL 94 2HG2 VAL 94 -13.442 7.911 5.401 745 HG23 VAL 94 3HG2 VAL 94 -12.901 9.541 4.999 746 HA PRO 95 HA PRO 95 -17.573 7.336 8.968 747 HB2 PRO 95 2HB PRO 95 -19.934 9.115 8.581 748 HB3 PRO 95 1HB PRO 95 -19.257 8.446 10.077 749 HG2 PRO 95 2HG PRO 95 -18.927 11.008 9.403 750 HG3 PRO 95 1HG PRO 95 -17.677 10.091 10.260 751 HD2 PRO 95 2HD PRO 95 -17.749 10.959 7.408 752 HD3 PRO 95 1HD PRO 95 -16.351 10.697 8.475 753 H ASP 96 H ASP 96 -18.623 8.520 5.848 754 HA ASP 96 HA ASP 96 -19.846 5.874 5.316 755 HB2 ASP 96 2HB ASP 96 -21.673 7.452 6.037 756 HB3 ASP 96 1HB ASP 96 -21.268 8.454 4.645 757 H ASP 97 H ASP 97 -19.741 5.299 3.093 758 HA ASP 97 HA ASP 97 -17.768 6.850 1.559 759 HB2 ASP 97 2HB ASP 97 -17.971 4.952 -0.066 760 HB3 ASP 97 1HB ASP 97 -17.544 4.428 1.564 761 H ASP 98 H ASP 98 -18.715 8.682 0.689 762 HA ASP 98 HA ASP 98 -21.394 8.548 -0.503 763 HB2 ASP 98 2HB ASP 98 -20.434 10.568 0.727 764 HB3 ASP 98 1HB ASP 98 -19.428 10.825 -0.694 765 H ARG 99 H ARG 99 -18.119 9.309 -1.670 766 HA ARG 99 HA ARG 99 -18.935 8.266 -4.348 767 HB2 ARG 99 2HB ARG 99 -17.185 10.661 -3.724 768 HB3 ARG 99 1HB ARG 99 -17.434 9.996 -5.338 769 HG2 ARG 99 2HG ARG 99 -19.886 10.379 -5.074 770 HG3 ARG 99 1HG ARG 99 -19.567 11.148 -3.518 771 HD2 ARG 99 2HD ARG 99 -18.038 12.756 -4.721 772 HD3 ARG 99 1HD ARG 99 -18.609 12.068 -6.240 773 HE ARG 99 HE ARG 99 -20.887 12.825 -4.720 774 HH11 ARG 99 1HH1 ARG 99 -21.920 14.779 -5.194 775 HH12 ARG 99 2HH1 ARG 99 -21.056 16.016 -6.046 776 HH21 ARG 99 1HH2 ARG 99 -18.133 14.167 -6.301 777 HH22 ARG 99 2HH2 ARG 99 -18.911 15.669 -6.673 778 H ALA 100 H ALA 100 -17.488 7.014 -2.017 779 HA ALA 100 HA ALA 100 -14.687 6.876 -2.624 780 HB1 ALA 100 1HB ALA 100 -14.575 5.187 -1.014 781 HB2 ALA 100 2HB ALA 100 -16.172 4.557 -1.421 782 HB3 ALA 100 3HB ALA 100 -16.022 6.063 -0.514 783 H SER 101 H SER 101 -13.525 5.313 -3.812 784 HA SER 101 HA SER 101 -15.147 3.887 -5.870 785 HB2 SER 101 2HB SER 101 -13.457 5.556 -6.659 786 HB3 SER 101 1HB SER 101 -12.196 4.583 -5.909 787 HG SER 101 HG SER 101 -13.953 3.877 -8.021 788 H GLU 102 H GLU 102 -14.157 1.760 -6.607 789 HA GLU 102 HA GLU 102 -13.188 0.259 -4.212 790 HB2 GLU 102 2HB GLU 102 -14.612 -0.751 -6.693 791 HB3 GLU 102 1HB GLU 102 -14.133 -1.736 -5.310 792 HG2 GLU 102 2HG GLU 102 -15.564 -0.338 -3.840 793 HG3 GLU 102 1HG GLU 102 -16.082 0.586 -5.251 794 H ILE 103 H ILE 103 -11.487 -1.246 -4.475 795 HA ILE 103 HA ILE 103 -9.822 -0.806 -6.926 796 HB ILE 103 HB ILE 103 -8.903 -1.558 -4.136 797 HG12 ILE 103 2HG1 ILE 103 -8.630 1.105 -5.559 798 HG13 ILE 103 1HG1 ILE 103 -9.872 0.769 -4.351 799 HG21 ILE 103 1HG2 ILE 103 -7.658 -1.541 -6.746 800 HG22 ILE 103 2HG2 ILE 103 -7.000 -2.094 -5.206 801 HG23 ILE 103 3HG2 ILE 103 -6.850 -0.400 -5.673 802 HD11 ILE 103 1HD1 ILE 103 -8.041 1.809 -3.192 803 HD12 ILE 103 2HD1 ILE 103 -6.870 0.737 -3.959 804 HD13 ILE 103 3HD1 ILE 103 -8.006 0.095 -2.771 805 H GLU 104 H GLU 104 -9.093 -2.647 -8.005 806 HA GLU 104 HA GLU 104 -9.964 -5.266 -6.841 807 HB2 GLU 104 2HB GLU 104 -11.033 -4.611 -9.013 808 HB3 GLU 104 1HB GLU 104 -9.431 -4.605 -9.752 809 HG2 GLU 104 2HG GLU 104 -9.142 -6.986 -9.062 810 HG3 GLU 104 1HG GLU 104 -10.793 -6.977 -8.441 811 H VAL 105 H VAL 105 -8.316 -6.517 -6.155 812 HA VAL 105 HA VAL 105 -5.675 -6.266 -7.523 813 HB VAL 105 HB VAL 105 -6.094 -6.743 -4.560 814 HG11 VAL 105 1HG1 VAL 105 -3.667 -6.300 -6.311 815 HG12 VAL 105 2HG1 VAL 105 -4.023 -7.696 -5.294 816 HG13 VAL 105 3HG1 VAL 105 -3.617 -6.147 -4.555 817 HG21 VAL 105 1HG2 VAL 105 -6.573 -4.511 -4.561 818 HG22 VAL 105 2HG2 VAL 105 -5.894 -4.267 -6.170 819 HG23 VAL 105 3HG2 VAL 105 -4.831 -4.332 -4.765 820 H ASP 106 H ASP 106 -4.893 -8.231 -8.208 821 HA ASP 106 HA ASP 106 -6.224 -10.673 -7.102 822 HB2 ASP 106 2HB ASP 106 -5.091 -10.166 -9.865 823 HB3 ASP 106 1HB ASP 106 -5.699 -11.725 -9.305 824 H PHE 107 H PHE 107 -4.887 -12.171 -6.177 825 HA PHE 107 HA PHE 107 -1.948 -11.847 -6.632 826 HB2 PHE 107 2HB PHE 107 -3.533 -12.124 -4.143 827 HB3 PHE 107 1HB PHE 107 -2.043 -13.066 -4.219 828 HD1 PHE 107 1HD PHE 107 0.134 -11.923 -4.673 829 HD2 PHE 107 2HD PHE 107 -3.490 -9.739 -3.941 830 HE1 PHE 107 1HE PHE 107 1.459 -9.878 -4.221 831 HE2 PHE 107 2HE PHE 107 -2.167 -7.693 -3.489 832 HZ PHE 107 HZ PHE 107 0.314 -7.765 -3.629 833 H VAL 108 H VAL 108 -1.133 -13.554 -7.687 834 HA VAL 108 HA VAL 108 -2.203 -16.266 -7.060 835 HB VAL 108 HB VAL 108 -2.664 -16.761 -9.256 836 HG11 VAL 108 1HG1 VAL 108 -3.631 -14.879 -10.416 837 HG12 VAL 108 2HG1 VAL 108 -2.610 -13.746 -9.529 838 HG13 VAL 108 3HG1 VAL 108 -3.884 -14.630 -8.689 839 HG21 VAL 108 1HG2 VAL 108 -0.357 -14.912 -9.923 840 HG22 VAL 108 2HG2 VAL 108 -1.386 -15.631 -11.161 841 HG23 VAL 108 3HG2 VAL 108 -0.424 -16.666 -10.108 842 HA PRO 109 HA PRO 109 2.050 -17.336 -6.549 843 HB2 PRO 109 2HB PRO 109 2.087 -19.851 -7.758 844 HB3 PRO 109 1HB PRO 109 1.607 -19.525 -6.085 845 HG2 PRO 109 2HG PRO 109 -0.067 -20.005 -8.473 846 HG3 PRO 109 1HG PRO 109 -0.365 -20.422 -6.777 847 HD2 PRO 109 2HD PRO 109 -1.614 -18.341 -8.023 848 HD3 PRO 109 1HD PRO 109 -1.259 -18.347 -6.281 849 H ASN 110 H ASN 110 3.807 -16.677 -7.705 850 HA ASN 110 HA ASN 110 3.755 -17.025 -10.671 851 HB2 ASN 110 2HB ASN 110 3.579 -14.651 -9.901 852 HB3 ASN 110 1HB ASN 110 5.142 -14.842 -9.110 853 HD21 ASN 110 1HD2 ASN 110 3.605 -15.155 -12.350 854 HD22 ASN 110 2HD2 ASN 110 5.004 -14.742 -13.217 855 H GLY 111 H GLY 111 5.230 -18.548 -11.262 856 HA2 GLY 111 2HA GLY 111 7.196 -19.835 -11.259 857 HA3 GLY 111 1HA GLY 111 7.993 -18.390 -10.630 858 H SER 112 H SER 112 9.165 -19.117 -8.892 859 HA SER 112 HA SER 112 7.653 -20.604 -6.784 860 HB2 SER 112 2HB SER 112 10.552 -20.981 -7.546 861 HB3 SER 112 1HB SER 112 9.726 -21.806 -6.231 862 HG SER 112 HG SER 112 9.898 -22.843 -8.440 863 H GLY 113 H GLY 113 7.877 -19.782 -4.724 864 HA2 GLY 113 2HA GLY 113 8.560 -18.337 -3.009 865 HA3 GLY 113 1HA GLY 113 10.106 -18.207 -3.847 866 H GLY 114 H GLY 114 7.371 -17.387 -5.768 867 HA2 GLY 114 2HA GLY 114 7.565 -14.523 -5.052 868 HA3 GLY 114 1HA GLY 114 8.016 -14.968 -6.695 869 H THR 115 H THR 115 5.783 -13.266 -5.903 870 HA THR 115 HA THR 115 3.584 -14.864 -7.127 871 HB THR 115 HB THR 115 3.301 -14.573 -4.618 872 HG1 THR 115 1HG THR 115 1.119 -13.591 -4.981 873 HG21 THR 115 1HG2 THR 115 2.436 -11.777 -5.047 874 HG22 THR 115 2HG2 THR 115 4.179 -12.041 -5.064 875 HG23 THR 115 3HG2 THR 115 3.231 -12.512 -3.656 876 H ARG 116 H ARG 116 2.310 -13.718 -8.589 877 HA ARG 116 HA ARG 116 3.249 -10.941 -9.201 878 HB2 ARG 116 2HB ARG 116 3.664 -12.644 -10.989 879 HB3 ARG 116 1HB ARG 116 1.926 -12.938 -11.066 880 HG2 ARG 116 2HG ARG 116 1.534 -10.590 -11.670 881 HG3 ARG 116 1HG ARG 116 3.264 -10.260 -11.553 882 HD2 ARG 116 2HD ARG 116 2.750 -10.608 -13.885 883 HD3 ARG 116 1HD ARG 116 3.634 -12.025 -13.319 884 HE ARG 116 HE ARG 116 0.891 -12.590 -12.970 885 HH11 ARG 116 1HH1 ARG 116 -0.219 -13.790 -14.531 886 HH12 ARG 116 2HH1 ARG 116 0.400 -13.866 -16.147 887 HH21 ARG 116 1HH2 ARG 116 3.144 -11.855 -15.475 888 HH22 ARG 116 2HH2 ARG 116 2.303 -12.770 -16.682 889 H VAL 117 H VAL 117 1.744 -9.353 -8.953 890 HA VAL 117 HA VAL 117 -1.117 -10.192 -8.827 891 HB VAL 117 HB VAL 117 -0.713 -9.725 -6.591 892 HG11 VAL 117 1HG1 VAL 117 1.514 -9.057 -6.486 893 HG12 VAL 117 2HG1 VAL 117 0.690 -7.556 -6.061 894 HG13 VAL 117 3HG1 VAL 117 1.299 -7.794 -7.700 895 HG21 VAL 117 1HG2 VAL 117 -1.889 -7.738 -6.118 896 HG22 VAL 117 2HG2 VAL 117 -2.427 -8.131 -7.749 897 HG23 VAL 117 3HG2 VAL 117 -1.200 -6.892 -7.501 898 H GLU 118 H GLU 118 -2.614 -8.902 -9.792 899 HA GLU 118 HA GLU 118 -1.567 -6.628 -11.419 900 HB2 GLU 118 2HB GLU 118 -2.649 -8.421 -12.710 901 HB3 GLU 118 1HB GLU 118 -4.086 -8.306 -11.698 902 HG2 GLU 118 2HG GLU 118 -4.402 -5.954 -12.455 903 HG3 GLU 118 1HG GLU 118 -3.013 -6.131 -13.520 904 H LEU 119 H LEU 119 -2.017 -4.656 -10.552 905 HA LEU 119 HA LEU 119 -4.463 -4.395 -8.861 906 HB2 LEU 119 2HB LEU 119 -2.205 -4.013 -7.759 907 HB3 LEU 119 1HB LEU 119 -2.017 -2.610 -8.808 908 HG LEU 119 HG LEU 119 -4.578 -2.781 -7.302 909 HD11 LEU 119 1HD1 LEU 119 -3.573 -1.951 -5.236 910 HD12 LEU 119 2HD1 LEU 119 -1.963 -2.048 -5.952 911 HD13 LEU 119 3HD1 LEU 119 -2.877 -3.522 -5.634 912 HD21 LEU 119 1HD2 LEU 119 -2.557 -0.594 -7.886 913 HD22 LEU 119 2HD2 LEU 119 -4.096 -0.344 -7.062 914 HD23 LEU 119 3HD2 LEU 119 -4.072 -0.868 -8.745 915 H ALA 120 H ALA 120 -6.050 -3.191 -9.758 916 HA ALA 120 HA ALA 120 -5.270 -1.031 -11.669 917 HB1 ALA 120 1HB ALA 120 -7.342 -3.194 -12.004 918 HB2 ALA 120 2HB ALA 120 -6.068 -2.710 -13.124 919 HB3 ALA 120 3HB ALA 120 -7.466 -1.665 -12.874 920 H HIS 121 H HIS 121 -6.372 0.870 -11.383 921 HA HIS 121 HA HIS 121 -8.604 0.872 -9.387 922 HB2 HIS 121 2HB HIS 121 -7.527 2.458 -8.194 923 HB3 HIS 121 1HB HIS 121 -6.115 2.190 -9.215 924 HD1 HIS 121 1HD HIS 121 -9.437 4.049 -9.685 925 HD2 HIS 121 2HD HIS 121 -5.353 4.578 -10.350 926 HE1 HIS 121 1HE HIS 121 -9.177 6.319 -10.778 927 HE2 HIS 121 2HE HIS 121 -6.694 6.659 -11.168 928 H VAL 122 H VAL 122 -10.457 1.964 -10.026 929 HA VAL 122 HA VAL 122 -10.288 3.606 -12.504 930 HB VAL 122 HB VAL 122 -12.336 2.511 -13.367 931 HG11 VAL 122 1HG1 VAL 122 -11.147 0.826 -14.379 932 HG12 VAL 122 2HG1 VAL 122 -10.513 0.215 -12.850 933 HG13 VAL 122 3HG1 VAL 122 -9.793 1.642 -13.597 934 HG21 VAL 122 1HG2 VAL 122 -12.739 0.186 -12.194 935 HG22 VAL 122 2HG2 VAL 122 -13.473 1.643 -11.522 936 HG23 VAL 122 3HG2 VAL 122 -12.002 0.983 -10.803 937 H LYS 123 H LYS 123 -11.822 5.245 -12.635 938 HA LYS 123 HA LYS 123 -13.282 6.879 -11.833 939 HB2 LYS 123 2HB LYS 123 -14.472 4.510 -10.366 940 HB3 LYS 123 1HB LYS 123 -15.267 6.058 -10.646 941 HG2 LYS 123 2HG LYS 123 -15.043 5.706 -13.096 942 HG3 LYS 123 1HG LYS 123 -14.329 4.123 -12.783 943 HD2 LYS 123 2HD LYS 123 -16.405 3.508 -11.516 944 HD3 LYS 123 1HD LYS 123 -17.117 5.037 -12.034 945 HE2 LYS 123 2HE LYS 123 -16.680 4.347 -14.417 946 HE3 LYS 123 1HE LYS 123 -16.184 2.766 -13.810 947 HZ1 LYS 123 1HZ LYS 123 -18.806 3.814 -14.180 948 HZ2 LYS 123 2HZ LYS 123 -18.580 3.280 -12.583 949 HZ3 LYS 123 3HZ LYS 123 -18.319 2.217 -13.882 950 H LEU 124 H LEU 124 -10.806 6.260 -10.199 951 HA LEU 124 HA LEU 124 -11.545 6.557 -7.411 952 HB2 LEU 124 2HB LEU 124 -9.293 5.745 -8.160 953 HB3 LEU 124 1HB LEU 124 -8.952 7.368 -8.765 954 HG LEU 124 HG LEU 124 -9.420 8.232 -6.429 955 HD11 LEU 124 1HD1 LEU 124 -10.354 6.785 -4.977 956 HD12 LEU 124 2HD1 LEU 124 -8.817 5.924 -4.942 957 HD13 LEU 124 3HD1 LEU 124 -10.079 5.427 -6.067 958 HD21 LEU 124 1HD2 LEU 124 -7.163 6.229 -6.743 959 HD22 LEU 124 2HD2 LEU 124 -7.212 7.546 -5.571 960 HD23 LEU 124 3HD2 LEU 124 -7.129 7.903 -7.297 961 H HIS 125 H HIS 125 -10.792 8.758 -10.050 962 HA HIS 125 HA HIS 125 -10.676 11.174 -8.560 963 HB2 HIS 125 2HB HIS 125 -9.948 11.042 -10.898 964 HB3 HIS 125 1HB HIS 125 -11.610 10.740 -11.400 965 HD1 HIS 125 1HD HIS 125 -11.304 13.097 -8.613 966 HD2 HIS 125 2HD HIS 125 -11.391 13.354 -12.775 967 HE1 HIS 125 1HE HIS 125 -11.765 15.519 -9.168 968 HE2 HIS 125 2HE HIS 125 -11.815 15.694 -11.701 969 H ARG 126 H ARG 126 -13.404 9.203 -9.467 970 HA ARG 126 HA ARG 126 -15.499 11.014 -9.608 971 HB2 ARG 126 2HB ARG 126 -16.937 9.272 -8.859 972 HB3 ARG 126 1HB ARG 126 -15.601 8.449 -9.657 973 HG2 ARG 126 2HG ARG 126 -14.505 8.237 -7.381 974 HG3 ARG 126 1HG ARG 126 -16.016 8.817 -6.684 975 HD2 ARG 126 2HD ARG 126 -15.699 6.351 -8.418 976 HD3 ARG 126 1HD ARG 126 -15.975 6.364 -6.676 977 HE ARG 126 HE ARG 126 -18.113 7.799 -7.621 978 HH11 ARG 126 1HH1 ARG 126 -20.054 6.870 -8.316 979 HH12 ARG 126 2HH1 ARG 126 -20.054 5.244 -8.914 980 HH21 ARG 126 1HH2 ARG 126 -16.645 4.793 -8.459 981 HH22 ARG 126 2HH2 ARG 126 -18.124 4.069 -8.995 982 H HIS 127 H HIS 127 -13.576 10.125 -6.815 983 HA HIS 127 HA HIS 127 -15.234 11.166 -4.762 984 HB2 HIS 127 2HB HIS 127 -12.838 9.939 -4.780 985 HB3 HIS 127 1HB HIS 127 -12.296 11.602 -4.560 986 HD1 HIS 127 1HD HIS 127 -14.947 12.404 -2.888 987 HD2 HIS 127 2HD HIS 127 -12.334 9.259 -2.062 988 HE1 HIS 127 1HE HIS 127 -15.216 11.877 -0.423 989 HE2 HIS 127 2HE HIS 127 -13.631 9.964 0.090 990 H GLY 128 H GLY 128 -12.821 12.750 -6.818 991 HA2 GLY 128 2HA GLY 128 -12.249 15.039 -6.989 992 HA3 GLY 128 1HA GLY 128 -13.991 15.184 -7.219 993 H ASP 129 H ASP 129 -12.920 13.995 -4.155 994 HA ASP 129 HA ASP 129 -13.734 16.586 -2.925 995 HB2 ASP 129 2HB ASP 129 -13.573 13.784 -1.776 996 HB3 ASP 129 1HB ASP 129 -14.008 15.218 -0.845 997 H GLY 130 H GLY 130 -10.991 15.496 -4.005 998 HA2 GLY 130 2HA GLY 130 -8.873 16.497 -3.331 999 HA3 GLY 130 1HA GLY 130 -9.448 16.499 -1.662 1000 H ALA 131 H ALA 131 -10.339 13.622 -3.122 1001 HA ALA 131 HA ALA 131 -8.718 11.984 -1.473 1002 HB1 ALA 131 1HB ALA 131 -10.723 11.093 -2.522 1003 HB2 ALA 131 2HB ALA 131 -9.339 10.146 -3.069 1004 HB3 ALA 131 3HB ALA 131 -10.048 11.366 -4.128 1005 H TRP 132 H TRP 132 -8.135 13.348 -4.668 1006 HA TRP 132 HA TRP 132 -5.912 11.784 -5.447 1007 HB2 TRP 132 2HB TRP 132 -6.869 13.363 -7.002 1008 HB3 TRP 132 1HB TRP 132 -6.531 14.711 -5.919 1009 HD1 TRP 132 HD TRP 132 -4.518 16.037 -6.629 1010 HE1 TRP 132 1HE TRP 132 -2.279 15.546 -7.806 1011 HE3 TRP 132 3HE TRP 132 -4.993 11.005 -7.373 1012 HZ2 TRP 132 2HZ TRP 132 -0.876 13.315 -8.914 1013 HZ3 TRP 132 3HZ TRP 132 -3.191 9.726 -8.484 1014 HH2 TRP 132 HH TRP 132 -1.139 10.873 -9.258 1015 H ASN 133 H ASN 133 -6.092 14.605 -3.300 1016 HA ASN 133 HA ASN 133 -3.283 14.934 -2.903 1017 HB2 ASN 133 2HB ASN 133 -5.156 16.496 -2.134 1018 HB3 ASN 133 1HB ASN 133 -5.403 15.385 -0.787 1019 HD21 ASN 133 1HD2 ASN 133 -4.700 17.493 0.432 1020 HD22 ASN 133 2HD2 ASN 133 -3.035 17.692 0.695 1021 H ILE 134 H ILE 134 -5.680 12.868 -1.273 1022 HA ILE 134 HA ILE 134 -3.959 11.836 0.749 1023 HB ILE 134 HB ILE 134 -6.460 10.912 -0.590 1024 HG12 ILE 134 2HG1 ILE 134 -7.318 10.986 1.663 1025 HG13 ILE 134 1HG1 ILE 134 -5.693 11.107 2.333 1026 HG21 ILE 134 1HG2 ILE 134 -6.309 8.843 0.933 1027 HG22 ILE 134 2HG2 ILE 134 -4.576 9.166 0.995 1028 HG23 ILE 134 3HG2 ILE 134 -5.355 8.816 -0.549 1029 HD11 ILE 134 1HD1 ILE 134 -7.132 13.279 2.069 1030 HD12 ILE 134 2HD1 ILE 134 -6.653 13.175 0.376 1031 HD13 ILE 134 3HD1 ILE 134 -5.426 13.323 1.634 1032 H HIS 135 H HIS 135 -4.606 10.727 -2.567 1033 HA HIS 135 HA HIS 135 -2.909 8.432 -2.494 1034 HB2 HIS 135 2HB HIS 135 -4.539 8.897 -4.317 1035 HB3 HIS 135 1HB HIS 135 -3.536 10.245 -4.849 1036 HD1 HIS 135 1HD HIS 135 -1.083 8.001 -3.829 1037 HD2 HIS 135 2HD HIS 135 -3.684 7.990 -7.092 1038 HE1 HIS 135 1HE HIS 135 -0.053 6.466 -5.564 1039 HE2 HIS 135 2HE HIS 135 -1.628 6.453 -7.552 1040 H LYS 136 H LYS 136 -2.299 11.842 -3.177 1041 HA LYS 136 HA LYS 136 0.383 11.636 -4.073 1042 HB2 LYS 136 2HB LYS 136 -1.033 13.703 -4.139 1043 HB3 LYS 136 1HB LYS 136 -0.804 13.855 -2.404 1044 HG2 LYS 136 2HG LYS 136 1.642 13.935 -2.754 1045 HG3 LYS 136 1HG LYS 136 1.373 13.862 -4.491 1046 HD2 LYS 136 2HD LYS 136 -0.018 15.942 -4.305 1047 HD3 LYS 136 1HD LYS 136 0.452 16.046 -2.608 1048 HE2 LYS 136 2HE LYS 136 2.860 16.042 -3.351 1049 HE3 LYS 136 1HE LYS 136 2.288 16.158 -5.015 1050 HZ1 LYS 136 1HZ LYS 136 2.506 18.195 -3.046 1051 HZ2 LYS 136 2HZ LYS 136 0.914 18.095 -3.632 1052 HZ3 LYS 136 3HZ LYS 136 2.204 18.339 -4.709 1053 H ALA 137 H ALA 137 -0.937 11.909 -0.781 1054 HA ALA 137 HA ALA 137 1.620 12.038 0.528 1055 HB1 ALA 137 1HB ALA 137 -0.133 10.832 2.332 1056 HB2 ALA 137 2HB ALA 137 -1.179 11.814 1.307 1057 HB3 ALA 137 3HB ALA 137 0.164 12.562 2.171 1058 H LEU 138 H LEU 138 -0.541 9.335 -0.269 1059 HA LEU 138 HA LEU 138 0.982 7.293 1.015 1060 HB2 LEU 138 2HB LEU 138 -0.775 7.113 -1.447 1061 HB3 LEU 138 1HB LEU 138 -0.235 5.750 -0.481 1062 HG LEU 138 HG LEU 138 -1.949 8.041 0.510 1063 HD11 LEU 138 1HD1 LEU 138 -3.042 5.348 0.681 1064 HD12 LEU 138 2HD1 LEU 138 -2.665 5.785 -0.986 1065 HD13 LEU 138 3HD1 LEU 138 -3.753 6.795 -0.035 1066 HD21 LEU 138 1HD2 LEU 138 -0.881 7.374 2.434 1067 HD22 LEU 138 2HD2 LEU 138 -0.530 5.767 1.801 1068 HD23 LEU 138 3HD2 LEU 138 -2.146 6.146 2.395 1069 H ASP 139 H ASP 139 1.381 9.029 -1.968 1070 HA ASP 139 HA ASP 139 3.195 7.123 -3.191 1071 HB2 ASP 139 2HB ASP 139 1.928 8.810 -4.504 1072 HB3 ASP 139 1HB ASP 139 2.869 10.089 -3.734 1073 H GLY 140 H GLY 140 5.005 6.655 -2.032 1074 HA2 GLY 140 2HA GLY 140 6.493 8.829 -0.685 1075 HA3 GLY 140 1HA GLY 140 6.810 7.102 -0.508 1076 HA PRO 141 HA PRO 141 10.196 8.851 -3.185 1077 HB2 PRO 141 2HB PRO 141 11.434 6.348 -2.149 1078 HB3 PRO 141 1HB PRO 141 12.106 7.987 -2.237 1079 HG2 PRO 141 2HG PRO 141 11.297 6.912 0.072 1080 HG3 PRO 141 1HG PRO 141 11.127 8.641 -0.275 1081 HD2 PRO 141 2HD PRO 141 9.030 6.519 -0.216 1082 HD3 PRO 141 1HD PRO 141 8.896 8.253 0.155 1083 H SER 142 H SER 142 10.888 8.081 -5.240 1084 HA SER 142 HA SER 142 10.774 6.786 -7.196 1085 HB2 SER 142 2HB SER 142 11.672 5.062 -5.450 1086 HB3 SER 142 1HB SER 142 10.038 4.407 -5.502 1087 HG SER 142 HG SER 142 11.774 3.649 -7.075 1088 HA PRO 143 HA PRO 143 6.108 7.292 -6.680 1089 HB2 PRO 143 2HB PRO 143 6.594 8.737 -9.233 1090 HB3 PRO 143 1HB PRO 143 5.612 9.211 -7.836 1091 HG2 PRO 143 2HG PRO 143 7.977 10.343 -8.355 1092 HG3 PRO 143 1HG PRO 143 7.395 10.083 -6.704 1093 HD2 PRO 143 2HD PRO 143 9.504 8.602 -8.209 1094 HD3 PRO 143 1HD PRO 143 9.368 8.915 -6.464 1095 H GLY 144 H GLY 144 4.581 6.029 -7.747 1096 HA2 GLY 144 2HA GLY 144 4.498 5.174 -10.381 1097 HA3 GLY 144 1HA GLY 144 5.566 4.010 -9.593 1098 H GLU 145 H GLU 145 3.560 2.660 -10.382 1099 HA GLU 145 HA GLU 145 1.054 2.788 -9.096 1100 HB2 GLU 145 2HB GLU 145 2.607 0.319 -9.936 1101 HB3 GLU 145 1HB GLU 145 0.882 0.363 -9.575 1102 HG2 GLU 145 2HG GLU 145 0.868 0.614 -11.893 1103 HG3 GLU 145 1HG GLU 145 0.843 2.294 -11.359 1104 H THR 146 H THR 146 0.238 1.599 -7.239 1105 HA THR 146 HA THR 146 1.813 1.824 -4.899 1106 HB THR 146 HB THR 146 -0.582 0.065 -5.445 1107 HG1 THR 146 1HG THR 146 -0.573 2.511 -5.539 1108 HG21 THR 146 1HG2 THR 146 0.989 0.643 -2.961 1109 HG22 THR 146 2HG2 THR 146 0.275 -0.877 -3.503 1110 HG23 THR 146 3HG2 THR 146 -0.752 0.395 -2.840 1111 H LEU 147 H LEU 147 1.293 -0.937 -7.055 1112 HA LEU 147 HA LEU 147 2.517 -2.926 -5.459 1113 HB2 LEU 147 2HB LEU 147 2.617 -2.683 -8.477 1114 HB3 LEU 147 1HB LEU 147 2.812 -4.157 -7.526 1115 HG LEU 147 HG LEU 147 0.317 -2.443 -7.619 1116 HD11 LEU 147 1HD1 LEU 147 -0.089 -3.636 -9.494 1117 HD12 LEU 147 2HD1 LEU 147 -0.273 -5.033 -8.434 1118 HD13 LEU 147 3HD1 LEU 147 1.281 -4.706 -9.197 1119 HD21 LEU 147 1HD2 LEU 147 1.214 -4.744 -5.933 1120 HD22 LEU 147 2HD2 LEU 147 -0.472 -4.717 -6.449 1121 HD23 LEU 147 3HD2 LEU 147 0.183 -3.378 -5.507 1122 H ALA 148 H ALA 148 3.916 -0.422 -7.509 1123 HA ALA 148 HA ALA 148 6.579 -1.445 -7.609 1124 HB1 ALA 148 1HB ALA 148 6.025 1.504 -7.430 1125 HB2 ALA 148 2HB ALA 148 5.478 0.598 -8.841 1126 HB3 ALA 148 3HB ALA 148 7.195 0.654 -8.439 1127 H ARG 149 H ARG 149 5.141 0.954 -5.378 1128 HA ARG 149 HA ARG 149 7.447 1.118 -3.684 1129 HB2 ARG 149 2HB ARG 149 4.533 1.688 -3.120 1130 HB3 ARG 149 1HB ARG 149 5.858 2.127 -2.050 1131 HG2 ARG 149 2HG ARG 149 6.870 3.446 -3.920 1132 HG3 ARG 149 1HG ARG 149 5.440 3.091 -4.892 1133 HD2 ARG 149 2HD ARG 149 5.481 4.577 -2.249 1134 HD3 ARG 149 1HD ARG 149 5.191 5.285 -3.838 1135 HE ARG 149 HE ARG 149 3.273 3.692 -2.282 1136 HH11 ARG 149 1HH1 ARG 149 1.196 3.609 -3.169 1137 HH12 ARG 149 2HH1 ARG 149 0.940 4.155 -4.793 1138 HH21 ARG 149 1HH2 ARG 149 4.262 5.001 -5.315 1139 HH22 ARG 149 2HH2 ARG 149 2.676 4.944 -6.007 1140 H PHE 150 H PHE 150 4.515 -0.865 -3.585 1141 HA PHE 150 HA PHE 150 5.003 -2.113 -1.055 1142 HB2 PHE 150 2HB PHE 150 2.831 -2.192 -2.252 1143 HB3 PHE 150 1HB PHE 150 3.567 -3.200 -3.492 1144 HD1 PHE 150 1HD PHE 150 2.268 -3.088 -0.072 1145 HD2 PHE 150 2HD PHE 150 4.290 -5.503 -2.992 1146 HE1 PHE 150 1HE PHE 150 1.796 -5.117 1.274 1147 HE2 PHE 150 2HE PHE 150 3.819 -7.530 -1.643 1148 HZ PHE 150 HZ PHE 150 2.573 -7.335 0.486 1149 H ALA 151 H ALA 151 5.905 -3.046 -4.378 1150 HA ALA 151 HA ALA 151 7.105 -5.545 -3.664 1151 HB1 ALA 151 1HB ALA 151 7.888 -5.622 -5.864 1152 HB2 ALA 151 2HB ALA 151 8.146 -3.879 -5.938 1153 HB3 ALA 151 3HB ALA 151 6.509 -4.532 -6.015 1154 H ASN 152 H ASN 152 8.418 -2.252 -3.831 1155 HA ASN 152 HA ASN 152 11.157 -2.956 -3.485 1156 HB2 ASN 152 2HB ASN 152 9.670 -0.468 -2.636 1157 HB3 ASN 152 1HB ASN 152 11.425 -0.621 -2.658 1158 HD21 ASN 152 1HD2 ASN 152 10.087 1.305 -4.306 1159 HD22 ASN 152 2HD2 ASN 152 10.282 0.847 -5.929 1160 H VAL 153 H VAL 153 8.730 -2.013 -1.029 1161 HA VAL 153 HA VAL 153 10.532 -2.461 1.172 1162 HB VAL 153 HB VAL 153 8.532 -2.260 2.574 1163 HG11 VAL 153 1HG1 VAL 153 9.546 -0.216 1.615 1164 HG12 VAL 153 2HG1 VAL 153 7.803 -0.039 1.816 1165 HG13 VAL 153 3HG1 VAL 153 8.478 -0.356 0.218 1166 HG21 VAL 153 1HG2 VAL 153 6.312 -1.982 1.486 1167 HG22 VAL 153 2HG2 VAL 153 6.978 -3.594 1.238 1168 HG23 VAL 153 3HG2 VAL 153 7.046 -2.401 -0.060 1169 H ILE 154 H ILE 154 8.087 -4.470 -0.425 1170 HA ILE 154 HA ILE 154 8.536 -6.677 1.452 1171 HB ILE 154 HB ILE 154 6.790 -6.221 -0.941 1172 HG12 ILE 154 2HG1 ILE 154 6.469 -5.763 1.737 1173 HG13 ILE 154 1HG1 ILE 154 5.145 -6.016 0.610 1174 HG21 ILE 154 1HG2 ILE 154 5.938 -8.577 -0.552 1175 HG22 ILE 154 2HG2 ILE 154 7.409 -8.858 0.385 1176 HG23 ILE 154 3HG2 ILE 154 7.515 -8.453 -1.328 1177 HD11 ILE 154 1HD1 ILE 154 6.503 -8.288 2.077 1178 HD12 ILE 154 2HD1 ILE 154 4.984 -8.341 1.178 1179 HD13 ILE 154 3HD1 ILE 154 5.080 -7.457 2.699 Start of MODEL 20 1 H1 MET 1 1HT MET 1 2.953 11.209 -4.862 2 H2 MET 1 2HT MET 1 2.752 12.692 -4.058 3 H3 MET 1 3HT MET 1 4.291 12.215 -4.596 4 HA MET 1 HA MET 1 2.009 13.231 -6.146 5 HB2 MET 1 2HB MET 1 3.923 14.686 -5.400 6 HB3 MET 1 1HB MET 1 4.999 13.679 -6.369 7 HG2 MET 1 2HG MET 1 4.518 15.122 -8.053 8 HG3 MET 1 1HG MET 1 2.990 14.248 -8.159 9 HE1 MET 1 1HE MET 1 3.979 17.855 -5.649 10 HE2 MET 1 2HE MET 1 4.387 18.051 -7.353 11 HE3 MET 1 3HE MET 1 5.031 16.680 -6.452 12 HA PRO 2 HA PRO 2 3.356 9.630 -8.664 13 HB2 PRO 2 2HB PRO 2 0.859 8.470 -8.839 14 HB3 PRO 2 1HB PRO 2 2.039 8.102 -7.573 15 HG2 PRO 2 2HG PRO 2 -0.474 9.502 -7.361 16 HG3 PRO 2 1HG PRO 2 0.605 8.948 -6.077 17 HD2 PRO 2 2HD PRO 2 0.306 11.642 -7.182 18 HD3 PRO 2 1HD PRO 2 1.172 11.128 -5.716 19 H GLU 3 H GLU 3 2.533 9.006 -10.900 20 HA GLU 3 HA GLU 3 2.129 11.175 -12.590 21 HB2 GLU 3 2HB GLU 3 0.917 8.423 -12.952 22 HB3 GLU 3 1HB GLU 3 1.227 9.592 -14.232 23 HG2 GLU 3 2HG GLU 3 3.658 9.512 -13.660 24 HG3 GLU 3 1HG GLU 3 3.307 8.250 -12.477 25 H GLU 4 H GLU 4 0.158 12.072 -13.568 26 HA GLU 4 HA GLU 4 -1.860 12.794 -11.778 27 HB2 GLU 4 2HB GLU 4 -2.149 12.400 -14.776 28 HB3 GLU 4 1HB GLU 4 -3.246 13.336 -13.759 29 HG2 GLU 4 2HG GLU 4 -1.351 14.809 -13.111 30 HG3 GLU 4 1HG GLU 4 -0.301 13.905 -14.203 31 H ILE 5 H ILE 5 -4.037 11.980 -11.446 32 HA ILE 5 HA ILE 5 -4.320 9.308 -10.870 33 HB ILE 5 HB ILE 5 -6.445 11.198 -11.915 34 HG12 ILE 5 2HG1 ILE 5 -5.879 10.235 -9.101 35 HG13 ILE 5 1HG1 ILE 5 -5.229 11.740 -9.755 36 HG21 ILE 5 1HG2 ILE 5 -7.947 9.515 -10.625 37 HG22 ILE 5 2HG2 ILE 5 -6.600 8.393 -10.825 38 HG23 ILE 5 3HG2 ILE 5 -7.402 9.070 -12.243 39 HD11 ILE 5 1HD1 ILE 5 -7.213 12.403 -8.645 40 HD12 ILE 5 2HD1 ILE 5 -8.110 11.004 -9.236 41 HD13 ILE 5 3HD1 ILE 5 -7.683 12.309 -10.343 42 HA PRO 6 HA PRO 6 -4.334 7.846 -15.205 43 HB2 PRO 6 2HB PRO 6 -3.023 5.531 -14.821 44 HB3 PRO 6 1HB PRO 6 -2.169 7.087 -14.797 45 HG2 PRO 6 2HG PRO 6 -2.947 5.323 -12.548 46 HG3 PRO 6 1HG PRO 6 -1.538 6.379 -12.724 47 HD2 PRO 6 2HD PRO 6 -3.908 6.975 -11.292 48 HD3 PRO 6 1HD PRO 6 -2.611 8.111 -11.707 49 H ASP 7 H ASP 7 -5.528 6.109 -16.271 50 HA ASP 7 HA ASP 7 -7.819 5.171 -14.800 51 HB2 ASP 7 2HB ASP 7 -8.355 3.936 -16.851 52 HB3 ASP 7 1HB ASP 7 -7.830 5.567 -17.258 53 H VAL 8 H VAL 8 -7.273 2.443 -16.378 54 HA VAL 8 HA VAL 8 -6.797 0.822 -14.138 55 HB VAL 8 HB VAL 8 -6.355 -0.964 -15.691 56 HG11 VAL 8 1HG1 VAL 8 -8.605 0.494 -15.767 57 HG12 VAL 8 2HG1 VAL 8 -8.351 -0.888 -16.833 58 HG13 VAL 8 3HG1 VAL 8 -8.068 0.748 -17.428 59 HG21 VAL 8 1HG2 VAL 8 -4.637 -0.154 -17.087 60 HG22 VAL 8 2HG2 VAL 8 -5.541 1.302 -17.505 61 HG23 VAL 8 3HG2 VAL 8 -6.020 -0.257 -18.176 62 H ARG 9 H ARG 9 -4.929 0.077 -13.123 63 HA ARG 9 HA ARG 9 -2.456 1.545 -13.776 64 HB2 ARG 9 2HB ARG 9 -3.259 -0.203 -11.448 65 HB3 ARG 9 1HB ARG 9 -1.638 0.459 -11.627 66 HG2 ARG 9 2HG ARG 9 -2.647 2.745 -11.772 67 HG3 ARG 9 1HG ARG 9 -4.221 2.028 -11.425 68 HD2 ARG 9 2HD ARG 9 -3.296 1.112 -9.300 69 HD3 ARG 9 1HD ARG 9 -1.775 1.939 -9.634 70 HE ARG 9 HE ARG 9 -3.507 4.015 -9.747 71 HH11 ARG 9 1HH1 ARG 9 -4.331 5.162 -7.984 72 HH12 ARG 9 2HH1 ARG 9 -4.470 4.379 -6.445 73 HH21 ARG 9 1HH2 ARG 9 -3.196 1.357 -7.568 74 HH22 ARG 9 2HH2 ARG 9 -3.828 2.227 -6.211 75 H LYS 10 H LYS 10 -0.717 -0.596 -12.656 76 HA LYS 10 HA LYS 10 -0.859 -2.532 -14.929 77 HB2 LYS 10 2HB LYS 10 1.511 -2.353 -15.271 78 HB3 LYS 10 1HB LYS 10 0.863 -0.713 -15.251 79 HG2 LYS 10 2HG LYS 10 1.470 -0.568 -12.820 80 HG3 LYS 10 1HG LYS 10 2.260 -2.137 -12.967 81 HD2 LYS 10 2HD LYS 10 3.617 -1.128 -14.877 82 HD3 LYS 10 1HD LYS 10 2.992 0.441 -14.367 83 HE2 LYS 10 2HE LYS 10 4.681 0.518 -12.876 84 HE3 LYS 10 1HE LYS 10 3.855 -0.769 -11.996 85 HZ1 LYS 10 1HZ LYS 10 5.018 -2.325 -13.610 86 HZ2 LYS 10 2HZ LYS 10 5.977 -1.598 -12.410 87 HZ3 LYS 10 3HZ LYS 10 6.011 -1.007 -14.004 88 H SER 11 H SER 11 1.097 -4.234 -14.420 89 HA SER 11 HA SER 11 0.653 -5.174 -11.612 90 HB2 SER 11 2HB SER 11 0.472 -7.422 -12.407 91 HB3 SER 11 1HB SER 11 -0.579 -6.455 -13.436 92 HG SER 11 HG SER 11 1.873 -6.411 -14.454 93 H VAL 12 H VAL 12 2.431 -6.320 -10.674 94 HA VAL 12 HA VAL 12 4.954 -6.371 -12.235 95 HB VAL 12 HB VAL 12 6.188 -5.367 -10.298 96 HG11 VAL 12 1HG1 VAL 12 5.627 -4.027 -12.271 97 HG12 VAL 12 2HG1 VAL 12 5.504 -3.042 -10.813 98 HG13 VAL 12 3HG1 VAL 12 4.043 -3.655 -11.589 99 HG21 VAL 12 1HG2 VAL 12 3.374 -4.698 -9.392 100 HG22 VAL 12 2HG2 VAL 12 4.855 -4.079 -8.660 101 HG23 VAL 12 3HG2 VAL 12 4.485 -5.802 -8.581 102 H VAL 13 H VAL 13 6.605 -7.705 -11.186 103 HA VAL 13 HA VAL 13 5.331 -9.879 -9.592 104 HB VAL 13 HB VAL 13 7.974 -9.888 -11.085 105 HG11 VAL 13 1HG1 VAL 13 6.839 -11.640 -9.136 106 HG12 VAL 13 2HG1 VAL 13 8.327 -11.857 -10.056 107 HG13 VAL 13 3HG1 VAL 13 6.800 -12.469 -10.692 108 HG21 VAL 13 1HG2 VAL 13 5.489 -9.788 -12.231 109 HG22 VAL 13 2HG2 VAL 13 5.705 -11.526 -12.040 110 HG23 VAL 13 3HG2 VAL 13 6.881 -10.589 -12.960 111 H VAL 14 H VAL 14 6.024 -10.282 -7.520 112 HA VAL 14 HA VAL 14 8.421 -8.768 -6.552 113 HB VAL 14 HB VAL 14 7.277 -8.317 -4.472 114 HG11 VAL 14 1HG1 VAL 14 5.149 -7.768 -6.525 115 HG12 VAL 14 2HG1 VAL 14 6.726 -6.992 -6.664 116 HG13 VAL 14 3HG1 VAL 14 5.735 -6.726 -5.229 117 HG21 VAL 14 1HG2 VAL 14 4.796 -9.034 -4.342 118 HG22 VAL 14 2HG2 VAL 14 6.012 -10.286 -4.080 119 HG23 VAL 14 3HG2 VAL 14 5.190 -10.166 -5.637 120 H ALA 15 H ALA 15 9.549 -9.819 -4.756 121 HA ALA 15 HA ALA 15 9.366 -12.758 -4.960 122 HB1 ALA 15 1HB ALA 15 11.308 -11.481 -3.104 123 HB2 ALA 15 2HB ALA 15 11.521 -11.146 -4.822 124 HB3 ALA 15 3HB ALA 15 11.542 -12.811 -4.239 125 H ALA 16 H ALA 16 7.497 -13.274 -3.779 126 HA ALA 16 HA ALA 16 7.808 -13.455 -0.915 127 HB1 ALA 16 1HB ALA 16 7.142 -11.058 -1.123 128 HB2 ALA 16 2HB ALA 16 5.950 -12.019 -0.249 129 HB3 ALA 16 3HB ALA 16 5.659 -11.570 -1.929 130 H SER 17 H SER 17 6.148 -14.826 -0.002 131 HA SER 17 HA SER 17 4.929 -16.605 -1.953 132 HB2 SER 17 2HB SER 17 4.223 -17.901 -0.071 133 HB3 SER 17 1HB SER 17 5.808 -17.261 0.355 134 HG SER 17 HG SER 17 3.269 -16.221 1.099 135 H VAL 18 H VAL 18 2.614 -16.995 -2.145 136 HA VAL 18 HA VAL 18 1.061 -14.619 -2.375 137 HB VAL 18 HB VAL 18 -0.387 -17.193 -2.032 138 HG11 VAL 18 1HG1 VAL 18 -0.416 -15.609 -4.546 139 HG12 VAL 18 2HG1 VAL 18 -1.043 -14.804 -3.110 140 HG13 VAL 18 3HG1 VAL 18 -1.756 -16.321 -3.652 141 HG21 VAL 18 1HG2 VAL 18 1.418 -18.242 -3.071 142 HG22 VAL 18 2HG2 VAL 18 1.886 -16.789 -3.953 143 HG23 VAL 18 3HG2 VAL 18 0.480 -17.718 -4.468 144 H GLU 19 H GLU 19 1.124 -17.157 0.112 145 HA GLU 19 HA GLU 19 -1.033 -16.238 1.696 146 HB2 GLU 19 2HB GLU 19 0.234 -18.373 2.065 147 HB3 GLU 19 1HB GLU 19 1.567 -17.419 2.717 148 HG2 GLU 19 2HG GLU 19 0.014 -16.478 4.425 149 HG3 GLU 19 1HG GLU 19 -1.257 -17.538 3.813 150 H HIS 20 H HIS 20 2.332 -15.173 1.531 151 HA HIS 20 HA HIS 20 2.283 -13.413 3.780 152 HB2 HIS 20 2HB HIS 20 4.423 -13.076 3.157 153 HB3 HIS 20 1HB HIS 20 4.126 -14.118 1.767 154 HD1 HIS 20 1HD HIS 20 2.887 -12.740 -0.330 155 HD2 HIS 20 2HD HIS 20 5.128 -10.514 2.394 156 HE1 HIS 20 1HE HIS 20 3.412 -10.533 -1.463 157 HE2 HIS 20 2HE HIS 20 4.764 -9.172 0.190 158 H CYS 21 H CYS 21 1.383 -12.957 0.379 159 HA CYS 21 HA CYS 21 1.040 -10.179 0.312 160 HB2 CYS 21 2HB CYS 21 -0.820 -12.200 -0.971 161 HB3 CYS 21 1HB CYS 21 -0.488 -10.561 -1.523 162 HG CYS 21 HG CYS 21 1.661 -12.835 -1.582 163 H PHE 22 H PHE 22 -1.572 -12.550 0.987 164 HA PHE 22 HA PHE 22 -3.378 -10.478 1.888 165 HB2 PHE 22 2HB PHE 22 -3.673 -13.362 2.671 166 HB3 PHE 22 1HB PHE 22 -4.922 -12.200 2.218 167 HD1 PHE 22 1HD PHE 22 -5.193 -11.513 -0.181 168 HD2 PHE 22 2HD PHE 22 -2.469 -14.605 1.027 169 HE1 PHE 22 1HE PHE 22 -5.025 -12.284 -2.529 170 HE2 PHE 22 2HE PHE 22 -2.304 -15.379 -1.316 171 HZ PHE 22 HZ PHE 22 -3.576 -14.216 -3.098 172 H GLU 23 H GLU 23 -1.183 -12.709 3.508 173 HA GLU 23 HA GLU 23 -2.079 -12.159 6.183 174 HB2 GLU 23 2HB GLU 23 -0.681 -14.126 5.503 175 HB3 GLU 23 1HB GLU 23 0.674 -13.026 5.277 176 HG2 GLU 23 2HG GLU 23 0.454 -12.314 7.651 177 HG3 GLU 23 1HG GLU 23 -0.817 -13.514 7.858 178 H VAL 24 H VAL 24 0.325 -10.637 4.078 179 HA VAL 24 HA VAL 24 1.577 -9.017 6.053 180 HB VAL 24 HB VAL 24 1.327 -8.936 3.079 181 HG11 VAL 24 1HG1 VAL 24 2.793 -6.821 3.221 182 HG12 VAL 24 2HG1 VAL 24 2.147 -6.638 4.852 183 HG13 VAL 24 3HG1 VAL 24 1.058 -6.622 3.464 184 HG21 VAL 24 1HG2 VAL 24 3.624 -8.887 5.064 185 HG22 VAL 24 2HG2 VAL 24 3.813 -8.899 3.312 186 HG23 VAL 24 3HG2 VAL 24 3.082 -10.280 4.128 187 H PHE 25 H PHE 25 -1.180 -8.245 3.879 188 HA PHE 25 HA PHE 25 -1.514 -5.565 4.777 189 HB2 PHE 25 2HB PHE 25 -3.893 -7.288 4.149 190 HB3 PHE 25 1HB PHE 25 -3.608 -5.600 3.736 191 HD1 PHE 25 1HD PHE 25 -0.893 -5.695 2.579 192 HD2 PHE 25 2HD PHE 25 -4.211 -8.378 2.129 193 HE1 PHE 25 1HE PHE 25 -0.015 -6.400 0.367 194 HE2 PHE 25 2HE PHE 25 -3.336 -9.088 -0.088 195 HZ PHE 25 HZ PHE 25 -1.238 -8.097 -0.967 196 H THR 26 H THR 26 -3.043 -8.561 5.941 197 HA THR 26 HA THR 26 -4.387 -7.174 8.119 198 HB THR 26 HB THR 26 -5.201 -9.376 8.723 199 HG1 THR 26 1HG THR 26 -3.116 -10.390 8.321 200 HG21 THR 26 1HG2 THR 26 -6.053 -10.123 6.444 201 HG22 THR 26 2HG2 THR 26 -5.049 -8.849 5.751 202 HG23 THR 26 3HG2 THR 26 -6.360 -8.437 6.857 203 H SER 27 H SER 27 -1.290 -8.751 7.737 204 HA SER 27 HA SER 27 -0.862 -9.379 10.511 205 HB2 SER 27 2HB SER 27 0.568 -10.390 8.863 206 HB3 SER 27 1HB SER 27 1.081 -8.815 8.272 207 HG SER 27 HG SER 27 2.645 -9.192 9.664 208 H ARG 28 H ARG 28 0.421 -6.636 8.583 209 HA ARG 28 HA ARG 28 -0.164 -4.614 10.460 210 HB2 ARG 28 2HB ARG 28 2.310 -4.391 11.325 211 HB3 ARG 28 1HB ARG 28 1.197 -5.484 12.145 212 HG2 ARG 28 2HG ARG 28 2.228 -7.379 11.323 213 HG3 ARG 28 1HG ARG 28 2.749 -6.579 9.841 214 HD2 ARG 28 2HD ARG 28 4.706 -7.006 11.209 215 HD3 ARG 28 1HD ARG 28 4.403 -5.268 11.205 216 HE ARG 28 HE ARG 28 3.034 -6.287 13.438 217 HH11 ARG 28 1HH1 ARG 28 3.998 -6.254 15.483 218 HH12 ARG 28 2HH1 ARG 28 5.723 -6.179 15.612 219 HH21 ARG 28 1HH2 ARG 28 6.242 -6.140 12.183 220 HH22 ARG 28 2HH2 ARG 28 6.994 -6.114 13.744 221 HA PRO 29 HA PRO 29 1.498 -3.353 6.312 222 HB2 PRO 29 2HB PRO 29 -0.334 -1.090 6.872 223 HB3 PRO 29 1HB PRO 29 -0.202 -2.102 5.425 224 HG2 PRO 29 2HG PRO 29 -2.242 -2.330 7.146 225 HG3 PRO 29 1HG PRO 29 -1.587 -3.715 6.257 226 HD2 PRO 29 2HD PRO 29 -1.237 -2.990 9.134 227 HD3 PRO 29 1HD PRO 29 -1.295 -4.593 8.373 228 H ALA 30 H ALA 30 1.349 -1.786 9.415 229 HA ALA 30 HA ALA 30 2.784 0.614 8.780 230 HB1 ALA 30 1HB ALA 30 2.147 0.947 10.917 231 HB2 ALA 30 2HB ALA 30 3.489 -0.091 11.399 232 HB3 ALA 30 3HB ALA 30 1.880 -0.778 11.167 233 H ASP 31 H ASP 31 3.770 -2.656 8.926 234 HA ASP 31 HA ASP 31 6.437 -2.488 9.822 235 HB2 ASP 31 2HB ASP 31 5.165 -4.586 9.174 236 HB3 ASP 31 1HB ASP 31 5.509 -4.182 7.492 237 H TRP 32 H TRP 32 5.035 -1.495 6.741 238 HA TRP 32 HA TRP 32 7.685 -0.323 6.036 239 HB2 TRP 32 2HB TRP 32 6.910 -0.997 3.579 240 HB3 TRP 32 1HB TRP 32 7.814 -2.122 4.593 241 HD1 TRP 32 HD TRP 32 6.719 -4.369 5.051 242 HE1 TRP 32 1HE TRP 32 4.369 -5.372 4.749 243 HE3 TRP 32 3HE TRP 32 4.177 -0.205 3.584 244 HZ2 TRP 32 2HZ TRP 32 1.757 -4.517 3.988 245 HZ3 TRP 32 3HZ TRP 32 1.756 -0.322 3.079 246 HH2 TRP 32 HH TRP 32 0.541 -2.475 3.276 247 H TRP 33 H TRP 33 4.488 0.264 6.604 248 HA TRP 33 HA TRP 33 3.712 1.924 4.428 249 HB2 TRP 33 2HB TRP 33 2.398 1.127 6.602 250 HB3 TRP 33 1HB TRP 33 2.889 2.715 7.190 251 HD1 TRP 33 HD TRP 33 2.172 4.847 5.643 252 HE1 TRP 33 1HE TRP 33 0.086 5.180 4.165 253 HE3 TRP 33 3HE TRP 33 0.669 -0.005 5.132 254 HZ2 TRP 33 2HZ TRP 33 -1.952 3.596 2.931 255 HZ3 TRP 33 3HZ TRP 33 -1.346 -0.566 3.803 256 HH2 TRP 33 HH TRP 33 -2.657 1.228 2.701 257 HA PRO 34 HA PRO 34 5.808 5.493 7.015 258 HB2 PRO 34 2HB PRO 34 8.102 4.071 8.205 259 HB3 PRO 34 1HB PRO 34 6.974 5.215 8.955 260 HG2 PRO 34 2HG PRO 34 6.938 2.602 9.531 261 HG3 PRO 34 1HG PRO 34 5.460 3.581 9.489 262 HD2 PRO 34 2HD PRO 34 6.506 1.659 7.437 263 HD3 PRO 34 1HD PRO 34 4.834 1.925 7.975 264 HA PRO 35 HA PRO 35 8.766 5.150 3.545 265 HB2 PRO 35 2HB PRO 35 8.371 7.617 2.502 266 HB3 PRO 35 1HB PRO 35 7.219 6.290 2.254 267 HG2 PRO 35 2HG PRO 35 7.043 8.636 4.047 268 HG3 PRO 35 1HG PRO 35 5.764 7.762 3.196 269 HD2 PRO 35 2HD PRO 35 6.427 7.462 5.914 270 HD3 PRO 35 1HD PRO 35 5.412 6.364 4.958 271 H SER 36 H SER 36 10.734 6.458 2.901 272 HA SER 36 HA SER 36 12.362 7.121 5.109 273 HB2 SER 36 2HB SER 36 13.177 6.649 2.779 274 HB3 SER 36 1HB SER 36 12.619 8.251 2.305 275 HG SER 36 HG SER 36 14.312 7.910 4.531 276 H HIS 37 H HIS 37 10.139 9.107 3.244 277 HA HIS 37 HA HIS 37 10.930 11.498 4.842 278 HB2 HIS 37 2HB HIS 37 9.061 11.311 2.456 279 HB3 HIS 37 1HB HIS 37 9.655 12.792 3.208 280 HD1 HIS 37 1HD HIS 37 12.407 13.001 3.192 281 HD2 HIS 37 2HD HIS 37 10.694 10.403 0.415 282 HE1 HIS 37 1HE HIS 37 14.169 12.581 1.418 283 HE2 HIS 37 2HE HIS 37 13.136 11.003 -0.277 284 H VAL 38 H VAL 38 8.714 12.910 5.203 285 HA VAL 38 HA VAL 38 6.911 11.035 6.674 286 HB VAL 38 HB VAL 38 7.261 14.026 7.029 287 HG11 VAL 38 1HG1 VAL 38 5.240 12.237 7.884 288 HG12 VAL 38 2HG1 VAL 38 5.493 13.899 8.417 289 HG13 VAL 38 3HG1 VAL 38 6.240 12.567 9.300 290 HG21 VAL 38 1HG2 VAL 38 8.975 11.892 7.780 291 HG22 VAL 38 2HG2 VAL 38 8.145 12.412 9.247 292 HG23 VAL 38 3HG2 VAL 38 9.069 13.575 8.297 293 H LEU 39 H LEU 39 5.024 10.636 5.670 294 HA LEU 39 HA LEU 39 3.860 12.757 3.910 295 HB2 LEU 39 2HB LEU 39 3.322 9.771 3.867 296 HB3 LEU 39 1HB LEU 39 2.741 10.962 2.702 297 HG LEU 39 HG LEU 39 5.642 10.246 3.224 298 HD11 LEU 39 1HD1 LEU 39 4.130 8.649 1.876 299 HD12 LEU 39 2HD1 LEU 39 5.623 9.184 1.107 300 HD13 LEU 39 3HD1 LEU 39 4.088 9.923 0.657 301 HD21 LEU 39 1HD2 LEU 39 5.747 12.499 2.628 302 HD22 LEU 39 2HD2 LEU 39 4.292 12.408 1.636 303 HD23 LEU 39 3HD2 LEU 39 5.807 11.724 1.045 304 H VAL 40 H VAL 40 3.620 11.385 6.895 305 HA VAL 40 HA VAL 40 0.691 11.967 7.089 306 HB VAL 40 HB VAL 40 2.262 9.992 8.756 307 HG11 VAL 40 1HG1 VAL 40 0.354 10.834 9.956 308 HG12 VAL 40 2HG1 VAL 40 -0.088 9.242 9.342 309 HG13 VAL 40 3HG1 VAL 40 -0.674 10.694 8.529 310 HG21 VAL 40 1HG2 VAL 40 0.246 9.386 6.580 311 HG22 VAL 40 2HG2 VAL 40 1.273 8.240 7.441 312 HG23 VAL 40 3HG2 VAL 40 1.987 9.380 6.300 313 H LYS 41 H LYS 41 0.063 13.037 9.104 314 HA LYS 41 HA LYS 41 1.852 15.042 9.980 315 HB2 LYS 41 2HB LYS 41 -0.506 13.827 11.436 316 HB3 LYS 41 1HB LYS 41 0.295 15.324 11.908 317 HG2 LYS 41 2HG LYS 41 -0.215 16.259 9.647 318 HG3 LYS 41 1HG LYS 41 -1.118 14.789 9.279 319 HD2 LYS 41 2HD LYS 41 -2.571 15.233 11.263 320 HD3 LYS 41 1HD LYS 41 -1.720 16.760 11.503 321 HE2 LYS 41 2HE LYS 41 -2.884 16.165 8.805 322 HE3 LYS 41 1HE LYS 41 -3.959 16.695 10.099 323 HZ1 LYS 41 1HZ LYS 41 -2.915 18.718 10.264 324 HZ2 LYS 41 2HZ LYS 41 -2.808 18.434 8.592 325 HZ3 LYS 41 3HZ LYS 41 -1.461 18.161 9.591 326 H LYS 42 H LYS 42 1.137 11.851 11.398 327 HA LYS 42 HA LYS 42 3.690 12.097 12.916 328 HB2 LYS 42 2HB LYS 42 1.582 12.398 14.360 329 HB3 LYS 42 1HB LYS 42 1.254 10.699 14.025 330 HG2 LYS 42 2HG LYS 42 2.472 10.721 16.075 331 HG3 LYS 42 1HG LYS 42 3.625 10.215 14.842 332 HD2 LYS 42 2HD LYS 42 3.666 13.072 14.953 333 HD3 LYS 42 1HD LYS 42 3.788 12.464 16.602 334 HE2 LYS 42 2HE LYS 42 5.666 11.045 15.999 335 HE3 LYS 42 1HE LYS 42 5.499 11.490 14.301 336 HZ1 LYS 42 1HZ LYS 42 5.667 13.830 15.839 337 HZ2 LYS 42 2HZ LYS 42 6.751 13.259 14.661 338 HZ3 LYS 42 3HZ LYS 42 6.945 12.809 16.287 339 H GLU 43 H GLU 43 4.887 10.152 13.020 340 HA GLU 43 HA GLU 43 4.633 8.341 10.876 341 HB2 GLU 43 2HB GLU 43 6.681 8.640 12.287 342 HB3 GLU 43 1HB GLU 43 5.879 7.741 13.574 343 HG2 GLU 43 2HG GLU 43 5.606 5.815 12.013 344 HG3 GLU 43 1HG GLU 43 6.516 6.710 10.795 345 H ARG 44 H ARG 44 3.473 6.479 10.571 346 HA ARG 44 HA ARG 44 1.373 5.840 12.536 347 HB2 ARG 44 2HB ARG 44 0.981 5.947 10.037 348 HB3 ARG 44 1HB ARG 44 1.964 4.492 9.888 349 HG2 ARG 44 2HG ARG 44 0.415 3.329 11.460 350 HG3 ARG 44 1HG ARG 44 -0.602 4.771 11.475 351 HD2 ARG 44 2HD ARG 44 0.100 3.118 9.032 352 HD3 ARG 44 1HD ARG 44 -1.465 3.154 9.844 353 HE ARG 44 HE ARG 44 -1.108 5.786 9.232 354 HH11 ARG 44 1HH1 ARG 44 -1.614 6.735 7.243 355 HH12 ARG 44 2HH1 ARG 44 -1.609 5.763 5.809 356 HH21 ARG 44 1HH2 ARG 44 -0.713 2.852 7.466 357 HH22 ARG 44 2HH2 ARG 44 -1.100 3.565 5.936 358 H ALA 45 H ALA 45 1.345 3.975 13.804 359 HA ALA 45 HA ALA 45 3.570 2.023 13.385 360 HB1 ALA 45 1HB ALA 45 3.758 3.819 15.341 361 HB2 ALA 45 2HB ALA 45 4.291 2.153 15.567 362 HB3 ALA 45 3HB ALA 45 2.714 2.664 16.171 363 H GLY 46 H GLY 46 0.276 2.615 14.497 364 HA2 GLY 46 2HA GLY 46 -0.055 -0.340 14.870 365 HA3 GLY 46 1HA GLY 46 -1.071 0.874 15.641 366 H LEU 47 H LEU 47 -1.840 -1.367 13.860 367 HA LEU 47 HA LEU 47 -3.585 0.185 12.064 368 HB2 LEU 47 2HB LEU 47 -1.259 -1.391 11.138 369 HB3 LEU 47 1HB LEU 47 -2.767 -1.733 10.292 370 HG LEU 47 HG LEU 47 -1.979 1.124 10.744 371 HD11 LEU 47 1HD1 LEU 47 -1.059 0.603 8.212 372 HD12 LEU 47 2HD1 LEU 47 -0.521 -0.822 9.097 373 HD13 LEU 47 3HD1 LEU 47 -0.036 0.783 9.636 374 HD21 LEU 47 1HD2 LEU 47 -3.269 1.464 8.729 375 HD22 LEU 47 2HD2 LEU 47 -4.202 0.414 9.797 376 HD23 LEU 47 3HD2 LEU 47 -3.330 -0.272 8.425 377 H ALA 48 H ALA 48 -5.573 -0.814 12.036 378 HA ALA 48 HA ALA 48 -5.750 -3.746 12.264 379 HB1 ALA 48 1HB ALA 48 -6.585 -1.853 14.435 380 HB2 ALA 48 2HB ALA 48 -5.814 -3.433 14.571 381 HB3 ALA 48 3HB ALA 48 -7.527 -3.319 14.166 382 H PHE 49 H PHE 49 -7.423 -4.422 10.980 383 HA PHE 49 HA PHE 49 -9.792 -2.682 10.668 384 HB2 PHE 49 2HB PHE 49 -9.693 -2.795 8.204 385 HB3 PHE 49 1HB PHE 49 -8.297 -1.944 8.867 386 HD1 PHE 49 1HD PHE 49 -9.471 -4.874 7.048 387 HD2 PHE 49 2HD PHE 49 -6.091 -3.100 9.018 388 HE1 PHE 49 1HE PHE 49 -7.964 -6.476 5.903 389 HE2 PHE 49 2HE PHE 49 -4.587 -4.703 7.877 390 HZ PHE 49 HZ PHE 49 -5.520 -6.388 6.314 391 H GLU 50 H GLU 50 -11.650 -3.820 9.980 392 HA GLU 50 HA GLU 50 -11.496 -6.732 10.389 393 HB2 GLU 50 2HB GLU 50 -14.071 -5.510 9.601 394 HB3 GLU 50 1HB GLU 50 -13.706 -6.592 10.946 395 HG2 GLU 50 2HG GLU 50 -12.453 -4.550 11.956 396 HG3 GLU 50 1HG GLU 50 -13.387 -3.600 10.799 397 HA PRO 51 HA PRO 51 -11.291 -6.933 5.846 398 HB2 PRO 51 2HB PRO 51 -10.636 -9.561 5.634 399 HB3 PRO 51 1HB PRO 51 -9.462 -8.301 6.056 400 HG2 PRO 51 2HG PRO 51 -10.818 -10.282 7.794 401 HG3 PRO 51 1HG PRO 51 -9.180 -9.617 7.898 402 HD2 PRO 51 2HD PRO 51 -11.322 -8.797 9.469 403 HD3 PRO 51 1HD PRO 51 -9.856 -7.838 9.175 404 H PHE 52 H PHE 52 -13.551 -6.665 5.457 405 HA PHE 52 HA PHE 52 -14.914 -9.109 4.610 406 HB2 PHE 52 2HB PHE 52 -16.230 -7.381 6.730 407 HB3 PHE 52 1HB PHE 52 -16.865 -8.871 6.025 408 HD1 PHE 52 1HD PHE 52 -14.694 -7.431 8.534 409 HD2 PHE 52 2HD PHE 52 -15.629 -11.047 6.418 410 HE1 PHE 52 1HE PHE 52 -13.472 -8.744 10.242 411 HE2 PHE 52 2HE PHE 52 -14.407 -12.364 8.129 412 HZ PHE 52 HZ PHE 52 -13.324 -11.211 10.040 413 H VAL 53 H VAL 53 -17.243 -8.339 3.762 414 HA VAL 53 HA VAL 53 -16.686 -6.050 2.021 415 HB VAL 53 HB VAL 53 -19.307 -7.542 2.359 416 HG11 VAL 53 1HG1 VAL 53 -19.724 -5.628 1.066 417 HG12 VAL 53 2HG1 VAL 53 -19.374 -6.849 -0.157 418 HG13 VAL 53 3HG1 VAL 53 -18.135 -5.679 0.302 419 HG21 VAL 53 1HG2 VAL 53 -17.745 -8.302 0.040 420 HG22 VAL 53 2HG2 VAL 53 -18.422 -9.328 1.304 421 HG23 VAL 53 3HG2 VAL 53 -16.832 -8.599 1.519 422 H GLY 54 H GLY 54 -17.114 -3.970 2.626 423 HA2 GLY 54 2HA GLY 54 -18.312 -2.177 3.607 424 HA3 GLY 54 1HA GLY 54 -19.507 -3.340 4.191 425 H GLY 55 H GLY 55 -16.215 -4.109 4.812 426 HA2 GLY 55 2HA GLY 55 -16.626 -4.043 7.679 427 HA3 GLY 55 1HA GLY 55 -15.101 -4.392 6.862 428 H ARG 56 H ARG 56 -14.670 -2.897 8.967 429 HA ARG 56 HA ARG 56 -14.582 -0.066 7.982 430 HB2 ARG 56 2HB ARG 56 -14.640 -1.124 10.826 431 HB3 ARG 56 1HB ARG 56 -14.461 0.575 10.387 432 HG2 ARG 56 2HG ARG 56 -16.639 0.457 9.178 433 HG3 ARG 56 1HG ARG 56 -16.829 -1.205 9.738 434 HD2 ARG 56 2HD ARG 56 -16.601 -0.341 12.101 435 HD3 ARG 56 1HD ARG 56 -16.672 1.293 11.444 436 HE ARG 56 HE ARG 56 -18.910 -0.204 10.473 437 HH11 ARG 56 1HH1 ARG 56 -20.926 0.165 11.426 438 HH12 ARG 56 2HH1 ARG 56 -21.007 0.908 12.989 439 HH21 ARG 56 1HH2 ARG 56 -17.568 1.210 13.317 440 HH22 ARG 56 2HH2 ARG 56 -19.105 1.500 14.059 441 H TYR 57 H TYR 57 -12.574 0.909 7.901 442 HA TYR 57 HA TYR 57 -10.263 -0.736 8.861 443 HB2 TYR 57 2HB TYR 57 -10.641 -0.357 6.311 444 HB3 TYR 57 1HB TYR 57 -10.088 1.284 6.636 445 HD1 TYR 57 1HD TYR 57 -9.076 -2.062 5.939 446 HD2 TYR 57 2HD TYR 57 -7.857 1.518 7.973 447 HE1 TYR 57 1HE TYR 57 -6.723 -2.854 5.915 448 HE2 TYR 57 2HE TYR 57 -5.506 0.732 7.944 449 HH TYR 57 HH TYR 57 -4.104 -0.829 6.591 450 H TYR 58 H TYR 58 -9.009 0.226 10.362 451 HA TYR 58 HA TYR 58 -8.890 3.184 10.476 452 HB2 TYR 58 2HB TYR 58 -9.223 3.050 12.979 453 HB3 TYR 58 1HB TYR 58 -10.664 2.701 12.022 454 HD1 TYR 58 1HD TYR 58 -11.325 0.328 11.596 455 HD2 TYR 58 2HD TYR 58 -8.231 1.379 14.377 456 HE1 TYR 58 1HE TYR 58 -11.498 -1.921 12.631 457 HE2 TYR 58 2HE TYR 58 -8.402 -0.871 15.415 458 HH TYR 58 HH TYR 58 -10.624 -3.330 14.115 459 H GLU 59 H GLU 59 -7.057 3.951 11.746 460 HA GLU 59 HA GLU 59 -5.052 1.888 12.480 461 HB2 GLU 59 2HB GLU 59 -3.315 2.916 11.164 462 HB3 GLU 59 1HB GLU 59 -4.682 2.628 10.088 463 HG2 GLU 59 2HG GLU 59 -5.423 4.998 10.536 464 HG3 GLU 59 1HG GLU 59 -3.895 5.246 11.384 465 H TRP 60 H TRP 60 -3.462 2.702 13.995 466 HA TRP 60 HA TRP 60 -4.386 5.184 15.375 467 HB2 TRP 60 2HB TRP 60 -2.643 2.913 16.375 468 HB3 TRP 60 1HB TRP 60 -3.125 4.321 17.322 469 HD1 TRP 60 HD TRP 60 -5.868 4.645 17.599 470 HE1 TRP 60 1HE TRP 60 -7.663 2.828 17.965 471 HE3 TRP 60 3HE TRP 60 -3.309 0.542 15.962 472 HZ2 TRP 60 2HZ TRP 60 -7.967 0.005 17.610 473 HZ3 TRP 60 3HZ TRP 60 -4.372 -1.696 15.986 474 HH2 TRP 60 HH TRP 60 -6.695 -1.969 16.806 475 H ASP 61 H ASP 61 -3.034 6.921 15.544 476 HA ASP 61 HA ASP 61 -0.372 6.689 14.228 477 HB2 ASP 61 2HB ASP 61 -2.043 9.094 15.006 478 HB3 ASP 61 1HB ASP 61 -0.444 9.198 14.276 479 H ILE 62 H ILE 62 1.523 7.488 15.362 480 HA ILE 62 HA ILE 62 1.682 6.770 18.079 481 HB ILE 62 HB ILE 62 3.417 8.711 16.555 482 HG12 ILE 62 2HG1 ILE 62 3.793 5.781 17.178 483 HG13 ILE 62 1HG1 ILE 62 3.252 6.405 15.628 484 HG21 ILE 62 1HG2 ILE 62 4.868 7.368 18.548 485 HG22 ILE 62 2HG2 ILE 62 3.389 7.921 19.331 486 HG23 ILE 62 3HG2 ILE 62 4.445 9.079 18.521 487 HD11 ILE 62 1HD1 ILE 62 5.540 6.226 15.250 488 HD12 ILE 62 2HD1 ILE 62 5.946 6.629 16.918 489 HD13 ILE 62 3HD1 ILE 62 5.420 7.894 15.807 490 H ASP 63 H ASP 63 0.974 9.914 16.626 491 HA ASP 63 HA ASP 63 0.376 10.939 19.378 492 HB2 ASP 63 2HB ASP 63 2.261 12.117 18.261 493 HB3 ASP 63 1HB ASP 63 1.181 12.539 16.930 494 H GLY 64 H GLY 64 -0.731 10.594 16.064 495 HA2 GLY 64 2HA GLY 64 -3.122 12.219 16.485 496 HA3 GLY 64 1HA GLY 64 -2.786 11.225 15.066 497 H THR 65 H THR 65 -5.259 11.391 16.689 498 HA THR 65 HA THR 65 -5.506 9.015 18.294 499 HB THR 65 HB THR 65 -7.016 11.069 18.335 500 HG1 THR 65 1HG THR 65 -8.840 9.129 18.067 501 HG21 THR 65 1HG2 THR 65 -8.455 11.492 16.622 502 HG22 THR 65 2HG2 THR 65 -8.690 9.782 16.264 503 HG23 THR 65 3HG2 THR 65 -7.248 10.614 15.684 504 H GLU 66 H GLU 66 -8.025 8.128 17.030 505 HA GLU 66 HA GLU 66 -6.797 6.351 14.988 506 HB2 GLU 66 2HB GLU 66 -8.029 5.332 16.902 507 HB3 GLU 66 1HB GLU 66 -9.491 6.164 16.371 508 HG2 GLU 66 2HG GLU 66 -9.295 5.005 14.164 509 HG3 GLU 66 1HG GLU 66 -7.924 4.097 14.803 510 H ILE 67 H ILE 67 -7.292 6.611 12.861 511 HA ILE 67 HA ILE 67 -9.750 8.144 12.156 512 HB ILE 67 HB ILE 67 -8.505 9.282 10.358 513 HG12 ILE 67 2HG1 ILE 67 -6.006 8.136 11.626 514 HG13 ILE 67 1HG1 ILE 67 -6.757 7.431 10.196 515 HG21 ILE 67 1HG2 ILE 67 -7.411 10.875 11.753 516 HG22 ILE 67 2HG2 ILE 67 -7.031 9.658 12.971 517 HG23 ILE 67 3HG2 ILE 67 -8.697 10.190 12.747 518 HD11 ILE 67 1HD1 ILE 67 -5.088 8.922 9.365 519 HD12 ILE 67 2HD1 ILE 67 -5.566 10.193 10.491 520 HD13 ILE 67 3HD1 ILE 67 -6.626 9.760 9.148 521 H VAL 68 H VAL 68 -10.361 7.768 9.799 522 HA VAL 68 HA VAL 68 -10.126 4.879 9.256 523 HB VAL 68 HB VAL 68 -11.658 7.023 7.751 524 HG11 VAL 68 1HG1 VAL 68 -11.204 4.954 6.463 525 HG12 VAL 68 2HG1 VAL 68 -12.918 5.117 6.845 526 HG13 VAL 68 3HG1 VAL 68 -11.911 4.000 7.767 527 HG21 VAL 68 1HG2 VAL 68 -12.579 5.073 9.888 528 HG22 VAL 68 2HG2 VAL 68 -13.609 6.208 9.015 529 HG23 VAL 68 3HG2 VAL 68 -12.371 6.809 10.117 530 H TRP 69 H TRP 69 -8.839 4.021 7.684 531 HA TRP 69 HA TRP 69 -7.285 5.945 6.006 532 HB2 TRP 69 2HB TRP 69 -5.638 4.736 7.031 533 HB3 TRP 69 1HB TRP 69 -6.684 3.347 7.302 534 HD1 TRP 69 HD TRP 69 -3.897 4.473 5.212 535 HE1 TRP 69 1HE TRP 69 -3.531 2.873 3.225 536 HE3 TRP 69 3HE TRP 69 -8.248 1.810 5.406 537 HZ2 TRP 69 2HZ TRP 69 -4.898 0.741 1.897 538 HZ3 TRP 69 3HZ TRP 69 -8.691 0.000 3.771 539 HH2 TRP 69 HH TRP 69 -7.023 -0.536 2.016 540 H GLY 70 H GLY 70 -9.871 3.832 5.802 541 HA2 GLY 70 2HA GLY 70 -10.434 4.104 3.122 542 HA3 GLY 70 1HA GLY 70 -9.313 2.742 3.150 543 H ARG 71 H ARG 71 -10.750 1.066 2.699 544 HA ARG 71 HA ARG 71 -12.455 0.211 4.894 545 HB2 ARG 71 2HB ARG 71 -13.733 1.903 3.225 546 HB3 ARG 71 1HB ARG 71 -13.976 0.398 2.345 547 HG2 ARG 71 2HG ARG 71 -14.871 -0.645 4.422 548 HG3 ARG 71 1HG ARG 71 -14.697 0.905 5.244 549 HD2 ARG 71 2HD ARG 71 -16.988 0.727 4.504 550 HD3 ARG 71 1HD ARG 71 -16.188 1.916 3.476 551 HE ARG 71 HE ARG 71 -15.929 -0.587 2.189 552 HH11 ARG 71 1HH1 ARG 71 -17.375 -1.159 0.548 553 HH12 ARG 71 2HH1 ARG 71 -18.921 -0.382 0.464 554 HH21 ARG 71 1HH2 ARG 71 -18.362 1.619 3.241 555 HH22 ARG 71 2HH2 ARG 71 -19.479 1.190 1.989 556 H ILE 72 H ILE 72 -13.983 -1.635 3.285 557 HA ILE 72 HA ILE 72 -11.862 -3.214 1.921 558 HB ILE 72 HB ILE 72 -13.764 -4.268 4.035 559 HG12 ILE 72 2HG1 ILE 72 -11.239 -4.898 4.834 560 HG13 ILE 72 1HG1 ILE 72 -10.936 -3.371 4.007 561 HG21 ILE 72 1HG2 ILE 72 -12.447 -6.390 3.681 562 HG22 ILE 72 2HG2 ILE 72 -11.720 -5.637 2.262 563 HG23 ILE 72 3HG2 ILE 72 -13.457 -5.938 2.308 564 HD11 ILE 72 1HD1 ILE 72 -11.449 -3.021 6.406 565 HD12 ILE 72 2HD1 ILE 72 -13.014 -3.796 6.172 566 HD13 ILE 72 3HD1 ILE 72 -12.659 -2.270 5.366 567 H LEU 73 H LEU 73 -12.802 -4.915 0.500 568 HA LEU 73 HA LEU 73 -15.583 -4.225 -0.366 569 HB2 LEU 73 2HB LEU 73 -13.771 -3.482 -1.957 570 HB3 LEU 73 1HB LEU 73 -13.319 -5.177 -2.144 571 HG LEU 73 HG LEU 73 -15.878 -5.496 -2.683 572 HD11 LEU 73 1HD1 LEU 73 -16.769 -3.491 -3.887 573 HD12 LEU 73 2HD1 LEU 73 -15.396 -2.564 -3.283 574 HD13 LEU 73 3HD1 LEU 73 -16.580 -3.224 -2.154 575 HD21 LEU 73 1HD2 LEU 73 -15.267 -4.682 -5.122 576 HD22 LEU 73 2HD2 LEU 73 -14.413 -6.052 -4.410 577 HD23 LEU 73 3HD2 LEU 73 -13.664 -4.456 -4.423 578 H GLU 74 H GLU 74 -13.101 -6.777 -0.565 579 HA GLU 74 HA GLU 74 -14.795 -8.812 0.524 580 HB2 GLU 74 2HB GLU 74 -15.943 -8.488 -1.681 581 HB3 GLU 74 1HB GLU 74 -14.439 -8.944 -2.475 582 HG2 GLU 74 2HG GLU 74 -14.488 -11.118 -1.261 583 HG3 GLU 74 1HG GLU 74 -16.047 -10.667 -0.571 584 H TRP 75 H TRP 75 -13.541 -10.630 1.003 585 HA TRP 75 HA TRP 75 -10.712 -10.499 0.075 586 HB2 TRP 75 2HB TRP 75 -10.105 -11.659 2.068 587 HB3 TRP 75 1HB TRP 75 -11.290 -10.454 2.574 588 HD1 TRP 75 HD TRP 75 -10.689 -14.149 2.400 589 HE1 TRP 75 1HE TRP 75 -12.713 -15.410 3.379 590 HE3 TRP 75 3HE TRP 75 -14.016 -10.295 2.810 591 HZ2 TRP 75 2HZ TRP 75 -15.390 -14.858 4.223 592 HZ3 TRP 75 3HZ TRP 75 -16.294 -10.691 3.703 593 HH2 TRP 75 HH TRP 75 -16.985 -12.966 4.409 594 H ASP 76 H ASP 76 -9.996 -12.081 -1.279 595 HA ASP 76 HA ASP 76 -11.714 -14.502 -1.599 596 HB2 ASP 76 2HB ASP 76 -10.821 -12.619 -3.518 597 HB3 ASP 76 1HB ASP 76 -9.937 -14.117 -3.819 598 HA PRO 77 HA PRO 77 -8.263 -16.703 0.372 599 HB2 PRO 77 2HB PRO 77 -9.257 -18.722 -1.634 600 HB3 PRO 77 1HB PRO 77 -8.776 -18.977 0.053 601 HG2 PRO 77 2HG PRO 77 -11.336 -18.807 -0.636 602 HG3 PRO 77 1HG PRO 77 -10.737 -18.137 0.891 603 HD2 PRO 77 2HD PRO 77 -11.692 -16.721 -1.516 604 HD3 PRO 77 1HD PRO 77 -11.542 -16.123 0.153 605 HA PRO 78 HA PRO 78 -4.532 -16.270 -1.964 606 HB2 PRO 78 2HB PRO 78 -4.668 -19.252 -2.310 607 HB3 PRO 78 1HB PRO 78 -3.272 -18.233 -1.900 608 HG2 PRO 78 2HG PRO 78 -4.776 -19.607 -0.064 609 HG3 PRO 78 1HG PRO 78 -3.804 -18.174 0.300 610 HD2 PRO 78 2HD PRO 78 -6.665 -18.412 0.417 611 HD3 PRO 78 1HD PRO 78 -5.691 -16.962 0.721 612 H HIS 79 H HIS 79 -5.851 -15.238 -3.653 613 HA HIS 79 HA HIS 79 -5.441 -16.304 -6.239 614 HB2 HIS 79 2HB HIS 79 -7.956 -17.133 -4.910 615 HB3 HIS 79 1HB HIS 79 -8.139 -16.502 -6.546 616 HD1 HIS 79 1HD HIS 79 -6.154 -17.592 -8.257 617 HD2 HIS 79 2HD HIS 79 -7.389 -19.830 -4.959 618 HE1 HIS 79 1HE HIS 79 -5.506 -19.995 -8.736 619 HE2 HIS 79 2HE HIS 79 -6.253 -21.365 -6.736 620 H ARG 80 H ARG 80 -7.903 -14.409 -4.391 621 HA ARG 80 HA ARG 80 -7.178 -12.107 -6.108 622 HB2 ARG 80 2HB ARG 80 -9.152 -13.308 -7.145 623 HB3 ARG 80 1HB ARG 80 -10.073 -12.870 -5.708 624 HG2 ARG 80 2HG ARG 80 -10.564 -11.075 -7.100 625 HG3 ARG 80 1HG ARG 80 -9.174 -10.446 -6.237 626 HD2 ARG 80 2HD ARG 80 -8.495 -10.003 -8.390 627 HD3 ARG 80 1HD ARG 80 -7.855 -11.636 -8.225 628 HE ARG 80 HE ARG 80 -10.232 -12.258 -9.237 629 HH11 ARG 80 1HH1 ARG 80 -10.973 -12.091 -11.355 630 HH12 ARG 80 2HH1 ARG 80 -10.334 -10.860 -12.392 631 HH21 ARG 80 1HH2 ARG 80 -8.199 -9.561 -9.998 632 HH22 ARG 80 2HH2 ARG 80 -8.769 -9.435 -11.625 633 H LEU 81 H LEU 81 -7.605 -10.089 -5.181 634 HA LEU 81 HA LEU 81 -8.728 -10.070 -2.421 635 HB2 LEU 81 2HB LEU 81 -6.218 -10.157 -2.307 636 HB3 LEU 81 1HB LEU 81 -6.168 -8.661 -3.238 637 HG LEU 81 HG LEU 81 -7.702 -7.678 -1.409 638 HD11 LEU 81 1HD1 LEU 81 -6.610 -9.389 0.646 639 HD12 LEU 81 2HD1 LEU 81 -7.558 -10.348 -0.491 640 HD13 LEU 81 3HD1 LEU 81 -8.295 -8.973 0.331 641 HD21 LEU 81 1HD2 LEU 81 -5.394 -7.970 0.169 642 HD22 LEU 81 2HD2 LEU 81 -5.728 -6.677 -0.984 643 HD23 LEU 81 3HD2 LEU 81 -4.832 -8.106 -1.497 644 H ALA 82 H ALA 82 -10.137 -8.370 -2.158 645 HA ALA 82 HA ALA 82 -9.902 -6.053 -4.033 646 HB1 ALA 82 1HB ALA 82 -12.611 -7.061 -3.227 647 HB2 ALA 82 2HB ALA 82 -11.760 -7.865 -4.545 648 HB3 ALA 82 3HB ALA 82 -12.142 -6.148 -4.661 649 H MET 83 H MET 83 -10.439 -4.045 -3.071 650 HA MET 83 HA MET 83 -11.485 -4.117 -0.293 651 HB2 MET 83 2HB MET 83 -8.924 -2.702 -1.074 652 HB3 MET 83 1HB MET 83 -9.678 -2.678 0.521 653 HG2 MET 83 2HG MET 83 -9.462 -5.191 0.571 654 HG3 MET 83 1HG MET 83 -8.520 -5.078 -0.915 655 HE1 MET 83 1HE MET 83 -9.045 -4.280 2.617 656 HE2 MET 83 2HE MET 83 -8.420 -2.643 2.429 657 HE3 MET 83 3HE MET 83 -7.484 -3.839 3.322 658 H THR 84 H THR 84 -12.669 -2.277 0.265 659 HA THR 84 HA THR 84 -13.038 -0.276 -1.920 660 HB THR 84 HB THR 84 -14.696 -0.784 0.576 661 HG1 THR 84 1HG THR 84 -16.144 -1.363 -1.378 662 HG21 THR 84 1HG2 THR 84 -16.189 0.569 -1.371 663 HG22 THR 84 2HG2 THR 84 -14.621 1.378 -1.357 664 HG23 THR 84 3HG2 THR 84 -15.560 1.247 0.130 665 H TRP 85 H TRP 85 -12.431 1.887 -1.540 666 HA TRP 85 HA TRP 85 -10.944 2.324 1.002 667 HB2 TRP 85 2HB TRP 85 -9.947 2.652 -1.381 668 HB3 TRP 85 1HB TRP 85 -10.845 4.170 -1.364 669 HD1 TRP 85 HD TRP 85 -10.364 5.747 0.908 670 HE1 TRP 85 1HE TRP 85 -8.103 6.188 2.067 671 HE3 TRP 85 3HE TRP 85 -7.670 1.798 -0.883 672 HZ2 TRP 85 2HZ TRP 85 -5.495 5.019 2.214 673 HZ3 TRP 85 3HZ TRP 85 -5.304 1.486 -0.224 674 HH2 TRP 85 HH TRP 85 -4.213 3.087 1.322 675 H ARG 86 H ARG 86 -11.975 3.458 2.564 676 HA ARG 86 HA ARG 86 -13.885 5.604 1.706 677 HB2 ARG 86 2HB ARG 86 -14.994 3.781 2.943 678 HB3 ARG 86 1HB ARG 86 -13.861 3.993 4.278 679 HG2 ARG 86 2HG ARG 86 -14.667 6.250 4.671 680 HG3 ARG 86 1HG ARG 86 -15.705 6.169 3.248 681 HD2 ARG 86 2HD ARG 86 -17.092 5.737 5.174 682 HD3 ARG 86 1HD ARG 86 -16.877 4.206 4.325 683 HE ARG 86 HE ARG 86 -14.819 4.372 6.256 684 HH11 ARG 86 1HH1 ARG 86 -15.065 3.323 8.244 685 HH12 ARG 86 2HH1 ARG 86 -16.654 2.926 8.808 686 HH21 ARG 86 1HH2 ARG 86 -18.258 4.261 6.038 687 HH22 ARG 86 2HH2 ARG 86 -18.461 3.457 7.560 688 H ILE 87 H ILE 87 -12.337 7.298 1.666 689 HA ILE 87 HA ILE 87 -11.373 8.106 4.359 690 HB ILE 87 HB ILE 87 -9.537 6.890 3.094 691 HG12 ILE 87 2HG1 ILE 87 -8.911 9.815 3.555 692 HG13 ILE 87 1HG1 ILE 87 -9.239 8.710 4.888 693 HG21 ILE 87 1HG2 ILE 87 -10.394 8.165 0.914 694 HG22 ILE 87 2HG2 ILE 87 -8.700 7.714 1.102 695 HG23 ILE 87 3HG2 ILE 87 -9.216 9.366 1.446 696 HD11 ILE 87 1HD1 ILE 87 -6.775 9.097 3.583 697 HD12 ILE 87 2HD1 ILE 87 -7.350 7.518 3.049 698 HD13 ILE 87 3HD1 ILE 87 -7.163 7.853 4.769 699 H ASP 88 H ASP 88 -10.868 10.418 4.479 700 HA ASP 88 HA ASP 88 -12.459 11.973 2.494 701 HB2 ASP 88 2HB ASP 88 -12.973 12.156 4.963 702 HB3 ASP 88 1HB ASP 88 -11.385 12.892 5.177 703 H GLY 89 H GLY 89 -11.557 13.814 1.485 704 HA2 GLY 89 2HA GLY 89 -8.833 13.656 0.706 705 HA3 GLY 89 1HA GLY 89 -9.861 15.065 0.470 706 H HIS 90 H HIS 90 -10.299 15.189 3.484 707 HA HIS 90 HA HIS 90 -7.927 16.839 4.013 708 HB2 HIS 90 2HB HIS 90 -10.422 16.329 5.635 709 HB3 HIS 90 1HB HIS 90 -9.175 17.493 6.050 710 HD1 HIS 90 1HD HIS 90 -8.605 18.791 3.362 711 HD2 HIS 90 2HD HIS 90 -12.463 17.933 4.686 712 HE1 HIS 90 1HE HIS 90 -10.161 20.328 2.079 713 HE2 HIS 90 2HE HIS 90 -12.514 19.811 2.875 714 H TRP 91 H TRP 91 -8.086 13.719 4.069 715 HA TRP 91 HA TRP 91 -7.045 12.021 5.299 716 HB2 TRP 91 2HB TRP 91 -5.585 14.498 5.998 717 HB3 TRP 91 1HB TRP 91 -5.415 13.182 7.158 718 HD1 TRP 91 HD TRP 91 -3.841 14.438 4.170 719 HE1 TRP 91 1HE TRP 91 -2.484 12.610 2.959 720 HE3 TRP 91 3HE TRP 91 -5.696 10.284 6.486 721 HZ2 TRP 91 2HZ TRP 91 -2.222 9.761 2.972 722 HZ3 TRP 91 3HZ TRP 91 -4.878 8.028 5.870 723 HH2 TRP 91 HH TRP 91 -3.145 7.762 4.118 724 H GLN 92 H GLN 92 -9.551 13.436 6.301 725 HA GLN 92 HA GLN 92 -9.288 12.858 9.209 726 HB2 GLN 92 2HB GLN 92 -11.519 14.219 7.674 727 HB3 GLN 92 1HB GLN 92 -11.460 14.008 9.425 728 HG2 GLN 92 2HG GLN 92 -9.466 15.562 7.752 729 HG3 GLN 92 1HG GLN 92 -10.685 16.248 8.818 730 HE21 GLN 92 1HE2 GLN 92 -7.481 15.844 8.799 731 HE22 GLN 92 2HE2 GLN 92 -7.187 15.486 10.432 732 H SER 93 H SER 93 -12.474 12.680 8.184 733 HA SER 93 HA SER 93 -12.444 9.859 7.394 734 HB2 SER 93 2HB SER 93 -13.544 8.973 9.312 735 HB3 SER 93 1HB SER 93 -12.216 9.936 9.949 736 HG SER 93 HG SER 93 -14.488 11.387 9.516 737 H VAL 94 H VAL 94 -14.672 9.115 6.874 738 HA VAL 94 HA VAL 94 -16.569 11.393 6.475 739 HB VAL 94 HB VAL 94 -17.157 9.682 4.405 740 HG11 VAL 94 1HG1 VAL 94 -16.933 12.131 4.268 741 HG12 VAL 94 2HG1 VAL 94 -16.008 11.353 2.984 742 HG13 VAL 94 3HG1 VAL 94 -15.182 11.987 4.407 743 HG21 VAL 94 1HG2 VAL 94 -14.143 9.848 4.450 744 HG22 VAL 94 2HG2 VAL 94 -15.172 8.847 3.427 745 HG23 VAL 94 3HG2 VAL 94 -14.986 8.460 5.138 746 HA PRO 95 HA PRO 95 -19.503 8.775 8.493 747 HB2 PRO 95 2HB PRO 95 -21.827 9.530 7.215 748 HB3 PRO 95 1HB PRO 95 -21.037 10.478 8.488 749 HG2 PRO 95 2HG PRO 95 -20.982 10.846 5.542 750 HG3 PRO 95 1HG PRO 95 -21.006 12.056 6.835 751 HD2 PRO 95 2HD PRO 95 -18.737 11.401 5.456 752 HD3 PRO 95 1HD PRO 95 -18.715 11.980 7.136 753 H ASP 96 H ASP 96 -19.461 8.778 4.964 754 HA ASP 96 HA ASP 96 -19.756 5.883 4.908 755 HB2 ASP 96 2HB ASP 96 -21.849 5.807 3.639 756 HB3 ASP 96 1HB ASP 96 -22.125 6.590 5.196 757 H ASP 97 H ASP 97 -19.891 5.162 2.490 758 HA ASP 97 HA ASP 97 -17.850 6.671 1.046 759 HB2 ASP 97 2HB ASP 97 -19.469 4.211 0.318 760 HB3 ASP 97 1HB ASP 97 -18.165 4.869 -0.666 761 H ASP 98 H ASP 98 -18.650 8.608 0.236 762 HA ASP 98 HA ASP 98 -21.299 8.667 -1.050 763 HB2 ASP 98 2HB ASP 98 -20.356 10.551 0.393 764 HB3 ASP 98 1HB ASP 98 -19.262 10.888 -0.945 765 H ARG 99 H ARG 99 -17.959 9.452 -1.972 766 HA ARG 99 HA ARG 99 -18.617 8.600 -4.755 767 HB2 ARG 99 2HB ARG 99 -16.891 10.941 -3.889 768 HB3 ARG 99 1HB ARG 99 -17.087 10.388 -5.552 769 HG2 ARG 99 2HG ARG 99 -19.542 10.780 -5.357 770 HG3 ARG 99 1HG ARG 99 -19.280 11.434 -3.740 771 HD2 ARG 99 2HD ARG 99 -17.691 13.107 -4.766 772 HD3 ARG 99 1HD ARG 99 -18.210 12.534 -6.351 773 HE ARG 99 HE ARG 99 -20.568 13.174 -4.978 774 HH11 ARG 99 1HH1 ARG 99 -21.527 15.208 -5.201 775 HH12 ARG 99 2HH1 ARG 99 -20.563 16.556 -5.702 776 HH21 ARG 99 1HH2 ARG 99 -17.637 14.709 -5.952 777 HH22 ARG 99 2HH2 ARG 99 -18.360 16.273 -6.127 778 H ALA 100 H ALA 100 -17.218 7.411 -2.266 779 HA ALA 100 HA ALA 100 -14.423 7.218 -2.832 780 HB1 ALA 100 1HB ALA 100 -15.321 4.793 -1.621 781 HB2 ALA 100 2HB ALA 100 -16.265 6.118 -0.941 782 HB3 ALA 100 3HB ALA 100 -14.504 6.154 -0.853 783 H SER 101 H SER 101 -13.249 5.643 -3.949 784 HA SER 101 HA SER 101 -14.822 4.125 -5.974 785 HB2 SER 101 2HB SER 101 -13.096 5.760 -6.768 786 HB3 SER 101 1HB SER 101 -11.865 4.796 -5.957 787 HG SER 101 HG SER 101 -12.218 4.315 -8.236 788 H GLU 102 H GLU 102 -13.896 1.962 -6.576 789 HA GLU 102 HA GLU 102 -12.916 0.559 -4.126 790 HB2 GLU 102 2HB GLU 102 -14.379 -0.546 -6.545 791 HB3 GLU 102 1HB GLU 102 -13.898 -1.472 -5.122 792 HG2 GLU 102 2HG GLU 102 -15.305 0.004 -3.707 793 HG3 GLU 102 1HG GLU 102 -15.818 0.876 -5.151 794 H ILE 103 H ILE 103 -11.218 -0.953 -4.351 795 HA ILE 103 HA ILE 103 -9.580 -0.585 -6.828 796 HB ILE 103 HB ILE 103 -8.662 -1.345 -4.041 797 HG12 ILE 103 2HG1 ILE 103 -8.339 1.303 -5.481 798 HG13 ILE 103 1HG1 ILE 103 -9.583 1.001 -4.267 799 HG21 ILE 103 1HG2 ILE 103 -6.450 -0.517 -5.185 800 HG22 ILE 103 2HG2 ILE 103 -7.314 -0.871 -6.681 801 HG23 ILE 103 3HG2 ILE 103 -7.031 -2.152 -5.501 802 HD11 ILE 103 1HD1 ILE 103 -7.694 2.031 -3.156 803 HD12 ILE 103 2HD1 ILE 103 -6.582 0.862 -3.868 804 HD13 ILE 103 3HD1 ILE 103 -7.760 0.337 -2.664 805 H GLU 104 H GLU 104 -8.882 -2.437 -7.903 806 HA GLU 104 HA GLU 104 -9.828 -5.036 -6.753 807 HB2 GLU 104 2HB GLU 104 -10.847 -4.346 -8.940 808 HB3 GLU 104 1HB GLU 104 -9.234 -4.381 -9.654 809 HG2 GLU 104 2HG GLU 104 -9.020 -6.770 -8.970 810 HG3 GLU 104 1HG GLU 104 -10.679 -6.720 -8.373 811 H VAL 105 H VAL 105 -8.222 -6.324 -6.044 812 HA VAL 105 HA VAL 105 -5.537 -6.075 -7.324 813 HB VAL 105 HB VAL 105 -6.109 -6.713 -4.417 814 HG11 VAL 105 1HG1 VAL 105 -4.048 -7.707 -4.912 815 HG12 VAL 105 2HG1 VAL 105 -3.562 -6.098 -4.377 816 HG13 VAL 105 3HG1 VAL 105 -3.627 -6.472 -6.099 817 HG21 VAL 105 1HG2 VAL 105 -6.564 -4.441 -4.476 818 HG22 VAL 105 2HG2 VAL 105 -5.531 -4.166 -5.877 819 HG23 VAL 105 3HG2 VAL 105 -4.812 -4.390 -4.284 820 H ASP 106 H ASP 106 -4.722 -7.986 -8.075 821 HA ASP 106 HA ASP 106 -6.139 -10.488 -7.252 822 HB2 ASP 106 2HB ASP 106 -6.517 -9.823 -9.624 823 HB3 ASP 106 1HB ASP 106 -4.777 -9.896 -9.892 824 H PHE 107 H PHE 107 -4.860 -12.071 -6.376 825 HA PHE 107 HA PHE 107 -1.904 -11.770 -6.702 826 HB2 PHE 107 2HB PHE 107 -3.559 -12.163 -4.274 827 HB3 PHE 107 1HB PHE 107 -2.067 -13.103 -4.370 828 HD1 PHE 107 1HD PHE 107 0.105 -11.989 -4.648 829 HD2 PHE 107 2HD PHE 107 -3.510 -9.760 -4.057 830 HE1 PHE 107 1HE PHE 107 1.445 -9.977 -4.092 831 HE2 PHE 107 2HE PHE 107 -2.181 -7.743 -3.507 832 HZ PHE 107 HZ PHE 107 0.305 -7.853 -3.523 833 H VAL 108 H VAL 108 -1.045 -13.429 -7.762 834 HA VAL 108 HA VAL 108 -2.193 -16.141 -7.355 835 HB VAL 108 HB VAL 108 -2.067 -14.555 -9.812 836 HG11 VAL 108 1HG1 VAL 108 -0.841 -17.327 -9.786 837 HG12 VAL 108 2HG1 VAL 108 -0.091 -15.832 -10.343 838 HG13 VAL 108 3HG1 VAL 108 -1.434 -16.533 -11.241 839 HG21 VAL 108 1HG2 VAL 108 -4.026 -15.768 -8.722 840 HG22 VAL 108 2HG2 VAL 108 -3.308 -17.265 -9.319 841 HG23 VAL 108 3HG2 VAL 108 -3.830 -16.023 -10.456 842 HA PRO 109 HA PRO 109 2.081 -17.083 -6.519 843 HB2 PRO 109 2HB PRO 109 2.105 -19.735 -7.388 844 HB3 PRO 109 1HB PRO 109 1.620 -19.187 -5.776 845 HG2 PRO 109 2HG PRO 109 -0.046 -19.965 -8.089 846 HG3 PRO 109 1HG PRO 109 -0.352 -20.155 -6.355 847 HD2 PRO 109 2HD PRO 109 -1.587 -18.252 -7.866 848 HD3 PRO 109 1HD PRO 109 -1.233 -18.025 -6.138 849 H ASN 110 H ASN 110 3.870 -16.630 -7.717 850 HA ASN 110 HA ASN 110 3.837 -17.324 -10.620 851 HB2 ASN 110 2HB ASN 110 3.733 -14.850 -10.004 852 HB3 ASN 110 1HB ASN 110 5.372 -15.045 -9.386 853 HD21 ASN 110 1HD2 ASN 110 5.412 -13.311 -11.391 854 HD22 ASN 110 2HD2 ASN 110 5.882 -14.003 -12.869 855 H GLY 111 H GLY 111 5.274 -18.931 -11.018 856 HA2 GLY 111 2HA GLY 111 7.212 -20.248 -10.879 857 HA3 GLY 111 1HA GLY 111 8.036 -18.773 -10.367 858 H SER 112 H SER 112 9.135 -19.300 -8.525 859 HA SER 112 HA SER 112 7.548 -20.532 -6.315 860 HB2 SER 112 2HB SER 112 9.470 -21.879 -5.666 861 HB3 SER 112 1HB SER 112 9.079 -22.221 -7.349 862 HG SER 112 HG SER 112 11.182 -21.811 -7.473 863 H GLY 113 H GLY 113 7.952 -19.633 -4.290 864 HA2 GLY 113 2HA GLY 113 8.750 -18.078 -2.730 865 HA3 GLY 113 1HA GLY 113 10.257 -18.061 -3.646 866 H GLY 114 H GLY 114 7.626 -17.327 -5.659 867 HA2 GLY 114 2HA GLY 114 7.822 -14.420 -5.095 868 HA3 GLY 114 1HA GLY 114 8.259 -14.979 -6.707 869 H THR 115 H THR 115 5.937 -13.299 -5.601 870 HA THR 115 HA THR 115 3.756 -14.884 -6.897 871 HB THR 115 HB THR 115 3.382 -12.817 -4.718 872 HG1 THR 115 1HG THR 115 4.019 -15.511 -4.634 873 HG21 THR 115 1HG2 THR 115 1.419 -13.176 -6.098 874 HG22 THR 115 2HG2 THR 115 1.169 -13.971 -4.544 875 HG23 THR 115 3HG2 THR 115 1.601 -14.923 -5.958 876 H ARG 116 H ARG 116 2.509 -13.778 -8.404 877 HA ARG 116 HA ARG 116 3.425 -11.002 -9.051 878 HB2 ARG 116 2HB ARG 116 3.849 -12.721 -10.817 879 HB3 ARG 116 1HB ARG 116 2.114 -13.036 -10.883 880 HG2 ARG 116 2HG ARG 116 1.698 -10.700 -11.520 881 HG3 ARG 116 1HG ARG 116 3.425 -10.354 -11.417 882 HD2 ARG 116 2HD ARG 116 2.903 -10.744 -13.742 883 HD3 ARG 116 1HD ARG 116 3.799 -12.146 -13.157 884 HE ARG 116 HE ARG 116 1.104 -12.784 -12.769 885 HH11 ARG 116 1HH1 ARG 116 -0.065 -13.932 -14.327 886 HH12 ARG 116 2HH1 ARG 116 0.457 -13.902 -15.977 887 HH21 ARG 116 1HH2 ARG 116 3.181 -11.848 -15.358 888 HH22 ARG 116 2HH2 ARG 116 2.294 -12.724 -16.562 889 H VAL 117 H VAL 117 1.914 -9.411 -8.860 890 HA VAL 117 HA VAL 117 -0.942 -10.263 -8.689 891 HB VAL 117 HB VAL 117 -0.658 -9.696 -6.498 892 HG11 VAL 117 1HG1 VAL 117 1.698 -9.334 -6.515 893 HG12 VAL 117 2HG1 VAL 117 0.995 -7.881 -5.804 894 HG13 VAL 117 3HG1 VAL 117 1.536 -7.869 -7.483 895 HG21 VAL 117 1HG2 VAL 117 -2.170 -7.965 -7.646 896 HG22 VAL 117 2HG2 VAL 117 -0.796 -6.862 -7.546 897 HG23 VAL 117 3HG2 VAL 117 -1.514 -7.512 -6.073 898 H GLU 118 H GLU 118 -2.445 -9.039 -9.706 899 HA GLU 118 HA GLU 118 -1.446 -6.776 -11.374 900 HB2 GLU 118 2HB GLU 118 -2.429 -8.648 -12.643 901 HB3 GLU 118 1HB GLU 118 -3.902 -8.535 -11.682 902 HG2 GLU 118 2HG GLU 118 -4.238 -6.212 -12.517 903 HG3 GLU 118 1HG GLU 118 -2.812 -6.393 -13.534 904 H LEU 119 H LEU 119 -2.084 -4.773 -10.733 905 HA LEU 119 HA LEU 119 -4.563 -4.568 -9.079 906 HB2 LEU 119 2HB LEU 119 -2.407 -4.131 -7.839 907 HB3 LEU 119 1HB LEU 119 -2.138 -2.760 -8.913 908 HG LEU 119 HG LEU 119 -4.806 -2.870 -7.612 909 HD11 LEU 119 1HD1 LEU 119 -2.301 -2.162 -6.054 910 HD12 LEU 119 2HD1 LEU 119 -3.276 -3.608 -5.789 911 HD13 LEU 119 3HD1 LEU 119 -3.962 -2.012 -5.480 912 HD21 LEU 119 1HD2 LEU 119 -2.708 -0.723 -8.065 913 HD22 LEU 119 2HD2 LEU 119 -4.300 -0.434 -7.365 914 HD23 LEU 119 3HD2 LEU 119 -4.159 -0.988 -9.032 915 H ALA 120 H ALA 120 -6.123 -3.311 -9.977 916 HA ALA 120 HA ALA 120 -5.280 -1.204 -11.918 917 HB1 ALA 120 1HB ALA 120 -6.669 -3.586 -12.564 918 HB2 ALA 120 2HB ALA 120 -6.390 -2.191 -13.606 919 HB3 ALA 120 3HB ALA 120 -7.856 -2.282 -12.628 920 H HIS 121 H HIS 121 -6.370 0.725 -11.671 921 HA HIS 121 HA HIS 121 -8.636 0.760 -9.713 922 HB2 HIS 121 2HB HIS 121 -7.617 2.379 -8.512 923 HB3 HIS 121 1HB HIS 121 -6.149 1.962 -9.392 924 HD1 HIS 121 1HD HIS 121 -9.247 4.055 -10.258 925 HD2 HIS 121 2HD HIS 121 -5.088 4.261 -10.453 926 HE1 HIS 121 1HE HIS 121 -8.686 6.298 -11.296 927 HE2 HIS 121 2HE HIS 121 -6.157 6.434 -11.412 928 H VAL 122 H VAL 122 -10.437 1.955 -10.315 929 HA VAL 122 HA VAL 122 -10.242 3.543 -12.826 930 HB VAL 122 HB VAL 122 -12.389 2.516 -13.592 931 HG11 VAL 122 1HG1 VAL 122 -10.204 1.696 -14.421 932 HG12 VAL 122 2HG1 VAL 122 -11.381 0.388 -14.314 933 HG13 VAL 122 3HG1 VAL 122 -10.133 0.554 -13.079 934 HG21 VAL 122 1HG2 VAL 122 -12.198 1.341 -10.940 935 HG22 VAL 122 2HG2 VAL 122 -12.362 0.090 -12.172 936 HG23 VAL 122 3HG2 VAL 122 -13.573 1.366 -12.046 937 H LYS 123 H LYS 123 -11.689 5.279 -12.934 938 HA LYS 123 HA LYS 123 -13.020 7.003 -12.088 939 HB2 LYS 123 2HB LYS 123 -14.343 4.594 -10.821 940 HB3 LYS 123 1HB LYS 123 -14.991 6.226 -10.694 941 HG2 LYS 123 2HG LYS 123 -16.104 5.260 -12.563 942 HG3 LYS 123 1HG LYS 123 -14.875 6.322 -13.250 943 HD2 LYS 123 2HD LYS 123 -13.465 4.514 -13.822 944 HD3 LYS 123 1HD LYS 123 -14.309 3.402 -12.745 945 HE2 LYS 123 2HE LYS 123 -14.751 3.416 -15.384 946 HE3 LYS 123 1HE LYS 123 -16.032 3.054 -14.227 947 HZ1 LYS 123 1HZ LYS 123 -16.269 5.656 -14.270 948 HZ2 LYS 123 2HZ LYS 123 -17.033 4.682 -15.434 949 HZ3 LYS 123 3HZ LYS 123 -15.577 5.474 -15.808 950 H LEU 124 H LEU 124 -10.570 6.275 -10.558 951 HA LEU 124 HA LEU 124 -11.139 6.427 -7.737 952 HB2 LEU 124 2HB LEU 124 -8.957 5.677 -8.629 953 HB3 LEU 124 1HB LEU 124 -8.653 7.303 -9.242 954 HG LEU 124 HG LEU 124 -8.877 8.147 -6.876 955 HD11 LEU 124 1HD1 LEU 124 -10.093 6.521 -5.707 956 HD12 LEU 124 2HD1 LEU 124 -8.443 6.195 -5.178 957 HD13 LEU 124 3HD1 LEU 124 -9.185 5.187 -6.420 958 HD21 LEU 124 1HD2 LEU 124 -6.716 6.319 -6.419 959 HD22 LEU 124 2HD2 LEU 124 -6.630 8.009 -6.913 960 HD23 LEU 124 3HD2 LEU 124 -6.738 6.739 -8.132 961 H HIS 125 H HIS 125 -10.527 8.868 -10.228 962 HA HIS 125 HA HIS 125 -10.358 11.120 -8.503 963 HB2 HIS 125 2HB HIS 125 -9.722 11.357 -10.818 964 HB3 HIS 125 1HB HIS 125 -11.347 10.924 -11.349 965 HD1 HIS 125 1HD HIS 125 -11.131 13.064 -8.352 966 HD2 HIS 125 2HD HIS 125 -11.577 13.627 -12.460 967 HE1 HIS 125 1HE HIS 125 -11.946 15.436 -8.658 968 HE2 HIS 125 2HE HIS 125 -12.200 15.804 -11.159 969 H ARG 126 H ARG 126 -13.157 9.345 -9.698 970 HA ARG 126 HA ARG 126 -15.203 11.190 -9.367 971 HB2 ARG 126 2HB ARG 126 -16.630 9.394 -9.326 972 HB3 ARG 126 1HB ARG 126 -15.171 8.517 -9.778 973 HG2 ARG 126 2HG ARG 126 -14.745 8.166 -7.296 974 HG3 ARG 126 1HG ARG 126 -16.367 8.797 -7.011 975 HD2 ARG 126 2HD ARG 126 -17.157 7.035 -8.720 976 HD3 ARG 126 1HD ARG 126 -15.574 6.294 -8.492 977 HE ARG 126 HE ARG 126 -16.412 6.532 -5.919 978 HH11 ARG 126 1HH1 ARG 126 -17.804 5.109 -4.841 979 HH12 ARG 126 2HH1 ARG 126 -18.932 4.165 -5.755 980 HH21 ARG 126 1HH2 ARG 126 -17.946 5.461 -8.816 981 HH22 ARG 126 2HH2 ARG 126 -19.014 4.365 -8.003 982 H HIS 127 H HIS 127 -13.280 9.603 -6.893 983 HA HIS 127 HA HIS 127 -14.833 10.303 -4.620 984 HB2 HIS 127 2HB HIS 127 -12.800 8.772 -4.688 985 HB3 HIS 127 1HB HIS 127 -11.813 10.231 -4.718 986 HD1 HIS 127 1HD HIS 127 -14.086 11.664 -2.755 987 HD2 HIS 127 2HD HIS 127 -11.768 8.276 -2.019 988 HE1 HIS 127 1HE HIS 127 -13.980 11.402 -0.235 989 HE2 HIS 127 2HE HIS 127 -12.571 9.342 0.224 990 H GLY 128 H GLY 128 -12.334 12.103 -6.371 991 HA2 GLY 128 2HA GLY 128 -11.575 14.324 -6.031 992 HA3 GLY 128 1HA GLY 128 -13.305 14.648 -6.143 993 H ASP 129 H ASP 129 -13.591 16.172 -4.555 994 HA ASP 129 HA ASP 129 -13.603 17.129 -2.410 995 HB2 ASP 129 2HB ASP 129 -13.880 14.184 -1.749 996 HB3 ASP 129 1HB ASP 129 -14.168 15.493 -0.602 997 H GLY 130 H GLY 130 -10.955 16.486 -3.524 998 HA2 GLY 130 2HA GLY 130 -8.774 16.811 -2.668 999 HA3 GLY 130 1HA GLY 130 -9.438 16.731 -1.039 1000 H ALA 131 H ALA 131 -10.458 14.078 -2.909 1001 HA ALA 131 HA ALA 131 -9.143 12.165 -1.272 1002 HB1 ALA 131 1HB ALA 131 -9.954 10.511 -2.801 1003 HB2 ALA 131 2HB ALA 131 -10.035 11.679 -4.121 1004 HB3 ALA 131 3HB ALA 131 -11.165 11.792 -2.773 1005 H TRP 132 H TRP 132 -8.186 13.655 -4.327 1006 HA TRP 132 HA TRP 132 -6.021 11.955 -4.995 1007 HB2 TRP 132 2HB TRP 132 -6.881 13.686 -6.509 1008 HB3 TRP 132 1HB TRP 132 -6.304 14.942 -5.417 1009 HD1 TRP 132 HD TRP 132 -4.110 15.941 -6.142 1010 HE1 TRP 132 1HE TRP 132 -2.026 15.131 -7.423 1011 HE3 TRP 132 3HE TRP 132 -5.427 11.076 -7.001 1012 HZ2 TRP 132 2HZ TRP 132 -1.047 12.744 -8.649 1013 HZ3 TRP 132 3HZ TRP 132 -3.894 9.562 -8.223 1014 HH2 TRP 132 HH TRP 132 -1.714 10.387 -9.051 1015 H ASN 133 H ASN 133 -6.148 14.732 -2.787 1016 HA ASN 133 HA ASN 133 -3.364 14.951 -2.275 1017 HB2 ASN 133 2HB ASN 133 -5.216 16.513 -1.479 1018 HB3 ASN 133 1HB ASN 133 -5.531 15.342 -0.197 1019 HD21 ASN 133 1HD2 ASN 133 -4.420 15.805 1.700 1020 HD22 ASN 133 2HD2 ASN 133 -2.928 16.607 1.789 1021 H ILE 134 H ILE 134 -5.818 12.835 -0.778 1022 HA ILE 134 HA ILE 134 -4.077 11.720 1.202 1023 HB ILE 134 HB ILE 134 -6.670 10.965 -0.037 1024 HG12 ILE 134 2HG1 ILE 134 -7.371 10.926 2.280 1025 HG13 ILE 134 1HG1 ILE 134 -5.694 10.960 2.831 1026 HG21 ILE 134 1HG2 ILE 134 -5.664 8.813 -0.190 1027 HG22 ILE 134 2HG2 ILE 134 -6.553 8.794 1.332 1028 HG23 ILE 134 3HG2 ILE 134 -4.805 9.024 1.336 1029 HD11 ILE 134 1HD1 ILE 134 -7.132 13.187 2.710 1030 HD12 ILE 134 2HD1 ILE 134 -6.629 13.150 1.022 1031 HD13 ILE 134 3HD1 ILE 134 -5.419 13.195 2.303 1032 H HIS 135 H HIS 135 -4.879 10.675 -2.105 1033 HA HIS 135 HA HIS 135 -3.278 8.317 -2.109 1034 HB2 HIS 135 2HB HIS 135 -4.943 8.924 -3.879 1035 HB3 HIS 135 1HB HIS 135 -3.838 10.179 -4.436 1036 HD1 HIS 135 1HD HIS 135 -1.560 7.754 -3.461 1037 HD2 HIS 135 2HD HIS 135 -4.232 7.926 -6.659 1038 HE1 HIS 135 1HE HIS 135 -0.703 6.127 -5.203 1039 HE2 HIS 135 2HE HIS 135 -2.320 6.224 -7.153 1040 H LYS 136 H LYS 136 -2.538 11.701 -2.742 1041 HA LYS 136 HA LYS 136 0.096 11.433 -3.730 1042 HB2 LYS 136 2HB LYS 136 -1.228 13.554 -3.658 1043 HB3 LYS 136 1HB LYS 136 -0.955 13.614 -1.924 1044 HG2 LYS 136 2HG LYS 136 1.484 13.622 -2.328 1045 HG3 LYS 136 1HG LYS 136 1.174 13.644 -4.059 1046 HD2 LYS 136 2HD LYS 136 -0.130 15.761 -3.746 1047 HD3 LYS 136 1HD LYS 136 0.370 15.766 -2.055 1048 HE2 LYS 136 2HE LYS 136 2.771 15.674 -2.877 1049 HE3 LYS 136 1HE LYS 136 2.143 15.974 -4.499 1050 HZ1 LYS 136 1HZ LYS 136 1.344 18.056 -3.885 1051 HZ2 LYS 136 2HZ LYS 136 2.861 17.973 -3.126 1052 HZ3 LYS 136 3HZ LYS 136 1.443 17.726 -2.225 1053 H ALA 137 H ALA 137 -1.080 11.640 -0.382 1054 HA ALA 137 HA ALA 137 1.547 11.571 0.804 1055 HB1 ALA 137 1HB ALA 137 -1.249 11.422 1.736 1056 HB2 ALA 137 2HB ALA 137 0.124 12.283 2.430 1057 HB3 ALA 137 3HB ALA 137 -0.090 10.562 2.749 1058 H LEU 138 H LEU 138 -0.827 9.060 0.008 1059 HA LEU 138 HA LEU 138 0.583 6.905 1.268 1060 HB2 LEU 138 2HB LEU 138 -1.327 6.855 -1.081 1061 HB3 LEU 138 1HB LEU 138 -0.849 5.460 -0.127 1062 HG LEU 138 HG LEU 138 -2.264 7.909 0.947 1063 HD11 LEU 138 1HD1 LEU 138 -3.373 5.918 -0.568 1064 HD12 LEU 138 2HD1 LEU 138 -4.247 6.816 0.674 1065 HD13 LEU 138 3HD1 LEU 138 -3.539 5.247 1.054 1066 HD21 LEU 138 1HD2 LEU 138 -2.555 5.980 2.814 1067 HD22 LEU 138 2HD2 LEU 138 -1.215 7.127 2.826 1068 HD23 LEU 138 3HD2 LEU 138 -0.991 5.515 2.149 1069 H ASP 139 H ASP 139 0.768 8.375 -1.931 1070 HA ASP 139 HA ASP 139 2.620 6.311 -2.891 1071 HB2 ASP 139 2HB ASP 139 0.981 7.435 -4.404 1072 HB3 ASP 139 1HB ASP 139 1.858 8.946 -4.171 1073 H GLY 140 H GLY 140 4.633 6.382 -2.011 1074 HA2 GLY 140 2HA GLY 140 5.882 8.861 -1.144 1075 HA3 GLY 140 1HA GLY 140 6.671 7.283 -1.225 1076 HA PRO 141 HA PRO 141 8.723 8.456 -4.947 1077 HB2 PRO 141 2HB PRO 141 8.664 6.126 -6.396 1078 HB3 PRO 141 1HB PRO 141 9.723 6.383 -4.997 1079 HG2 PRO 141 2HG PRO 141 7.160 4.894 -5.182 1080 HG3 PRO 141 1HG PRO 141 8.615 4.532 -4.239 1081 HD2 PRO 141 2HD PRO 141 6.351 5.646 -3.151 1082 HD3 PRO 141 1HD PRO 141 7.981 5.892 -2.487 1083 H SER 142 H SER 142 8.222 9.340 -6.975 1084 HA SER 142 HA SER 142 5.449 9.510 -7.722 1085 HB2 SER 142 2HB SER 142 6.440 11.366 -8.565 1086 HB3 SER 142 1HB SER 142 8.011 10.585 -8.702 1087 HG SER 142 HG SER 142 5.867 9.895 -10.406 1088 HA PRO 143 HA PRO 143 6.611 6.799 -11.586 1089 HB2 PRO 143 2HB PRO 143 8.985 5.370 -11.258 1090 HB3 PRO 143 1HB PRO 143 8.783 6.826 -12.247 1091 HG2 PRO 143 2HG PRO 143 9.894 6.533 -9.511 1092 HG3 PRO 143 1HG PRO 143 10.368 7.635 -10.814 1093 HD2 PRO 143 2HD PRO 143 8.922 8.484 -8.693 1094 HD3 PRO 143 1HD PRO 143 8.696 9.165 -10.319 1095 H GLY 144 H GLY 144 5.995 4.620 -11.824 1096 HA2 GLY 144 2HA GLY 144 5.634 2.366 -11.150 1097 HA3 GLY 144 1HA GLY 144 6.384 2.738 -9.600 1098 H GLU 145 H GLU 145 4.016 1.274 -9.702 1099 HA GLU 145 HA GLU 145 1.912 3.230 -8.894 1100 HB2 GLU 145 2HB GLU 145 1.715 0.285 -9.602 1101 HB3 GLU 145 1HB GLU 145 0.355 1.303 -9.126 1102 HG2 GLU 145 2HG GLU 145 2.154 1.813 -11.515 1103 HG3 GLU 145 1HG GLU 145 0.540 1.109 -11.595 1104 H THR 146 H THR 146 0.403 1.513 -7.254 1105 HA THR 146 HA THR 146 1.686 1.817 -4.738 1106 HB THR 146 HB THR 146 -0.514 -0.105 -5.518 1107 HG1 THR 146 1HG THR 146 -1.820 1.535 -5.260 1108 HG21 THR 146 1HG2 THR 146 0.173 -0.886 -3.434 1109 HG22 THR 146 2HG2 THR 146 -1.037 0.314 -2.979 1110 HG23 THR 146 3HG2 THR 146 0.678 0.716 -2.893 1111 H LEU 147 H LEU 147 1.493 -0.958 -6.922 1112 HA LEU 147 HA LEU 147 2.723 -2.860 -5.207 1113 HB2 LEU 147 2HB LEU 147 2.973 -2.726 -8.219 1114 HB3 LEU 147 1HB LEU 147 3.081 -4.157 -7.193 1115 HG LEU 147 HG LEU 147 0.618 -2.425 -7.523 1116 HD11 LEU 147 1HD1 LEU 147 1.046 -3.753 -9.520 1117 HD12 LEU 147 2HD1 LEU 147 -0.294 -4.472 -8.629 1118 HD13 LEU 147 3HD1 LEU 147 1.311 -5.196 -8.540 1119 HD21 LEU 147 1HD2 LEU 147 0.287 -3.305 -5.421 1120 HD22 LEU 147 2HD2 LEU 147 1.380 -4.661 -5.703 1121 HD23 LEU 147 3HD2 LEU 147 -0.255 -4.691 -6.367 1122 H ALA 148 H ALA 148 4.056 -0.309 -7.226 1123 HA ALA 148 HA ALA 148 6.746 -1.199 -7.375 1124 HB1 ALA 148 1HB ALA 148 5.297 1.142 -8.049 1125 HB2 ALA 148 2HB ALA 148 6.941 0.719 -8.529 1126 HB3 ALA 148 3HB ALA 148 6.664 1.658 -7.061 1127 H ARG 149 H ARG 149 5.396 1.165 -5.032 1128 HA ARG 149 HA ARG 149 7.769 1.166 -3.413 1129 HB2 ARG 149 2HB ARG 149 6.432 2.376 -1.782 1130 HB3 ARG 149 1HB ARG 149 6.052 2.980 -3.392 1131 HG2 ARG 149 2HG ARG 149 4.097 1.396 -3.437 1132 HG3 ARG 149 1HG ARG 149 4.426 1.029 -1.743 1133 HD2 ARG 149 2HD ARG 149 4.213 3.470 -1.228 1134 HD3 ARG 149 1HD ARG 149 3.741 3.745 -2.905 1135 HE ARG 149 HE ARG 149 1.631 2.748 -2.434 1136 HH11 ARG 149 1HH1 ARG 149 0.095 1.988 -0.962 1137 HH12 ARG 149 2HH1 ARG 149 0.590 1.562 0.643 1138 HH21 ARG 149 1HH2 ARG 149 3.923 2.353 0.111 1139 HH22 ARG 149 2HH2 ARG 149 2.756 1.769 1.249 1140 H PHE 150 H PHE 150 4.722 -0.630 -3.242 1141 HA PHE 150 HA PHE 150 5.208 -1.931 -0.742 1142 HB2 PHE 150 2HB PHE 150 2.997 -1.898 -1.802 1143 HB3 PHE 150 1HB PHE 150 3.615 -2.838 -3.152 1144 HD1 PHE 150 1HD PHE 150 3.063 -2.950 0.539 1145 HD2 PHE 150 2HD PHE 150 3.716 -5.185 -3.070 1146 HE1 PHE 150 1HE PHE 150 2.581 -5.059 1.755 1147 HE2 PHE 150 2HE PHE 150 3.234 -7.292 -1.856 1148 HZ PHE 150 HZ PHE 150 2.673 -7.228 0.554 1149 H ALA 151 H ALA 151 6.049 -2.826 -4.080 1150 HA ALA 151 HA ALA 151 7.068 -5.431 -3.432 1151 HB1 ALA 151 1HB ALA 151 6.448 -4.618 -5.733 1152 HB2 ALA 151 2HB ALA 151 8.022 -5.410 -5.650 1153 HB3 ALA 151 3HB ALA 151 7.922 -3.651 -5.725 1154 H ASN 152 H ASN 152 8.693 -2.267 -3.745 1155 HA ASN 152 HA ASN 152 11.341 -3.279 -3.396 1156 HB2 ASN 152 2HB ASN 152 11.992 -1.096 -3.474 1157 HB3 ASN 152 1HB ASN 152 10.326 -0.838 -3.991 1158 HD21 ASN 152 1HD2 ASN 152 8.841 0.121 -2.469 1159 HD22 ASN 152 2HD2 ASN 152 9.360 0.785 -0.997 1160 H VAL 153 H VAL 153 9.094 -1.880 -0.987 1161 HA VAL 153 HA VAL 153 10.886 -2.343 1.220 1162 HB VAL 153 HB VAL 153 8.942 -1.848 2.625 1163 HG11 VAL 153 1HG1 VAL 153 9.159 0.331 2.093 1164 HG12 VAL 153 2HG1 VAL 153 8.299 0.095 0.571 1165 HG13 VAL 153 3HG1 VAL 153 10.040 -0.180 0.653 1166 HG21 VAL 153 1HG2 VAL 153 6.779 -1.306 1.255 1167 HG22 VAL 153 2HG2 VAL 153 7.125 -2.981 1.681 1168 HG23 VAL 153 3HG2 VAL 153 7.481 -2.392 0.058 1169 H ILE 154 H ILE 154 8.561 -4.325 -0.466 1170 HA ILE 154 HA ILE 154 8.460 -6.355 1.644 1171 HB ILE 154 HB ILE 154 7.362 -6.138 -1.147 1172 HG12 ILE 154 2HG1 ILE 154 6.418 -5.062 1.087 1173 HG13 ILE 154 1HG1 ILE 154 5.334 -5.765 -0.106 1174 HG21 ILE 154 1HG2 ILE 154 7.811 -8.430 -1.059 1175 HG22 ILE 154 2HG2 ILE 154 6.155 -8.322 -0.458 1176 HG23 ILE 154 3HG2 ILE 154 7.494 -8.521 0.673 1177 HD11 ILE 154 1HD1 ILE 154 5.028 -7.736 1.151 1178 HD12 ILE 154 2HD1 ILE 154 5.036 -6.470 2.377 1179 HD13 ILE 154 3HD1 ILE 154 6.477 -7.450 2.114
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