NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
599792 | 2nb4 | 25961 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA PRO 1 HA PRO 1 1.844 0.806 -1.891 2 HB2 PRO 1 2HB PRO 1 4.255 -0.324 -1.359 3 HB3 PRO 1 3HB PRO 1 3.797 1.282 -0.777 4 HG2 PRO 1 2HG PRO 1 3.762 -1.338 0.671 5 HG3 PRO 1 3HG PRO 1 4.307 0.250 1.243 6 HD2 PRO 1 2HD PRO 1 1.887 -0.780 1.888 7 HD3 PRO 1 3HD PRO 1 2.162 0.963 1.693 8 H LEU 2 H LEU 2 2.761 -0.475 -3.642 9 HA LEU 2 HA LEU 2 2.755 -3.337 -3.486 10 HB2 LEU 2 2HB LEU 2 0.387 -1.893 -4.426 11 HB3 LEU 2 3HB LEU 2 0.976 -3.120 -5.545 12 HG LEU 2 HG LEU 2 0.894 -4.299 -2.973 13 HD11 LEU 2 1HD1 LEU 2 -1.873 -3.481 -3.541 14 HD12 LEU 2 2HD1 LEU 2 -0.832 -2.226 -2.870 15 HD13 LEU 2 3HD1 LEU 2 -1.055 -3.744 -2.001 16 HD21 LEU 2 3HD2 LEU 2 -1.022 -5.572 -4.153 17 HD22 LEU 2 1HD2 LEU 2 0.608 -5.677 -4.816 18 HD23 LEU 2 2HD2 LEU 2 -0.579 -4.607 -5.562 19 H THR 3 H THR 3 3.554 -4.337 -5.394 20 HA THR 3 HA THR 3 4.606 -2.482 -7.423 21 HB THR 3 HB THR 3 6.340 -3.269 -5.702 22 HG1 THR 3 HG1 THR 3 7.554 -2.653 -7.312 23 HG21 THR 3 3HG2 THR 3 6.971 -5.438 -5.573 24 HG22 THR 3 1HG2 THR 3 6.694 -5.731 -7.290 25 HG23 THR 3 2HG2 THR 3 5.336 -5.735 -6.164 26 H ARG 4 H ARG 4 5.378 -3.682 -9.406 27 HA ARG 4 HA ARG 4 3.266 -5.380 -10.322 28 HB2 ARG 4 2HB ARG 4 5.582 -3.997 -11.499 29 HB3 ARG 4 3HB ARG 4 5.158 -5.511 -12.286 30 HG2 ARG 4 2HG ARG 4 4.034 -3.730 -13.409 31 HG3 ARG 4 3HG ARG 4 2.833 -4.673 -12.524 32 HD2 ARG 4 2HD ARG 4 2.183 -2.856 -11.427 33 HD3 ARG 4 3HD ARG 4 3.820 -2.616 -10.817 34 HE ARG 4 HE ARG 4 3.474 -1.685 -13.506 35 HH11 ARG 4 1HH1 ARG 4 3.075 -0.875 -10.144 36 HH12 ARG 4 2HH1 ARG 4 3.156 0.835 -10.412 37 HH21 ARG 4 2HH2 ARG 4 3.442 1.652 -12.533 38 HH22 ARG 4 1HH2 ARG 4 3.581 0.563 -13.872 39 HA PRO 5 HA PRO 5 4.931 -9.387 -9.678 40 HB2 PRO 5 2HB PRO 5 4.268 -10.677 -11.973 41 HB3 PRO 5 3HB PRO 5 3.078 -10.228 -10.745 42 HG2 PRO 5 2HG PRO 5 3.767 -8.847 -13.311 43 HG3 PRO 5 3HG PRO 5 2.172 -9.156 -12.599 44 HD2 PRO 5 2HD PRO 5 3.406 -6.752 -12.422 45 HD3 PRO 5 3HD PRO 5 2.334 -7.371 -11.149 46 H TYR 6 H TYR 6 7.155 -8.428 -9.787 47 HA TYR 6 HA TYR 6 8.594 -9.472 -12.137 48 HB2 TYR 6 2HB TYR 6 8.470 -6.815 -11.339 49 HB3 TYR 6 3HB TYR 6 10.015 -7.370 -10.705 50 HD1 TYR 6 HD1 TYR 6 8.031 -6.872 -13.769 51 HD2 TYR 6 HD2 TYR 6 11.840 -7.887 -12.168 52 HE1 TYR 6 HE1 TYR 6 9.032 -6.610 -16.000 53 HE2 TYR 6 HE2 TYR 6 12.852 -7.627 -14.395 54 HH TYR 6 HH TYR 6 11.139 -6.232 -17.040 55 H LEU 7 H LEU 7 10.209 -10.859 -11.744 56 HA LEU 7 HA LEU 7 11.005 -11.265 -8.937 57 HB2 LEU 7 2HB LEU 7 11.651 -13.583 -9.773 58 HB3 LEU 7 3HB LEU 7 9.933 -13.222 -9.608 59 HG LEU 7 HG LEU 7 10.999 -12.708 -12.286 60 HD11 LEU 7 1HD1 LEU 7 12.273 -14.764 -11.383 61 HD12 LEU 7 2HD1 LEU 7 11.474 -14.877 -12.951 62 HD13 LEU 7 3HD1 LEU 7 10.721 -15.588 -11.524 63 HD21 LEU 7 3HD2 LEU 7 8.937 -13.522 -12.960 64 HD22 LEU 7 1HD2 LEU 7 8.572 -12.806 -11.391 65 HD23 LEU 7 2HD2 LEU 7 8.763 -14.553 -11.539 66 H GLY 8 H GLY 8 13.048 -10.839 -8.425 67 HA2 GLY 8 2HA GLY 8 15.047 -10.823 -10.603 68 HA3 GLY 8 3HA GLY 8 15.023 -9.608 -9.333 69 H PHE 9 H PHE 9 14.622 -13.128 -9.119 70 HA PHE 9 HA PHE 9 17.239 -13.557 -8.058 71 HB2 PHE 9 2HB PHE 9 16.496 -14.260 -5.788 72 HB3 PHE 9 3HB PHE 9 16.297 -12.535 -6.077 73 HD1 PHE 9 HD1 PHE 9 14.010 -11.655 -6.627 74 HD2 PHE 9 HD2 PHE 9 14.672 -15.614 -5.213 75 HE1 PHE 9 HE1 PHE 9 11.638 -11.821 -5.992 76 HE2 PHE 9 HE2 PHE 9 12.302 -15.787 -4.576 77 HZ PHE 9 HZ PHE 9 10.781 -13.890 -4.967 78 H ARG 10 H ARG 10 17.412 -15.850 -7.145 79 HA ARG 10 HA ARG 10 15.648 -17.612 -8.715 80 HB2 ARG 10 2HB ARG 10 18.567 -17.532 -8.339 81 HB3 ARG 10 3HB ARG 10 17.856 -19.134 -8.201 82 HG2 ARG 10 2HG ARG 10 16.645 -18.213 -10.449 83 HG3 ARG 10 3HG ARG 10 18.222 -17.427 -10.551 84 HD2 ARG 10 2HD ARG 10 19.363 -19.443 -10.641 85 HD3 ARG 10 3HD ARG 10 18.035 -20.340 -9.907 86 HE ARG 10 HE ARG 10 17.355 -19.244 -12.462 87 HH11 ARG 10 1HH1 ARG 10 18.920 -21.901 -10.846 88 HH12 ARG 10 2HH1 ARG 10 18.680 -23.009 -12.156 89 HH21 ARG 10 2HH2 ARG 10 17.607 -22.321 -14.060 90 HH22 ARG 10 1HH2 ARG 10 17.033 -20.694 -14.193 91 H VAL 11 H VAL 11 14.797 -19.434 -7.769 92 HA VAL 11 HA VAL 11 15.399 -19.893 -4.929 93 HB VAL 11 HB VAL 11 13.024 -20.235 -4.442 94 HG11 VAL 11 1HG1 VAL 11 13.669 -17.548 -5.650 95 HG12 VAL 11 2HG1 VAL 11 12.304 -17.872 -4.578 96 HG13 VAL 11 3HG1 VAL 11 13.956 -18.056 -3.986 97 HG21 VAL 11 3HG2 VAL 11 11.994 -20.888 -6.410 98 HG22 VAL 11 1HG2 VAL 11 11.424 -19.230 -6.223 99 HG23 VAL 11 2HG2 VAL 11 12.733 -19.590 -7.348 100 H ALA 12 H ALA 12 15.670 -21.975 -4.407 101 HA ALA 12 HA ALA 12 14.789 -24.012 -6.349 102 HB1 ALA 12 1HB ALA 12 17.091 -24.055 -6.590 103 HB2 ALA 12 2HB ALA 12 17.379 -23.731 -4.880 104 HB3 ALA 12 3HB ALA 12 16.811 -25.320 -5.393 105 H VAL 13 H VAL 13 13.383 -25.428 -5.567 106 HA VAL 13 HA VAL 13 12.769 -25.492 -2.753 107 HB VAL 13 HB VAL 13 10.936 -25.634 -4.321 108 HG11 VAL 13 1HG1 VAL 13 11.029 -26.805 -6.206 109 HG12 VAL 13 2HG1 VAL 13 12.667 -27.298 -5.770 110 HG13 VAL 13 3HG1 VAL 13 11.291 -28.304 -5.315 111 HG21 VAL 13 3HG2 VAL 13 9.814 -27.651 -3.480 112 HG22 VAL 13 1HG2 VAL 13 11.360 -28.250 -2.880 113 HG23 VAL 13 2HG2 VAL 13 10.657 -26.784 -2.196 114 H GLY 14 H GLY 14 13.694 -26.779 -1.307 115 HA2 GLY 14 2HA GLY 14 14.429 -29.500 -2.019 116 HA3 GLY 14 3HA GLY 14 15.764 -28.453 -1.561 117 H ARG 15 H ARG 15 16.177 -29.864 0.215 118 HA ARG 15 HA ARG 15 14.394 -29.340 2.491 119 HB2 ARG 15 2HB ARG 15 15.788 -31.983 2.095 120 HB3 ARG 15 3HB ARG 15 14.537 -31.582 3.264 121 HG2 ARG 15 2HG ARG 15 14.127 -31.666 0.283 122 HG3 ARG 15 3HG ARG 15 13.733 -32.979 1.395 123 HD2 ARG 15 2HD ARG 15 12.637 -30.283 1.985 124 HD3 ARG 15 3HD ARG 15 11.937 -31.176 0.636 125 HE ARG 15 HE ARG 15 11.588 -31.715 3.419 126 HH11 ARG 15 1HH1 ARG 15 11.705 -33.174 0.261 127 HH12 ARG 15 2HH1 ARG 15 10.713 -34.523 0.704 128 HH21 ARG 15 2HH2 ARG 15 9.903 -34.700 2.840 129 HH22 ARG 15 1HH2 ARG 15 10.281 -33.487 4.015 130 H ASP 16 H ASP 16 15.389 -28.851 4.385 131 HA ASP 16 HA ASP 16 18.304 -28.568 4.284 132 HB2 ASP 16 2HB ASP 16 17.872 -27.152 6.384 133 HB3 ASP 16 3HB ASP 16 17.318 -26.507 4.841 134 H SER 17 H SER 17 19.137 -28.589 6.782 135 HA SER 17 HA SER 17 19.297 -31.295 7.467 136 HB2 SER 17 2HB SER 17 20.950 -29.514 8.100 137 HB3 SER 17 3HB SER 17 19.806 -28.959 9.322 138 HG SER 17 HG SER 17 20.416 -30.539 10.558 139 H SER 18 H SER 18 17.002 -28.857 8.346 140 HA SER 18 HA SER 18 15.925 -30.401 10.557 141 HB2 SER 18 2HB SER 18 14.961 -28.469 11.218 142 HB3 SER 18 3HB SER 18 15.987 -27.703 10.005 143 HG SER 18 HG SER 18 13.272 -28.443 9.817 144 H GLY 19 H GLY 19 14.915 -29.363 7.315 145 HA2 GLY 19 2HA GLY 19 13.624 -30.625 5.819 146 HA3 GLY 19 3HA GLY 19 13.199 -31.709 7.135 147 H CYS 20 H CYS 20 12.792 -28.235 6.425 148 HA CYS 20 HA CYS 20 9.980 -28.513 7.256 149 HB2 CYS 20 2HB CYS 20 11.988 -26.336 7.625 150 HB3 CYS 20 3HB CYS 20 10.297 -25.885 7.448 151 HG CYS 20 HG CYS 20 11.849 -26.857 10.125 152 H THR 21 H THR 21 11.585 -28.632 4.557 153 HA THR 21 HA THR 21 11.224 -28.097 2.372 154 HB THR 21 HB THR 21 8.399 -27.476 3.248 155 HG1 THR 21 HG1 THR 21 8.039 -29.598 3.319 156 HG21 THR 21 3HG2 THR 21 9.731 -27.557 0.702 157 HG22 THR 21 1HG2 THR 21 8.066 -27.113 1.074 158 HG23 THR 21 2HG2 THR 21 8.483 -28.800 0.772 159 H THR 22 H THR 22 12.576 -26.255 2.396 160 HA THR 22 HA THR 22 11.095 -23.731 2.135 161 HB THR 22 HB THR 22 12.066 -23.468 4.274 162 HG1 THR 22 HG1 THR 22 12.493 -21.735 2.742 163 HG21 THR 22 3HG2 THR 22 14.591 -23.806 4.549 164 HG22 THR 22 1HG2 THR 22 14.505 -24.735 3.053 165 HG23 THR 22 2HG2 THR 22 13.585 -25.252 4.467 166 H LEU 23 H LEU 23 12.202 -22.109 0.849 167 HA LEU 23 HA LEU 23 13.916 -23.351 -1.190 168 HB2 LEU 23 2HB LEU 23 12.068 -20.981 -1.269 169 HB3 LEU 23 3HB LEU 23 13.230 -21.322 -2.550 170 HG LEU 23 HG LEU 23 12.016 -23.654 -2.591 171 HD11 LEU 23 1HD1 LEU 23 9.853 -21.848 -1.521 172 HD12 LEU 23 2HD1 LEU 23 10.614 -23.163 -0.627 173 HD13 LEU 23 3HD1 LEU 23 9.662 -23.513 -2.069 174 HD21 LEU 23 3HD2 LEU 23 11.963 -22.471 -4.562 175 HD22 LEU 23 1HD2 LEU 23 11.230 -21.050 -3.817 176 HD23 LEU 23 2HD2 LEU 23 10.253 -22.486 -4.129 177 H SER 24 H SER 24 15.949 -22.684 -1.481 178 HA SER 24 HA SER 24 16.945 -20.535 0.225 179 HB2 SER 24 2HB SER 24 17.975 -23.011 -0.432 180 HB3 SER 24 3HB SER 24 18.909 -21.917 -1.452 181 HG SER 24 HG SER 24 19.048 -22.312 1.224 182 H ILE 25 H ILE 25 18.071 -18.751 -0.539 183 HA ILE 25 HA ILE 25 17.465 -18.037 -3.309 184 HB ILE 25 HB ILE 25 18.582 -16.238 -1.161 185 HG12 ILE 25 2HG1 ILE 25 16.454 -17.135 -0.386 186 HG13 ILE 25 3HG1 ILE 25 16.254 -15.449 -0.853 187 HG21 ILE 25 1HG2 ILE 25 17.942 -14.440 -2.555 188 HG22 ILE 25 2HG2 ILE 25 18.777 -15.593 -3.594 189 HG23 ILE 25 3HG2 ILE 25 17.016 -15.498 -3.619 190 HD11 ILE 25 3HD1 ILE 25 15.709 -17.041 -3.125 191 HD12 ILE 25 1HD1 ILE 25 14.832 -17.725 -1.757 192 HD13 ILE 25 2HD1 ILE 25 14.603 -16.031 -2.194 193 H GLN 26 H GLN 26 18.974 -17.842 -4.845 194 HA GLN 26 HA GLN 26 21.772 -18.272 -4.070 195 HB2 GLN 26 2HB GLN 26 20.317 -18.688 -6.681 196 HB3 GLN 26 3HB GLN 26 22.065 -18.802 -6.527 197 HG2 GLN 26 2HG GLN 26 21.906 -20.893 -5.841 198 HG3 GLN 26 3HG GLN 26 20.853 -20.411 -4.512 199 HE21 GLN 26 2HE2 GLN 26 17.854 -21.001 -6.445 200 HE22 GLN 26 1HE2 GLN 26 18.555 -19.783 -5.441 201 H GLU 27 H GLU 27 19.612 -15.986 -5.501 202 HA GLU 27 HA GLU 27 21.892 -14.256 -6.200 203 HB2 GLU 27 2HB GLU 27 19.620 -14.981 -7.706 204 HB3 GLU 27 3HB GLU 27 19.389 -13.299 -7.250 205 HG2 GLU 27 2HG GLU 27 20.592 -12.870 -9.080 206 HG3 GLU 27 3HG GLU 27 21.973 -13.260 -8.057 207 H VAL 28 H VAL 28 20.741 -11.824 -6.310 208 HA VAL 28 HA VAL 28 19.991 -11.353 -3.508 209 HB VAL 28 HB VAL 28 20.959 -9.287 -5.480 210 HG11 VAL 28 1HG1 VAL 28 19.851 -8.291 -3.628 211 HG12 VAL 28 2HG1 VAL 28 20.678 -9.348 -2.482 212 HG13 VAL 28 3HG1 VAL 28 21.583 -8.107 -3.351 213 HG21 VAL 28 3HG2 VAL 28 22.658 -11.028 -5.253 214 HG22 VAL 28 1HG2 VAL 28 23.174 -9.530 -4.477 215 HG23 VAL 28 2HG2 VAL 28 22.589 -10.874 -3.497 216 H THR 29 H THR 29 18.022 -10.644 -3.008 217 HA THR 29 HA THR 29 16.311 -9.637 -5.187 218 HB THR 29 HB THR 29 15.374 -11.692 -4.460 219 HG1 THR 29 HG1 THR 29 13.969 -9.712 -4.498 220 HG21 THR 29 3HG2 THR 29 15.961 -12.498 -2.463 221 HG22 THR 29 1HG2 THR 29 14.764 -11.418 -1.749 222 HG23 THR 29 2HG2 THR 29 16.444 -10.900 -1.895 223 H GLN 30 H GLN 30 17.833 -8.856 -2.280 224 HA GLN 30 HA GLN 30 15.896 -6.828 -1.504 225 HB2 GLN 30 2HB GLN 30 18.444 -7.869 -0.307 226 HB3 GLN 30 3HB GLN 30 17.754 -6.350 0.249 227 HG2 GLN 30 2HG GLN 30 16.976 -8.001 1.727 228 HG3 GLN 30 3HG GLN 30 15.617 -7.611 0.675 229 HE21 GLN 30 2HE2 GLN 30 17.550 -11.147 -0.060 230 HE22 GLN 30 1HE2 GLN 30 18.447 -9.719 0.314 231 H THR 31 H THR 31 17.843 -6.902 -3.962 232 HA THR 31 HA THR 31 18.943 -4.197 -3.573 233 HB THR 31 HB THR 31 20.314 -4.843 -5.681 234 HG1 THR 31 HG1 THR 31 20.699 -7.187 -5.658 235 HG21 THR 31 3HG2 THR 31 22.076 -5.765 -4.313 236 HG22 THR 31 1HG2 THR 31 20.916 -6.245 -3.075 237 HG23 THR 31 2HG2 THR 31 21.218 -4.535 -3.385 238 H TYR 32 H TYR 32 16.202 -5.233 -4.518 239 HA TYR 32 HA TYR 32 16.119 -3.652 -7.004 240 HB2 TYR 32 2HB TYR 32 14.889 -6.269 -6.316 241 HB3 TYR 32 3HB TYR 32 13.923 -5.161 -7.284 242 HD1 TYR 32 HD1 TYR 32 17.104 -7.043 -7.173 243 HD2 TYR 32 HD2 TYR 32 14.409 -4.797 -9.580 244 HE1 TYR 32 HE1 TYR 32 18.315 -7.761 -9.189 245 HE2 TYR 32 HE2 TYR 32 15.612 -5.510 -11.603 246 HH TYR 32 HH TYR 32 17.631 -8.030 -11.750 247 H THR 33 H THR 33 14.302 -2.327 -7.336 248 HA THR 33 HA THR 33 12.251 -2.096 -5.335 249 HB THR 33 HB THR 33 14.022 0.319 -5.668 250 HG1 THR 33 HG1 THR 33 15.021 -0.264 -3.743 251 HG21 THR 33 3HG2 THR 33 12.897 0.911 -3.482 252 HG22 THR 33 1HG2 THR 33 11.821 -0.458 -3.760 253 HG23 THR 33 2HG2 THR 33 11.847 0.889 -4.898 254 H GLY 34 H GLY 34 10.651 -0.435 -5.878 255 HA2 GLY 34 2HA GLY 34 10.750 1.085 -8.247 256 HA3 GLY 34 3HA GLY 34 9.978 -0.454 -8.598 257 H SER 35 H SER 35 8.880 -0.565 -5.822 258 HA SER 35 HA SER 35 6.602 1.220 -6.313 259 HB2 SER 35 2HB SER 35 5.351 -0.296 -4.803 260 HB3 SER 35 3HB SER 35 6.040 -1.152 -6.183 261 HG SER 35 HG SER 35 6.305 -2.025 -3.906 262 H ASN 36 H ASN 36 6.228 2.898 -5.024 263 HA ASN 36 HA ASN 36 6.522 4.441 -3.372 264 HB2 ASN 36 2HB ASN 36 5.632 2.047 -2.223 265 HB3 ASN 36 3HB ASN 36 6.922 2.608 -1.164 266 HD21 ASN 36 2HD2 ASN 36 3.363 4.526 -1.337 267 HD22 ASN 36 1HD2 ASN 36 3.760 3.232 -2.410 268 H GLY 37 H GLY 37 8.929 3.422 -4.703 269 HA2 GLY 37 2HA GLY 37 10.857 4.539 -2.862 270 HA3 GLY 37 3HA GLY 37 11.105 2.833 -3.206 271 H GLY 38 H GLY 38 10.891 2.392 -5.718 272 HA2 GLY 38 2HA GLY 38 11.921 2.620 -7.756 273 HA3 GLY 38 3HA GLY 38 11.614 4.342 -7.579 274 H ALA 39 H ALA 39 13.906 1.758 -6.896 275 HA ALA 39 HA ALA 39 16.162 3.254 -7.547 276 HB1 ALA 39 1HB ALA 39 15.326 3.448 -4.703 277 HB2 ALA 39 2HB ALA 39 17.047 3.295 -5.057 278 HB3 ALA 39 3HB ALA 39 16.124 4.637 -5.733 279 H ASP 40 H ASP 40 15.827 0.916 -8.421 280 HA ASP 40 HA ASP 40 16.540 -1.267 -6.754 281 HB2 ASP 40 2HB ASP 40 16.810 -2.516 -8.862 282 HB3 ASP 40 3HB ASP 40 15.304 -1.602 -8.834 283 H LEU 41 H LEU 41 18.450 -1.468 -5.798 284 HA LEU 41 HA LEU 41 20.855 -1.721 -7.215 285 HB2 LEU 41 2HB LEU 41 20.225 0.904 -6.977 286 HB3 LEU 41 3HB LEU 41 21.167 0.655 -5.508 287 HG LEU 41 HG LEU 41 22.878 -0.423 -7.213 288 HD11 LEU 41 1HD1 LEU 41 22.734 1.278 -9.240 289 HD12 LEU 41 2HD1 LEU 41 21.009 1.152 -8.894 290 HD13 LEU 41 3HD1 LEU 41 21.939 -0.296 -9.280 291 HD21 LEU 41 3HD2 LEU 41 22.449 2.514 -6.702 292 HD22 LEU 41 1HD2 LEU 41 23.905 1.853 -7.446 293 HD23 LEU 41 2HD2 LEU 41 23.472 1.397 -5.798 294 H MET 42 H MET 42 22.728 -1.031 -5.306 295 HA MET 42 HA MET 42 21.909 -2.713 -3.030 296 HB2 MET 42 2HB MET 42 24.747 -2.290 -3.947 297 HB3 MET 42 3HB MET 42 24.127 -3.538 -2.875 298 HG2 MET 42 2HG MET 42 24.102 -4.863 -4.651 299 HG3 MET 42 3HG MET 42 22.704 -3.938 -5.194 300 HE1 MET 42 3HE MET 42 26.937 -3.200 -5.653 301 HE2 MET 42 1HE MET 42 26.216 -4.761 -5.260 302 HE3 MET 42 2HE MET 42 26.729 -4.418 -6.912 303 H GLY 43 H GLY 43 21.834 -1.767 -1.101 304 HA2 GLY 43 2HA GLY 43 23.770 0.075 -0.162 305 HA3 GLY 43 3HA GLY 43 22.324 0.937 -0.664 306 HA PRO 44 HA PRO 44 20.296 0.075 3.121 307 HB2 PRO 44 2HB PRO 44 17.805 -0.720 2.391 308 HB3 PRO 44 3HB PRO 44 18.366 0.949 2.234 309 HG2 PRO 44 2HG PRO 44 18.195 -1.197 0.153 310 HG3 PRO 44 3HG PRO 44 17.754 0.517 0.032 311 HD2 PRO 44 2HD PRO 44 20.087 -0.460 -0.937 312 HD3 PRO 44 3HD PRO 44 19.937 1.185 -0.286 313 H ALA 45 H ALA 45 20.191 -2.507 0.745 314 HA ALA 45 HA ALA 45 19.240 -4.563 2.423 315 HB1 ALA 45 1HB ALA 45 19.586 -4.461 -0.174 316 HB2 ALA 45 2HB ALA 45 21.155 -5.163 0.220 317 HB3 ALA 45 3HB ALA 45 19.674 -5.998 0.687 318 H PHE 46 H PHE 46 22.506 -3.415 1.693 319 HA PHE 46 HA PHE 46 23.878 -5.435 3.116 320 HB2 PHE 46 2HB PHE 46 24.731 -3.639 1.389 321 HB3 PHE 46 3HB PHE 46 25.016 -2.682 2.840 322 HD1 PHE 46 HD1 PHE 46 26.143 -5.439 0.802 323 HD2 PHE 46 HD2 PHE 46 26.584 -3.513 4.572 324 HE1 PHE 46 HE1 PHE 46 28.280 -6.609 1.146 325 HE2 PHE 46 HE2 PHE 46 28.722 -4.679 4.922 326 HZ PHE 46 HZ PHE 46 29.574 -6.229 3.207 327 H ALA 47 H ALA 47 22.135 -2.668 4.129 328 HA ALA 47 HA ALA 47 23.453 -2.093 6.553 329 HB1 ALA 47 1HB ALA 47 21.430 -0.937 5.186 330 HB2 ALA 47 2HB ALA 47 20.539 -1.696 6.505 331 HB3 ALA 47 3HB ALA 47 21.837 -0.557 6.859 332 H ALA 48 H ALA 48 21.103 -4.516 5.657 333 HA ALA 48 HA ALA 48 20.815 -5.354 8.451 334 HB1 ALA 48 1HB ALA 48 18.915 -5.098 6.576 335 HB2 ALA 48 2HB ALA 48 19.347 -6.791 6.330 336 HB3 ALA 48 3HB ALA 48 18.806 -6.240 7.916 337 H GLY 49 H GLY 49 22.361 -6.220 5.493 338 HA2 GLY 49 2HA GLY 49 24.206 -7.731 5.468 339 HA3 GLY 49 3HA GLY 49 23.482 -8.588 6.820 340 H LEU 50 H LEU 50 21.287 -7.745 4.359 341 HA LEU 50 HA LEU 50 20.704 -10.457 3.768 342 HB2 LEU 50 2HB LEU 50 19.858 -8.085 2.129 343 HB3 LEU 50 3HB LEU 50 19.035 -9.633 2.307 344 HG LEU 50 HG LEU 50 19.267 -8.354 4.866 345 HD11 LEU 50 1HD1 LEU 50 17.445 -6.584 3.941 346 HD12 LEU 50 2HD1 LEU 50 18.588 -6.614 2.598 347 HD13 LEU 50 3HD1 LEU 50 19.145 -6.206 4.221 348 HD21 LEU 50 3HD2 LEU 50 17.179 -9.489 3.095 349 HD22 LEU 50 1HD2 LEU 50 16.654 -8.400 4.379 350 HD23 LEU 50 2HD2 LEU 50 17.566 -9.857 4.777 351 H ARG 51 H ARG 51 21.953 -11.733 2.580 352 HA ARG 51 HA ARG 51 22.929 -10.755 0.005 353 HB2 ARG 51 2HB ARG 51 24.604 -11.229 2.284 354 HB3 ARG 51 3HB ARG 51 24.975 -12.415 1.040 355 HG2 ARG 51 2HG ARG 51 24.856 -10.119 -0.415 356 HG3 ARG 51 3HG ARG 51 25.506 -9.543 1.121 357 HD2 ARG 51 2HD ARG 51 26.693 -12.033 0.090 358 HD3 ARG 51 3HD ARG 51 27.005 -10.589 -0.872 359 HE ARG 51 HE ARG 51 27.485 -10.179 1.918 360 HH11 ARG 51 1HH1 ARG 51 28.845 -11.435 -1.030 361 HH12 ARG 51 2HH1 ARG 51 30.486 -11.214 -0.521 362 HH21 ARG 51 2HH2 ARG 51 30.938 -10.331 1.544 363 HH22 ARG 51 1HH2 ARG 51 29.641 -9.882 2.600 364 H VAL 52 H VAL 52 24.077 -12.746 -1.135 365 HA VAL 52 HA VAL 52 22.046 -14.740 -1.401 366 HB VAL 52 HB VAL 52 23.464 -15.725 -3.115 367 HG11 VAL 52 1HG1 VAL 52 23.137 -14.078 -4.651 368 HG12 VAL 52 2HG1 VAL 52 22.206 -13.392 -3.318 369 HG13 VAL 52 3HG1 VAL 52 23.849 -12.830 -3.630 370 HG21 VAL 52 3HG2 VAL 52 25.542 -14.079 -1.790 371 HG22 VAL 52 1HG2 VAL 52 25.656 -15.683 -2.515 372 HG23 VAL 52 2HG2 VAL 52 25.643 -14.249 -3.542 373 H GLY 53 H GLY 53 21.941 -16.745 -0.569 374 HA2 GLY 53 2HA GLY 53 23.510 -18.695 0.032 375 HA3 GLY 53 3HA GLY 53 24.131 -17.561 1.222 376 H ASP 54 H ASP 54 21.929 -16.399 2.249 377 HA ASP 54 HA ASP 54 20.794 -18.562 3.794 378 HB2 ASP 54 2HB ASP 54 20.070 -15.647 4.042 379 HB3 ASP 54 3HB ASP 54 19.998 -16.900 5.278 380 H GLN 55 H GLN 55 18.562 -18.971 4.048 381 HA GLN 55 HA GLN 55 17.004 -18.344 1.649 382 HB2 GLN 55 2HB GLN 55 15.590 -20.224 2.273 383 HB3 GLN 55 3HB GLN 55 17.278 -20.718 2.236 384 HG2 GLN 55 2HG GLN 55 16.996 -20.003 4.837 385 HG3 GLN 55 3HG GLN 55 15.386 -20.620 4.469 386 HE21 GLN 55 2HE2 GLN 55 16.881 -23.848 3.452 387 HE22 GLN 55 1HE2 GLN 55 15.985 -22.600 2.663 388 H LEU 56 H LEU 56 14.889 -17.551 1.760 389 HA LEU 56 HA LEU 56 14.136 -16.371 4.353 390 HB2 LEU 56 2HB LEU 56 13.703 -15.203 1.607 391 HB3 LEU 56 3HB LEU 56 13.171 -14.488 3.128 392 HG LEU 56 HG LEU 56 15.723 -14.532 3.703 393 HD11 LEU 56 1HD1 LEU 56 16.319 -13.956 0.931 394 HD12 LEU 56 2HD1 LEU 56 15.820 -15.631 1.162 395 HD13 LEU 56 3HD1 LEU 56 17.176 -14.981 2.083 396 HD21 LEU 56 3HD2 LEU 56 14.516 -12.489 3.584 397 HD22 LEU 56 1HD2 LEU 56 14.380 -12.597 1.829 398 HD23 LEU 56 2HD2 LEU 56 15.950 -12.299 2.574 399 H VAL 57 H VAL 57 12.201 -16.932 5.101 400 HA VAL 57 HA VAL 57 10.248 -18.074 3.209 401 HB VAL 57 HB VAL 57 9.403 -19.454 5.087 402 HG11 VAL 57 1HG1 VAL 57 10.850 -21.154 4.653 403 HG12 VAL 57 2HG1 VAL 57 11.383 -20.026 3.405 404 HG13 VAL 57 3HG1 VAL 57 12.278 -20.155 4.919 405 HG21 VAL 57 3HG2 VAL 57 11.374 -17.876 6.552 406 HG22 VAL 57 1HG2 VAL 57 9.961 -18.754 7.137 407 HG23 VAL 57 2HG2 VAL 57 11.481 -19.607 6.869 408 H ARG 58 H ARG 58 10.749 -16.118 6.090 409 HA ARG 58 HA ARG 58 9.421 -14.636 7.200 410 HB2 ARG 58 2HB ARG 58 9.336 -14.031 4.487 411 HB3 ARG 58 3HB ARG 58 7.649 -13.997 4.983 412 HG2 ARG 58 2HG ARG 58 7.915 -12.148 6.245 413 HG3 ARG 58 3HG ARG 58 9.545 -12.596 6.751 414 HD2 ARG 58 2HD ARG 58 10.139 -12.114 4.255 415 HD3 ARG 58 3HD ARG 58 8.643 -11.183 4.279 416 HE ARG 58 HE ARG 58 10.198 -10.440 6.488 417 HH11 ARG 58 1HH1 ARG 58 10.219 -10.208 3.014 418 HH12 ARG 58 2HH1 ARG 58 11.123 -8.731 2.988 419 HH21 ARG 58 2HH2 ARG 58 11.789 -7.758 4.952 420 HH22 ARG 58 1HH2 ARG 58 11.389 -8.495 6.466 421 H PHE 59 H PHE 59 8.552 -17.424 7.113 422 HA PHE 59 HA PHE 59 5.737 -16.976 7.799 423 HB2 PHE 59 2HB PHE 59 6.830 -19.074 5.942 424 HB3 PHE 59 3HB PHE 59 5.331 -19.340 6.825 425 HD1 PHE 59 HD1 PHE 59 6.416 -18.592 3.745 426 HD2 PHE 59 HD2 PHE 59 3.887 -16.919 6.732 427 HE1 PHE 59 HE1 PHE 59 5.182 -17.363 2.007 428 HE2 PHE 59 HE2 PHE 59 2.648 -15.688 4.999 429 HZ PHE 59 HZ PHE 59 3.294 -15.910 2.633 430 H ALA 60 H ALA 60 4.924 -18.297 9.440 431 HA ALA 60 HA ALA 60 6.855 -19.191 11.339 432 HB1 ALA 60 1HB ALA 60 4.603 -20.115 12.402 433 HB2 ALA 60 2HB ALA 60 5.030 -18.404 12.444 434 HB3 ALA 60 3HB ALA 60 3.898 -19.000 11.231 435 H GLY 61 H GLY 61 7.971 -21.013 11.043 436 HA2 GLY 61 2HA GLY 61 7.538 -23.493 11.380 437 HA3 GLY 61 3HA GLY 61 6.550 -23.351 9.934 438 H TYR 62 H TYR 62 9.061 -21.272 9.529 439 HA TYR 62 HA TYR 62 10.934 -21.279 8.239 440 HB2 TYR 62 2HB TYR 62 11.362 -24.162 8.981 441 HB3 TYR 62 3HB TYR 62 12.567 -22.920 8.659 442 HD1 TYR 62 HD1 TYR 62 11.713 -20.715 10.363 443 HD2 TYR 62 HD2 TYR 62 11.732 -24.897 11.150 444 HE1 TYR 62 HE1 TYR 62 11.886 -20.255 12.773 445 HE2 TYR 62 HE2 TYR 62 11.905 -24.448 13.562 446 HH TYR 62 HH TYR 62 12.085 -22.899 15.138 447 H THR 63 H THR 63 8.483 -21.877 6.979 448 HA THR 63 HA THR 63 9.453 -23.514 4.738 449 HB THR 63 HB THR 63 7.880 -24.924 5.899 450 HG1 THR 63 HG1 THR 63 6.428 -23.814 3.726 451 HG21 THR 63 3HG2 THR 63 6.543 -22.462 6.426 452 HG22 THR 63 1HG2 THR 63 6.207 -24.061 7.088 453 HG23 THR 63 2HG2 THR 63 5.423 -23.542 5.596 454 H VAL 64 H VAL 64 8.659 -22.932 2.678 455 HA VAL 64 HA VAL 64 7.010 -20.541 2.461 456 HB VAL 64 HB VAL 64 9.420 -19.796 2.625 457 HG11 VAL 64 1HG1 VAL 64 9.985 -20.389 -0.159 458 HG12 VAL 64 2HG1 VAL 64 11.003 -20.589 1.268 459 HG13 VAL 64 3HG1 VAL 64 9.849 -21.847 0.822 460 HG21 VAL 64 3HG2 VAL 64 8.033 -19.152 0.026 461 HG22 VAL 64 1HG2 VAL 64 7.608 -18.458 1.590 462 HG23 VAL 64 2HG2 VAL 64 9.194 -18.142 0.886 463 H THR 65 H THR 65 6.210 -20.167 0.317 464 HA THR 65 HA THR 65 5.721 -22.611 -1.109 465 HB THR 65 HB THR 65 4.861 -20.280 -2.571 466 HG1 THR 65 HG1 THR 65 3.342 -19.746 -0.681 467 HG21 THR 65 3HG2 THR 65 2.709 -21.297 -2.370 468 HG22 THR 65 1HG2 THR 65 3.220 -22.242 -0.972 469 HG23 THR 65 2HG2 THR 65 3.883 -22.597 -2.567 470 H GLU 66 H GLU 66 6.839 -19.446 -2.323 471 HA GLU 66 HA GLU 66 9.192 -20.355 -3.520 472 HB2 GLU 66 2HB GLU 66 8.418 -20.288 -5.932 473 HB3 GLU 66 3HB GLU 66 7.942 -21.707 -5.009 474 HG2 GLU 66 2HG GLU 66 5.758 -21.241 -5.170 475 HG3 GLU 66 3HG GLU 66 6.005 -19.509 -4.957 476 H LEU 67 H LEU 67 9.623 -18.800 -5.611 477 HA LEU 67 HA LEU 67 9.956 -16.248 -4.593 478 HB2 LEU 67 2HB LEU 67 10.661 -15.590 -6.741 479 HB3 LEU 67 3HB LEU 67 11.111 -17.286 -6.572 480 HG LEU 67 HG LEU 67 8.781 -17.624 -7.812 481 HD11 LEU 67 1HD1 LEU 67 8.899 -14.896 -7.827 482 HD12 LEU 67 2HD1 LEU 67 7.966 -15.883 -8.951 483 HD13 LEU 67 3HD1 LEU 67 9.569 -15.307 -9.406 484 HD21 LEU 67 3HD2 LEU 67 11.528 -17.111 -8.855 485 HD22 LEU 67 1HD2 LEU 67 10.205 -17.369 -9.992 486 HD23 LEU 67 2HD2 LEU 67 10.602 -18.612 -8.806 487 H ALA 68 H ALA 68 7.296 -17.577 -6.472 488 HA ALA 68 HA ALA 68 5.962 -15.201 -7.097 489 HB1 ALA 68 1HB ALA 68 3.969 -16.588 -7.377 490 HB2 ALA 68 2HB ALA 68 5.387 -17.346 -8.104 491 HB3 ALA 68 3HB ALA 68 4.778 -17.921 -6.552 492 H ALA 69 H ALA 69 5.721 -17.292 -4.244 493 HA ALA 69 HA ALA 69 3.653 -15.806 -2.987 494 HB1 ALA 69 1HB ALA 69 5.403 -18.054 -2.287 495 HB2 ALA 69 2HB ALA 69 4.893 -17.061 -0.921 496 HB3 ALA 69 3HB ALA 69 3.685 -17.806 -1.969 497 H PHE 70 H PHE 70 7.160 -15.630 -2.932 498 HA PHE 70 HA PHE 70 7.273 -13.768 -0.754 499 HB2 PHE 70 2HB PHE 70 9.128 -15.351 -1.389 500 HB3 PHE 70 3HB PHE 70 9.419 -14.341 -2.802 501 HD1 PHE 70 HD1 PHE 70 8.670 -13.465 0.740 502 HD2 PHE 70 HD2 PHE 70 11.432 -13.269 -2.492 503 HE1 PHE 70 HE1 PHE 70 10.135 -12.016 2.085 504 HE2 PHE 70 HE2 PHE 70 12.902 -11.820 -1.152 505 HZ PHE 70 HZ PHE 70 12.255 -11.192 1.140 506 H ASN 71 H ASN 71 6.854 -13.562 -4.173 507 HA ASN 71 HA ASN 71 7.793 -10.973 -4.667 508 HB2 ASN 71 2HB ASN 71 6.832 -12.866 -6.260 509 HB3 ASN 71 3HB ASN 71 5.346 -11.937 -6.078 510 HD21 ASN 71 2HD2 ASN 71 6.299 -9.412 -8.233 511 HD22 ASN 71 1HD2 ASN 71 5.097 -10.107 -7.205 512 H THR 72 H THR 72 4.626 -12.114 -3.574 513 HA THR 72 HA THR 72 3.412 -9.537 -3.569 514 HB THR 72 HB THR 72 1.805 -10.811 -1.896 515 HG1 THR 72 HG1 THR 72 1.959 -13.021 -2.075 516 HG21 THR 72 3HG2 THR 72 0.744 -11.916 -3.929 517 HG22 THR 72 1HG2 THR 72 2.109 -11.291 -4.853 518 HG23 THR 72 2HG2 THR 72 1.015 -10.177 -4.031 519 H VAL 73 H VAL 73 4.809 -11.588 -1.026 520 HA VAL 73 HA VAL 73 4.261 -9.947 1.160 521 HB VAL 73 HB VAL 73 6.634 -11.771 0.743 522 HG11 VAL 73 1HG1 VAL 73 6.565 -11.833 3.288 523 HG12 VAL 73 2HG1 VAL 73 7.210 -10.371 2.541 524 HG13 VAL 73 3HG1 VAL 73 5.568 -10.383 3.185 525 HG21 VAL 73 3HG2 VAL 73 4.568 -12.982 0.525 526 HG22 VAL 73 1HG2 VAL 73 5.282 -13.360 2.093 527 HG23 VAL 73 2HG2 VAL 73 3.926 -12.236 1.988 528 H VAL 74 H VAL 74 7.129 -10.031 -0.939 529 HA VAL 74 HA VAL 74 8.611 -8.050 0.359 530 HB VAL 74 HB VAL 74 8.574 -8.806 -2.564 531 HG11 VAL 74 1HG1 VAL 74 11.051 -7.791 -2.105 532 HG12 VAL 74 2HG1 VAL 74 9.718 -6.890 -2.832 533 HG13 VAL 74 3HG1 VAL 74 10.054 -6.732 -1.108 534 HG21 VAL 74 3HG2 VAL 74 9.787 -10.575 -1.979 535 HG22 VAL 74 1HG2 VAL 74 10.932 -9.551 -1.112 536 HG23 VAL 74 2HG2 VAL 74 9.500 -10.168 -0.287 537 H ALA 75 H ALA 75 6.375 -7.758 -2.395 538 HA ALA 75 HA ALA 75 6.615 -4.999 -2.768 539 HB1 ALA 75 1HB ALA 75 3.997 -6.344 -3.235 540 HB2 ALA 75 2HB ALA 75 4.856 -5.171 -4.234 541 HB3 ALA 75 3HB ALA 75 5.403 -6.847 -4.174 542 H ARG 76 H ARG 76 4.392 -6.855 -0.723 543 HA ARG 76 HA ARG 76 2.915 -4.617 0.194 544 HB2 ARG 76 2HB ARG 76 3.146 -7.480 0.914 545 HB3 ARG 76 3HB ARG 76 2.564 -6.409 2.182 546 HG2 ARG 76 2HG ARG 76 0.762 -7.454 0.847 547 HG3 ARG 76 3HG ARG 76 0.731 -5.690 0.821 548 HD2 ARG 76 2HD ARG 76 1.842 -5.702 -1.357 549 HD3 ARG 76 3HD ARG 76 1.885 -7.464 -1.328 550 HE ARG 76 HE ARG 76 -0.350 -5.804 -2.000 551 HH11 ARG 76 1HH1 ARG 76 0.603 -8.898 -0.722 552 HH12 ARG 76 2HH1 ARG 76 -0.869 -9.688 -1.182 553 HH21 ARG 76 2HH2 ARG 76 -2.515 -8.511 -2.256 554 HH22 ARG 76 1HH2 ARG 76 -2.292 -6.831 -2.610 555 H HIS 77 H HIS 77 5.836 -6.210 1.299 556 HA HIS 77 HA HIS 77 5.952 -4.785 3.791 557 HB2 HIS 77 2HB HIS 77 7.858 -6.580 2.309 558 HB3 HIS 77 3HB HIS 77 8.367 -5.705 3.750 559 HD1 HIS 77 HD1 HIS 77 5.201 -6.273 4.804 560 HD2 HIS 77 HD2 HIS 77 8.297 -8.916 3.970 561 HE1 HIS 77 HE1 HIS 77 4.663 -8.366 6.090 562 H VAL 78 H VAL 78 7.066 -4.271 0.544 563 HA VAL 78 HA VAL 78 9.157 -2.488 0.925 564 HB VAL 78 HB VAL 78 7.087 -2.667 -1.253 565 HG11 VAL 78 1HG1 VAL 78 9.050 -0.542 -0.738 566 HG12 VAL 78 2HG1 VAL 78 9.071 -1.202 -2.375 567 HG13 VAL 78 3HG1 VAL 78 7.583 -0.522 -1.715 568 HG21 VAL 78 3HG2 VAL 78 9.793 -3.068 -2.076 569 HG22 VAL 78 1HG2 VAL 78 9.464 -4.065 -0.659 570 HG23 VAL 78 2HG2 VAL 78 8.448 -4.209 -2.093 571 H ARG 79 H ARG 79 9.170 -0.725 2.150 572 HA ARG 79 HA ARG 79 7.200 1.345 1.720 573 HB2 ARG 79 2HB ARG 79 7.082 -0.412 4.032 574 HB3 ARG 79 3HB ARG 79 7.278 1.271 4.501 575 HG2 ARG 79 2HG ARG 79 5.335 1.456 2.605 576 HG3 ARG 79 3HG ARG 79 4.975 -0.106 3.343 577 HD2 ARG 79 2HD ARG 79 4.973 0.955 5.556 578 HD3 ARG 79 3HD ARG 79 5.304 2.513 4.802 579 HE ARG 79 HE ARG 79 2.777 1.157 4.936 580 HH11 ARG 79 1HH1 ARG 79 4.686 3.473 3.172 581 HH12 ARG 79 2HH1 ARG 79 3.312 4.291 2.504 582 HH21 ARG 79 2HH2 ARG 79 1.194 3.581 3.012 583 HH22 ARG 79 1HH2 ARG 79 0.961 2.226 4.063 584 HA PRO 80 HA PRO 80 10.569 4.014 2.599 585 HB2 PRO 80 2HB PRO 80 9.343 6.124 3.787 586 HB3 PRO 80 3HB PRO 80 9.191 5.772 2.062 587 HG2 PRO 80 2HG PRO 80 7.302 5.144 4.298 588 HG3 PRO 80 3HG PRO 80 6.948 5.769 2.676 589 HD2 PRO 80 2HD PRO 80 6.628 3.162 3.335 590 HD3 PRO 80 3HD PRO 80 7.096 3.684 1.704 591 H SER 81 H SER 81 11.983 3.277 4.087 592 HA SER 81 HA SER 81 13.028 2.950 6.081 593 HB2 SER 81 2HB SER 81 11.176 4.858 7.454 594 HB3 SER 81 3HB SER 81 12.921 4.671 7.625 595 HG SER 81 HG SER 81 12.059 6.577 6.415 596 H ALA 82 H ALA 82 10.961 1.174 5.434 597 HA ALA 82 HA ALA 82 9.586 0.684 7.979 598 HB1 ALA 82 1HB ALA 82 9.085 -0.158 5.162 599 HB2 ALA 82 2HB ALA 82 8.461 -1.143 6.485 600 HB3 ALA 82 3HB ALA 82 7.979 0.547 6.341 601 H SER 83 H SER 83 10.591 -0.609 9.362 602 HA SER 83 HA SER 83 12.220 -2.821 8.292 603 HB2 SER 83 2HB SER 83 13.644 -2.654 10.218 604 HB3 SER 83 3HB SER 83 13.460 -1.028 9.561 605 HG SER 83 HG SER 83 11.683 -0.852 11.169 606 H ILE 84 H ILE 84 11.633 -4.831 8.796 607 HA ILE 84 HA ILE 84 9.956 -5.294 11.154 608 HB ILE 84 HB ILE 84 8.604 -6.936 9.759 609 HG12 ILE 84 2HG1 ILE 84 9.074 -5.302 7.354 610 HG13 ILE 84 3HG1 ILE 84 10.419 -6.346 7.803 611 HG21 ILE 84 1HG2 ILE 84 7.090 -5.164 8.926 612 HG22 ILE 84 2HG2 ILE 84 7.638 -4.888 10.579 613 HG23 ILE 84 3HG2 ILE 84 8.352 -3.976 9.249 614 HD11 ILE 84 3HD1 ILE 84 8.894 -7.394 6.197 615 HD12 ILE 84 1HD1 ILE 84 8.984 -8.284 7.716 616 HD13 ILE 84 2HD1 ILE 84 7.587 -7.264 7.373 617 HA PRO 85 HA PRO 85 12.497 -8.813 11.814 618 HB2 PRO 85 2HB PRO 85 10.752 -10.508 13.018 619 HB3 PRO 85 3HB PRO 85 11.408 -9.076 13.820 620 HG2 PRO 85 2HG PRO 85 8.757 -9.449 12.480 621 HG3 PRO 85 3HG PRO 85 9.131 -8.642 14.014 622 HD2 PRO 85 2HD PRO 85 8.699 -7.276 11.717 623 HD3 PRO 85 3HD PRO 85 9.817 -6.704 12.972 624 H VAL 86 H VAL 86 13.197 -10.411 10.542 625 HA VAL 86 HA VAL 86 11.230 -11.829 8.863 626 HB VAL 86 HB VAL 86 12.731 -10.285 7.589 627 HG11 VAL 86 1HG1 VAL 86 15.027 -12.055 7.652 628 HG12 VAL 86 2HG1 VAL 86 14.949 -10.299 7.812 629 HG13 VAL 86 3HG1 VAL 86 14.705 -11.327 9.225 630 HG21 VAL 86 3HG2 VAL 86 12.780 -11.684 5.792 631 HG22 VAL 86 1HG2 VAL 86 13.474 -13.020 6.711 632 HG23 VAL 86 2HG2 VAL 86 11.757 -12.647 6.857 633 H VAL 87 H VAL 87 11.461 -14.031 8.601 634 HA VAL 87 HA VAL 87 13.269 -15.328 10.517 635 HB VAL 87 HB VAL 87 10.978 -15.928 10.882 636 HG11 VAL 87 1HG1 VAL 87 10.232 -17.364 8.576 637 HG12 VAL 87 2HG1 VAL 87 9.516 -15.881 9.211 638 HG13 VAL 87 3HG1 VAL 87 10.823 -15.795 8.029 639 HG21 VAL 87 3HG2 VAL 87 11.149 -18.266 10.873 640 HG22 VAL 87 1HG2 VAL 87 12.119 -18.277 9.399 641 HG23 VAL 87 2HG2 VAL 87 12.821 -17.705 10.912 642 H PHE 88 H PHE 88 15.093 -16.108 9.709 643 HA PHE 88 HA PHE 88 15.044 -17.278 7.005 644 HB2 PHE 88 2HB PHE 88 17.335 -16.519 6.675 645 HB3 PHE 88 3HB PHE 88 16.299 -15.149 7.062 646 HD1 PHE 88 HD1 PHE 88 16.379 -14.155 9.339 647 HD2 PHE 88 HD2 PHE 88 19.159 -17.109 8.049 648 HE1 PHE 88 HE1 PHE 88 17.891 -13.531 11.177 649 HE2 PHE 88 HE2 PHE 88 20.674 -16.490 9.885 650 HZ PHE 88 HZ PHE 88 20.041 -14.700 11.453 651 H SER 89 H SER 89 16.574 -19.008 6.630 652 HA SER 89 HA SER 89 17.412 -20.392 9.090 653 HB2 SER 89 2HB SER 89 15.695 -21.359 6.872 654 HB3 SER 89 3HB SER 89 16.902 -22.492 7.478 655 HG SER 89 HG SER 89 14.793 -21.246 8.888 656 H ARG 90 H ARG 90 19.284 -21.654 8.950 657 HA ARG 90 HA ARG 90 20.884 -21.234 6.510 658 HB2 ARG 90 2HB ARG 90 21.483 -20.676 9.321 659 HB3 ARG 90 3HB ARG 90 22.728 -21.624 8.519 660 HG2 ARG 90 2HG ARG 90 23.064 -19.940 6.874 661 HG3 ARG 90 3HG ARG 90 21.645 -19.044 7.421 662 HD2 ARG 90 2HD ARG 90 22.705 -18.239 9.291 663 HD3 ARG 90 3HD ARG 90 23.827 -19.597 9.369 664 HE ARG 90 HE ARG 90 24.214 -17.127 7.992 665 HH11 ARG 90 1HH1 ARG 90 24.984 -20.522 7.947 666 HH12 ARG 90 2HH1 ARG 90 26.460 -20.309 7.065 667 HH21 ARG 90 2HH2 ARG 90 27.126 -18.210 6.431 668 HH22 ARG 90 1HH2 ARG 90 26.156 -16.833 6.830 669 H ASP 91 H ASP 91 20.107 -23.278 5.743 670 HA ASP 91 HA ASP 91 20.310 -25.507 5.337 671 HB2 ASP 91 2HB ASP 91 22.666 -25.649 7.189 672 HB3 ASP 91 3HB ASP 91 22.391 -26.504 5.674 673 H GLY 92 H GLY 92 18.585 -24.704 7.420 674 HA2 GLY 92 2HA GLY 92 17.205 -26.177 8.697 675 HA3 GLY 92 3HA GLY 92 18.622 -27.162 9.031 676 H VAL 93 H VAL 93 19.222 -23.841 9.322 677 HA VAL 93 HA VAL 93 19.276 -24.100 12.236 678 HB VAL 93 HB VAL 93 20.520 -22.049 10.402 679 HG11 VAL 93 1HG1 VAL 93 20.011 -20.861 12.368 680 HG12 VAL 93 2HG1 VAL 93 20.441 -22.225 13.402 681 HG13 VAL 93 3HG1 VAL 93 21.700 -21.339 12.540 682 HG21 VAL 93 3HG2 VAL 93 21.956 -23.957 12.217 683 HG22 VAL 93 1HG2 VAL 93 21.459 -24.434 10.594 684 HG23 VAL 93 2HG2 VAL 93 22.572 -23.084 10.813 685 H VAL 94 H VAL 94 18.282 -22.636 13.616 686 HA VAL 94 HA VAL 94 16.132 -21.050 12.383 687 HB VAL 94 HB VAL 94 16.326 -22.137 15.196 688 HG11 VAL 94 1HG1 VAL 94 14.069 -20.668 13.836 689 HG12 VAL 94 2HG1 VAL 94 14.032 -21.354 15.461 690 HG13 VAL 94 3HG1 VAL 94 15.116 -20.011 15.093 691 HG21 VAL 94 3HG2 VAL 94 15.922 -23.933 13.674 692 HG22 VAL 94 1HG2 VAL 94 14.389 -23.539 14.454 693 HG23 VAL 94 2HG2 VAL 94 14.705 -22.998 12.805 694 H MET 95 H MET 95 16.595 -18.958 12.247 695 HA MET 95 HA MET 95 17.588 -17.567 14.603 696 HB2 MET 95 2HB MET 95 19.577 -18.211 13.194 697 HB3 MET 95 3HB MET 95 18.926 -17.183 11.924 698 HG2 MET 95 2HG MET 95 20.607 -15.972 13.110 699 HG3 MET 95 3HG MET 95 19.035 -15.265 13.475 700 HE1 MET 95 3HE MET 95 20.847 -14.162 14.985 701 HE2 MET 95 1HE MET 95 19.559 -14.147 16.189 702 HE3 MET 95 2HE MET 95 21.171 -14.710 16.630 703 H SER 96 H SER 96 17.181 -15.303 14.578 704 HA SER 96 HA SER 96 15.433 -14.358 12.414 705 HB2 SER 96 2HB SER 96 13.935 -13.320 14.098 706 HB3 SER 96 3HB SER 96 13.958 -15.079 14.217 707 HG SER 96 HG SER 96 14.578 -13.267 16.084 708 H ALA 97 H ALA 97 15.863 -12.348 11.738 709 HA ALA 97 HA ALA 97 17.343 -10.525 13.487 710 HB1 ALA 97 1HB ALA 97 18.868 -9.943 11.604 711 HB2 ALA 97 2HB ALA 97 19.092 -11.574 12.237 712 HB3 ALA 97 3HB ALA 97 18.225 -11.329 10.721 713 H THR 98 H THR 98 16.849 -8.396 13.212 714 HA THR 98 HA THR 98 14.533 -7.804 11.582 715 HB THR 98 HB THR 98 16.113 -5.982 13.407 716 HG1 THR 98 HG1 THR 98 14.946 -6.800 14.976 717 HG21 THR 98 3HG2 THR 98 13.873 -5.541 11.596 718 HG22 THR 98 1HG2 THR 98 14.909 -4.373 12.415 719 HG23 THR 98 2HG2 THR 98 13.518 -5.059 13.254 720 H ILE 99 H ILE 99 14.584 -6.943 9.615 721 HA ILE 99 HA ILE 99 17.076 -5.647 8.721 722 HB ILE 99 HB ILE 99 16.433 -6.281 6.423 723 HG12 ILE 99 2HG1 ILE 99 14.607 -8.381 6.917 724 HG13 ILE 99 3HG1 ILE 99 13.964 -6.960 7.734 725 HG21 ILE 99 1HG2 ILE 99 17.535 -8.228 6.604 726 HG22 ILE 99 2HG2 ILE 99 17.639 -7.812 8.313 727 HG23 ILE 99 3HG2 ILE 99 16.370 -8.897 7.746 728 HD11 ILE 99 3HD1 ILE 99 13.798 -7.619 5.014 729 HD12 ILE 99 1HD1 ILE 99 13.245 -6.147 5.812 730 HD13 ILE 99 2HD1 ILE 99 14.870 -6.224 5.130 731 H VAL 100 H VAL 100 16.968 -3.571 8.181 732 HA VAL 100 HA VAL 100 14.314 -2.347 7.866 733 HB VAL 100 HB VAL 100 15.458 -1.290 9.643 734 HG11 VAL 100 1HG1 VAL 100 17.690 -2.133 9.225 735 HG12 VAL 100 2HG1 VAL 100 17.848 -1.083 7.815 736 HG13 VAL 100 3HG1 VAL 100 17.737 -0.383 9.430 737 HG21 VAL 100 3HG2 VAL 100 15.487 0.949 8.966 738 HG22 VAL 100 1HG2 VAL 100 16.078 0.547 7.353 739 HG23 VAL 100 2HG2 VAL 100 14.416 0.165 7.804 740 H VAL 101 H VAL 101 13.727 -2.077 5.819 741 HA VAL 101 HA VAL 101 15.785 -1.522 3.798 742 HB VAL 101 HB VAL 101 12.906 -2.288 3.316 743 HG11 VAL 101 1HG1 VAL 101 14.204 -3.088 1.130 744 HG12 VAL 101 2HG1 VAL 101 13.552 -1.457 1.301 745 HG13 VAL 101 3HG1 VAL 101 15.264 -1.759 1.601 746 HG21 VAL 101 3HG2 VAL 101 13.959 -4.538 2.723 747 HG22 VAL 101 1HG2 VAL 101 15.361 -3.987 3.640 748 HG23 VAL 101 2HG2 VAL 101 13.796 -4.149 4.435 749 H GLY 102 H GLY 102 15.954 0.432 2.905 750 HA2 GLY 102 2HA GLY 102 13.824 2.388 3.476 751 HA3 GLY 102 3HA GLY 102 15.510 2.788 3.178 752 H GLU 103 H GLU 103 12.445 2.607 1.836 753 HA GLU 103 HA GLU 103 13.387 2.310 -0.907 754 HB2 GLU 103 2HB GLU 103 10.754 2.235 0.453 755 HB3 GLU 103 3HB GLU 103 10.766 2.848 -1.195 756 HG2 GLU 103 2HG GLU 103 10.409 0.638 -1.590 757 HG3 GLU 103 3HG GLU 103 12.170 0.680 -1.652 758 H LEU 104 H LEU 104 12.361 4.761 1.328 759 HA LEU 104 HA LEU 104 13.030 6.807 -0.647 760 HB2 LEU 104 2HB LEU 104 10.491 6.840 0.979 761 HB3 LEU 104 3HB LEU 104 11.060 8.136 -0.070 762 HG LEU 104 HG LEU 104 10.435 5.393 -1.128 763 HD11 LEU 104 1HD1 LEU 104 8.582 7.658 -0.510 764 HD12 LEU 104 2HD1 LEU 104 8.370 5.931 -0.229 765 HD13 LEU 104 3HD1 LEU 104 8.260 6.577 -1.866 766 HD21 LEU 104 3HD2 LEU 104 11.798 7.108 -2.426 767 HD22 LEU 104 1HD2 LEU 104 10.311 8.050 -2.525 768 HD23 LEU 104 2HD2 LEU 104 10.380 6.436 -3.233 769 H GLU 105 H GLU 105 14.867 7.365 0.464 770 HA GLU 105 HA GLU 105 14.894 7.800 3.289 771 HB2 GLU 105 2HB GLU 105 16.845 7.234 1.598 772 HB3 GLU 105 3HB GLU 105 16.965 8.985 1.493 773 HG2 GLU 105 2HG GLU 105 16.989 8.839 4.103 774 HG3 GLU 105 3HG GLU 105 17.506 7.182 3.797 Start of MODEL 2 1 HA PRO 1 HA PRO 1 2.653 1.500 -1.537 2 HB2 PRO 1 2HB PRO 1 4.923 0.023 -1.349 3 HB3 PRO 1 3HB PRO 1 4.798 1.674 -0.732 4 HG2 PRO 1 2HG PRO 1 4.595 -0.921 0.746 5 HG3 PRO 1 3HG PRO 1 5.446 0.565 1.206 6 HD2 PRO 1 2HD PRO 1 3.024 -0.099 2.219 7 HD3 PRO 1 3HD PRO 1 3.521 1.586 1.958 8 H LEU 2 H LEU 2 3.159 0.084 -3.373 9 HA LEU 2 HA LEU 2 2.333 -2.706 -3.049 10 HB2 LEU 2 2HB LEU 2 0.785 -0.628 -4.307 11 HB3 LEU 2 3HB LEU 2 1.210 -1.878 -5.475 12 HG LEU 2 HG LEU 2 0.304 -3.319 -3.301 13 HD11 LEU 2 1HD1 LEU 2 -1.645 -2.353 -2.464 14 HD12 LEU 2 2HD1 LEU 2 -1.684 -1.114 -3.718 15 HD13 LEU 2 3HD1 LEU 2 -0.474 -1.034 -2.437 16 HD21 LEU 2 3HD2 LEU 2 -0.902 -2.451 -5.899 17 HD22 LEU 2 1HD2 LEU 2 -1.820 -3.451 -4.773 18 HD23 LEU 2 2HD2 LEU 2 -0.289 -4.036 -5.423 19 H THR 3 H THR 3 2.987 -4.091 -4.782 20 HA THR 3 HA THR 3 5.038 -2.942 -6.555 21 HB THR 3 HB THR 3 6.042 -4.163 -4.586 22 HG1 THR 3 HG1 THR 3 6.984 -3.945 -6.806 23 HG21 THR 3 3HG2 THR 3 5.572 -6.312 -4.122 24 HG22 THR 3 1HG2 THR 3 5.558 -6.774 -5.823 25 HG23 THR 3 2HG2 THR 3 4.125 -6.048 -5.095 26 H ARG 4 H ARG 4 5.616 -4.475 -8.362 27 HA ARG 4 HA ARG 4 3.147 -5.700 -9.379 28 HB2 ARG 4 2HB ARG 4 5.322 -4.155 -10.594 29 HB3 ARG 4 3HB ARG 4 4.881 -5.590 -11.510 30 HG2 ARG 4 2HG ARG 4 3.485 -4.032 -12.434 31 HG3 ARG 4 3HG ARG 4 2.448 -4.698 -11.171 32 HD2 ARG 4 2HD ARG 4 4.103 -2.503 -10.223 33 HD3 ARG 4 3HD ARG 4 3.053 -2.031 -11.558 34 HE ARG 4 HE ARG 4 1.518 -3.471 -9.728 35 HH11 ARG 4 1HH1 ARG 4 3.257 -0.460 -9.910 36 HH12 ARG 4 2HH1 ARG 4 2.225 0.354 -8.781 37 HH21 ARG 4 2HH2 ARG 4 0.461 -0.756 -7.831 38 HH22 ARG 4 1HH2 ARG 4 0.153 -2.409 -8.240 39 HA PRO 5 HA PRO 5 4.800 -9.763 -9.398 40 HB2 PRO 5 2HB PRO 5 3.880 -10.760 -11.749 41 HB3 PRO 5 3HB PRO 5 2.832 -10.458 -10.359 42 HG2 PRO 5 2HG PRO 5 3.276 -8.778 -12.796 43 HG3 PRO 5 3HG PRO 5 1.758 -9.164 -11.965 44 HD2 PRO 5 2HD PRO 5 3.046 -6.805 -11.628 45 HD3 PRO 5 3HD PRO 5 2.101 -7.570 -10.335 46 H TYR 6 H TYR 6 7.010 -8.748 -9.642 47 HA TYR 6 HA TYR 6 8.188 -9.557 -12.219 48 HB2 TYR 6 2HB TYR 6 8.093 -7.006 -11.519 49 HB3 TYR 6 3HB TYR 6 9.499 -7.450 -10.557 50 HD1 TYR 6 HD1 TYR 6 11.593 -7.311 -11.530 51 HD2 TYR 6 HD2 TYR 6 8.189 -7.771 -14.041 52 HE1 TYR 6 HE1 TYR 6 13.029 -7.070 -13.512 53 HE2 TYR 6 HE2 TYR 6 9.616 -7.532 -16.030 54 HH TYR 6 HH TYR 6 11.660 -7.095 -16.787 55 H LEU 7 H LEU 7 10.206 -10.564 -12.161 56 HA LEU 7 HA LEU 7 11.020 -11.529 -9.499 57 HB2 LEU 7 2HB LEU 7 11.878 -13.526 -10.639 58 HB3 LEU 7 3HB LEU 7 10.141 -13.316 -10.851 59 HG LEU 7 HG LEU 7 11.234 -12.094 -13.084 60 HD11 LEU 7 1HD1 LEU 7 12.663 -13.965 -13.998 61 HD12 LEU 7 2HD1 LEU 7 12.811 -14.543 -12.339 62 HD13 LEU 7 3HD1 LEU 7 13.414 -12.943 -12.772 63 HD21 LEU 7 3HD2 LEU 7 9.229 -13.656 -12.744 64 HD22 LEU 7 1HD2 LEU 7 10.374 -14.968 -13.027 65 HD23 LEU 7 2HD2 LEU 7 10.100 -13.752 -14.275 66 H GLY 8 H GLY 8 12.951 -10.891 -8.812 67 HA2 GLY 8 2HA GLY 8 14.963 -10.128 -10.839 68 HA3 GLY 8 3HA GLY 8 14.721 -9.210 -9.359 69 H PHE 9 H PHE 9 14.420 -12.605 -9.064 70 HA PHE 9 HA PHE 9 17.210 -13.062 -8.453 71 HB2 PHE 9 2HB PHE 9 16.945 -13.571 -6.138 72 HB3 PHE 9 3HB PHE 9 16.208 -11.992 -6.391 73 HD1 PHE 9 HD1 PHE 9 13.650 -11.981 -6.813 74 HD2 PHE 9 HD2 PHE 9 15.766 -15.223 -5.044 75 HE1 PHE 9 HE1 PHE 9 11.556 -12.798 -5.813 76 HE2 PHE 9 HE2 PHE 9 13.675 -16.046 -4.042 77 HZ PHE 9 HZ PHE 9 11.566 -14.833 -4.426 78 H ARG 10 H ARG 10 17.442 -15.369 -7.488 79 HA ARG 10 HA ARG 10 15.571 -17.126 -8.936 80 HB2 ARG 10 2HB ARG 10 18.535 -17.292 -8.488 81 HB3 ARG 10 3HB ARG 10 17.601 -18.743 -8.827 82 HG2 ARG 10 2HG ARG 10 16.730 -17.431 -10.870 83 HG3 ARG 10 3HG ARG 10 18.121 -16.383 -10.585 84 HD2 ARG 10 2HD ARG 10 18.288 -19.374 -10.920 85 HD3 ARG 10 3HD ARG 10 18.529 -18.217 -12.228 86 HE ARG 10 HE ARG 10 20.227 -17.601 -10.055 87 HH11 ARG 10 1HH1 ARG 10 19.819 -19.901 -12.637 88 HH12 ARG 10 2HH1 ARG 10 21.509 -20.263 -12.757 89 HH21 ARG 10 2HH2 ARG 10 23.007 -19.221 -11.372 90 HH22 ARG 10 1HH2 ARG 10 22.454 -18.069 -10.204 91 H VAL 11 H VAL 11 14.876 -19.031 -7.958 92 HA VAL 11 HA VAL 11 15.589 -19.411 -5.134 93 HB VAL 11 HB VAL 11 13.435 -18.152 -5.303 94 HG11 VAL 11 1HG1 VAL 11 12.248 -20.706 -6.349 95 HG12 VAL 11 2HG1 VAL 11 11.489 -19.119 -6.203 96 HG13 VAL 11 3HG1 VAL 11 12.741 -19.391 -7.416 97 HG21 VAL 11 3HG2 VAL 11 13.997 -19.575 -3.369 98 HG22 VAL 11 1HG2 VAL 11 12.261 -19.508 -3.675 99 HG23 VAL 11 2HG2 VAL 11 13.187 -20.931 -4.154 100 H ALA 12 H ALA 12 15.807 -21.493 -4.510 101 HA ALA 12 HA ALA 12 15.006 -23.580 -6.432 102 HB1 ALA 12 1HB ALA 12 17.547 -22.962 -6.125 103 HB2 ALA 12 2HB ALA 12 17.393 -23.995 -4.704 104 HB3 ALA 12 3HB ALA 12 17.030 -24.639 -6.305 105 H VAL 13 H VAL 13 13.610 -24.982 -5.611 106 HA VAL 13 HA VAL 13 13.063 -25.037 -2.779 107 HB VAL 13 HB VAL 13 11.187 -25.164 -4.296 108 HG11 VAL 13 1HG1 VAL 13 12.868 -26.844 -5.790 109 HG12 VAL 13 2HG1 VAL 13 11.486 -27.830 -5.309 110 HG13 VAL 13 3HG1 VAL 13 11.232 -26.323 -6.190 111 HG21 VAL 13 3HG2 VAL 13 10.066 -27.154 -3.417 112 HG22 VAL 13 1HG2 VAL 13 11.622 -27.799 -2.892 113 HG23 VAL 13 2HG2 VAL 13 10.984 -26.328 -2.158 114 H GLY 14 H GLY 14 13.834 -26.440 -1.335 115 HA2 GLY 14 2HA GLY 14 14.605 -29.120 -2.096 116 HA3 GLY 14 3HA GLY 14 15.953 -28.090 -1.640 117 H ARG 15 H ARG 15 16.422 -29.428 0.142 118 HA ARG 15 HA ARG 15 14.617 -28.989 2.420 119 HB2 ARG 15 2HB ARG 15 15.907 -31.576 1.570 120 HB3 ARG 15 3HB ARG 15 15.352 -31.306 3.217 121 HG2 ARG 15 2HG ARG 15 13.597 -32.436 2.183 122 HG3 ARG 15 3HG ARG 15 13.090 -30.746 2.178 123 HD2 ARG 15 2HD ARG 15 13.111 -30.629 -0.059 124 HD3 ARG 15 3HD ARG 15 14.630 -31.515 -0.181 125 HE ARG 15 HE ARG 15 12.382 -33.170 0.498 126 HH11 ARG 15 1HH1 ARG 15 14.184 -31.718 -2.103 127 HH12 ARG 15 2HH1 ARG 15 13.682 -32.888 -3.278 128 HH21 ARG 15 2HH2 ARG 15 12.276 -34.593 -2.673 129 HH22 ARG 15 1HH2 ARG 15 11.714 -34.717 -1.040 130 H ASP 16 H ASP 16 15.602 -28.655 4.396 131 HA ASP 16 HA ASP 16 18.472 -28.078 4.257 132 HB2 ASP 16 2HB ASP 16 17.962 -26.904 6.491 133 HB3 ASP 16 3HB ASP 16 17.321 -26.178 5.019 134 H SER 17 H SER 17 19.369 -28.229 6.733 135 HA SER 17 HA SER 17 19.729 -30.991 7.173 136 HB2 SER 17 2HB SER 17 21.194 -28.893 7.848 137 HB3 SER 17 3HB SER 17 20.288 -29.024 9.355 138 HG SER 17 HG SER 17 22.129 -30.799 8.215 139 H SER 18 H SER 18 17.448 -28.694 8.412 140 HA SER 18 HA SER 18 16.628 -30.345 10.634 141 HB2 SER 18 2HB SER 18 15.978 -28.314 11.337 142 HB3 SER 18 3HB SER 18 16.136 -27.635 9.716 143 HG SER 18 HG SER 18 13.905 -28.423 11.056 144 H GLY 19 H GLY 19 15.072 -29.224 7.623 145 HA2 GLY 19 2HA GLY 19 13.871 -30.691 6.173 146 HA3 GLY 19 3HA GLY 19 13.605 -31.768 7.536 147 H CYS 20 H CYS 20 12.971 -28.314 6.905 148 HA CYS 20 HA CYS 20 10.216 -28.768 7.842 149 HB2 CYS 20 2HB CYS 20 12.173 -26.843 8.623 150 HB3 CYS 20 3HB CYS 20 10.848 -25.991 7.841 151 HG CYS 20 HG CYS 20 8.963 -27.460 9.570 152 H THR 21 H THR 21 11.709 -28.710 5.078 153 HA THR 21 HA THR 21 11.193 -28.168 2.927 154 HB THR 21 HB THR 21 8.419 -27.529 3.934 155 HG1 THR 21 HG1 THR 21 9.771 -29.969 3.680 156 HG21 THR 21 3HG2 THR 21 9.623 -27.620 1.353 157 HG22 THR 21 1HG2 THR 21 7.943 -27.288 1.772 158 HG23 THR 21 2HG2 THR 21 8.467 -28.945 1.476 159 H THR 22 H THR 22 12.531 -26.332 2.865 160 HA THR 22 HA THR 22 11.047 -23.816 2.667 161 HB THR 22 HB THR 22 11.950 -23.517 4.818 162 HG1 THR 22 HG1 THR 22 13.698 -21.970 4.403 163 HG21 THR 22 3HG2 THR 22 14.309 -24.977 3.718 164 HG22 THR 22 1HG2 THR 22 13.445 -25.218 5.236 165 HG23 THR 22 2HG2 THR 22 14.548 -23.854 5.057 166 H LEU 23 H LEU 23 12.151 -22.180 1.405 167 HA LEU 23 HA LEU 23 13.881 -23.392 -0.629 168 HB2 LEU 23 2HB LEU 23 11.972 -21.102 -0.605 169 HB3 LEU 23 3HB LEU 23 13.289 -21.107 -1.776 170 HG LEU 23 HG LEU 23 12.465 -23.132 -2.776 171 HD11 LEU 23 1HD1 LEU 23 11.633 -24.475 -1.100 172 HD12 LEU 23 2HD1 LEU 23 10.153 -23.935 -1.892 173 HD13 LEU 23 3HD1 LEU 23 10.674 -23.178 -0.387 174 HD21 LEU 23 3HD2 LEU 23 10.787 -20.756 -2.492 175 HD22 LEU 23 1HD2 LEU 23 9.907 -22.196 -3.004 176 HD23 LEU 23 2HD2 LEU 23 11.289 -21.627 -3.942 177 H SER 24 H SER 24 15.633 -22.081 -1.527 178 HA SER 24 HA SER 24 16.813 -20.277 0.484 179 HB2 SER 24 2HB SER 24 17.851 -22.664 0.048 180 HB3 SER 24 3HB SER 24 18.552 -21.867 -1.360 181 HG SER 24 HG SER 24 19.429 -20.304 0.090 182 H ILE 25 H ILE 25 17.987 -18.501 -0.268 183 HA ILE 25 HA ILE 25 17.282 -17.681 -2.985 184 HB ILE 25 HB ILE 25 18.546 -15.980 -0.840 185 HG12 ILE 25 2HG1 ILE 25 16.425 -16.883 -0.008 186 HG13 ILE 25 3HG1 ILE 25 16.280 -15.161 -0.347 187 HG21 ILE 25 1HG2 ILE 25 17.795 -14.121 -2.143 188 HG22 ILE 25 2HG2 ILE 25 18.674 -15.215 -3.209 189 HG23 ILE 25 3HG2 ILE 25 16.911 -15.182 -3.240 190 HD11 ILE 25 3HD1 ILE 25 14.559 -15.556 -1.669 191 HD12 ILE 25 1HD1 ILE 25 15.550 -16.606 -2.682 192 HD13 ILE 25 2HD1 ILE 25 14.683 -17.276 -1.300 193 H GLN 26 H GLN 26 18.733 -17.411 -4.574 194 HA GLN 26 HA GLN 26 21.559 -17.903 -3.922 195 HB2 GLN 26 2HB GLN 26 19.950 -18.416 -6.418 196 HB3 GLN 26 3HB GLN 26 21.709 -18.440 -6.417 197 HG2 GLN 26 2HG GLN 26 21.516 -20.601 -5.942 198 HG3 GLN 26 3HG GLN 26 21.099 -20.076 -4.312 199 HE21 GLN 26 2HE2 GLN 26 18.040 -21.106 -6.839 200 HE22 GLN 26 1HE2 GLN 26 19.443 -20.303 -7.447 201 H GLU 27 H GLU 27 19.375 -15.540 -4.982 202 HA GLU 27 HA GLU 27 21.609 -13.848 -5.889 203 HB2 GLU 27 2HB GLU 27 19.395 -14.636 -7.400 204 HB3 GLU 27 3HB GLU 27 19.036 -12.987 -6.908 205 HG2 GLU 27 2HG GLU 27 20.162 -12.534 -8.811 206 HG3 GLU 27 3HG GLU 27 21.535 -12.609 -7.708 207 H VAL 28 H VAL 28 20.342 -11.440 -6.045 208 HA VAL 28 HA VAL 28 19.517 -10.968 -3.255 209 HB VAL 28 HB VAL 28 20.694 -8.847 -5.027 210 HG11 VAL 28 1HG1 VAL 28 21.206 -7.747 -2.966 211 HG12 VAL 28 2HG1 VAL 28 19.517 -8.256 -2.905 212 HG13 VAL 28 3HG1 VAL 28 20.747 -9.171 -2.032 213 HG21 VAL 28 3HG2 VAL 28 22.892 -9.337 -4.009 214 HG22 VAL 28 1HG2 VAL 28 22.206 -10.793 -3.289 215 HG23 VAL 28 2HG2 VAL 28 22.313 -10.644 -5.043 216 H THR 29 H THR 29 17.583 -10.085 -2.892 217 HA THR 29 HA THR 29 16.144 -8.907 -5.181 218 HB THR 29 HB THR 29 15.026 -10.939 -4.689 219 HG1 THR 29 HG1 THR 29 13.770 -8.820 -4.681 220 HG21 THR 29 3HG2 THR 29 14.966 -10.126 -1.782 221 HG22 THR 29 1HG2 THR 29 16.071 -11.313 -2.471 222 HG23 THR 29 2HG2 THR 29 14.335 -11.621 -2.472 223 H GLN 30 H GLN 30 17.373 -8.410 -2.071 224 HA GLN 30 HA GLN 30 15.478 -6.343 -1.334 225 HB2 GLN 30 2HB GLN 30 17.697 -7.773 -0.024 226 HB3 GLN 30 3HB GLN 30 17.517 -6.089 0.450 227 HG2 GLN 30 2HG GLN 30 16.258 -7.308 1.997 228 HG3 GLN 30 3HG GLN 30 15.081 -6.615 0.883 229 HE21 GLN 30 2HE2 GLN 30 15.893 -10.606 0.445 230 HE22 GLN 30 1HE2 GLN 30 17.168 -9.480 0.748 231 H THR 31 H THR 31 17.748 -6.408 -3.583 232 HA THR 31 HA THR 31 18.750 -3.696 -3.012 233 HB THR 31 HB THR 31 20.405 -4.343 -4.936 234 HG1 THR 31 HG1 THR 31 19.407 -6.359 -5.407 235 HG21 THR 31 3HG2 THR 31 22.000 -4.727 -3.337 236 HG22 THR 31 1HG2 THR 31 20.979 -5.839 -2.428 237 HG23 THR 31 2HG2 THR 31 20.707 -4.100 -2.314 238 H TYR 32 H TYR 32 16.197 -4.763 -4.367 239 HA TYR 32 HA TYR 32 16.463 -3.150 -6.820 240 HB2 TYR 32 2HB TYR 32 15.689 -5.865 -6.571 241 HB3 TYR 32 3HB TYR 32 14.246 -4.956 -7.005 242 HD1 TYR 32 HD1 TYR 32 17.551 -6.061 -8.105 243 HD2 TYR 32 HD2 TYR 32 14.109 -3.785 -9.143 244 HE1 TYR 32 HE1 TYR 32 18.290 -6.023 -10.451 245 HE2 TYR 32 HE2 TYR 32 14.838 -3.743 -11.491 246 HH TYR 32 HH TYR 32 17.210 -5.752 -12.717 247 H THR 33 H THR 33 14.729 -1.816 -7.382 248 HA THR 33 HA THR 33 12.359 -1.680 -5.762 249 HB THR 33 HB THR 33 14.137 0.752 -5.676 250 HG1 THR 33 HG1 THR 33 14.534 0.055 -3.461 251 HG21 THR 33 3HG2 THR 33 11.663 0.982 -5.340 252 HG22 THR 33 1HG2 THR 33 12.638 1.511 -3.970 253 HG23 THR 33 2HG2 THR 33 11.820 -0.050 -3.918 254 H GLY 34 H GLY 34 10.731 -0.452 -6.700 255 HA2 GLY 34 2HA GLY 34 11.301 1.271 -8.951 256 HA3 GLY 34 3HA GLY 34 10.515 -0.240 -9.384 257 H SER 35 H SER 35 8.926 -0.409 -6.974 258 HA SER 35 HA SER 35 6.939 1.650 -7.646 259 HB2 SER 35 2HB SER 35 6.515 -0.983 -6.214 260 HB3 SER 35 3HB SER 35 5.260 0.127 -6.765 261 HG SER 35 HG SER 35 6.066 -0.252 -8.920 262 H ASN 36 H ASN 36 6.151 3.023 -6.138 263 HA ASN 36 HA ASN 36 6.084 4.259 -4.229 264 HB2 ASN 36 2HB ASN 36 6.103 1.438 -3.222 265 HB3 ASN 36 3HB ASN 36 6.208 2.764 -2.068 266 HD21 ASN 36 2HD2 ASN 36 2.878 3.726 -2.361 267 HD22 ASN 36 1HD2 ASN 36 4.454 4.102 -1.759 268 H GLY 37 H GLY 37 8.687 3.735 -5.498 269 HA2 GLY 37 2HA GLY 37 10.340 4.924 -3.510 270 HA3 GLY 37 3HA GLY 37 10.754 3.230 -3.727 271 H GLY 38 H GLY 38 10.968 2.606 -6.150 272 HA2 GLY 38 2HA GLY 38 12.127 2.846 -8.118 273 HA3 GLY 38 3HA GLY 38 11.726 4.556 -8.041 274 H ALA 39 H ALA 39 14.046 2.111 -7.030 275 HA ALA 39 HA ALA 39 16.284 3.716 -7.481 276 HB1 ALA 39 1HB ALA 39 15.152 3.881 -4.736 277 HB2 ALA 39 2HB ALA 39 16.906 3.831 -4.920 278 HB3 ALA 39 3HB ALA 39 15.975 5.110 -5.698 279 H ASP 40 H ASP 40 16.186 1.370 -8.361 280 HA ASP 40 HA ASP 40 16.810 -0.773 -6.608 281 HB2 ASP 40 2HB ASP 40 17.393 -2.006 -8.659 282 HB3 ASP 40 3HB ASP 40 15.851 -1.169 -8.821 283 H LEU 41 H LEU 41 18.596 -0.856 -5.421 284 HA LEU 41 HA LEU 41 21.177 -0.813 -6.638 285 HB2 LEU 41 2HB LEU 41 20.280 1.666 -5.998 286 HB3 LEU 41 3HB LEU 41 21.094 1.208 -4.503 287 HG LEU 41 HG LEU 41 23.094 0.645 -6.059 288 HD11 LEU 41 1HD1 LEU 41 21.905 0.847 -8.166 289 HD12 LEU 41 2HD1 LEU 41 23.190 2.051 -8.064 290 HD13 LEU 41 3HD1 LEU 41 21.512 2.528 -7.803 291 HD21 LEU 41 3HD2 LEU 41 22.831 3.546 -6.072 292 HD22 LEU 41 1HD2 LEU 41 23.989 2.515 -5.231 293 HD23 LEU 41 2HD2 LEU 41 22.402 2.818 -4.523 294 H MET 42 H MET 42 22.738 -0.324 -4.384 295 HA MET 42 HA MET 42 21.875 -2.508 -2.607 296 HB2 MET 42 2HB MET 42 23.860 -3.128 -3.817 297 HB3 MET 42 3HB MET 42 24.645 -1.609 -3.406 298 HG2 MET 42 2HG MET 42 23.783 -3.164 -1.089 299 HG3 MET 42 3HG MET 42 24.982 -3.972 -2.096 300 HE1 MET 42 3HE MET 42 27.118 -2.028 -3.096 301 HE2 MET 42 1HE MET 42 28.166 -2.041 -1.677 302 HE3 MET 42 2HE MET 42 27.340 -3.517 -2.176 303 H GLY 43 H GLY 43 21.263 -1.869 -0.653 304 HA2 GLY 43 2HA GLY 43 22.863 -0.058 0.898 305 HA3 GLY 43 3HA GLY 43 21.339 0.657 0.393 306 HA PRO 44 HA PRO 44 19.139 -1.288 3.643 307 HB2 PRO 44 2HB PRO 44 16.948 -2.367 2.458 308 HB3 PRO 44 3HB PRO 44 17.170 -0.625 2.661 309 HG2 PRO 44 2HG PRO 44 17.650 -2.326 0.245 310 HG3 PRO 44 3HG PRO 44 16.884 -0.731 0.356 311 HD2 PRO 44 2HD PRO 44 19.452 -1.062 -0.438 312 HD3 PRO 44 3HD PRO 44 18.906 0.372 0.455 313 H ALA 45 H ALA 45 19.785 -3.344 0.870 314 HA ALA 45 HA ALA 45 19.168 -5.810 2.156 315 HB1 ALA 45 1HB ALA 45 19.745 -6.814 0.195 316 HB2 ALA 45 2HB ALA 45 19.475 -5.174 -0.398 317 HB3 ALA 45 3HB ALA 45 21.116 -5.739 -0.083 318 H PHE 46 H PHE 46 22.215 -4.104 1.482 319 HA PHE 46 HA PHE 46 23.836 -6.051 2.794 320 HB2 PHE 46 2HB PHE 46 24.274 -3.809 1.155 321 HB3 PHE 46 3HB PHE 46 25.078 -3.448 2.679 322 HD1 PHE 46 HD1 PHE 46 27.324 -3.865 2.571 323 HD2 PHE 46 HD2 PHE 46 24.642 -6.534 0.621 324 HE1 PHE 46 HE1 PHE 46 29.223 -5.281 1.903 325 HE2 PHE 46 HE2 PHE 46 26.536 -7.954 -0.049 326 HZ PHE 46 HZ PHE 46 28.830 -7.328 0.592 327 H ALA 47 H ALA 47 22.006 -3.324 3.835 328 HA ALA 47 HA ALA 47 23.429 -2.837 6.266 329 HB1 ALA 47 1HB ALA 47 21.084 -1.725 6.802 330 HB2 ALA 47 2HB ALA 47 22.243 -0.975 5.704 331 HB3 ALA 47 3HB ALA 47 20.886 -1.897 5.058 332 H ALA 48 H ALA 48 20.680 -4.821 5.333 333 HA ALA 48 HA ALA 48 20.146 -5.603 8.077 334 HB1 ALA 48 1HB ALA 48 18.124 -5.622 7.091 335 HB2 ALA 48 2HB ALA 48 18.793 -5.904 5.483 336 HB3 ALA 48 3HB ALA 48 18.593 -7.251 6.604 337 H GLY 49 H GLY 49 21.960 -6.727 5.366 338 HA2 GLY 49 2HA GLY 49 23.709 -8.341 5.710 339 HA3 GLY 49 3HA GLY 49 22.693 -9.124 6.912 340 H LEU 50 H LEU 50 20.969 -8.183 4.157 341 HA LEU 50 HA LEU 50 20.370 -10.864 3.450 342 HB2 LEU 50 2HB LEU 50 19.729 -8.182 2.300 343 HB3 LEU 50 3HB LEU 50 19.358 -9.640 1.382 344 HG LEU 50 HG LEU 50 17.401 -8.833 2.583 345 HD11 LEU 50 1HD1 LEU 50 18.173 -11.267 4.105 346 HD12 LEU 50 2HD1 LEU 50 18.112 -11.358 2.345 347 HD13 LEU 50 3HD1 LEU 50 16.674 -10.890 3.254 348 HD21 LEU 50 3HD2 LEU 50 19.046 -9.270 5.074 349 HD22 LEU 50 1HD2 LEU 50 17.333 -8.853 5.025 350 HD23 LEU 50 2HD2 LEU 50 18.535 -7.709 4.427 351 H ARG 51 H ARG 51 21.748 -12.177 2.458 352 HA ARG 51 HA ARG 51 23.113 -11.229 0.054 353 HB2 ARG 51 2HB ARG 51 24.439 -11.660 2.525 354 HB3 ARG 51 3HB ARG 51 24.899 -12.974 1.451 355 HG2 ARG 51 2HG ARG 51 25.112 -10.761 -0.162 356 HG3 ARG 51 3HG ARG 51 25.663 -10.171 1.407 357 HD2 ARG 51 2HD ARG 51 26.989 -12.475 1.365 358 HD3 ARG 51 3HD ARG 51 26.835 -12.235 -0.375 359 HE ARG 51 HE ARG 51 27.767 -9.872 0.869 360 HH11 ARG 51 1HH1 ARG 51 28.791 -13.067 -0.058 361 HH12 ARG 51 2HH1 ARG 51 30.456 -12.624 -0.237 362 HH21 ARG 51 2HH2 ARG 51 31.118 -10.466 0.160 363 HH22 ARG 51 1HH2 ARG 51 29.957 -9.275 0.637 364 H VAL 52 H VAL 52 23.839 -12.957 -1.342 365 HA VAL 52 HA VAL 52 21.965 -14.988 -1.690 366 HB VAL 52 HB VAL 52 23.448 -15.929 -3.353 367 HG11 VAL 52 1HG1 VAL 52 23.614 -14.082 -4.805 368 HG12 VAL 52 2HG1 VAL 52 22.267 -13.712 -3.728 369 HG13 VAL 52 3HG1 VAL 52 23.837 -12.951 -3.471 370 HG21 VAL 52 3HG2 VAL 52 25.739 -14.709 -3.595 371 HG22 VAL 52 1HG2 VAL 52 25.524 -14.367 -1.879 372 HG23 VAL 52 2HG2 VAL 52 25.569 -16.036 -2.447 373 H GLY 53 H GLY 53 21.753 -17.018 -0.946 374 HA2 GLY 53 2HA GLY 53 22.974 -19.089 -0.291 375 HA3 GLY 53 3HA GLY 53 23.926 -18.059 0.767 376 H ASP 54 H ASP 54 22.012 -16.490 1.936 377 HA ASP 54 HA ASP 54 20.990 -18.215 3.930 378 HB2 ASP 54 2HB ASP 54 20.378 -15.314 3.334 379 HB3 ASP 54 3HB ASP 54 19.849 -16.165 4.783 380 H GLN 55 H GLN 55 18.781 -18.580 4.520 381 HA GLN 55 HA GLN 55 17.033 -18.776 2.173 382 HB2 GLN 55 2HB GLN 55 17.035 -20.243 4.811 383 HB3 GLN 55 3HB GLN 55 15.747 -20.395 3.623 384 HG2 GLN 55 2HG GLN 55 17.140 -21.453 2.075 385 HG3 GLN 55 3HG GLN 55 18.604 -20.942 2.912 386 HE21 GLN 55 2HE2 GLN 55 16.655 -24.327 3.968 387 HE22 GLN 55 1HE2 GLN 55 16.025 -23.234 2.788 388 H LEU 56 H LEU 56 14.892 -18.079 2.230 389 HA LEU 56 HA LEU 56 14.106 -16.446 4.544 390 HB2 LEU 56 2HB LEU 56 14.027 -15.663 1.641 391 HB3 LEU 56 3HB LEU 56 13.097 -14.831 2.885 392 HG LEU 56 HG LEU 56 15.026 -13.522 2.478 393 HD11 LEU 56 1HD1 LEU 56 15.603 -13.192 4.621 394 HD12 LEU 56 2HD1 LEU 56 16.111 -14.864 4.853 395 HD13 LEU 56 3HD1 LEU 56 14.401 -14.441 4.948 396 HD21 LEU 56 3HD2 LEU 56 16.974 -14.340 1.786 397 HD22 LEU 56 1HD2 LEU 56 16.223 -15.936 1.787 398 HD23 LEU 56 2HD2 LEU 56 17.116 -15.380 3.203 399 H VAL 57 H VAL 57 12.183 -17.017 5.297 400 HA VAL 57 HA VAL 57 10.275 -18.303 3.453 401 HB VAL 57 HB VAL 57 9.369 -19.379 5.615 402 HG11 VAL 57 1HG1 VAL 57 11.956 -20.643 5.173 403 HG12 VAL 57 2HG1 VAL 57 10.329 -21.256 4.871 404 HG13 VAL 57 3HG1 VAL 57 11.122 -20.230 3.676 405 HG21 VAL 57 3HG2 VAL 57 10.872 -17.890 7.040 406 HG22 VAL 57 1HG2 VAL 57 10.806 -19.602 7.459 407 HG23 VAL 57 2HG2 VAL 57 12.188 -18.966 6.568 408 H ARG 58 H ARG 58 10.699 -16.146 6.203 409 HA ARG 58 HA ARG 58 9.339 -14.594 7.170 410 HB2 ARG 58 2HB ARG 58 8.054 -14.429 4.442 411 HB3 ARG 58 3HB ARG 58 8.119 -13.170 5.669 412 HG2 ARG 58 2HG ARG 58 10.422 -12.813 5.326 413 HG3 ARG 58 3HG ARG 58 10.588 -14.299 4.388 414 HD2 ARG 58 2HD ARG 58 9.099 -11.802 3.589 415 HD3 ARG 58 3HD ARG 58 10.606 -12.403 2.898 416 HE ARG 58 HE ARG 58 7.973 -13.220 2.209 417 HH11 ARG 58 1HH1 ARG 58 11.237 -14.378 2.557 418 HH12 ARG 58 2HH1 ARG 58 11.046 -15.657 1.404 419 HH21 ARG 58 2HH2 ARG 58 9.038 -15.952 0.342 420 HH22 ARG 58 1HH2 ARG 58 7.708 -14.900 0.689 421 H PHE 59 H PHE 59 8.460 -17.383 7.227 422 HA PHE 59 HA PHE 59 5.644 -16.881 7.845 423 HB2 PHE 59 2HB PHE 59 6.702 -19.048 6.045 424 HB3 PHE 59 3HB PHE 59 5.178 -19.238 6.905 425 HD1 PHE 59 HD1 PHE 59 3.860 -16.731 6.733 426 HD2 PHE 59 HD2 PHE 59 6.309 -18.645 3.825 427 HE1 PHE 59 HE1 PHE 59 2.699 -15.498 4.948 428 HE2 PHE 59 HE2 PHE 59 5.152 -17.415 2.036 429 HZ PHE 59 HZ PHE 59 3.345 -15.838 2.596 430 H ALA 60 H ALA 60 4.806 -18.129 9.520 431 HA ALA 60 HA ALA 60 6.712 -19.051 11.430 432 HB1 ALA 60 1HB ALA 60 3.752 -18.799 11.328 433 HB2 ALA 60 2HB ALA 60 4.460 -19.860 12.547 434 HB3 ALA 60 3HB ALA 60 4.904 -18.154 12.498 435 H GLY 61 H GLY 61 7.762 -20.917 11.174 436 HA2 GLY 61 2HA GLY 61 7.230 -23.375 11.561 437 HA3 GLY 61 3HA GLY 61 6.265 -23.223 10.100 438 H TYR 62 H TYR 62 8.853 -21.245 9.683 439 HA TYR 62 HA TYR 62 10.742 -21.347 8.421 440 HB2 TYR 62 2HB TYR 62 11.064 -24.234 9.192 441 HB3 TYR 62 3HB TYR 62 12.309 -23.023 8.905 442 HD1 TYR 62 HD1 TYR 62 11.420 -20.798 10.593 443 HD2 TYR 62 HD2 TYR 62 11.403 -24.982 11.366 444 HE1 TYR 62 HE1 TYR 62 11.540 -20.346 13.008 445 HE2 TYR 62 HE2 TYR 62 11.521 -24.541 13.783 446 HH TYR 62 HH TYR 62 11.058 -21.408 15.106 447 H THR 63 H THR 63 8.292 -21.860 7.134 448 HA THR 63 HA THR 63 9.223 -23.572 4.933 449 HB THR 63 HB THR 63 7.599 -24.933 6.036 450 HG1 THR 63 HG1 THR 63 6.604 -25.348 4.212 451 HG21 THR 63 3HG2 THR 63 5.188 -23.488 5.880 452 HG22 THR 63 1HG2 THR 63 6.363 -22.414 6.638 453 HG23 THR 63 2HG2 THR 63 6.044 -24.003 7.333 454 H VAL 64 H VAL 64 8.457 -23.000 2.854 455 HA VAL 64 HA VAL 64 6.912 -20.547 2.585 456 HB VAL 64 HB VAL 64 9.376 -19.932 2.750 457 HG11 VAL 64 1HG1 VAL 64 9.739 -21.989 1.006 458 HG12 VAL 64 2HG1 VAL 64 9.780 -20.596 -0.076 459 HG13 VAL 64 3HG1 VAL 64 10.898 -20.690 1.285 460 HG21 VAL 64 3HG2 VAL 64 8.914 -18.088 1.551 461 HG22 VAL 64 1HG2 VAL 64 8.548 -19.008 0.091 462 HG23 VAL 64 2HG2 VAL 64 7.325 -18.825 1.349 463 H THR 65 H THR 65 6.270 -20.123 0.351 464 HA THR 65 HA THR 65 5.737 -22.612 -1.044 465 HB THR 65 HB THR 65 4.773 -19.798 -1.592 466 HG1 THR 65 HG1 THR 65 2.800 -20.677 -0.754 467 HG21 THR 65 3HG2 THR 65 3.016 -21.273 -2.909 468 HG22 THR 65 1HG2 THR 65 4.384 -22.378 -3.029 469 HG23 THR 65 2HG2 THR 65 4.515 -20.740 -3.668 470 H GLU 66 H GLU 66 6.488 -19.413 -2.398 471 HA GLU 66 HA GLU 66 8.935 -20.135 -3.587 472 HB2 GLU 66 2HB GLU 66 8.327 -20.467 -5.879 473 HB3 GLU 66 3HB GLU 66 7.399 -21.603 -4.911 474 HG2 GLU 66 2HG GLU 66 5.755 -19.397 -5.059 475 HG3 GLU 66 3HG GLU 66 6.497 -19.471 -6.656 476 H LEU 67 H LEU 67 9.008 -18.602 -5.834 477 HA LEU 67 HA LEU 67 9.314 -16.023 -4.879 478 HB2 LEU 67 2HB LEU 67 9.219 -15.367 -7.334 479 HB3 LEU 67 3HB LEU 67 10.437 -16.548 -6.856 480 HG LEU 67 HG LEU 67 8.157 -18.007 -7.656 481 HD11 LEU 67 1HD1 LEU 67 8.884 -16.427 -10.021 482 HD12 LEU 67 2HD1 LEU 67 7.902 -15.579 -8.827 483 HD13 LEU 67 3HD1 LEU 67 7.326 -17.091 -9.528 484 HD21 LEU 67 3HD2 LEU 67 10.241 -18.976 -7.967 485 HD22 LEU 67 1HD2 LEU 67 10.915 -17.530 -8.718 486 HD23 LEU 67 2HD2 LEU 67 9.770 -18.534 -9.609 487 H ALA 68 H ALA 68 6.499 -17.558 -6.301 488 HA ALA 68 HA ALA 68 4.934 -15.312 -6.829 489 HB1 ALA 68 1HB ALA 68 4.017 -18.032 -5.903 490 HB2 ALA 68 2HB ALA 68 3.013 -16.811 -6.684 491 HB3 ALA 68 3HB ALA 68 4.340 -17.561 -7.571 492 H ALA 69 H ALA 69 5.286 -17.188 -3.839 493 HA ALA 69 HA ALA 69 3.368 -15.707 -2.359 494 HB1 ALA 69 1HB ALA 69 4.529 -16.762 -0.374 495 HB2 ALA 69 2HB ALA 69 3.876 -17.875 -1.577 496 HB3 ALA 69 3HB ALA 69 5.606 -17.537 -1.535 497 H PHE 70 H PHE 70 6.816 -15.360 -2.912 498 HA PHE 70 HA PHE 70 7.231 -13.385 -0.895 499 HB2 PHE 70 2HB PHE 70 9.057 -14.796 -1.790 500 HB3 PHE 70 3HB PHE 70 8.896 -13.990 -3.347 501 HD1 PHE 70 HD1 PHE 70 10.875 -12.831 -3.649 502 HD2 PHE 70 HD2 PHE 70 8.852 -12.565 0.087 503 HE1 PHE 70 HE1 PHE 70 12.462 -11.100 -2.916 504 HE2 PHE 70 HE2 PHE 70 10.436 -10.833 0.825 505 HZ PHE 70 HZ PHE 70 12.243 -10.097 -0.677 506 H ASN 71 H ASN 71 6.041 -13.337 -4.128 507 HA ASN 71 HA ASN 71 6.654 -10.726 -4.904 508 HB2 ASN 71 2HB ASN 71 4.938 -12.848 -5.812 509 HB3 ASN 71 3HB ASN 71 4.077 -11.314 -5.902 510 HD21 ASN 71 2HD2 ASN 71 6.710 -9.929 -8.066 511 HD22 ASN 71 1HD2 ASN 71 6.034 -9.555 -6.520 512 H THR 72 H THR 72 3.875 -11.981 -3.094 513 HA THR 72 HA THR 72 2.598 -9.446 -2.832 514 HB THR 72 HB THR 72 1.593 -10.918 -0.753 515 HG1 THR 72 HG1 THR 72 2.646 -12.798 -1.103 516 HG21 THR 72 3HG2 THR 72 0.870 -10.682 -3.646 517 HG22 THR 72 1HG2 THR 72 0.065 -10.001 -2.233 518 HG23 THR 72 2HG2 THR 72 -0.080 -11.723 -2.586 519 H VAL 73 H VAL 73 4.871 -11.283 -0.883 520 HA VAL 73 HA VAL 73 4.671 -9.692 1.459 521 HB VAL 73 HB VAL 73 6.931 -11.451 0.497 522 HG11 VAL 73 1HG1 VAL 73 6.651 -9.712 2.841 523 HG12 VAL 73 2HG1 VAL 73 7.143 -11.367 3.206 524 HG13 VAL 73 3HG1 VAL 73 8.098 -10.387 2.093 525 HG21 VAL 73 3HG2 VAL 73 4.599 -11.938 2.340 526 HG22 VAL 73 1HG2 VAL 73 4.973 -12.761 0.826 527 HG23 VAL 73 2HG2 VAL 73 5.999 -13.006 2.239 528 H VAL 74 H VAL 74 6.780 -9.595 -1.376 529 HA VAL 74 HA VAL 74 8.599 -7.668 -0.511 530 HB VAL 74 HB VAL 74 7.566 -8.232 -3.290 531 HG11 VAL 74 1HG1 VAL 74 8.413 -6.101 -3.561 532 HG12 VAL 74 2HG1 VAL 74 9.643 -6.318 -2.314 533 HG13 VAL 74 3HG1 VAL 74 9.831 -7.099 -3.884 534 HG21 VAL 74 3HG2 VAL 74 10.319 -8.903 -2.456 535 HG22 VAL 74 1HG2 VAL 74 9.025 -9.855 -1.730 536 HG23 VAL 74 2HG2 VAL 74 9.196 -9.792 -3.484 537 H ALA 75 H ALA 75 5.396 -7.312 -1.940 538 HA ALA 75 HA ALA 75 5.467 -4.539 -2.387 539 HB1 ALA 75 1HB ALA 75 3.711 -6.438 -3.016 540 HB2 ALA 75 2HB ALA 75 2.892 -5.774 -1.602 541 HB3 ALA 75 3HB ALA 75 3.281 -4.728 -2.968 542 H ARG 76 H ARG 76 4.452 -6.432 0.432 543 HA ARG 76 HA ARG 76 3.722 -4.095 1.943 544 HB2 ARG 76 2HB ARG 76 3.870 -7.033 2.513 545 HB3 ARG 76 3HB ARG 76 3.723 -5.893 3.844 546 HG2 ARG 76 2HG ARG 76 1.544 -6.682 3.258 547 HG3 ARG 76 3HG ARG 76 1.677 -4.988 2.780 548 HD2 ARG 76 2HD ARG 76 1.417 -5.464 0.607 549 HD3 ARG 76 3HD ARG 76 2.492 -6.859 0.693 550 HE ARG 76 HE ARG 76 -0.372 -6.868 0.869 551 HH11 ARG 76 1HH1 ARG 76 2.544 -8.556 1.741 552 HH12 ARG 76 2HH1 ARG 76 1.764 -10.096 1.889 553 HH21 ARG 76 2HH2 ARG 76 -0.486 -10.284 1.500 554 HH22 ARG 76 1HH2 ARG 76 -1.412 -8.889 1.060 555 H HIS 77 H HIS 77 6.583 -5.945 1.417 556 HA HIS 77 HA HIS 77 7.936 -5.116 3.811 557 HB2 HIS 77 2HB HIS 77 8.652 -6.663 1.369 558 HB3 HIS 77 3HB HIS 77 9.966 -5.933 2.287 559 HD1 HIS 77 HD1 HIS 77 7.027 -7.161 4.192 560 HD2 HIS 77 HD2 HIS 77 10.787 -8.529 3.073 561 HE1 HIS 77 HE1 HIS 77 7.449 -9.197 5.606 562 H VAL 78 H VAL 78 8.284 -4.301 0.358 563 HA VAL 78 HA VAL 78 10.241 -2.347 0.608 564 HB VAL 78 HB VAL 78 9.333 -1.399 -1.517 565 HG11 VAL 78 1HG1 VAL 78 10.063 -4.238 -1.106 566 HG12 VAL 78 2HG1 VAL 78 9.445 -3.790 -2.697 567 HG13 VAL 78 3HG1 VAL 78 10.871 -2.982 -2.044 568 HG21 VAL 78 3HG2 VAL 78 7.208 -1.717 -2.076 569 HG22 VAL 78 1HG2 VAL 78 7.489 -3.456 -2.169 570 HG23 VAL 78 2HG2 VAL 78 6.977 -2.725 -0.647 571 H ARG 79 H ARG 79 10.210 -0.595 1.844 572 HA ARG 79 HA ARG 79 7.993 1.261 1.662 573 HB2 ARG 79 2HB ARG 79 8.641 -0.278 4.141 574 HB3 ARG 79 3HB ARG 79 8.113 1.392 4.296 575 HG2 ARG 79 2HG ARG 79 6.061 0.861 3.083 576 HG3 ARG 79 3HG ARG 79 6.593 -0.814 2.921 577 HD2 ARG 79 2HD ARG 79 5.781 -1.301 4.930 578 HD3 ARG 79 3HD ARG 79 6.764 -0.035 5.664 579 HE ARG 79 HE ARG 79 4.585 1.223 4.513 580 HH11 ARG 79 1HH1 ARG 79 5.167 -1.145 6.998 581 HH12 ARG 79 2HH1 ARG 79 3.768 -0.709 7.922 582 HH21 ARG 79 2HH2 ARG 79 2.388 0.968 7.195 583 HH22 ARG 79 1HH2 ARG 79 2.740 1.806 5.721 584 HA PRO 80 HA PRO 80 11.130 4.292 2.127 585 HB2 PRO 80 2HB PRO 80 9.848 6.255 3.495 586 HB3 PRO 80 3HB PRO 80 9.506 5.885 1.800 587 HG2 PRO 80 2HG PRO 80 8.013 5.055 4.259 588 HG3 PRO 80 3HG PRO 80 7.380 5.633 2.707 589 HD2 PRO 80 2HD PRO 80 7.441 3.008 3.368 590 HD3 PRO 80 3HD PRO 80 7.627 3.576 1.697 591 H SER 81 H SER 81 12.623 3.231 3.470 592 HA SER 81 HA SER 81 13.878 2.867 5.334 593 HB2 SER 81 2HB SER 81 12.592 5.358 6.458 594 HB3 SER 81 3HB SER 81 14.198 4.717 6.805 595 HG SER 81 HG SER 81 13.673 6.524 5.069 596 H ALA 82 H ALA 82 11.423 1.506 5.246 597 HA ALA 82 HA ALA 82 10.618 1.481 8.081 598 HB1 ALA 82 1HB ALA 82 8.471 1.059 7.503 599 HB2 ALA 82 2HB ALA 82 8.962 1.881 6.022 600 HB3 ALA 82 3HB ALA 82 8.921 0.119 6.080 601 H SER 83 H SER 83 11.174 -0.235 9.246 602 HA SER 83 HA SER 83 12.222 -2.593 7.858 603 HB2 SER 83 2HB SER 83 13.679 -2.841 9.575 604 HB3 SER 83 3HB SER 83 13.263 -1.168 9.943 605 HG SER 83 HG SER 83 12.264 -3.534 11.120 606 H ILE 84 H ILE 84 11.462 -4.652 8.226 607 HA ILE 84 HA ILE 84 9.075 -4.916 9.924 608 HB ILE 84 HB ILE 84 8.345 -6.624 8.057 609 HG12 ILE 84 2HG1 ILE 84 8.893 -5.810 5.801 610 HG13 ILE 84 3HG1 ILE 84 9.954 -4.589 6.497 611 HG21 ILE 84 1HG2 ILE 84 6.941 -4.893 7.075 612 HG22 ILE 84 2HG2 ILE 84 7.053 -4.694 8.822 613 HG23 ILE 84 3HG2 ILE 84 7.986 -3.646 7.754 614 HD11 ILE 84 3HD1 ILE 84 10.825 -6.930 5.572 615 HD12 ILE 84 1HD1 ILE 84 11.610 -6.066 6.894 616 HD13 ILE 84 2HD1 ILE 84 10.498 -7.391 7.243 617 HA PRO 85 HA PRO 85 10.856 -8.618 11.468 618 HB2 PRO 85 2HB PRO 85 8.674 -10.195 11.818 619 HB3 PRO 85 3HB PRO 85 9.027 -8.802 12.847 620 HG2 PRO 85 2HG PRO 85 7.140 -9.019 10.533 621 HG3 PRO 85 3HG PRO 85 6.900 -8.228 12.101 622 HD2 PRO 85 2HD PRO 85 7.527 -6.850 9.856 623 HD3 PRO 85 3HD PRO 85 8.065 -6.341 11.470 624 H VAL 86 H VAL 86 11.918 -10.267 10.564 625 HA VAL 86 HA VAL 86 10.639 -11.830 8.444 626 HB VAL 86 HB VAL 86 13.439 -10.742 8.143 627 HG11 VAL 86 1HG1 VAL 86 11.926 -12.800 6.814 628 HG12 VAL 86 2HG1 VAL 86 12.377 -11.524 5.681 629 HG13 VAL 86 3HG1 VAL 86 13.620 -12.351 6.620 630 HG21 VAL 86 3HG2 VAL 86 12.203 -9.516 6.171 631 HG22 VAL 86 1HG2 VAL 86 10.807 -9.686 7.236 632 HG23 VAL 86 2HG2 VAL 86 12.239 -8.820 7.791 633 H VAL 87 H VAL 87 11.136 -13.958 8.490 634 HA VAL 87 HA VAL 87 13.054 -14.827 10.545 635 HB VAL 87 HB VAL 87 10.833 -15.627 11.007 636 HG11 VAL 87 1HG1 VAL 87 10.669 -15.853 8.169 637 HG12 VAL 87 2HG1 VAL 87 10.300 -17.421 8.891 638 HG13 VAL 87 3HG1 VAL 87 9.383 -15.992 9.368 639 HG21 VAL 87 3HG2 VAL 87 12.216 -18.011 9.828 640 HG22 VAL 87 1HG2 VAL 87 12.901 -17.151 11.206 641 HG23 VAL 87 2HG2 VAL 87 11.303 -17.886 11.331 642 H PHE 88 H PHE 88 14.888 -15.730 9.902 643 HA PHE 88 HA PHE 88 14.992 -16.948 7.220 644 HB2 PHE 88 2HB PHE 88 17.254 -16.167 6.964 645 HB3 PHE 88 3HB PHE 88 16.251 -14.792 7.414 646 HD1 PHE 88 HD1 PHE 88 19.195 -16.609 8.132 647 HD2 PHE 88 HD2 PHE 88 16.187 -14.193 9.930 648 HE1 PHE 88 HE1 PHE 88 20.709 -16.128 10.012 649 HE2 PHE 88 HE2 PHE 88 17.696 -13.708 11.812 650 HZ PHE 88 HZ PHE 88 19.960 -14.675 11.854 651 H SER 89 H SER 89 16.531 -18.689 6.954 652 HA SER 89 HA SER 89 17.211 -20.055 9.472 653 HB2 SER 89 2HB SER 89 15.552 -20.994 7.226 654 HB3 SER 89 3HB SER 89 16.788 -22.138 7.751 655 HG SER 89 HG SER 89 15.464 -22.592 9.308 656 H ARG 90 H ARG 90 19.080 -21.328 9.456 657 HA ARG 90 HA ARG 90 20.839 -20.903 7.130 658 HB2 ARG 90 2HB ARG 90 21.361 -19.722 9.385 659 HB3 ARG 90 3HB ARG 90 21.874 -21.317 9.917 660 HG2 ARG 90 2HG ARG 90 23.293 -21.251 7.712 661 HG3 ARG 90 3HG ARG 90 23.093 -19.507 7.898 662 HD2 ARG 90 2HD ARG 90 23.863 -19.909 10.328 663 HD3 ARG 90 3HD ARG 90 24.448 -21.459 9.724 664 HE ARG 90 HE ARG 90 26.156 -20.364 8.659 665 HH11 ARG 90 1HH1 ARG 90 23.740 -18.055 9.634 666 HH12 ARG 90 2HH1 ARG 90 24.707 -16.676 9.229 667 HH21 ARG 90 2HH2 ARG 90 26.811 -16.962 8.368 668 HH22 ARG 90 1HH2 ARG 90 27.439 -18.557 8.122 669 H ASP 91 H ASP 91 20.045 -22.915 6.269 670 HA ASP 91 HA ASP 91 20.227 -25.136 5.816 671 HB2 ASP 91 2HB ASP 91 22.482 -25.384 7.777 672 HB3 ASP 91 3HB ASP 91 22.273 -26.174 6.217 673 H GLY 92 H GLY 92 18.410 -24.360 7.820 674 HA2 GLY 92 2HA GLY 92 16.945 -25.848 8.984 675 HA3 GLY 92 3HA GLY 92 18.333 -26.850 9.380 676 H VAL 93 H VAL 93 18.939 -23.541 9.766 677 HA VAL 93 HA VAL 93 18.810 -23.851 12.675 678 HB VAL 93 HB VAL 93 20.205 -21.787 10.968 679 HG11 VAL 93 1HG1 VAL 93 19.904 -22.033 13.944 680 HG12 VAL 93 2HG1 VAL 93 21.281 -21.200 13.218 681 HG13 VAL 93 3HG1 VAL 93 19.641 -20.623 12.918 682 HG21 VAL 93 3HG2 VAL 93 21.028 -24.269 11.267 683 HG22 VAL 93 1HG2 VAL 93 22.164 -22.922 11.326 684 HG23 VAL 93 2HG2 VAL 93 21.594 -23.660 12.822 685 H VAL 94 H VAL 94 17.760 -22.387 14.012 686 HA VAL 94 HA VAL 94 15.712 -20.754 12.673 687 HB VAL 94 HB VAL 94 15.736 -21.812 15.503 688 HG11 VAL 94 1HG1 VAL 94 13.450 -21.023 15.634 689 HG12 VAL 94 2HG1 VAL 94 14.525 -19.682 15.234 690 HG13 VAL 94 3HG1 VAL 94 13.535 -20.425 13.977 691 HG21 VAL 94 3HG2 VAL 94 14.108 -22.699 13.122 692 HG22 VAL 94 1HG2 VAL 94 15.473 -23.577 13.814 693 HG23 VAL 94 2HG2 VAL 94 14.002 -23.346 14.759 694 H MET 95 H MET 95 16.216 -18.670 12.561 695 HA MET 95 HA MET 95 17.088 -17.288 14.967 696 HB2 MET 95 2HB MET 95 19.165 -17.965 13.741 697 HB3 MET 95 3HB MET 95 18.621 -16.994 12.380 698 HG2 MET 95 2HG MET 95 20.203 -15.716 13.604 699 HG3 MET 95 3HG MET 95 18.611 -15.013 13.880 700 HE1 MET 95 3HE MET 95 21.791 -16.389 16.295 701 HE2 MET 95 1HE MET 95 20.842 -17.856 16.539 702 HE3 MET 95 2HE MET 95 21.239 -17.325 14.905 703 H SER 96 H SER 96 16.543 -15.109 15.009 704 HA SER 96 HA SER 96 14.820 -14.224 12.789 705 HB2 SER 96 2HB SER 96 13.397 -13.167 14.309 706 HB3 SER 96 3HB SER 96 13.855 -14.633 15.175 707 HG SER 96 HG SER 96 14.286 -13.151 16.653 708 H ALA 97 H ALA 97 15.243 -12.337 11.799 709 HA ALA 97 HA ALA 97 17.110 -10.452 13.038 710 HB1 ALA 97 1HB ALA 97 18.357 -10.243 10.904 711 HB2 ALA 97 2HB ALA 97 18.538 -11.820 11.673 712 HB3 ALA 97 3HB ALA 97 17.463 -11.633 10.288 713 H THR 98 H THR 98 16.728 -8.336 12.553 714 HA THR 98 HA THR 98 14.214 -7.740 11.255 715 HB THR 98 HB THR 98 16.220 -5.865 12.524 716 HG1 THR 98 HG1 THR 98 15.392 -6.616 14.313 717 HG21 THR 98 3HG2 THR 98 13.331 -5.401 11.779 718 HG22 THR 98 1HG2 THR 98 14.719 -4.779 10.888 719 HG23 THR 98 2HG2 THR 98 14.418 -4.239 12.540 720 H ILE 99 H ILE 99 13.963 -7.085 9.222 721 HA ILE 99 HA ILE 99 16.364 -6.354 7.690 722 HB ILE 99 HB ILE 99 13.720 -7.130 6.488 723 HG12 ILE 99 2HG1 ILE 99 14.345 -8.976 7.927 724 HG13 ILE 99 3HG1 ILE 99 14.656 -9.425 6.254 725 HG21 ILE 99 1HG2 ILE 99 14.939 -6.318 4.753 726 HG22 ILE 99 2HG2 ILE 99 16.482 -6.677 5.525 727 HG23 ILE 99 3HG2 ILE 99 15.560 -7.968 4.755 728 HD11 ILE 99 3HD1 ILE 99 16.739 -9.920 6.785 729 HD12 ILE 99 1HD1 ILE 99 17.014 -8.252 7.286 730 HD13 ILE 99 2HD1 ILE 99 16.434 -9.440 8.454 731 H VAL 100 H VAL 100 16.606 -4.323 7.042 732 HA VAL 100 HA VAL 100 14.285 -2.522 7.171 733 HB VAL 100 HB VAL 100 16.030 -0.695 7.141 734 HG11 VAL 100 1HG1 VAL 100 16.811 -1.343 9.562 735 HG12 VAL 100 2HG1 VAL 100 15.117 -0.980 9.227 736 HG13 VAL 100 3HG1 VAL 100 15.653 -2.656 9.353 737 HG21 VAL 100 3HG2 VAL 100 17.736 -2.816 6.537 738 HG22 VAL 100 1HG2 VAL 100 18.195 -1.154 6.905 739 HG23 VAL 100 2HG2 VAL 100 18.142 -2.359 8.191 740 H VAL 101 H VAL 101 13.346 -2.212 5.265 741 HA VAL 101 HA VAL 101 14.999 -2.205 2.837 742 HB VAL 101 HB VAL 101 12.000 -2.439 3.120 743 HG11 VAL 101 1HG1 VAL 101 12.083 -1.619 1.018 744 HG12 VAL 101 2HG1 VAL 101 13.781 -2.048 0.802 745 HG13 VAL 101 3HG1 VAL 101 12.530 -3.278 0.621 746 HG21 VAL 101 3HG2 VAL 101 12.538 -4.547 3.685 747 HG22 VAL 101 1HG2 VAL 101 12.865 -4.743 1.963 748 HG23 VAL 101 2HG2 VAL 101 14.187 -4.395 3.077 749 H GLY 102 H GLY 102 15.349 -0.383 1.730 750 HA2 GLY 102 2HA GLY 102 13.798 2.005 2.514 751 HA3 GLY 102 3HA GLY 102 15.474 2.043 1.985 752 H GLU 103 H GLU 103 12.286 2.455 1.048 753 HA GLU 103 HA GLU 103 12.621 1.750 -1.729 754 HB2 GLU 103 2HB GLU 103 10.430 2.866 -0.051 755 HB3 GLU 103 3HB GLU 103 10.371 3.177 -1.780 756 HG2 GLU 103 2HG GLU 103 10.527 0.744 -2.183 757 HG3 GLU 103 3HG GLU 103 10.460 0.484 -0.441 758 H LEU 104 H LEU 104 12.682 4.672 0.227 759 HA LEU 104 HA LEU 104 13.483 6.193 -2.166 760 HB2 LEU 104 2HB LEU 104 12.026 7.060 0.317 761 HB3 LEU 104 3HB LEU 104 12.763 8.205 -0.803 762 HG LEU 104 HG LEU 104 10.461 8.133 -1.329 763 HD11 LEU 104 1HD1 LEU 104 11.839 6.311 -3.294 764 HD12 LEU 104 2HD1 LEU 104 12.013 8.065 -3.251 765 HD13 LEU 104 3HD1 LEU 104 10.443 7.344 -3.603 766 HD21 LEU 104 3HD2 LEU 104 9.184 6.147 -1.661 767 HD22 LEU 104 1HD2 LEU 104 10.033 5.982 -0.124 768 HD23 LEU 104 2HD2 LEU 104 10.623 5.133 -1.553 769 H GLU 105 H GLU 105 15.680 5.623 -1.919 770 HA GLU 105 HA GLU 105 17.824 5.912 -1.216 771 HB2 GLU 105 2HB GLU 105 16.622 8.382 -1.055 772 HB3 GLU 105 3HB GLU 105 17.304 8.187 0.553 773 HG2 GLU 105 2HG GLU 105 19.498 7.915 -0.322 774 HG3 GLU 105 3HG GLU 105 18.888 7.811 -1.973 Start of MODEL 3 1 HA PRO 1 HA PRO 1 2.209 0.655 -1.438 2 HB2 PRO 1 2HB PRO 1 4.579 -0.647 -1.195 3 HB3 PRO 1 3HB PRO 1 4.305 0.976 -0.551 4 HG2 PRO 1 2HG PRO 1 4.251 -1.659 0.868 5 HG3 PRO 1 3HG PRO 1 4.968 -0.123 1.388 6 HD2 PRO 1 2HD PRO 1 2.570 -0.993 2.297 7 HD3 PRO 1 3HD PRO 1 2.944 0.730 2.087 8 H LEU 2 H LEU 2 2.998 -0.716 -3.253 9 HA LEU 2 HA LEU 2 2.262 -3.541 -3.017 10 HB2 LEU 2 2HB LEU 2 1.153 -3.262 -5.317 11 HB3 LEU 2 3HB LEU 2 0.265 -2.754 -3.882 12 HG LEU 2 HG LEU 2 1.755 -0.542 -4.956 13 HD11 LEU 2 1HD1 LEU 2 -0.257 -1.693 -6.870 14 HD12 LEU 2 2HD1 LEU 2 1.481 -1.932 -7.049 15 HD13 LEU 2 3HD1 LEU 2 0.805 -0.304 -7.102 16 HD21 LEU 2 3HD2 LEU 2 -0.475 0.480 -4.988 17 HD22 LEU 2 1HD2 LEU 2 -0.152 -0.345 -3.463 18 HD23 LEU 2 2HD2 LEU 2 -1.197 -1.098 -4.668 19 H THR 3 H THR 3 3.054 -4.861 -4.802 20 HA THR 3 HA THR 3 5.316 -3.642 -6.240 21 HB THR 3 HB THR 3 6.101 -4.977 -4.271 22 HG1 THR 3 HG1 THR 3 7.788 -5.619 -5.437 23 HG21 THR 3 3HG2 THR 3 5.683 -7.545 -5.584 24 HG22 THR 3 1HG2 THR 3 4.177 -6.787 -5.071 25 HG23 THR 3 2HG2 THR 3 5.456 -7.090 -3.896 26 H ARG 4 H ARG 4 5.920 -4.699 -8.209 27 HA ARG 4 HA ARG 4 3.635 -5.955 -9.521 28 HB2 ARG 4 2HB ARG 4 5.936 -4.337 -10.379 29 HB3 ARG 4 3HB ARG 4 5.531 -5.657 -11.468 30 HG2 ARG 4 2HG ARG 4 3.324 -4.824 -11.784 31 HG3 ARG 4 3HG ARG 4 3.531 -3.631 -10.501 32 HD2 ARG 4 2HD ARG 4 5.592 -2.954 -12.079 33 HD3 ARG 4 3HD ARG 4 4.497 -3.611 -13.295 34 HE ARG 4 HE ARG 4 3.153 -1.779 -13.023 35 HH11 ARG 4 1HH1 ARG 4 5.361 -1.983 -10.339 36 HH12 ARG 4 2HH1 ARG 4 4.918 -0.439 -9.688 37 HH21 ARG 4 2HH2 ARG 4 3.324 0.832 -10.734 38 HH22 ARG 4 1HH2 ARG 4 2.560 0.254 -12.176 39 HA PRO 5 HA PRO 5 5.311 -10.002 -9.752 40 HB2 PRO 5 2HB PRO 5 4.644 -10.774 -12.268 41 HB3 PRO 5 3HB PRO 5 3.457 -10.600 -10.970 42 HG2 PRO 5 2HG PRO 5 4.136 -8.702 -13.183 43 HG3 PRO 5 3HG PRO 5 2.543 -9.159 -12.550 44 HD2 PRO 5 2HD PRO 5 3.773 -6.846 -11.866 45 HD3 PRO 5 3HD PRO 5 2.706 -7.725 -10.753 46 H TYR 6 H TYR 6 7.520 -8.912 -9.690 47 HA TYR 6 HA TYR 6 8.969 -9.534 -12.179 48 HB2 TYR 6 2HB TYR 6 8.802 -7.044 -10.857 49 HB3 TYR 6 3HB TYR 6 10.421 -7.662 -10.548 50 HD1 TYR 6 HD1 TYR 6 12.059 -7.088 -12.061 51 HD2 TYR 6 HD2 TYR 6 8.034 -7.357 -13.415 52 HE1 TYR 6 HE1 TYR 6 12.769 -6.355 -14.299 53 HE2 TYR 6 HE2 TYR 6 8.733 -6.626 -15.657 54 HH TYR 6 HH TYR 6 11.953 -5.462 -16.289 55 H LEU 7 H LEU 7 10.571 -10.966 -12.003 56 HA LEU 7 HA LEU 7 11.477 -11.696 -9.296 57 HB2 LEU 7 2HB LEU 7 12.081 -13.903 -10.454 58 HB3 LEU 7 3HB LEU 7 10.388 -13.579 -10.090 59 HG LEU 7 HG LEU 7 11.356 -12.838 -12.793 60 HD11 LEU 7 1HD1 LEU 7 11.652 -14.924 -13.614 61 HD12 LEU 7 2HD1 LEU 7 10.537 -15.658 -12.462 62 HD13 LEU 7 3HD1 LEU 7 12.176 -15.243 -11.960 63 HD21 LEU 7 3HD2 LEU 7 8.900 -14.404 -12.284 64 HD22 LEU 7 1HD2 LEU 7 9.171 -13.028 -13.353 65 HD23 LEU 7 2HD2 LEU 7 8.953 -12.770 -11.622 66 H GLY 8 H GLY 8 13.529 -11.262 -8.844 67 HA2 GLY 8 2HA GLY 8 15.459 -11.161 -11.079 68 HA3 GLY 8 3HA GLY 8 15.441 -9.932 -9.823 69 H PHE 9 H PHE 9 14.856 -13.298 -9.113 70 HA PHE 9 HA PHE 9 17.598 -13.692 -8.209 71 HB2 PHE 9 2HB PHE 9 16.777 -14.464 -5.961 72 HB3 PHE 9 3HB PHE 9 16.627 -12.732 -6.239 73 HD1 PHE 9 HD1 PHE 9 14.895 -15.797 -5.505 74 HD2 PHE 9 HD2 PHE 9 14.390 -11.778 -6.812 75 HE1 PHE 9 HE1 PHE 9 12.501 -15.921 -4.951 76 HE2 PHE 9 HE2 PHE 9 11.995 -11.895 -6.259 77 HZ PHE 9 HZ PHE 9 11.048 -13.969 -5.326 78 H ARG 10 H ARG 10 17.658 -15.995 -7.074 79 HA ARG 10 HA ARG 10 16.170 -17.819 -8.846 80 HB2 ARG 10 2HB ARG 10 18.954 -17.985 -7.710 81 HB3 ARG 10 3HB ARG 10 18.124 -19.401 -8.338 82 HG2 ARG 10 2HG ARG 10 18.241 -17.008 -10.079 83 HG3 ARG 10 3HG ARG 10 19.734 -17.915 -9.828 84 HD2 ARG 10 2HD ARG 10 17.869 -19.886 -10.297 85 HD3 ARG 10 3HD ARG 10 17.367 -18.594 -11.386 86 HE ARG 10 HE ARG 10 20.066 -18.816 -11.764 87 HH11 ARG 10 1HH1 ARG 10 17.349 -20.983 -11.970 88 HH12 ARG 10 2HH1 ARG 10 18.063 -21.970 -13.202 89 HH21 ARG 10 2HH2 ARG 10 20.150 -21.471 -14.007 90 HH22 ARG 10 1HH2 ARG 10 21.016 -20.107 -13.387 91 H VAL 11 H VAL 11 15.166 -19.597 -7.988 92 HA VAL 11 HA VAL 11 15.351 -20.003 -5.084 93 HB VAL 11 HB VAL 11 12.842 -20.446 -5.119 94 HG11 VAL 11 1HG1 VAL 11 14.093 -17.738 -5.374 95 HG12 VAL 11 2HG1 VAL 11 12.355 -17.906 -5.112 96 HG13 VAL 11 3HG1 VAL 11 13.493 -18.560 -3.933 97 HG21 VAL 11 3HG2 VAL 11 13.106 -20.125 -7.818 98 HG22 VAL 11 1HG2 VAL 11 11.587 -20.022 -6.927 99 HG23 VAL 11 2HG2 VAL 11 12.479 -18.553 -7.321 100 H ALA 12 H ALA 12 15.700 -22.060 -4.582 101 HA ALA 12 HA ALA 12 14.850 -24.140 -6.489 102 HB1 ALA 12 1HB ALA 12 17.075 -25.069 -4.987 103 HB2 ALA 12 2HB ALA 12 16.952 -24.802 -6.727 104 HB3 ALA 12 3HB ALA 12 17.486 -23.495 -5.670 105 H VAL 13 H VAL 13 13.442 -25.519 -5.649 106 HA VAL 13 HA VAL 13 12.917 -25.557 -2.816 107 HB VAL 13 HB VAL 13 11.107 -25.707 -4.530 108 HG11 VAL 13 1HG1 VAL 13 10.812 -27.514 -5.914 109 HG12 VAL 13 2HG1 VAL 13 12.574 -27.421 -5.872 110 HG13 VAL 13 3HG1 VAL 13 11.728 -28.602 -4.871 111 HG21 VAL 13 3HG2 VAL 13 9.859 -27.535 -3.360 112 HG22 VAL 13 1HG2 VAL 13 11.351 -27.924 -2.504 113 HG23 VAL 13 2HG2 VAL 13 10.595 -26.346 -2.285 114 H GLY 14 H GLY 14 13.467 -27.086 -1.358 115 HA2 GLY 14 2HA GLY 14 14.269 -29.731 -2.084 116 HA3 GLY 14 3HA GLY 14 15.654 -28.725 -1.688 117 H ARG 15 H ARG 15 16.182 -29.941 0.135 118 HA ARG 15 HA ARG 15 14.405 -29.480 2.430 119 HB2 ARG 15 2HB ARG 15 15.980 -32.026 2.077 120 HB3 ARG 15 3HB ARG 15 14.730 -31.682 3.264 121 HG2 ARG 15 2HG ARG 15 14.252 -31.868 0.299 122 HG3 ARG 15 3HG ARG 15 13.998 -33.188 1.442 123 HD2 ARG 15 2HD ARG 15 12.198 -32.138 2.453 124 HD3 ARG 15 3HD ARG 15 12.691 -30.539 1.899 125 HE ARG 15 HE ARG 15 12.118 -31.796 -0.407 126 HH11 ARG 15 1HH1 ARG 15 10.372 -31.472 2.587 127 HH12 ARG 15 2HH1 ARG 15 8.812 -31.548 1.837 128 HH21 ARG 15 2HH2 ARG 15 8.642 -31.792 -0.435 129 HH22 ARG 15 1HH2 ARG 15 10.070 -31.898 -1.406 130 H ASP 16 H ASP 16 15.397 -28.894 4.304 131 HA ASP 16 HA ASP 16 18.277 -28.380 4.130 132 HB2 ASP 16 2HB ASP 16 17.766 -26.976 6.231 133 HB3 ASP 16 3HB ASP 16 17.161 -26.392 4.683 134 H SER 17 H SER 17 19.164 -28.291 6.608 135 HA SER 17 HA SER 17 19.554 -30.964 7.331 136 HB2 SER 17 2HB SER 17 21.189 -29.311 7.951 137 HB3 SER 17 3HB SER 17 20.001 -28.415 8.897 138 HG SER 17 HG SER 17 21.328 -30.802 9.493 139 H SER 18 H SER 18 17.104 -28.689 8.244 140 HA SER 18 HA SER 18 16.199 -30.284 10.495 141 HB2 SER 18 2HB SER 18 16.133 -27.727 10.395 142 HB3 SER 18 3HB SER 18 14.768 -27.914 9.294 143 HG SER 18 HG SER 18 13.706 -27.941 11.127 144 H GLY 19 H GLY 19 14.990 -29.322 7.292 145 HA2 GLY 19 2HA GLY 19 13.756 -30.680 5.831 146 HA3 GLY 19 3HA GLY 19 13.486 -31.813 7.148 147 H CYS 20 H CYS 20 12.726 -28.394 6.459 148 HA CYS 20 HA CYS 20 9.997 -28.925 7.432 149 HB2 CYS 20 2HB CYS 20 11.885 -26.814 8.017 150 HB3 CYS 20 3HB CYS 20 10.392 -26.148 7.366 151 HG CYS 20 HG CYS 20 9.354 -28.293 9.485 152 H THR 21 H THR 21 11.473 -28.916 4.658 153 HA THR 21 HA THR 21 10.923 -28.485 2.491 154 HB THR 21 HB THR 21 8.121 -27.797 3.304 155 HG1 THR 21 HG1 THR 21 8.414 -29.583 4.547 156 HG21 THR 21 3HG2 THR 21 9.520 -28.652 0.915 157 HG22 THR 21 1HG2 THR 21 7.902 -27.974 1.087 158 HG23 THR 21 2HG2 THR 21 8.157 -29.708 1.283 159 H THR 22 H THR 22 12.230 -26.576 2.500 160 HA THR 22 HA THR 22 10.645 -24.156 2.066 161 HB THR 22 HB THR 22 11.338 -23.716 4.271 162 HG1 THR 22 HG1 THR 22 12.944 -22.054 3.957 163 HG21 THR 22 3HG2 THR 22 12.937 -25.025 5.128 164 HG22 THR 22 1HG2 THR 22 14.099 -23.906 4.417 165 HG23 THR 22 2HG2 THR 22 13.621 -25.357 3.538 166 H LEU 23 H LEU 23 11.767 -22.519 0.823 167 HA LEU 23 HA LEU 23 13.674 -23.726 -1.037 168 HB2 LEU 23 2HB LEU 23 11.958 -21.259 -1.183 169 HB3 LEU 23 3HB LEU 23 13.180 -21.652 -2.390 170 HG LEU 23 HG LEU 23 11.898 -23.849 -2.701 171 HD11 LEU 23 1HD1 LEU 23 9.451 -23.591 -2.183 172 HD12 LEU 23 2HD1 LEU 23 9.893 -22.241 -1.138 173 HD13 LEU 23 3HD1 LEU 23 10.498 -23.860 -0.789 174 HD21 LEU 23 3HD2 LEU 23 11.298 -21.144 -3.657 175 HD22 LEU 23 1HD2 LEU 23 9.993 -22.309 -3.884 176 HD23 LEU 23 2HD2 LEU 23 11.590 -22.632 -4.559 177 H SER 24 H SER 24 15.488 -22.424 -1.819 178 HA SER 24 HA SER 24 16.511 -20.571 0.231 179 HB2 SER 24 2HB SER 24 17.692 -22.699 0.416 180 HB3 SER 24 3HB SER 24 18.071 -22.663 -1.306 181 HG SER 24 HG SER 24 19.810 -21.917 -0.002 182 H ILE 25 H ILE 25 17.643 -18.787 -0.474 183 HA ILE 25 HA ILE 25 17.304 -18.150 -3.308 184 HB ILE 25 HB ILE 25 18.080 -16.336 -1.020 185 HG12 ILE 25 2HG1 ILE 25 15.810 -17.156 -0.733 186 HG13 ILE 25 3HG1 ILE 25 15.764 -15.471 -1.241 187 HG21 ILE 25 1HG2 ILE 25 17.652 -14.513 -2.559 188 HG22 ILE 25 2HG2 ILE 25 18.884 -15.586 -3.219 189 HG23 ILE 25 3HG2 ILE 25 17.233 -15.657 -3.833 190 HD11 ILE 25 3HD1 ILE 25 15.686 -17.009 -3.587 191 HD12 ILE 25 1HD1 ILE 25 14.564 -17.758 -2.452 192 HD13 ILE 25 2HD1 ILE 25 14.390 -16.052 -2.868 193 H GLN 26 H GLN 26 18.956 -17.905 -4.690 194 HA GLN 26 HA GLN 26 21.675 -18.233 -3.618 195 HB2 GLN 26 2HB GLN 26 20.443 -18.960 -6.265 196 HB3 GLN 26 3HB GLN 26 22.186 -18.864 -6.056 197 HG2 GLN 26 2HG GLN 26 22.124 -20.979 -5.411 198 HG3 GLN 26 3HG GLN 26 21.333 -20.428 -3.936 199 HE21 GLN 26 2HE2 GLN 26 19.190 -22.252 -6.891 200 HE22 GLN 26 1HE2 GLN 26 20.751 -21.583 -7.207 201 H GLU 27 H GLU 27 19.591 -15.989 -5.011 202 HA GLU 27 HA GLU 27 21.859 -14.321 -5.884 203 HB2 GLU 27 2HB GLU 27 18.997 -14.106 -6.827 204 HB3 GLU 27 3HB GLU 27 20.382 -13.217 -7.444 205 HG2 GLU 27 2HG GLU 27 20.891 -16.027 -7.613 206 HG3 GLU 27 3HG GLU 27 19.341 -15.651 -8.365 207 H VAL 28 H VAL 28 20.670 -11.887 -6.041 208 HA VAL 28 HA VAL 28 19.851 -11.367 -3.257 209 HB VAL 28 HB VAL 28 21.241 -9.390 -5.059 210 HG11 VAL 28 1HG1 VAL 28 21.550 -8.088 -3.122 211 HG12 VAL 28 2HG1 VAL 28 19.875 -8.641 -3.048 212 HG13 VAL 28 3HG1 VAL 28 21.108 -9.422 -2.057 213 HG21 VAL 28 3HG2 VAL 28 23.308 -9.913 -3.860 214 HG22 VAL 28 1HG2 VAL 28 22.480 -11.206 -2.993 215 HG23 VAL 28 2HG2 VAL 28 22.706 -11.318 -4.739 216 H THR 29 H THR 29 17.897 -10.529 -2.975 217 HA THR 29 HA THR 29 16.618 -9.146 -5.244 218 HB THR 29 HB THR 29 15.523 -11.285 -4.876 219 HG1 THR 29 HG1 THR 29 14.308 -9.154 -5.172 220 HG21 THR 29 3HG2 THR 29 14.561 -11.947 -2.811 221 HG22 THR 29 1HG2 THR 29 14.842 -10.363 -2.089 222 HG23 THR 29 2HG2 THR 29 16.204 -11.427 -2.440 223 H GLN 30 H GLN 30 17.742 -8.867 -2.097 224 HA GLN 30 HA GLN 30 15.806 -6.919 -1.197 225 HB2 GLN 30 2HB GLN 30 18.329 -8.072 -0.052 226 HB3 GLN 30 3HB GLN 30 17.598 -6.643 0.665 227 HG2 GLN 30 2HG GLN 30 16.157 -7.893 1.775 228 HG3 GLN 30 3HG GLN 30 15.577 -8.611 0.273 229 HE21 GLN 30 2HE2 GLN 30 18.118 -11.265 0.538 230 HE22 GLN 30 1HE2 GLN 30 17.734 -10.010 -0.585 231 H THR 31 H THR 31 18.140 -6.779 -3.443 232 HA THR 31 HA THR 31 18.922 -4.020 -2.768 233 HB THR 31 HB THR 31 20.678 -4.475 -4.646 234 HG1 THR 31 HG1 THR 31 21.271 -6.748 -4.619 235 HG21 THR 31 3HG2 THR 31 22.249 -4.862 -3.016 236 HG22 THR 31 1HG2 THR 31 21.245 -6.042 -2.174 237 HG23 THR 31 2HG2 THR 31 20.897 -4.320 -2.023 238 H TYR 32 H TYR 32 16.488 -5.217 -4.224 239 HA TYR 32 HA TYR 32 16.710 -3.529 -6.630 240 HB2 TYR 32 2HB TYR 32 15.688 -6.278 -6.276 241 HB3 TYR 32 3HB TYR 32 14.686 -5.224 -7.267 242 HD1 TYR 32 HD1 TYR 32 15.582 -4.267 -9.358 243 HD2 TYR 32 HD2 TYR 32 17.816 -7.060 -7.053 244 HE1 TYR 32 HE1 TYR 32 17.060 -4.664 -11.283 245 HE2 TYR 32 HE2 TYR 32 19.302 -7.463 -8.971 246 HH TYR 32 HH TYR 32 18.596 -6.234 -12.132 247 H THR 33 H THR 33 14.939 -2.258 -7.185 248 HA THR 33 HA THR 33 12.539 -2.293 -5.581 249 HB THR 33 HB THR 33 14.120 0.269 -5.546 250 HG1 THR 33 HG1 THR 33 14.725 -0.345 -3.396 251 HG21 THR 33 3HG2 THR 33 12.041 0.902 -4.902 252 HG22 THR 33 1HG2 THR 33 12.571 0.276 -3.341 253 HG23 THR 33 2HG2 THR 33 11.583 -0.726 -4.404 254 H GLY 34 H GLY 34 10.927 -0.736 -6.344 255 HA2 GLY 34 2HA GLY 34 11.290 0.896 -8.604 256 HA3 GLY 34 3HA GLY 34 10.743 -0.684 -9.145 257 H SER 35 H SER 35 9.161 -1.093 -6.679 258 HA SER 35 HA SER 35 6.879 0.593 -7.445 259 HB2 SER 35 2HB SER 35 6.747 -1.951 -5.827 260 HB3 SER 35 3HB SER 35 5.439 -1.142 -6.689 261 HG SER 35 HG SER 35 6.001 -2.165 -8.430 262 H ASN 36 H ASN 36 6.086 2.046 -6.068 263 HA ASN 36 HA ASN 36 5.795 3.315 -4.204 264 HB2 ASN 36 2HB ASN 36 5.988 0.544 -3.079 265 HB3 ASN 36 3HB ASN 36 5.923 1.920 -1.981 266 HD21 ASN 36 2HD2 ASN 36 2.543 2.562 -2.452 267 HD22 ASN 36 1HD2 ASN 36 4.046 3.078 -1.775 268 H GLY 37 H GLY 37 8.454 3.061 -5.338 269 HA2 GLY 37 2HA GLY 37 9.920 4.371 -3.280 270 HA3 GLY 37 3HA GLY 37 10.505 2.730 -3.509 271 H GLY 38 H GLY 38 10.926 2.158 -5.889 272 HA2 GLY 38 2HA GLY 38 11.973 2.604 -7.896 273 HA3 GLY 38 3HA GLY 38 11.600 4.305 -7.660 274 H ALA 39 H ALA 39 13.840 1.731 -6.742 275 HA ALA 39 HA ALA 39 16.137 3.272 -7.101 276 HB1 ALA 39 1HB ALA 39 15.927 4.617 -5.292 277 HB2 ALA 39 2HB ALA 39 14.916 3.468 -4.415 278 HB3 ALA 39 3HB ALA 39 16.663 3.235 -4.481 279 H ASP 40 H ASP 40 16.568 1.228 -8.093 280 HA ASP 40 HA ASP 40 16.927 -1.078 -6.359 281 HB2 ASP 40 2HB ASP 40 17.475 -2.284 -8.427 282 HB3 ASP 40 3HB ASP 40 15.952 -1.412 -8.583 283 H LEU 41 H LEU 41 18.723 -1.199 -5.190 284 HA LEU 41 HA LEU 41 21.290 -1.225 -6.381 285 HB2 LEU 41 2HB LEU 41 20.457 1.313 -5.928 286 HB3 LEU 41 3HB LEU 41 21.250 0.948 -4.397 287 HG LEU 41 HG LEU 41 23.078 0.121 -6.310 288 HD11 LEU 41 1HD1 LEU 41 21.775 1.245 -8.049 289 HD12 LEU 41 2HD1 LEU 41 23.338 2.024 -7.802 290 HD13 LEU 41 3HD1 LEU 41 21.875 2.757 -7.145 291 HD21 LEU 41 3HD2 LEU 41 24.208 2.326 -5.621 292 HD22 LEU 41 1HD2 LEU 41 23.843 1.145 -4.363 293 HD23 LEU 41 2HD2 LEU 41 22.803 2.553 -4.578 294 H MET 42 H MET 42 22.895 -0.662 -4.206 295 HA MET 42 HA MET 42 21.956 -2.644 -2.240 296 HB2 MET 42 2HB MET 42 24.846 -1.959 -2.709 297 HB3 MET 42 3HB MET 42 24.167 -3.395 -1.955 298 HG2 MET 42 2HG MET 42 24.562 -4.368 -3.919 299 HG3 MET 42 3HG MET 42 23.098 -3.541 -4.446 300 HE1 MET 42 3HE MET 42 26.564 -4.245 -4.709 301 HE2 MET 42 1HE MET 42 27.188 -3.276 -6.045 302 HE3 MET 42 2HE MET 42 27.249 -2.649 -4.397 303 H GLY 43 H GLY 43 21.538 -1.891 -0.274 304 HA2 GLY 43 2HA GLY 43 23.250 0.017 1.018 305 HA3 GLY 43 3HA GLY 43 21.699 0.707 0.565 306 HA PRO 44 HA PRO 44 19.734 -0.941 4.114 307 HB2 PRO 44 2HB PRO 44 17.431 -2.033 3.180 308 HB3 PRO 44 3HB PRO 44 17.710 -0.289 3.246 309 HG2 PRO 44 2HG PRO 44 17.956 -2.159 0.922 310 HG3 PRO 44 3HG PRO 44 17.239 -0.538 0.982 311 HD2 PRO 44 2HD PRO 44 19.727 -0.996 0.016 312 HD3 PRO 44 3HD PRO 44 19.287 0.510 0.848 313 H ALA 45 H ALA 45 19.825 -3.246 1.423 314 HA ALA 45 HA ALA 45 19.378 -5.568 2.976 315 HB1 ALA 45 1HB ALA 45 20.988 -5.701 0.474 316 HB2 ALA 45 2HB ALA 45 19.692 -6.755 1.042 317 HB3 ALA 45 3HB ALA 45 19.310 -5.166 0.379 318 H PHE 46 H PHE 46 22.356 -4.041 1.777 319 HA PHE 46 HA PHE 46 24.120 -5.952 2.884 320 HB2 PHE 46 2HB PHE 46 24.721 -4.357 1.065 321 HB3 PHE 46 3HB PHE 46 24.695 -3.052 2.245 322 HD1 PHE 46 HD1 PHE 46 26.834 -2.320 2.630 323 HD2 PHE 46 HD2 PHE 46 26.109 -6.503 2.316 324 HE1 PHE 46 HE1 PHE 46 29.191 -2.766 3.175 325 HE2 PHE 46 HE2 PHE 46 28.465 -6.955 2.862 326 HZ PHE 46 HZ PHE 46 30.010 -5.086 3.293 327 H ALA 47 H ALA 47 22.445 -3.243 4.219 328 HA ALA 47 HA ALA 47 24.129 -2.777 6.457 329 HB1 ALA 47 1HB ALA 47 21.832 -1.609 5.376 330 HB2 ALA 47 2HB ALA 47 21.377 -2.135 6.998 331 HB3 ALA 47 3HB ALA 47 22.757 -1.060 6.774 332 H ALA 48 H ALA 48 21.456 -4.961 5.835 333 HA ALA 48 HA ALA 48 21.403 -5.848 8.612 334 HB1 ALA 48 1HB ALA 48 19.440 -5.615 6.714 335 HB2 ALA 48 2HB ALA 48 19.772 -7.348 6.714 336 HB3 ALA 48 3HB ALA 48 19.315 -6.538 8.212 337 H GLY 49 H GLY 49 22.751 -6.757 5.571 338 HA2 GLY 49 2HA GLY 49 24.584 -8.306 5.504 339 HA3 GLY 49 3HA GLY 49 23.839 -9.185 6.831 340 H LEU 50 H LEU 50 21.666 -8.174 4.410 341 HA LEU 50 HA LEU 50 21.030 -10.863 3.712 342 HB2 LEU 50 2HB LEU 50 20.121 -8.419 2.225 343 HB3 LEU 50 3HB LEU 50 19.292 -9.964 2.400 344 HG LEU 50 HG LEU 50 19.760 -8.108 4.722 345 HD11 LEU 50 1HD1 LEU 50 18.015 -6.823 4.183 346 HD12 LEU 50 2HD1 LEU 50 17.063 -8.193 3.612 347 HD13 LEU 50 3HD1 LEU 50 18.244 -7.434 2.544 348 HD21 LEU 50 3HD2 LEU 50 17.407 -9.633 4.951 349 HD22 LEU 50 1HD2 LEU 50 18.900 -9.796 5.875 350 HD23 LEU 50 2HD2 LEU 50 18.670 -10.734 4.399 351 H ARG 51 H ARG 51 22.259 -12.055 2.418 352 HA ARG 51 HA ARG 51 23.116 -10.931 -0.139 353 HB2 ARG 51 2HB ARG 51 24.906 -11.205 1.955 354 HB3 ARG 51 3HB ARG 51 25.157 -12.669 1.013 355 HG2 ARG 51 2HG ARG 51 25.228 -10.982 -0.996 356 HG3 ARG 51 3HG ARG 51 25.640 -9.830 0.276 357 HD2 ARG 51 2HD ARG 51 27.105 -12.367 0.405 358 HD3 ARG 51 3HD ARG 51 27.424 -11.414 -1.043 359 HE ARG 51 HE ARG 51 28.217 -10.795 1.650 360 HH11 ARG 51 1HH1 ARG 51 27.537 -9.498 -1.508 361 HH12 ARG 51 2HH1 ARG 51 28.512 -8.084 -1.281 362 HH21 ARG 51 2HH2 ARG 51 29.632 -7.767 0.693 363 HH22 ARG 51 1HH2 ARG 51 29.504 -8.938 1.962 364 H VAL 52 H VAL 52 24.248 -12.845 -1.422 365 HA VAL 52 HA VAL 52 22.270 -14.739 -1.963 366 HB VAL 52 HB VAL 52 24.032 -15.942 -3.263 367 HG11 VAL 52 1HG1 VAL 52 22.732 -13.708 -3.891 368 HG12 VAL 52 2HG1 VAL 52 24.381 -13.082 -3.959 369 HG13 VAL 52 3HG1 VAL 52 23.913 -14.448 -4.972 370 HG21 VAL 52 3HG2 VAL 52 25.747 -14.449 -1.531 371 HG22 VAL 52 1HG2 VAL 52 26.166 -15.705 -2.697 372 HG23 VAL 52 2HG2 VAL 52 26.093 -14.018 -3.206 373 H GLY 53 H GLY 53 21.656 -16.493 -0.891 374 HA2 GLY 53 2HA GLY 53 22.553 -18.710 -0.098 375 HA3 GLY 53 3HA GLY 53 23.602 -17.756 0.939 376 H ASP 54 H ASP 54 21.533 -15.786 1.546 377 HA ASP 54 HA ASP 54 20.368 -17.124 3.784 378 HB2 ASP 54 2HB ASP 54 20.713 -14.393 2.878 379 HB3 ASP 54 3HB ASP 54 19.089 -14.651 3.510 380 H GLN 55 H GLN 55 18.485 -18.148 3.902 381 HA GLN 55 HA GLN 55 16.708 -18.127 1.608 382 HB2 GLN 55 2HB GLN 55 16.329 -19.673 4.167 383 HB3 GLN 55 3HB GLN 55 15.657 -20.024 2.581 384 HG2 GLN 55 2HG GLN 55 17.824 -20.627 1.737 385 HG3 GLN 55 3HG GLN 55 18.588 -20.134 3.247 386 HE21 GLN 55 2HE2 GLN 55 16.167 -23.422 3.497 387 HE22 GLN 55 1HE2 GLN 55 15.646 -22.005 2.656 388 H LEU 56 H LEU 56 14.624 -17.388 1.575 389 HA LEU 56 HA LEU 56 13.767 -15.827 3.923 390 HB2 LEU 56 2HB LEU 56 13.271 -15.340 0.992 391 HB3 LEU 56 3HB LEU 56 12.487 -14.441 2.289 392 HG LEU 56 HG LEU 56 14.897 -13.844 3.015 393 HD11 LEU 56 1HD1 LEU 56 15.452 -15.465 0.776 394 HD12 LEU 56 2HD1 LEU 56 16.586 -14.548 1.768 395 HD13 LEU 56 3HD1 LEU 56 15.871 -13.810 0.335 396 HD21 LEU 56 3HD2 LEU 56 13.944 -12.653 0.424 397 HD22 LEU 56 1HD2 LEU 56 14.811 -11.863 1.741 398 HD23 LEU 56 2HD2 LEU 56 13.133 -12.358 1.963 399 H VAL 57 H VAL 57 12.036 -16.585 4.926 400 HA VAL 57 HA VAL 57 10.100 -18.187 3.381 401 HB VAL 57 HB VAL 57 11.225 -19.613 4.967 402 HG11 VAL 57 1HG1 VAL 57 11.334 -19.188 7.314 403 HG12 VAL 57 2HG1 VAL 57 11.943 -17.756 6.482 404 HG13 VAL 57 3HG1 VAL 57 10.314 -17.758 7.159 405 HG21 VAL 57 3HG2 VAL 57 8.847 -19.422 6.579 406 HG22 VAL 57 1HG2 VAL 57 8.463 -19.206 4.871 407 HG23 VAL 57 2HG2 VAL 57 9.310 -20.656 5.408 408 H ARG 58 H ARG 58 10.506 -15.908 6.061 409 HA ARG 58 HA ARG 58 9.062 -14.473 7.086 410 HB2 ARG 58 2HB ARG 58 9.168 -13.679 4.626 411 HB3 ARG 58 3HB ARG 58 7.550 -14.355 4.491 412 HG2 ARG 58 2HG ARG 58 7.416 -11.992 4.927 413 HG3 ARG 58 3HG ARG 58 6.810 -12.887 6.322 414 HD2 ARG 58 2HD ARG 58 9.595 -12.513 6.680 415 HD3 ARG 58 3HD ARG 58 8.905 -10.962 6.206 416 HE ARG 58 HE ARG 58 8.582 -12.277 8.706 417 HH11 ARG 58 1HH1 ARG 58 6.944 -10.242 6.404 418 HH12 ARG 58 2HH1 ARG 58 5.902 -9.520 7.587 419 HH21 ARG 58 2HH2 ARG 58 6.059 -10.142 9.786 420 HH22 ARG 58 1HH2 ARG 58 7.217 -11.334 10.271 421 H PHE 59 H PHE 59 8.401 -17.318 7.169 422 HA PHE 59 HA PHE 59 5.573 -17.034 7.869 423 HB2 PHE 59 2HB PHE 59 6.733 -19.215 6.131 424 HB3 PHE 59 3HB PHE 59 5.167 -19.346 6.925 425 HD1 PHE 59 HD1 PHE 59 4.014 -16.713 6.587 426 HD2 PHE 59 HD2 PHE 59 6.334 -19.027 3.870 427 HE1 PHE 59 HE1 PHE 59 2.955 -15.548 4.695 428 HE2 PHE 59 HE2 PHE 59 5.280 -17.865 1.975 429 HZ PHE 59 HZ PHE 59 3.589 -16.123 2.386 430 H ALA 60 H ALA 60 4.942 -18.176 9.656 431 HA ALA 60 HA ALA 60 6.998 -19.055 11.427 432 HB1 ALA 60 1HB ALA 60 4.839 -19.834 12.739 433 HB2 ALA 60 2HB ALA 60 5.288 -18.132 12.622 434 HB3 ALA 60 3HB ALA 60 4.042 -18.790 11.562 435 H GLY 61 H GLY 61 8.017 -20.934 11.149 436 HA2 GLY 61 2HA GLY 61 7.560 -23.373 11.626 437 HA3 GLY 61 3HA GLY 61 6.421 -23.267 10.292 438 H TYR 62 H TYR 62 8.961 -21.300 9.544 439 HA TYR 62 HA TYR 62 10.681 -21.432 8.062 440 HB2 TYR 62 2HB TYR 62 11.131 -24.310 8.744 441 HB3 TYR 62 3HB TYR 62 12.308 -23.034 8.454 442 HD1 TYR 62 HD1 TYR 62 11.402 -25.156 10.872 443 HD2 TYR 62 HD2 TYR 62 11.662 -20.949 10.292 444 HE1 TYR 62 HE1 TYR 62 11.651 -24.843 13.299 445 HE2 TYR 62 HE2 TYR 62 11.913 -20.624 12.717 446 HH TYR 62 HH TYR 62 11.074 -22.376 14.903 447 H THR 63 H THR 63 8.083 -21.966 7.095 448 HA THR 63 HA THR 63 8.721 -23.774 4.860 449 HB THR 63 HB THR 63 7.124 -24.968 6.184 450 HG1 THR 63 HG1 THR 63 5.602 -23.722 4.130 451 HG21 THR 63 3HG2 THR 63 6.114 -22.352 6.756 452 HG22 THR 63 1HG2 THR 63 5.727 -23.883 7.539 453 HG23 THR 63 2HG2 THR 63 4.806 -23.355 6.131 454 H VAL 64 H VAL 64 8.463 -22.922 2.891 455 HA VAL 64 HA VAL 64 6.728 -20.576 2.566 456 HB VAL 64 HB VAL 64 9.128 -19.863 2.837 457 HG11 VAL 64 1HG1 VAL 64 9.632 -21.964 1.115 458 HG12 VAL 64 2HG1 VAL 64 9.853 -20.532 0.107 459 HG13 VAL 64 3HG1 VAL 64 10.776 -20.713 1.599 460 HG21 VAL 64 3HG2 VAL 64 9.030 -18.237 1.073 461 HG22 VAL 64 1HG2 VAL 64 7.939 -19.257 0.134 462 HG23 VAL 64 2HG2 VAL 64 7.389 -18.535 1.646 463 H THR 65 H THR 65 6.036 -20.194 0.387 464 HA THR 65 HA THR 65 5.571 -22.636 -1.055 465 HB THR 65 HB THR 65 4.794 -19.791 -1.725 466 HG1 THR 65 HG1 THR 65 3.769 -20.607 0.147 467 HG21 THR 65 3HG2 THR 65 4.484 -20.699 -3.776 468 HG22 THR 65 1HG2 THR 65 3.016 -21.339 -3.040 469 HG23 THR 65 2HG2 THR 65 4.456 -22.350 -3.159 470 H GLU 66 H GLU 66 6.592 -19.503 -2.393 471 HA GLU 66 HA GLU 66 9.051 -20.396 -3.435 472 HB2 GLU 66 2HB GLU 66 8.551 -20.690 -5.761 473 HB3 GLU 66 3HB GLU 66 7.509 -21.768 -4.843 474 HG2 GLU 66 2HG GLU 66 6.006 -19.471 -5.077 475 HG3 GLU 66 3HG GLU 66 6.824 -19.593 -6.633 476 H LEU 67 H LEU 67 9.366 -18.885 -5.671 477 HA LEU 67 HA LEU 67 9.781 -16.325 -4.705 478 HB2 LEU 67 2HB LEU 67 10.059 -15.655 -7.062 479 HB3 LEU 67 3HB LEU 67 10.938 -17.125 -6.647 480 HG LEU 67 HG LEU 67 8.733 -18.247 -7.638 481 HD11 LEU 67 1HD1 LEU 67 7.386 -16.870 -8.729 482 HD12 LEU 67 2HD1 LEU 67 8.721 -16.383 -9.773 483 HD13 LEU 67 3HD1 LEU 67 8.404 -15.502 -8.279 484 HD21 LEU 67 3HD2 LEU 67 11.303 -17.389 -8.802 485 HD22 LEU 67 1HD2 LEU 67 10.058 -17.881 -9.951 486 HD23 LEU 67 2HD2 LEU 67 10.584 -18.996 -8.690 487 H ALA 68 H ALA 68 6.968 -17.682 -6.299 488 HA ALA 68 HA ALA 68 5.592 -15.343 -6.935 489 HB1 ALA 68 1HB ALA 68 3.809 -16.679 -7.392 490 HB2 ALA 68 2HB ALA 68 5.071 -17.911 -7.341 491 HB3 ALA 68 3HB ALA 68 4.027 -17.659 -5.941 492 H ALA 69 H ALA 69 5.629 -17.212 -3.921 493 HA ALA 69 HA ALA 69 3.720 -15.604 -2.571 494 HB1 ALA 69 1HB ALA 69 5.751 -17.615 -1.669 495 HB2 ALA 69 2HB ALA 69 4.793 -16.696 -0.507 496 HB3 ALA 69 3HB ALA 69 3.991 -17.739 -1.681 497 H PHE 70 H PHE 70 7.212 -15.469 -2.906 498 HA PHE 70 HA PHE 70 7.773 -13.642 -0.856 499 HB2 PHE 70 2HB PHE 70 9.469 -14.964 -2.138 500 HB3 PHE 70 3HB PHE 70 9.217 -13.881 -3.502 501 HD1 PHE 70 HD1 PHE 70 9.716 -13.412 0.169 502 HD2 PHE 70 HD2 PHE 70 10.957 -12.423 -3.780 503 HE1 PHE 70 HE1 PHE 70 11.401 -11.872 1.088 504 HE2 PHE 70 HE2 PHE 70 12.645 -10.883 -2.868 505 HZ PHE 70 HZ PHE 70 12.870 -10.606 -0.432 506 H ASN 71 H ASN 71 6.443 -13.206 -4.040 507 HA ASN 71 HA ASN 71 6.942 -10.442 -4.329 508 HB2 ASN 71 2HB ASN 71 5.945 -12.352 -5.965 509 HB3 ASN 71 3HB ASN 71 4.455 -11.527 -5.515 510 HD21 ASN 71 2HD2 ASN 71 7.191 -9.751 -7.931 511 HD22 ASN 71 1HD2 ASN 71 7.547 -11.214 -7.083 512 H THR 72 H THR 72 4.365 -12.261 -2.781 513 HA THR 72 HA THR 72 2.614 -10.072 -2.354 514 HB THR 72 HB THR 72 2.646 -12.375 -0.454 515 HG1 THR 72 HG1 THR 72 2.570 -13.747 -2.056 516 HG21 THR 72 3HG2 THR 72 0.918 -10.642 -0.289 517 HG22 THR 72 1HG2 THR 72 0.222 -12.201 -0.731 518 HG23 THR 72 2HG2 THR 72 0.444 -10.954 -1.959 519 H VAL 73 H VAL 73 5.040 -11.649 -0.292 520 HA VAL 73 HA VAL 73 4.618 -9.947 1.944 521 HB VAL 73 HB VAL 73 6.795 -10.834 2.760 522 HG11 VAL 73 1HG1 VAL 73 4.423 -12.369 2.083 523 HG12 VAL 73 2HG1 VAL 73 5.858 -13.380 2.256 524 HG13 VAL 73 3HG1 VAL 73 5.354 -12.328 3.579 525 HG21 VAL 73 3HG2 VAL 73 7.836 -12.673 1.427 526 HG22 VAL 73 1HG2 VAL 73 6.809 -12.199 0.073 527 HG23 VAL 73 2HG2 VAL 73 8.007 -11.071 0.709 528 H VAL 74 H VAL 74 6.890 -9.910 -0.762 529 HA VAL 74 HA VAL 74 8.559 -7.847 0.111 530 HB VAL 74 HB VAL 74 7.803 -8.799 -2.638 531 HG11 VAL 74 1HG1 VAL 74 9.962 -7.311 -3.166 532 HG12 VAL 74 2HG1 VAL 74 8.315 -6.698 -3.319 533 HG13 VAL 74 3HG1 VAL 74 9.259 -6.340 -1.873 534 HG21 VAL 74 3HG2 VAL 74 9.571 -10.149 -2.444 535 HG22 VAL 74 1HG2 VAL 74 10.596 -8.846 -1.841 536 HG23 VAL 74 2HG2 VAL 74 9.563 -9.742 -0.728 537 H ALA 75 H ALA 75 5.458 -7.754 -1.555 538 HA ALA 75 HA ALA 75 5.434 -5.020 -2.204 539 HB1 ALA 75 1HB ALA 75 3.327 -5.378 -2.944 540 HB2 ALA 75 2HB ALA 75 3.803 -7.068 -2.771 541 HB3 ALA 75 3HB ALA 75 2.857 -6.284 -1.506 542 H ARG 76 H ARG 76 4.287 -6.754 0.669 543 HA ARG 76 HA ARG 76 3.381 -4.336 1.948 544 HB2 ARG 76 2HB ARG 76 3.606 -7.207 2.827 545 HB3 ARG 76 3HB ARG 76 3.156 -5.930 3.949 546 HG2 ARG 76 2HG ARG 76 1.100 -6.690 3.287 547 HG3 ARG 76 3HG ARG 76 1.358 -5.371 2.143 548 HD2 ARG 76 2HD ARG 76 2.099 -6.938 0.454 549 HD3 ARG 76 3HD ARG 76 1.972 -8.273 1.599 550 HE ARG 76 HE ARG 76 -0.528 -7.285 1.585 551 HH11 ARG 76 1HH1 ARG 76 1.653 -8.187 -0.974 552 HH12 ARG 76 2HH1 ARG 76 0.389 -8.646 -2.066 553 HH21 ARG 76 2HH2 ARG 76 -1.803 -8.473 -1.423 554 HH22 ARG 76 1HH2 ARG 76 -2.201 -7.886 0.156 555 H HIS 77 H HIS 77 6.330 -6.050 1.689 556 HA HIS 77 HA HIS 77 7.469 -5.083 4.154 557 HB2 HIS 77 2HB HIS 77 8.201 -7.224 3.210 558 HB3 HIS 77 3HB HIS 77 8.777 -6.400 1.764 559 HD1 HIS 77 HD1 HIS 77 11.085 -7.614 2.523 560 HD2 HIS 77 HD2 HIS 77 9.762 -4.460 4.882 561 HE1 HIS 77 HE1 HIS 77 13.084 -6.896 3.869 562 H VAL 78 H VAL 78 8.061 -4.450 0.696 563 HA VAL 78 HA VAL 78 9.951 -2.459 0.920 564 HB VAL 78 HB VAL 78 9.031 -1.561 -1.244 565 HG11 VAL 78 1HG1 VAL 78 10.655 -3.075 -1.709 566 HG12 VAL 78 2HG1 VAL 78 9.899 -4.348 -0.749 567 HG13 VAL 78 3HG1 VAL 78 9.284 -3.973 -2.359 568 HG21 VAL 78 3HG2 VAL 78 6.721 -2.933 -0.380 569 HG22 VAL 78 1HG2 VAL 78 6.954 -2.026 -1.874 570 HG23 VAL 78 2HG2 VAL 78 7.298 -3.755 -1.830 571 H ARG 79 H ARG 79 9.892 -0.677 2.114 572 HA ARG 79 HA ARG 79 7.670 1.164 1.839 573 HB2 ARG 79 2HB ARG 79 8.254 -0.343 4.337 574 HB3 ARG 79 3HB ARG 79 7.834 1.357 4.498 575 HG2 ARG 79 2HG ARG 79 5.812 0.773 3.014 576 HG3 ARG 79 3HG ARG 79 6.180 -0.899 3.441 577 HD2 ARG 79 2HD ARG 79 5.978 1.158 5.594 578 HD3 ARG 79 3HD ARG 79 4.504 0.507 4.879 579 HE ARG 79 HE ARG 79 6.139 -1.643 5.569 580 HH11 ARG 79 1HH1 ARG 79 4.378 0.924 7.127 581 HH12 ARG 79 2HH1 ARG 79 4.100 0.026 8.583 582 HH21 ARG 79 2HH2 ARG 79 4.900 -2.112 8.783 583 HH22 ARG 79 1HH2 ARG 79 5.780 -2.835 7.480 584 HA PRO 80 HA PRO 80 10.772 4.238 2.252 585 HB2 PRO 80 2HB PRO 80 9.477 6.215 3.588 586 HB3 PRO 80 3HB PRO 80 9.133 5.810 1.902 587 HG2 PRO 80 2HG PRO 80 7.656 5.013 4.381 588 HG3 PRO 80 3HG PRO 80 7.012 5.557 2.821 589 HD2 PRO 80 2HD PRO 80 7.098 2.945 3.530 590 HD3 PRO 80 3HD PRO 80 7.273 3.484 1.848 591 H SER 81 H SER 81 12.389 3.477 3.560 592 HA SER 81 HA SER 81 13.650 3.127 5.428 593 HB2 SER 81 2HB SER 81 13.924 5.001 6.822 594 HB3 SER 81 3HB SER 81 13.350 5.690 5.304 595 HG SER 81 HG SER 81 12.269 6.475 7.231 596 H ALA 82 H ALA 82 11.310 1.592 5.351 597 HA ALA 82 HA ALA 82 10.503 1.517 8.185 598 HB1 ALA 82 1HB ALA 82 8.814 1.797 6.155 599 HB2 ALA 82 2HB ALA 82 8.936 0.038 6.148 600 HB3 ALA 82 3HB ALA 82 8.399 0.878 7.602 601 H SER 83 H SER 83 11.205 -0.135 9.360 602 HA SER 83 HA SER 83 12.279 -2.490 7.960 603 HB2 SER 83 2HB SER 83 13.940 -2.643 9.526 604 HB3 SER 83 3HB SER 83 13.625 -0.913 9.663 605 HG SER 83 HG SER 83 13.437 -1.523 11.706 606 H ILE 84 H ILE 84 11.691 -4.547 8.576 607 HA ILE 84 HA ILE 84 9.689 -4.826 10.698 608 HB ILE 84 HB ILE 84 8.422 -6.420 9.183 609 HG12 ILE 84 2HG1 ILE 84 9.186 -4.999 6.768 610 HG13 ILE 84 3HG1 ILE 84 10.546 -5.880 7.454 611 HG21 ILE 84 1HG2 ILE 84 7.634 -4.167 9.820 612 HG22 ILE 84 2HG2 ILE 84 8.418 -3.515 8.382 613 HG23 ILE 84 3HG2 ILE 84 7.085 -4.658 8.217 614 HD11 ILE 84 3HD1 ILE 84 9.119 -7.915 7.491 615 HD12 ILE 84 1HD1 ILE 84 7.883 -7.000 6.628 616 HD13 ILE 84 2HD1 ILE 84 9.453 -7.288 5.877 617 HA PRO 85 HA PRO 85 11.886 -8.470 11.782 618 HB2 PRO 85 2HB PRO 85 9.890 -10.013 12.784 619 HB3 PRO 85 3HB PRO 85 10.526 -8.597 13.630 620 HG2 PRO 85 2HG PRO 85 8.057 -8.852 11.957 621 HG3 PRO 85 3HG PRO 85 8.277 -8.018 13.507 622 HD2 PRO 85 2HD PRO 85 8.242 -6.707 11.138 623 HD3 PRO 85 3HD PRO 85 9.220 -6.162 12.516 624 H VAL 86 H VAL 86 12.705 -9.820 10.315 625 HA VAL 86 HA VAL 86 10.842 -11.417 8.678 626 HB VAL 86 HB VAL 86 13.620 -10.478 7.949 627 HG11 VAL 86 1HG1 VAL 86 11.819 -12.514 6.797 628 HG12 VAL 86 2HG1 VAL 86 12.602 -11.423 5.653 629 HG13 VAL 86 3HG1 VAL 86 13.577 -12.397 6.753 630 HG21 VAL 86 3HG2 VAL 86 12.404 -8.607 7.517 631 HG22 VAL 86 1HG2 VAL 86 12.060 -9.485 6.027 632 HG23 VAL 86 2HG2 VAL 86 10.890 -9.495 7.347 633 H VAL 87 H VAL 87 11.256 -13.595 8.404 634 HA VAL 87 HA VAL 87 13.230 -14.731 10.269 635 HB VAL 87 HB VAL 87 11.064 -15.483 10.872 636 HG11 VAL 87 1HG1 VAL 87 10.643 -15.564 7.962 637 HG12 VAL 87 2HG1 VAL 87 9.873 -16.863 8.875 638 HG13 VAL 87 3HG1 VAL 87 9.517 -15.180 9.263 639 HG21 VAL 87 3HG2 VAL 87 12.008 -17.780 9.201 640 HG22 VAL 87 1HG2 VAL 87 12.984 -17.191 10.546 641 HG23 VAL 87 2HG2 VAL 87 11.349 -17.785 10.837 642 H PHE 88 H PHE 88 14.934 -15.763 9.470 643 HA PHE 88 HA PHE 88 14.788 -16.814 6.724 644 HB2 PHE 88 2HB PHE 88 17.116 -16.137 6.371 645 HB3 PHE 88 3HB PHE 88 16.110 -14.743 6.754 646 HD1 PHE 88 HD1 PHE 88 16.178 -13.802 9.081 647 HD2 PHE 88 HD2 PHE 88 18.976 -16.690 7.685 648 HE1 PHE 88 HE1 PHE 88 17.710 -13.197 10.909 649 HE2 PHE 88 HE2 PHE 88 20.511 -16.091 9.511 650 HZ PHE 88 HZ PHE 88 19.879 -14.343 11.127 651 H SER 89 H SER 89 16.368 -18.529 6.265 652 HA SER 89 HA SER 89 17.228 -20.000 8.659 653 HB2 SER 89 2HB SER 89 15.206 -20.803 6.723 654 HB3 SER 89 3HB SER 89 16.508 -21.985 6.847 655 HG SER 89 HG SER 89 14.523 -21.837 8.438 656 H ARG 90 H ARG 90 19.146 -21.070 8.482 657 HA ARG 90 HA ARG 90 20.529 -20.871 5.887 658 HB2 ARG 90 2HB ARG 90 21.366 -20.125 8.613 659 HB3 ARG 90 3HB ARG 90 22.565 -21.018 7.688 660 HG2 ARG 90 2HG ARG 90 21.321 -18.873 6.164 661 HG3 ARG 90 3HG ARG 90 22.160 -18.309 7.611 662 HD2 ARG 90 2HD ARG 90 24.006 -20.004 6.695 663 HD3 ARG 90 3HD ARG 90 23.230 -19.596 5.166 664 HE ARG 90 HE ARG 90 24.271 -17.576 5.262 665 HH11 ARG 90 1HH1 ARG 90 24.057 -18.854 8.492 666 HH12 ARG 90 2HH1 ARG 90 24.956 -17.557 9.206 667 HH21 ARG 90 2HH2 ARG 90 25.751 -15.855 7.895 668 HH22 ARG 90 1HH2 ARG 90 25.457 -15.862 6.189 669 H ASP 91 H ASP 91 19.992 -22.949 5.218 670 HA ASP 91 HA ASP 91 20.268 -25.193 4.969 671 HB2 ASP 91 2HB ASP 91 22.485 -25.201 6.983 672 HB3 ASP 91 3HB ASP 91 22.345 -26.099 5.474 673 H GLY 92 H GLY 92 18.392 -24.297 6.880 674 HA2 GLY 92 2HA GLY 92 16.955 -25.722 8.151 675 HA3 GLY 92 3HA GLY 92 18.365 -26.649 8.643 676 H VAL 93 H VAL 93 19.646 -23.833 9.041 677 HA VAL 93 HA VAL 93 19.295 -23.754 11.845 678 HB VAL 93 HB VAL 93 20.492 -21.697 9.984 679 HG11 VAL 93 1HG1 VAL 93 20.400 -21.857 12.983 680 HG12 VAL 93 2HG1 VAL 93 21.647 -20.947 12.128 681 HG13 VAL 93 3HG1 VAL 93 19.948 -20.510 11.938 682 HG21 VAL 93 3HG2 VAL 93 22.094 -23.404 11.818 683 HG22 VAL 93 1HG2 VAL 93 21.451 -24.133 10.347 684 HG23 VAL 93 2HG2 VAL 93 22.515 -22.730 10.243 685 H VAL 94 H VAL 94 18.218 -22.296 13.161 686 HA VAL 94 HA VAL 94 16.105 -20.734 11.824 687 HB VAL 94 HB VAL 94 15.131 -22.494 13.141 688 HG11 VAL 94 1HG1 VAL 94 15.841 -21.779 15.797 689 HG12 VAL 94 2HG1 VAL 94 16.133 -23.299 14.950 690 HG13 VAL 94 3HG1 VAL 94 17.325 -22.001 14.870 691 HG21 VAL 94 3HG2 VAL 94 13.970 -20.356 13.175 692 HG22 VAL 94 1HG2 VAL 94 13.777 -21.187 14.718 693 HG23 VAL 94 2HG2 VAL 94 14.915 -19.847 14.574 694 H MET 95 H MET 95 16.525 -18.630 11.832 695 HA MET 95 HA MET 95 17.359 -17.356 14.317 696 HB2 MET 95 2HB MET 95 19.416 -17.875 12.934 697 HB3 MET 95 3HB MET 95 18.793 -16.753 11.731 698 HG2 MET 95 2HG MET 95 20.407 -15.622 13.078 699 HG3 MET 95 3HG MET 95 18.810 -14.972 13.442 700 HE1 MET 95 3HE MET 95 21.884 -16.547 16.167 701 HE2 MET 95 1HE MET 95 21.942 -16.025 14.483 702 HE3 MET 95 2HE MET 95 21.610 -14.852 15.759 703 H SER 96 H SER 96 16.932 -15.083 14.380 704 HA SER 96 HA SER 96 15.162 -14.111 12.240 705 HB2 SER 96 2HB SER 96 13.545 -13.332 13.770 706 HB3 SER 96 3HB SER 96 13.956 -14.943 14.356 707 HG SER 96 HG SER 96 15.391 -13.916 15.846 708 H ALA 97 H ALA 97 15.630 -12.131 11.525 709 HA ALA 97 HA ALA 97 17.079 -10.267 13.251 710 HB1 ALA 97 1HB ALA 97 18.021 -10.952 10.469 711 HB2 ALA 97 2HB ALA 97 18.749 -9.784 11.573 712 HB3 ALA 97 3HB ALA 97 18.782 -11.504 11.962 713 H THR 98 H THR 98 16.591 -8.148 12.904 714 HA THR 98 HA THR 98 14.319 -7.604 11.199 715 HB THR 98 HB THR 98 15.796 -5.522 12.787 716 HG1 THR 98 HG1 THR 98 15.214 -6.484 14.572 717 HG21 THR 98 3HG2 THR 98 14.113 -4.285 11.998 718 HG22 THR 98 1HG2 THR 98 13.036 -5.229 13.026 719 HG23 THR 98 2HG2 THR 98 13.292 -5.703 11.347 720 H ILE 99 H ILE 99 14.410 -6.786 9.215 721 HA ILE 99 HA ILE 99 16.929 -5.532 8.337 722 HB ILE 99 HB ILE 99 16.174 -6.183 6.010 723 HG12 ILE 99 2HG1 ILE 99 14.291 -7.948 7.591 724 HG13 ILE 99 3HG1 ILE 99 13.816 -6.614 6.545 725 HG21 ILE 99 1HG2 ILE 99 17.725 -7.741 6.293 726 HG22 ILE 99 2HG2 ILE 99 17.473 -7.685 8.037 727 HG23 ILE 99 3HG2 ILE 99 16.532 -8.799 7.045 728 HD11 ILE 99 3HD1 ILE 99 13.467 -8.375 5.151 729 HD12 ILE 99 1HD1 ILE 99 15.141 -7.997 4.746 730 HD13 ILE 99 2HD1 ILE 99 14.778 -9.330 5.843 731 H VAL 100 H VAL 100 16.846 -3.467 7.752 732 HA VAL 100 HA VAL 100 14.217 -2.208 7.428 733 HB VAL 100 HB VAL 100 15.577 -1.142 9.097 734 HG11 VAL 100 1HG1 VAL 100 17.706 -1.772 7.319 735 HG12 VAL 100 2HG1 VAL 100 17.717 -0.031 7.611 736 HG13 VAL 100 3HG1 VAL 100 17.792 -1.155 8.969 737 HG21 VAL 100 3HG2 VAL 100 15.345 1.056 8.411 738 HG22 VAL 100 1HG2 VAL 100 15.858 0.703 6.761 739 HG23 VAL 100 2HG2 VAL 100 14.257 0.210 7.312 740 H VAL 101 H VAL 101 13.518 -1.974 5.415 741 HA VAL 101 HA VAL 101 15.472 -1.665 3.245 742 HB VAL 101 HB VAL 101 12.526 -2.304 3.044 743 HG11 VAL 101 1HG1 VAL 101 13.589 -1.182 1.076 744 HG12 VAL 101 2HG1 VAL 101 14.674 -2.567 0.948 745 HG13 VAL 101 3HG1 VAL 101 12.936 -2.785 0.742 746 HG21 VAL 101 3HG2 VAL 101 14.921 -4.131 2.868 747 HG22 VAL 101 1HG2 VAL 101 13.724 -4.101 4.163 748 HG23 VAL 101 2HG2 VAL 101 13.252 -4.595 2.537 749 H GLY 102 H GLY 102 15.597 0.152 2.052 750 HA2 GLY 102 2HA GLY 102 13.736 2.331 2.755 751 HA3 GLY 102 3HA GLY 102 15.388 2.560 2.199 752 H GLU 103 H GLU 103 12.162 2.552 1.302 753 HA GLU 103 HA GLU 103 12.680 1.963 -1.506 754 HB2 GLU 103 2HB GLU 103 10.230 2.350 0.159 755 HB3 GLU 103 3HB GLU 103 10.123 2.627 -1.574 756 HG2 GLU 103 2HG GLU 103 9.524 0.312 -0.694 757 HG3 GLU 103 3HG GLU 103 10.600 0.411 -2.086 758 H LEU 104 H LEU 104 11.861 4.667 0.591 759 HA LEU 104 HA LEU 104 12.252 6.480 -1.700 760 HB2 LEU 104 2HB LEU 104 10.446 6.717 0.691 761 HB3 LEU 104 3HB LEU 104 10.874 8.103 -0.310 762 HG LEU 104 HG LEU 104 8.751 7.394 -1.045 763 HD11 LEU 104 1HD1 LEU 104 10.734 6.154 -2.944 764 HD12 LEU 104 2HD1 LEU 104 10.396 7.881 -2.828 765 HD13 LEU 104 3HD1 LEU 104 9.126 6.767 -3.335 766 HD21 LEU 104 3HD2 LEU 104 8.154 5.136 -1.567 767 HD22 LEU 104 1HD2 LEU 104 8.861 5.158 0.049 768 HD23 LEU 104 2HD2 LEU 104 9.813 4.587 -1.321 769 H GLU 105 H GLU 105 14.492 6.624 -1.329 770 HA GLU 105 HA GLU 105 16.400 7.510 -0.463 771 HB2 GLU 105 2HB GLU 105 14.468 9.360 0.947 772 HB3 GLU 105 3HB GLU 105 16.197 9.627 0.776 773 HG2 GLU 105 2HG GLU 105 14.084 9.678 -1.347 774 HG3 GLU 105 3HG GLU 105 15.191 10.961 -0.862 Start of MODEL 4 1 HA PRO 1 HA PRO 1 1.295 1.247 -1.548 2 HB2 PRO 1 2HB PRO 1 3.715 0.041 -1.305 3 HB3 PRO 1 3HB PRO 1 3.361 1.632 -0.621 4 HG2 PRO 1 2HG PRO 1 3.401 -1.043 0.724 5 HG3 PRO 1 3HG PRO 1 4.043 0.508 1.297 6 HD2 PRO 1 2HD PRO 1 1.673 -0.491 2.144 7 HD3 PRO 1 3HD PRO 1 1.974 1.252 1.989 8 H LEU 2 H LEU 2 2.736 -0.290 -3.122 9 HA LEU 2 HA LEU 2 2.211 -3.061 -3.081 10 HB2 LEU 2 2HB LEU 2 0.464 -3.325 -4.606 11 HB3 LEU 2 3HB LEU 2 -0.092 -2.070 -3.500 12 HG LEU 2 HG LEU 2 1.040 -0.598 -5.508 13 HD11 LEU 2 1HD1 LEU 2 -0.459 -2.814 -6.878 14 HD12 LEU 2 2HD1 LEU 2 1.301 -2.767 -6.780 15 HD13 LEU 2 3HD1 LEU 2 0.430 -1.478 -7.610 16 HD21 LEU 2 3HD2 LEU 2 -0.967 0.223 -4.896 17 HD22 LEU 2 1HD2 LEU 2 -1.678 -1.377 -4.682 18 HD23 LEU 2 2HD2 LEU 2 -1.536 -0.684 -6.298 19 H THR 3 H THR 3 3.049 -4.156 -4.928 20 HA THR 3 HA THR 3 4.589 -2.448 -6.768 21 HB THR 3 HB THR 3 6.001 -3.518 -4.944 22 HG1 THR 3 HG1 THR 3 7.555 -3.402 -6.382 23 HG21 THR 3 3HG2 THR 3 6.168 -5.755 -4.709 24 HG22 THR 3 1HG2 THR 3 6.074 -6.045 -6.446 25 HG23 THR 3 2HG2 THR 3 4.600 -5.778 -5.515 26 H ARG 4 H ARG 4 5.363 -3.699 -8.716 27 HA ARG 4 HA ARG 4 3.112 -5.187 -9.788 28 HB2 ARG 4 2HB ARG 4 5.383 -3.669 -10.884 29 HB3 ARG 4 3HB ARG 4 4.953 -5.106 -11.803 30 HG2 ARG 4 2HG ARG 4 3.426 -3.851 -12.812 31 HG3 ARG 4 3HG ARG 4 2.520 -3.901 -11.298 32 HD2 ARG 4 2HD ARG 4 2.775 -1.609 -12.052 33 HD3 ARG 4 3HD ARG 4 3.673 -1.865 -10.556 34 HE ARG 4 HE ARG 4 5.304 -2.240 -12.867 35 HH11 ARG 4 1HH1 ARG 4 3.913 0.169 -10.773 36 HH12 ARG 4 2HH1 ARG 4 5.136 1.351 -11.104 37 HH21 ARG 4 2HH2 ARG 4 6.845 0.860 -12.549 38 HH22 ARG 4 1HH2 ARG 4 6.919 -0.693 -13.311 39 HA PRO 5 HA PRO 5 4.826 -9.219 -9.570 40 HB2 PRO 5 2HB PRO 5 4.090 -10.296 -11.951 41 HB3 PRO 5 3HB PRO 5 2.942 -9.975 -10.646 42 HG2 PRO 5 2HG PRO 5 3.529 -8.354 -13.093 43 HG3 PRO 5 3HG PRO 5 1.963 -8.744 -12.359 44 HD2 PRO 5 2HD PRO 5 3.186 -6.355 -12.000 45 HD3 PRO 5 3HD PRO 5 2.165 -7.101 -10.755 46 H TYR 6 H TYR 6 7.038 -8.230 -9.668 47 HA TYR 6 HA TYR 6 8.399 -9.036 -12.154 48 HB2 TYR 6 2HB TYR 6 8.287 -6.466 -11.099 49 HB3 TYR 6 3HB TYR 6 9.861 -7.065 -10.586 50 HD1 TYR 6 HD1 TYR 6 11.662 -6.956 -12.050 51 HD2 TYR 6 HD2 TYR 6 7.712 -6.756 -13.618 52 HE1 TYR 6 HE1 TYR 6 12.578 -6.472 -14.281 53 HE2 TYR 6 HE2 TYR 6 8.617 -6.273 -15.854 54 HH TYR 6 HH TYR 6 12.071 -5.774 -16.369 55 H LEU 7 H LEU 7 9.893 -10.561 -11.920 56 HA LEU 7 HA LEU 7 10.932 -11.091 -9.214 57 HB2 LEU 7 2HB LEU 7 11.213 -13.420 -9.918 58 HB3 LEU 7 3HB LEU 7 9.533 -12.894 -10.002 59 HG LEU 7 HG LEU 7 10.545 -12.454 -12.562 60 HD11 LEU 7 1HD1 LEU 7 12.444 -13.744 -12.444 61 HD12 LEU 7 2HD1 LEU 7 11.257 -14.928 -12.991 62 HD13 LEU 7 3HD1 LEU 7 11.735 -14.879 -11.294 63 HD21 LEU 7 3HD2 LEU 7 9.064 -14.936 -11.769 64 HD22 LEU 7 1HD2 LEU 7 8.886 -13.946 -13.218 65 HD23 LEU 7 2HD2 LEU 7 8.302 -13.348 -11.665 66 H GLY 8 H GLY 8 13.031 -10.749 -8.927 67 HA2 GLY 8 2HA GLY 8 14.804 -10.913 -11.286 68 HA3 GLY 8 3HA GLY 8 14.954 -9.630 -10.095 69 H PHE 9 H PHE 9 14.272 -12.992 -9.336 70 HA PHE 9 HA PHE 9 17.017 -13.505 -8.561 71 HB2 PHE 9 2HB PHE 9 16.499 -13.988 -6.227 72 HB3 PHE 9 3HB PHE 9 16.092 -12.317 -6.605 73 HD1 PHE 9 HD1 PHE 9 13.638 -11.821 -7.190 74 HD2 PHE 9 HD2 PHE 9 14.933 -15.373 -5.236 75 HE1 PHE 9 HE1 PHE 9 11.355 -12.184 -6.346 76 HE2 PHE 9 HE2 PHE 9 12.652 -15.743 -4.390 77 HZ PHE 9 HZ PHE 9 10.860 -14.148 -4.945 78 H ARG 10 H ARG 10 17.245 -15.753 -7.649 79 HA ARG 10 HA ARG 10 15.281 -17.537 -8.931 80 HB2 ARG 10 2HB ARG 10 18.076 -17.335 -9.303 81 HB3 ARG 10 3HB ARG 10 17.793 -18.838 -8.434 82 HG2 ARG 10 2HG ARG 10 16.127 -19.456 -10.177 83 HG3 ARG 10 3HG ARG 10 16.610 -18.015 -11.074 84 HD2 ARG 10 2HD ARG 10 18.577 -20.118 -10.210 85 HD3 ARG 10 3HD ARG 10 17.707 -20.211 -11.740 86 HE ARG 10 HE ARG 10 18.845 -17.710 -11.693 87 HH11 ARG 10 1HH1 ARG 10 19.982 -20.996 -11.510 88 HH12 ARG 10 2HH1 ARG 10 21.509 -20.646 -12.249 89 HH21 ARG 10 2HH2 ARG 10 22.004 -18.508 -12.906 90 HH22 ARG 10 1HH2 ARG 10 20.853 -17.237 -12.667 91 H VAL 11 H VAL 11 14.672 -19.432 -7.866 92 HA VAL 11 HA VAL 11 15.549 -19.717 -5.076 93 HB VAL 11 HB VAL 11 13.148 -20.298 -4.497 94 HG11 VAL 11 1HG1 VAL 11 12.593 -18.055 -3.972 95 HG12 VAL 11 2HG1 VAL 11 14.355 -18.153 -3.935 96 HG13 VAL 11 3HG1 VAL 11 13.539 -17.431 -5.323 97 HG21 VAL 11 3HG2 VAL 11 12.299 -20.572 -6.761 98 HG22 VAL 11 1HG2 VAL 11 11.408 -19.306 -5.916 99 HG23 VAL 11 2HG2 VAL 11 12.634 -18.876 -7.109 100 H ALA 12 H ALA 12 16.057 -21.744 -4.554 101 HA ALA 12 HA ALA 12 15.141 -23.905 -6.337 102 HB1 ALA 12 1HB ALA 12 17.757 -23.158 -5.544 103 HB2 ALA 12 2HB ALA 12 17.401 -24.728 -4.822 104 HB3 ALA 12 3HB ALA 12 17.262 -24.508 -6.566 105 H VAL 13 H VAL 13 13.783 -25.315 -5.465 106 HA VAL 13 HA VAL 13 13.271 -25.315 -2.628 107 HB VAL 13 HB VAL 13 11.410 -25.528 -4.201 108 HG11 VAL 13 1HG1 VAL 13 12.058 -28.330 -4.877 109 HG12 VAL 13 2HG1 VAL 13 11.243 -27.089 -5.831 110 HG13 VAL 13 3HG1 VAL 13 13.002 -27.085 -5.696 111 HG21 VAL 13 3HG2 VAL 13 11.041 -26.430 -2.021 112 HG22 VAL 13 1HG2 VAL 13 10.343 -27.554 -3.187 113 HG23 VAL 13 2HG2 VAL 13 11.894 -27.919 -2.430 114 H GLY 14 H GLY 14 14.036 -26.696 -1.152 115 HA2 GLY 14 2HA GLY 14 14.946 -29.343 -1.912 116 HA3 GLY 14 3HA GLY 14 16.212 -28.257 -1.359 117 H ARG 15 H ARG 15 16.583 -29.750 0.376 118 HA ARG 15 HA ARG 15 14.697 -29.339 2.593 119 HB2 ARG 15 2HB ARG 15 15.777 -31.907 1.527 120 HB3 ARG 15 3HB ARG 15 15.566 -31.755 3.266 121 HG2 ARG 15 2HG ARG 15 13.608 -32.767 2.374 122 HG3 ARG 15 3HG ARG 15 13.192 -31.119 2.851 123 HD2 ARG 15 2HD ARG 15 12.612 -30.580 0.769 124 HD3 ARG 15 3HD ARG 15 14.118 -31.224 0.116 125 HE ARG 15 HE ARG 15 11.558 -32.529 0.183 126 HH11 ARG 15 1HH1 ARG 15 15.005 -32.992 0.032 127 HH12 ARG 15 2HH1 ARG 15 14.894 -34.549 -0.720 128 HH21 ARG 15 2HH2 ARG 15 12.842 -35.449 -1.197 129 HH22 ARG 15 1HH2 ARG 15 11.399 -34.577 -0.807 130 H ASP 16 H ASP 16 15.607 -29.077 4.609 131 HA ASP 16 HA ASP 16 18.498 -28.601 4.611 132 HB2 ASP 16 2HB ASP 16 17.922 -27.470 6.856 133 HB3 ASP 16 3HB ASP 16 17.392 -26.678 5.375 134 H SER 17 H SER 17 19.286 -28.847 7.113 135 HA SER 17 HA SER 17 19.396 -31.668 7.509 136 HB2 SER 17 2HB SER 17 20.436 -29.349 9.146 137 HB3 SER 17 3HB SER 17 20.730 -31.039 9.558 138 HG SER 17 HG SER 17 22.389 -30.777 8.283 139 H SER 18 H SER 18 17.480 -29.092 8.815 140 HA SER 18 HA SER 18 16.624 -30.457 11.171 141 HB2 SER 18 2HB SER 18 14.795 -28.678 11.140 142 HB3 SER 18 3HB SER 18 16.455 -28.087 11.212 143 HG SER 18 HG SER 18 14.653 -27.412 9.471 144 H GLY 19 H GLY 19 14.781 -29.562 8.243 145 HA2 GLY 19 2HA GLY 19 13.640 -31.385 7.029 146 HA3 GLY 19 3HA GLY 19 13.243 -32.060 8.602 147 H CYS 20 H CYS 20 13.026 -28.728 7.384 148 HA CYS 20 HA CYS 20 10.161 -28.782 8.065 149 HB2 CYS 20 2HB CYS 20 12.290 -26.839 8.594 150 HB3 CYS 20 3HB CYS 20 10.838 -26.117 7.913 151 HG CYS 20 HG CYS 20 9.479 -27.884 10.066 152 H THR 21 H THR 21 12.339 -28.636 5.530 153 HA THR 21 HA THR 21 12.108 -28.301 3.290 154 HB THR 21 HB THR 21 9.216 -27.746 3.315 155 HG1 THR 21 HG1 THR 21 8.862 -30.068 3.819 156 HG21 THR 21 3HG2 THR 21 9.286 -28.846 1.350 157 HG22 THR 21 1HG2 THR 21 10.280 -30.148 2.002 158 HG23 THR 21 2HG2 THR 21 11.032 -28.638 1.490 159 H THR 22 H THR 22 13.150 -26.380 3.026 160 HA THR 22 HA THR 22 11.445 -24.010 2.781 161 HB THR 22 HB THR 22 12.394 -23.583 4.897 162 HG1 THR 22 HG1 THR 22 12.679 -21.871 3.309 163 HG21 THR 22 3HG2 THR 22 15.018 -23.660 5.035 164 HG22 THR 22 1HG2 THR 22 14.841 -24.830 3.728 165 HG23 THR 22 2HG2 THR 22 14.063 -25.122 5.283 166 H LEU 23 H LEU 23 12.366 -22.328 1.436 167 HA LEU 23 HA LEU 23 14.089 -23.460 -0.644 168 HB2 LEU 23 2HB LEU 23 12.131 -21.197 -0.564 169 HB3 LEU 23 3HB LEU 23 13.341 -21.291 -1.842 170 HG LEU 23 HG LEU 23 12.426 -23.523 -2.460 171 HD11 LEU 23 1HD1 LEU 23 11.202 -24.531 -0.887 172 HD12 LEU 23 2HD1 LEU 23 9.879 -23.517 -1.460 173 HD13 LEU 23 3HD1 LEU 23 10.835 -23.014 -0.066 174 HD21 LEU 23 3HD2 LEU 23 10.009 -22.004 -2.759 175 HD22 LEU 23 1HD2 LEU 23 11.225 -22.422 -3.966 176 HD23 LEU 23 2HD2 LEU 23 11.414 -20.963 -2.993 177 H SER 24 H SER 24 15.977 -22.492 -1.315 178 HA SER 24 HA SER 24 17.046 -20.435 0.498 179 HB2 SER 24 2HB SER 24 18.167 -22.748 0.302 180 HB3 SER 24 3HB SER 24 18.718 -22.202 -1.282 181 HG SER 24 HG SER 24 20.179 -21.045 -0.327 182 H ILE 25 H ILE 25 18.070 -18.626 -0.314 183 HA ILE 25 HA ILE 25 17.327 -17.908 -3.029 184 HB ILE 25 HB ILE 25 16.991 -16.334 -1.113 185 HG12 ILE 25 2HG1 ILE 25 18.391 -14.431 -2.430 186 HG13 ILE 25 3HG1 ILE 25 18.414 -15.714 -3.635 187 HG21 ILE 25 1HG2 ILE 25 18.672 -15.530 0.159 188 HG22 ILE 25 2HG2 ILE 25 19.473 -17.020 -0.336 189 HG23 ILE 25 3HG2 ILE 25 19.820 -15.511 -1.179 190 HD11 ILE 25 3HD1 ILE 25 15.886 -15.829 -3.281 191 HD12 ILE 25 1HD1 ILE 25 16.064 -14.270 -2.477 192 HD13 ILE 25 2HD1 ILE 25 16.538 -14.451 -4.166 193 H GLN 26 H GLN 26 18.685 -17.706 -4.711 194 HA GLN 26 HA GLN 26 21.530 -18.269 -4.221 195 HB2 GLN 26 2HB GLN 26 19.806 -18.750 -6.652 196 HB3 GLN 26 3HB GLN 26 21.554 -18.941 -6.650 197 HG2 GLN 26 2HG GLN 26 21.447 -20.930 -5.660 198 HG3 GLN 26 3HG GLN 26 20.254 -20.381 -4.485 199 HE21 GLN 26 2HE2 GLN 26 17.518 -21.080 -6.808 200 HE22 GLN 26 1HE2 GLN 26 18.117 -19.731 -5.911 201 H GLU 27 H GLU 27 19.315 -15.923 -5.348 202 HA GLU 27 HA GLU 27 21.550 -14.294 -6.367 203 HB2 GLU 27 2HB GLU 27 19.357 -15.125 -7.820 204 HB3 GLU 27 3HB GLU 27 18.894 -13.509 -7.307 205 HG2 GLU 27 2HG GLU 27 20.007 -12.804 -9.096 206 HG3 GLU 27 3HG GLU 27 21.464 -13.134 -8.160 207 H VAL 28 H VAL 28 20.312 -11.874 -6.579 208 HA VAL 28 HA VAL 28 19.563 -11.280 -3.789 209 HB VAL 28 HB VAL 28 20.840 -9.313 -5.678 210 HG11 VAL 28 1HG1 VAL 28 19.553 -8.658 -3.537 211 HG12 VAL 28 2HG1 VAL 28 20.962 -9.293 -2.686 212 HG13 VAL 28 3HG1 VAL 28 21.144 -7.954 -3.820 213 HG21 VAL 28 3HG2 VAL 28 22.976 -9.787 -4.564 214 HG22 VAL 28 1HG2 VAL 28 22.215 -11.113 -3.685 215 HG23 VAL 28 2HG2 VAL 28 22.368 -11.192 -5.440 216 H THR 29 H THR 29 17.634 -10.392 -3.452 217 HA THR 29 HA THR 29 16.238 -9.169 -5.744 218 HB THR 29 HB THR 29 15.114 -11.223 -5.253 219 HG1 THR 29 HG1 THR 29 13.718 -9.450 -5.600 220 HG21 THR 29 3HG2 THR 29 14.865 -10.318 -2.384 221 HG22 THR 29 1HG2 THR 29 16.056 -11.487 -2.953 222 HG23 THR 29 2HG2 THR 29 14.335 -11.855 -3.069 223 H GLN 30 H GLN 30 17.631 -8.561 -2.813 224 HA GLN 30 HA GLN 30 15.694 -6.584 -1.918 225 HB2 GLN 30 2HB GLN 30 18.199 -7.760 -0.794 226 HB3 GLN 30 3HB GLN 30 17.662 -6.193 -0.203 227 HG2 GLN 30 2HG GLN 30 16.725 -7.685 1.295 228 HG3 GLN 30 3HG GLN 30 15.401 -7.339 0.183 229 HE21 GLN 30 2HE2 GLN 30 17.289 -10.947 -0.267 230 HE22 GLN 30 1HE2 GLN 30 18.201 -9.514 0.051 231 H THR 31 H THR 31 17.620 -6.524 -4.394 232 HA THR 31 HA THR 31 18.707 -3.834 -3.878 233 HB THR 31 HB THR 31 20.004 -4.442 -6.103 234 HG1 THR 31 HG1 THR 31 19.428 -6.982 -4.938 235 HG21 THR 31 3HG2 THR 31 20.625 -4.397 -3.395 236 HG22 THR 31 1HG2 THR 31 21.771 -4.431 -4.734 237 HG23 THR 31 2HG2 THR 31 21.269 -5.936 -3.964 238 H TYR 32 H TYR 32 15.970 -4.852 -4.865 239 HA TYR 32 HA TYR 32 15.859 -3.141 -7.262 240 HB2 TYR 32 2HB TYR 32 14.464 -5.735 -6.662 241 HB3 TYR 32 3HB TYR 32 13.782 -4.590 -7.811 242 HD1 TYR 32 HD1 TYR 32 15.066 -4.002 -9.870 243 HD2 TYR 32 HD2 TYR 32 16.309 -7.113 -7.246 244 HE1 TYR 32 HE1 TYR 32 16.515 -4.908 -11.639 245 HE2 TYR 32 HE2 TYR 32 17.762 -8.026 -9.008 246 HH TYR 32 HH TYR 32 18.025 -6.443 -12.177 247 H THR 33 H THR 33 14.097 -1.760 -7.479 248 HA THR 33 HA THR 33 12.062 -1.677 -5.418 249 HB THR 33 HB THR 33 13.758 0.785 -5.821 250 HG1 THR 33 HG1 THR 33 13.881 -0.869 -3.526 251 HG21 THR 33 3HG2 THR 33 11.355 0.089 -4.289 252 HG22 THR 33 1HG2 THR 33 11.939 1.663 -4.826 253 HG23 THR 33 2HG2 THR 33 12.591 0.935 -3.358 254 H GLY 34 H GLY 34 10.332 -0.189 -5.906 255 HA2 GLY 34 2HA GLY 34 10.344 1.231 -8.414 256 HA3 GLY 34 3HA GLY 34 9.373 -0.234 -8.450 257 H SER 35 H SER 35 8.520 -0.041 -5.691 258 HA SER 35 HA SER 35 6.565 2.130 -6.015 259 HB2 SER 35 2HB SER 35 5.838 0.320 -3.917 260 HB3 SER 35 3HB SER 35 5.013 0.620 -5.447 261 HG SER 35 HG SER 35 6.706 -1.436 -4.717 262 H ASN 36 H ASN 36 5.984 3.423 -4.220 263 HA ASN 36 HA ASN 36 6.481 4.792 -2.470 264 HB2 ASN 36 2HB ASN 36 6.431 2.153 -1.525 265 HB3 ASN 36 3HB ASN 36 7.857 2.879 -0.789 266 HD21 ASN 36 2HD2 ASN 36 4.568 3.449 1.082 267 HD22 ASN 36 1HD2 ASN 36 5.130 2.064 0.215 268 H GLY 37 H GLY 37 8.495 4.470 -4.572 269 HA2 GLY 37 2HA GLY 37 10.538 6.048 -3.545 270 HA3 GLY 37 3HA GLY 37 11.094 4.385 -3.437 271 H GLY 38 H GLY 38 10.840 3.101 -5.524 272 HA2 GLY 38 2HA GLY 38 11.124 2.886 -7.814 273 HA3 GLY 38 3HA GLY 38 10.861 4.616 -7.976 274 H ALA 39 H ALA 39 13.256 2.180 -7.067 275 HA ALA 39 HA ALA 39 15.330 3.342 -8.537 276 HB1 ALA 39 1HB ALA 39 16.666 3.926 -6.295 277 HB2 ALA 39 2HB ALA 39 15.729 5.120 -7.194 278 HB3 ALA 39 3HB ALA 39 15.033 4.343 -5.772 279 H ASP 40 H ASP 40 15.707 1.210 -9.090 280 HA ASP 40 HA ASP 40 16.259 -0.763 -7.050 281 HB2 ASP 40 2HB ASP 40 16.593 -2.304 -8.921 282 HB3 ASP 40 3HB ASP 40 15.091 -1.405 -9.118 283 H LEU 41 H LEU 41 18.163 -0.924 -6.086 284 HA LEU 41 HA LEU 41 20.609 -0.971 -7.558 285 HB2 LEU 41 2HB LEU 41 19.820 1.542 -6.932 286 HB3 LEU 41 3HB LEU 41 20.751 1.124 -5.495 287 HG LEU 41 HG LEU 41 22.542 0.417 -7.325 288 HD11 LEU 41 1HD1 LEU 41 21.870 0.938 -9.386 289 HD12 LEU 41 2HD1 LEU 41 22.173 2.614 -8.930 290 HD13 LEU 41 3HD1 LEU 41 20.547 1.945 -8.795 291 HD21 LEU 41 3HD2 LEU 41 22.450 3.334 -6.988 292 HD22 LEU 41 1HD2 LEU 41 23.705 2.175 -6.549 293 HD23 LEU 41 2HD2 LEU 41 22.308 2.402 -5.496 294 H MET 42 H MET 42 22.435 -0.524 -5.564 295 HA MET 42 HA MET 42 21.683 -2.556 -3.568 296 HB2 MET 42 2HB MET 42 23.466 -3.258 -5.127 297 HB3 MET 42 3HB MET 42 24.437 -1.882 -4.620 298 HG2 MET 42 2HG MET 42 23.869 -3.083 -2.238 299 HG3 MET 42 3HG MET 42 24.006 -4.462 -3.327 300 HE1 MET 42 3HE MET 42 27.510 -4.642 -1.731 301 HE2 MET 42 1HE MET 42 25.997 -4.259 -0.909 302 HE3 MET 42 2HE MET 42 26.030 -5.502 -2.159 303 H GLY 43 H GLY 43 21.411 -1.792 -1.582 304 HA2 GLY 43 2HA GLY 43 23.327 -0.073 -0.342 305 HA3 GLY 43 3HA GLY 43 21.844 0.787 -0.726 306 HA PRO 44 HA PRO 44 19.845 -0.712 2.871 307 HB2 PRO 44 2HB PRO 44 17.403 -1.525 2.008 308 HB3 PRO 44 3HB PRO 44 17.873 0.176 2.094 309 HG2 PRO 44 2HG PRO 44 17.826 -1.659 -0.271 310 HG3 PRO 44 3HG PRO 44 17.295 0.029 -0.153 311 HD2 PRO 44 2HD PRO 44 19.680 -0.676 -1.224 312 HD3 PRO 44 3HD PRO 44 19.440 0.850 -0.349 313 H ALA 45 H ALA 45 20.299 -2.897 0.251 314 HA ALA 45 HA ALA 45 19.243 -5.255 1.378 315 HB1 ALA 45 1HB ALA 45 21.204 -4.652 -0.783 316 HB2 ALA 45 2HB ALA 45 21.057 -6.309 -0.195 317 HB3 ALA 45 3HB ALA 45 19.651 -5.484 -0.869 318 H PHE 46 H PHE 46 22.531 -3.903 1.411 319 HA PHE 46 HA PHE 46 23.563 -6.008 3.061 320 HB2 PHE 46 2HB PHE 46 24.937 -4.683 1.429 321 HB3 PHE 46 3HB PHE 46 24.795 -3.302 2.512 322 HD1 PHE 46 HD1 PHE 46 26.399 -2.966 4.134 323 HD2 PHE 46 HD2 PHE 46 25.902 -6.857 2.481 324 HE1 PHE 46 HE1 PHE 46 28.367 -3.747 5.388 325 HE2 PHE 46 HE2 PHE 46 27.868 -7.644 3.733 326 HZ PHE 46 HZ PHE 46 29.103 -6.088 5.189 327 H ALA 47 H ALA 47 21.660 -3.327 3.678 328 HA ALA 47 HA ALA 47 22.679 -2.418 6.144 329 HB1 ALA 47 1HB ALA 47 20.997 -0.966 6.014 330 HB2 ALA 47 2HB ALA 47 20.572 -1.731 4.482 331 HB3 ALA 47 3HB ALA 47 19.793 -2.254 5.975 332 H ALA 48 H ALA 48 20.432 -5.005 5.308 333 HA ALA 48 HA ALA 48 20.140 -5.700 8.138 334 HB1 ALA 48 1HB ALA 48 18.741 -7.109 5.896 335 HB2 ALA 48 2HB ALA 48 18.238 -6.909 7.575 336 HB3 ALA 48 3HB ALA 48 18.180 -5.537 6.468 337 H GLY 49 H GLY 49 21.742 -6.697 5.250 338 HA2 GLY 49 2HA GLY 49 23.646 -8.152 5.394 339 HA3 GLY 49 3HA GLY 49 22.852 -8.996 6.715 340 H LEU 50 H LEU 50 20.820 -8.222 4.089 341 HA LEU 50 HA LEU 50 20.283 -10.946 3.526 342 HB2 LEU 50 2HB LEU 50 19.577 -8.643 1.734 343 HB3 LEU 50 3HB LEU 50 18.721 -10.170 1.941 344 HG LEU 50 HG LEU 50 18.694 -8.944 4.460 345 HD11 LEU 50 1HD1 LEU 50 17.354 -6.834 3.486 346 HD12 LEU 50 2HD1 LEU 50 18.609 -6.983 2.257 347 HD13 LEU 50 3HD1 LEU 50 19.055 -6.775 3.950 348 HD21 LEU 50 3HD2 LEU 50 16.217 -8.482 3.404 349 HD22 LEU 50 1HD2 LEU 50 16.753 -10.005 4.115 350 HD23 LEU 50 2HD2 LEU 50 16.825 -9.775 2.368 351 H ARG 51 H ARG 51 21.634 -12.254 2.492 352 HA ARG 51 HA ARG 51 22.804 -11.358 -0.033 353 HB2 ARG 51 2HB ARG 51 24.306 -11.623 2.345 354 HB3 ARG 51 3HB ARG 51 24.715 -13.007 1.340 355 HG2 ARG 51 2HG ARG 51 24.769 -10.879 -0.421 356 HG3 ARG 51 3HG ARG 51 25.466 -10.226 1.063 357 HD2 ARG 51 2HD ARG 51 26.350 -12.717 -0.390 358 HD3 ARG 51 3HD ARG 51 27.201 -11.173 -0.348 359 HE ARG 51 HE ARG 51 26.730 -12.302 2.252 360 HH11 ARG 51 1HH1 ARG 51 28.859 -12.248 -0.502 361 HH12 ARG 51 2HH1 ARG 51 30.247 -12.765 0.397 362 HH21 ARG 51 2HH2 ARG 51 30.070 -13.184 2.642 363 HH22 ARG 51 1HH2 ARG 51 28.550 -12.984 3.446 364 H VAL 52 H VAL 52 23.611 -13.165 -1.351 365 HA VAL 52 HA VAL 52 21.745 -15.220 -1.593 366 HB VAL 52 HB VAL 52 23.398 -16.311 -3.110 367 HG11 VAL 52 1HG1 VAL 52 21.859 -14.626 -3.953 368 HG12 VAL 52 2HG1 VAL 52 22.994 -13.348 -3.513 369 HG13 VAL 52 3HG1 VAL 52 23.416 -14.509 -4.773 370 HG21 VAL 52 3HG2 VAL 52 25.567 -15.920 -2.819 371 HG22 VAL 52 1HG2 VAL 52 25.309 -14.259 -3.352 372 HG23 VAL 52 2HG2 VAL 52 25.216 -14.659 -1.637 373 H GLY 53 H GLY 53 21.418 -16.991 -0.428 374 HA2 GLY 53 2HA GLY 53 22.623 -19.113 0.250 375 HA3 GLY 53 3HA GLY 53 23.670 -18.042 1.168 376 H ASP 54 H ASP 54 21.059 -16.415 1.628 377 HA ASP 54 HA ASP 54 20.333 -17.881 4.053 378 HB2 ASP 54 2HB ASP 54 19.838 -15.021 3.207 379 HB3 ASP 54 3HB ASP 54 19.239 -15.721 4.709 380 H GLN 55 H GLN 55 18.487 -18.963 4.205 381 HA GLN 55 HA GLN 55 16.595 -18.923 2.041 382 HB2 GLN 55 2HB GLN 55 16.389 -20.361 4.691 383 HB3 GLN 55 3HB GLN 55 15.472 -20.707 3.231 384 HG2 GLN 55 2HG GLN 55 17.877 -21.048 2.213 385 HG3 GLN 55 3HG GLN 55 18.292 -21.346 3.900 386 HE21 GLN 55 2HE2 GLN 55 16.941 -24.525 3.987 387 HE22 GLN 55 1HE2 GLN 55 17.812 -23.263 4.781 388 H LEU 56 H LEU 56 15.173 -17.320 1.873 389 HA LEU 56 HA LEU 56 14.151 -16.011 4.270 390 HB2 LEU 56 2HB LEU 56 13.129 -14.426 2.661 391 HB3 LEU 56 3HB LEU 56 14.884 -14.540 2.541 392 HG LEU 56 HG LEU 56 13.992 -16.357 0.660 393 HD11 LEU 56 1HD1 LEU 56 12.498 -14.562 -0.638 394 HD12 LEU 56 2HD1 LEU 56 12.012 -14.193 1.017 395 HD13 LEU 56 3HD1 LEU 56 11.812 -15.826 0.383 396 HD21 LEU 56 3HD2 LEU 56 14.494 -14.221 -0.861 397 HD22 LEU 56 1HD2 LEU 56 15.764 -15.128 -0.039 398 HD23 LEU 56 2HD2 LEU 56 15.151 -13.633 0.668 399 H VAL 57 H VAL 57 12.401 -16.823 5.202 400 HA VAL 57 HA VAL 57 10.320 -18.022 3.491 401 HB VAL 57 HB VAL 57 9.620 -19.284 5.544 402 HG11 VAL 57 1HG1 VAL 57 12.342 -20.248 5.213 403 HG12 VAL 57 2HG1 VAL 57 10.811 -21.008 4.775 404 HG13 VAL 57 3HG1 VAL 57 11.570 -19.854 3.678 405 HG21 VAL 57 3HG2 VAL 57 10.599 -17.961 7.275 406 HG22 VAL 57 1HG2 VAL 57 11.380 -19.542 7.308 407 HG23 VAL 57 2HG2 VAL 57 12.213 -18.161 6.594 408 H ARG 58 H ARG 58 10.935 -16.043 6.356 409 HA ARG 58 HA ARG 58 9.636 -14.570 7.513 410 HB2 ARG 58 2HB ARG 58 8.315 -14.167 4.824 411 HB3 ARG 58 3HB ARG 58 8.322 -13.034 6.169 412 HG2 ARG 58 2HG ARG 58 10.296 -12.199 5.583 413 HG3 ARG 58 3HG ARG 58 11.001 -13.803 5.368 414 HD2 ARG 58 2HD ARG 58 11.098 -13.097 3.211 415 HD3 ARG 58 3HD ARG 58 9.462 -13.754 3.201 416 HE ARG 58 HE ARG 58 8.666 -11.638 2.885 417 HH11 ARG 58 1HH1 ARG 58 11.924 -11.442 4.098 418 HH12 ARG 58 2HH1 ARG 58 12.031 -9.724 3.906 419 HH21 ARG 58 2HH2 ARG 58 10.250 -8.549 3.072 420 HH22 ARG 58 1HH2 ARG 58 8.795 -9.375 2.629 421 H PHE 59 H PHE 59 8.711 -17.342 7.357 422 HA PHE 59 HA PHE 59 5.899 -16.854 8.042 423 HB2 PHE 59 2HB PHE 59 6.980 -19.005 6.231 424 HB3 PHE 59 3HB PHE 59 5.435 -19.179 7.056 425 HD1 PHE 59 HD1 PHE 59 4.237 -16.569 6.879 426 HD2 PHE 59 HD2 PHE 59 6.562 -18.666 3.996 427 HE1 PHE 59 HE1 PHE 59 3.132 -15.310 5.077 428 HE2 PHE 59 HE2 PHE 59 5.462 -17.410 2.190 429 HZ PHE 59 HZ PHE 59 3.745 -15.728 2.729 430 H ALA 60 H ALA 60 5.054 -18.171 9.672 431 HA ALA 60 HA ALA 60 6.951 -19.078 11.596 432 HB1 ALA 60 1HB ALA 60 4.864 -19.855 12.815 433 HB2 ALA 60 2HB ALA 60 4.976 -18.131 12.458 434 HB3 ALA 60 3HB ALA 60 3.950 -19.171 11.471 435 H GLY 61 H GLY 61 8.066 -20.903 11.310 436 HA2 GLY 61 2HA GLY 61 7.600 -23.385 11.639 437 HA3 GLY 61 3HA GLY 61 6.662 -23.231 10.162 438 H TYR 62 H TYR 62 9.190 -21.166 9.834 439 HA TYR 62 HA TYR 62 11.105 -21.181 8.608 440 HB2 TYR 62 2HB TYR 62 11.541 -24.066 9.303 441 HB3 TYR 62 3HB TYR 62 12.724 -22.775 9.131 442 HD1 TYR 62 HD1 TYR 62 11.715 -24.900 11.455 443 HD2 TYR 62 HD2 TYR 62 11.739 -20.685 10.873 444 HE1 TYR 62 HE1 TYR 62 11.700 -24.570 13.892 445 HE2 TYR 62 HE2 TYR 62 11.725 -20.343 13.309 446 HH TYR 62 HH TYR 62 11.753 -23.100 15.552 447 H THR 63 H THR 63 8.696 -21.766 7.267 448 HA THR 63 HA THR 63 9.740 -23.375 5.043 449 HB THR 63 HB THR 63 8.199 -24.858 6.128 450 HG1 THR 63 HG1 THR 63 7.637 -25.256 4.125 451 HG21 THR 63 3HG2 THR 63 5.700 -23.562 5.897 452 HG22 THR 63 1HG2 THR 63 6.784 -22.443 6.722 453 HG23 THR 63 2HG2 THR 63 6.530 -24.063 7.370 454 H VAL 64 H VAL 64 8.806 -22.869 2.971 455 HA VAL 64 HA VAL 64 7.198 -20.449 2.786 456 HB VAL 64 HB VAL 64 9.644 -19.770 2.829 457 HG11 VAL 64 1HG1 VAL 64 9.671 -20.901 0.039 458 HG12 VAL 64 2HG1 VAL 64 11.008 -20.162 0.923 459 HG13 VAL 64 3HG1 VAL 64 10.374 -21.728 1.428 460 HG21 VAL 64 3HG2 VAL 64 9.342 -18.082 1.166 461 HG22 VAL 64 1HG2 VAL 64 8.172 -19.073 0.294 462 HG23 VAL 64 2HG2 VAL 64 7.764 -18.415 1.879 463 H THR 65 H THR 65 6.403 -20.050 0.610 464 HA THR 65 HA THR 65 5.787 -22.526 -0.739 465 HB THR 65 HB THR 65 4.820 -20.341 -2.257 466 HG1 THR 65 HG1 THR 65 4.229 -20.012 0.506 467 HG21 THR 65 3HG2 THR 65 2.694 -21.223 -1.718 468 HG22 THR 65 1HG2 THR 65 3.274 -21.900 -0.197 469 HG23 THR 65 2HG2 THR 65 3.789 -22.604 -1.730 470 H GLU 66 H GLU 66 6.777 -19.388 -2.108 471 HA GLU 66 HA GLU 66 9.096 -20.338 -3.387 472 HB2 GLU 66 2HB GLU 66 8.343 -20.459 -5.699 473 HB3 GLU 66 3HB GLU 66 7.489 -21.640 -4.717 474 HG2 GLU 66 2HG GLU 66 5.488 -20.630 -4.986 475 HG3 GLU 66 3HG GLU 66 6.187 -19.012 -5.041 476 H LEU 67 H LEU 67 9.323 -18.781 -5.576 477 HA LEU 67 HA LEU 67 9.854 -16.251 -4.570 478 HB2 LEU 67 2HB LEU 67 10.154 -15.548 -6.875 479 HB3 LEU 67 3HB LEU 67 10.878 -17.129 -6.595 480 HG LEU 67 HG LEU 67 8.560 -17.964 -7.562 481 HD11 LEU 67 1HD1 LEU 67 7.274 -16.432 -8.512 482 HD12 LEU 67 2HD1 LEU 67 8.619 -15.872 -9.506 483 HD13 LEU 67 3HD1 LEU 67 8.356 -15.178 -7.906 484 HD21 LEU 67 3HD2 LEU 67 11.126 -17.214 -8.795 485 HD22 LEU 67 1HD2 LEU 67 9.788 -17.473 -9.915 486 HD23 LEU 67 2HD2 LEU 67 10.266 -18.755 -8.802 487 H ALA 68 H ALA 68 6.962 -17.495 -6.126 488 HA ALA 68 HA ALA 68 5.629 -15.101 -6.640 489 HB1 ALA 68 1HB ALA 68 4.812 -17.189 -7.514 490 HB2 ALA 68 2HB ALA 68 4.504 -17.795 -5.887 491 HB3 ALA 68 3HB ALA 68 3.555 -16.451 -6.522 492 H ALA 69 H ALA 69 5.760 -17.052 -3.689 493 HA ALA 69 HA ALA 69 3.882 -15.526 -2.221 494 HB1 ALA 69 1HB ALA 69 5.904 -17.598 -1.579 495 HB2 ALA 69 2HB ALA 69 5.303 -16.602 -0.253 496 HB3 ALA 69 3HB ALA 69 4.177 -17.550 -1.226 497 H PHE 70 H PHE 70 7.349 -15.260 -2.709 498 HA PHE 70 HA PHE 70 7.815 -13.343 -0.665 499 HB2 PHE 70 2HB PHE 70 9.612 -14.729 -1.637 500 HB3 PHE 70 3HB PHE 70 9.417 -13.890 -3.172 501 HD1 PHE 70 HD1 PHE 70 9.936 -13.037 0.426 502 HD2 PHE 70 HD2 PHE 70 10.928 -12.236 -3.635 503 HE1 PHE 70 HE1 PHE 70 11.549 -11.331 1.160 504 HE2 PHE 70 HE2 PHE 70 12.544 -10.530 -2.907 505 HZ PHE 70 HZ PHE 70 12.857 -10.076 -0.507 506 H ASN 71 H ASN 71 6.789 -13.151 -3.995 507 HA ASN 71 HA ASN 71 7.286 -10.385 -4.375 508 HB2 ASN 71 2HB ASN 71 6.895 -12.077 -6.200 509 HB3 ASN 71 3HB ASN 71 5.188 -12.057 -5.767 510 HD21 ASN 71 2HD2 ASN 71 6.386 -9.521 -8.446 511 HD22 ASN 71 1HD2 ASN 71 7.052 -11.071 -8.073 512 H THR 72 H THR 72 4.591 -12.212 -3.072 513 HA THR 72 HA THR 72 2.736 -10.052 -3.029 514 HB THR 72 HB THR 72 2.337 -12.100 -0.971 515 HG1 THR 72 HG1 THR 72 2.627 -12.848 -3.707 516 HG21 THR 72 3HG2 THR 72 0.436 -10.888 -1.519 517 HG22 THR 72 1HG2 THR 72 0.220 -12.361 -2.463 518 HG23 THR 72 2HG2 THR 72 0.806 -10.891 -3.243 519 H VAL 73 H VAL 73 4.852 -11.501 -0.569 520 HA VAL 73 HA VAL 73 4.069 -9.773 1.532 521 HB VAL 73 HB VAL 73 6.157 -10.520 2.654 522 HG11 VAL 73 1HG1 VAL 73 5.442 -13.126 2.054 523 HG12 VAL 73 2HG1 VAL 73 4.727 -12.104 3.302 524 HG13 VAL 73 3HG1 VAL 73 3.988 -12.194 1.703 525 HG21 VAL 73 3HG2 VAL 73 7.663 -10.711 0.813 526 HG22 VAL 73 1HG2 VAL 73 7.466 -12.321 1.505 527 HG23 VAL 73 2HG2 VAL 73 6.628 -11.894 0.013 528 H VAL 74 H VAL 74 6.683 -9.651 -0.843 529 HA VAL 74 HA VAL 74 8.016 -7.405 0.228 530 HB VAL 74 HB VAL 74 7.957 -8.570 -2.549 531 HG11 VAL 74 1HG1 VAL 74 8.424 -6.310 -2.974 532 HG12 VAL 74 2HG1 VAL 74 9.418 -6.154 -1.525 533 HG13 VAL 74 3HG1 VAL 74 10.004 -7.089 -2.901 534 HG21 VAL 74 3HG2 VAL 74 9.253 -9.336 -0.214 535 HG22 VAL 74 1HG2 VAL 74 9.624 -9.872 -1.853 536 HG23 VAL 74 2HG2 VAL 74 10.492 -8.504 -1.155 537 H ALA 75 H ALA 75 5.380 -7.741 -2.086 538 HA ALA 75 HA ALA 75 5.273 -5.126 -3.045 539 HB1 ALA 75 1HB ALA 75 2.975 -7.024 -2.582 540 HB2 ALA 75 2HB ALA 75 2.947 -5.598 -3.620 541 HB3 ALA 75 3HB ALA 75 3.992 -6.961 -4.021 542 H ARG 76 H ARG 76 3.720 -6.564 -0.195 543 HA ARG 76 HA ARG 76 2.499 -4.073 0.577 544 HB2 ARG 76 2HB ARG 76 2.807 -6.517 2.312 545 HB3 ARG 76 3HB ARG 76 1.579 -5.262 2.412 546 HG2 ARG 76 2HG ARG 76 1.852 -7.421 0.343 547 HG3 ARG 76 3HG ARG 76 0.535 -7.166 1.490 548 HD2 ARG 76 2HD ARG 76 0.290 -4.873 0.294 549 HD3 ARG 76 3HD ARG 76 1.203 -5.647 -0.999 550 HE ARG 76 HE ARG 76 -1.535 -6.081 -0.343 551 HH11 ARG 76 1HH1 ARG 76 1.320 -7.633 -1.592 552 HH12 ARG 76 2HH1 ARG 76 0.439 -8.813 -2.505 553 HH21 ARG 76 2HH2 ARG 76 -1.852 -8.809 -2.476 554 HH22 ARG 76 1HH2 ARG 76 -2.707 -7.629 -1.541 555 H HIS 77 H HIS 77 5.479 -5.713 1.175 556 HA HIS 77 HA HIS 77 6.124 -4.292 3.589 557 HB2 HIS 77 2HB HIS 77 7.121 -6.443 3.326 558 HB3 HIS 77 3HB HIS 77 7.740 -6.036 1.728 559 HD1 HIS 77 HD1 HIS 77 8.274 -5.074 5.359 560 HD2 HIS 77 HD2 HIS 77 10.280 -5.057 1.720 561 HE1 HIS 77 HE1 HIS 77 10.628 -4.368 5.892 562 H VAL 78 H VAL 78 6.516 -3.775 0.184 563 HA VAL 78 HA VAL 78 8.666 -2.054 0.051 564 HB VAL 78 HB VAL 78 6.085 -2.048 -1.502 565 HG11 VAL 78 1HG1 VAL 78 7.838 -0.690 -3.077 566 HG12 VAL 78 2HG1 VAL 78 6.595 0.062 -2.075 567 HG13 VAL 78 3HG1 VAL 78 8.250 -0.071 -1.478 568 HG21 VAL 78 3HG2 VAL 78 8.424 -2.608 -3.032 569 HG22 VAL 78 1HG2 VAL 78 8.435 -3.617 -1.585 570 HG23 VAL 78 2HG2 VAL 78 7.054 -3.661 -2.682 571 H ARG 79 H ARG 79 8.949 -0.572 1.644 572 HA ARG 79 HA ARG 79 7.253 1.767 1.580 573 HB2 ARG 79 2HB ARG 79 7.014 -0.214 3.687 574 HB3 ARG 79 3HB ARG 79 7.489 1.352 4.329 575 HG2 ARG 79 2HG ARG 79 5.457 2.204 4.024 576 HG3 ARG 79 3HG ARG 79 5.343 1.558 2.386 577 HD2 ARG 79 2HD ARG 79 4.362 -0.397 3.079 578 HD3 ARG 79 3HD ARG 79 5.093 -0.320 4.682 579 HE ARG 79 HE ARG 79 2.570 0.762 3.890 580 HH11 ARG 79 1HH1 ARG 79 5.253 1.173 6.069 581 HH12 ARG 79 2HH1 ARG 79 4.321 2.008 7.267 582 HH21 ARG 79 2HH2 ARG 79 2.090 2.397 6.920 583 HH22 ARG 79 1HH2 ARG 79 1.332 1.860 5.459 584 HA PRO 80 HA PRO 80 11.006 3.854 2.477 585 HB2 PRO 80 2HB PRO 80 10.144 5.982 3.925 586 HB3 PRO 80 3HB PRO 80 9.861 5.825 2.187 587 HG2 PRO 80 2HG PRO 80 8.013 5.238 4.468 588 HG3 PRO 80 3HG PRO 80 7.672 6.061 2.934 589 HD2 PRO 80 2HD PRO 80 7.025 3.468 3.372 590 HD3 PRO 80 3HD PRO 80 7.482 4.081 1.769 591 H SER 81 H SER 81 12.318 2.692 3.801 592 HA SER 81 HA SER 81 13.389 2.013 5.689 593 HB2 SER 81 2HB SER 81 13.254 4.570 6.045 594 HB3 SER 81 3HB SER 81 11.978 4.200 7.205 595 HG SER 81 HG SER 81 13.690 4.065 8.469 596 H ALA 82 H ALA 82 10.985 0.716 5.067 597 HA ALA 82 HA ALA 82 9.486 0.395 7.529 598 HB1 ALA 82 1HB ALA 82 8.638 -1.589 5.815 599 HB2 ALA 82 2HB ALA 82 7.913 0.009 5.996 600 HB3 ALA 82 3HB ALA 82 9.104 -0.280 4.728 601 H SER 83 H SER 83 10.317 -0.803 9.106 602 HA SER 83 HA SER 83 11.933 -3.157 8.399 603 HB2 SER 83 2HB SER 83 11.854 -2.114 11.192 604 HB3 SER 83 3HB SER 83 13.191 -2.838 10.299 605 HG SER 83 HG SER 83 13.643 -0.687 10.458 606 H ILE 84 H ILE 84 11.278 -5.151 8.939 607 HA ILE 84 HA ILE 84 9.159 -5.491 10.924 608 HB ILE 84 HB ILE 84 8.059 -7.164 9.324 609 HG12 ILE 84 2HG1 ILE 84 9.133 -5.438 7.131 610 HG13 ILE 84 3HG1 ILE 84 10.114 -6.782 7.705 611 HG21 ILE 84 1HG2 ILE 84 7.751 -4.337 8.393 612 HG22 ILE 84 2HG2 ILE 84 6.517 -5.569 8.648 613 HG23 ILE 84 3HG2 ILE 84 7.293 -4.799 10.032 614 HD11 ILE 84 3HD1 ILE 84 8.936 -7.658 5.908 615 HD12 ILE 84 1HD1 ILE 84 8.029 -8.214 7.314 616 HD13 ILE 84 2HD1 ILE 84 7.440 -6.846 6.368 617 HA PRO 85 HA PRO 85 11.408 -9.069 12.109 618 HB2 PRO 85 2HB PRO 85 9.416 -10.704 12.964 619 HB3 PRO 85 3HB PRO 85 9.938 -9.274 13.863 620 HG2 PRO 85 2HG PRO 85 7.595 -9.609 12.031 621 HG3 PRO 85 3HG PRO 85 7.680 -8.785 13.599 622 HD2 PRO 85 2HD PRO 85 7.745 -7.448 11.245 623 HD3 PRO 85 3HD PRO 85 8.608 -6.881 12.690 624 H VAL 86 H VAL 86 12.368 -10.460 10.777 625 HA VAL 86 HA VAL 86 10.683 -12.099 8.997 626 HB VAL 86 HB VAL 86 13.436 -11.005 8.401 627 HG11 VAL 86 1HG1 VAL 86 12.520 -11.991 6.056 628 HG12 VAL 86 2HG1 VAL 86 13.570 -12.881 7.160 629 HG13 VAL 86 3HG1 VAL 86 11.827 -13.150 7.190 630 HG21 VAL 86 3HG2 VAL 86 10.791 -10.397 7.084 631 HG22 VAL 86 1HG2 VAL 86 11.604 -9.352 8.248 632 HG23 VAL 86 2HG2 VAL 86 12.356 -9.687 6.689 633 H VAL 87 H VAL 87 11.220 -14.250 8.753 634 HA VAL 87 HA VAL 87 13.147 -15.284 10.719 635 HB VAL 87 HB VAL 87 10.831 -16.683 9.373 636 HG11 VAL 87 1HG1 VAL 87 13.078 -17.655 11.040 637 HG12 VAL 87 2HG1 VAL 87 11.479 -18.323 11.373 638 HG13 VAL 87 3HG1 VAL 87 12.179 -18.470 9.760 639 HG21 VAL 87 3HG2 VAL 87 10.356 -16.765 12.049 640 HG22 VAL 87 1HG2 VAL 87 11.128 -15.187 11.880 641 HG23 VAL 87 2HG2 VAL 87 9.679 -15.565 10.947 642 H PHE 88 H PHE 88 14.951 -16.246 10.053 643 HA PHE 88 HA PHE 88 15.079 -17.243 7.286 644 HB2 PHE 88 2HB PHE 88 17.297 -16.357 7.016 645 HB3 PHE 88 3HB PHE 88 16.255 -15.045 7.557 646 HD1 PHE 88 HD1 PHE 88 19.303 -16.722 8.084 647 HD2 PHE 88 HD2 PHE 88 16.214 -14.627 10.131 648 HE1 PHE 88 HE1 PHE 88 20.846 -16.275 9.947 649 HE2 PHE 88 HE2 PHE 88 17.752 -14.176 11.997 650 HZ PHE 88 HZ PHE 88 20.072 -14.999 11.907 651 H SER 89 H SER 89 16.614 -18.941 6.916 652 HA SER 89 HA SER 89 17.539 -20.320 9.341 653 HB2 SER 89 2HB SER 89 15.649 -21.303 7.284 654 HB3 SER 89 3HB SER 89 16.901 -22.439 7.784 655 HG SER 89 HG SER 89 14.768 -21.387 9.222 656 H ARG 90 H ARG 90 19.398 -21.575 9.106 657 HA ARG 90 HA ARG 90 20.799 -21.288 6.530 658 HB2 ARG 90 2HB ARG 90 21.711 -20.699 9.304 659 HB3 ARG 90 3HB ARG 90 22.882 -21.383 8.184 660 HG2 ARG 90 2HG ARG 90 21.756 -19.391 6.692 661 HG3 ARG 90 3HG ARG 90 21.755 -18.698 8.315 662 HD2 ARG 90 2HD ARG 90 24.221 -20.069 7.387 663 HD3 ARG 90 3HD ARG 90 23.844 -18.494 6.690 664 HE ARG 90 HE ARG 90 23.602 -18.295 9.464 665 HH11 ARG 90 1HH1 ARG 90 26.063 -18.827 7.060 666 HH12 ARG 90 2HH1 ARG 90 27.327 -18.118 8.009 667 HH21 ARG 90 2HH2 ARG 90 26.869 -17.284 10.093 668 HH22 ARG 90 1HH2 ARG 90 25.258 -17.359 10.723 669 H ASP 91 H ASP 91 20.283 -23.357 5.836 670 HA ASP 91 HA ASP 91 20.560 -25.599 5.569 671 HB2 ASP 91 2HB ASP 91 22.770 -25.608 7.594 672 HB3 ASP 91 3HB ASP 91 22.634 -26.514 6.090 673 H GLY 92 H GLY 92 18.670 -24.728 7.473 674 HA2 GLY 92 2HA GLY 92 17.231 -26.172 8.722 675 HA3 GLY 92 3HA GLY 92 18.643 -27.091 9.222 676 H VAL 93 H VAL 93 19.880 -24.246 9.632 677 HA VAL 93 HA VAL 93 19.525 -24.192 12.437 678 HB VAL 93 HB VAL 93 20.696 -22.118 10.580 679 HG11 VAL 93 1HG1 VAL 93 20.661 -22.263 13.587 680 HG12 VAL 93 2HG1 VAL 93 21.778 -21.249 12.672 681 HG13 VAL 93 3HG1 VAL 93 20.040 -20.972 12.560 682 HG21 VAL 93 3HG2 VAL 93 21.734 -24.478 10.876 683 HG22 VAL 93 1HG2 VAL 93 22.774 -23.057 10.987 684 HG23 VAL 93 2HG2 VAL 93 22.233 -23.871 12.455 685 H VAL 94 H VAL 94 18.406 -22.779 13.759 686 HA VAL 94 HA VAL 94 16.275 -21.237 12.428 687 HB VAL 94 HB VAL 94 15.305 -23.014 13.709 688 HG11 VAL 94 1HG1 VAL 94 15.988 -22.421 16.381 689 HG12 VAL 94 2HG1 VAL 94 16.372 -23.874 15.456 690 HG13 VAL 94 3HG1 VAL 94 17.496 -22.514 15.472 691 HG21 VAL 94 3HG2 VAL 94 13.933 -21.766 15.296 692 HG22 VAL 94 1HG2 VAL 94 15.086 -20.432 15.255 693 HG23 VAL 94 2HG2 VAL 94 14.167 -20.848 13.809 694 H MET 95 H MET 95 16.666 -19.127 12.459 695 HA MET 95 HA MET 95 17.420 -17.855 14.966 696 HB2 MET 95 2HB MET 95 19.558 -18.312 13.798 697 HB3 MET 95 3HB MET 95 18.981 -17.385 12.419 698 HG2 MET 95 2HG MET 95 20.460 -16.029 13.727 699 HG3 MET 95 3HG MET 95 18.821 -15.396 13.858 700 HE1 MET 95 3HE MET 95 21.634 -16.094 17.096 701 HE2 MET 95 1HE MET 95 21.853 -15.899 15.356 702 HE3 MET 95 2HE MET 95 21.162 -14.586 16.311 703 H SER 96 H SER 96 16.754 -15.718 15.137 704 HA SER 96 HA SER 96 15.013 -14.788 12.950 705 HB2 SER 96 2HB SER 96 14.144 -13.368 15.092 706 HB3 SER 96 3HB SER 96 13.469 -14.925 14.613 707 HG SER 96 HG SER 96 14.083 -15.590 16.499 708 H ALA 97 H ALA 97 15.419 -12.874 12.034 709 HA ALA 97 HA ALA 97 17.096 -10.926 13.436 710 HB1 ALA 97 1HB ALA 97 18.435 -10.572 11.366 711 HB2 ALA 97 2HB ALA 97 18.694 -12.140 12.132 712 HB3 ALA 97 3HB ALA 97 17.685 -12.019 10.691 713 H THR 98 H THR 98 16.613 -8.822 12.993 714 HA THR 98 HA THR 98 14.150 -8.333 11.559 715 HB THR 98 HB THR 98 15.945 -6.340 12.956 716 HG1 THR 98 HG1 THR 98 14.887 -6.824 14.770 717 HG21 THR 98 3HG2 THR 98 14.443 -4.756 12.452 718 HG22 THR 98 1HG2 THR 98 13.081 -5.810 12.831 719 HG23 THR 98 2HG2 THR 98 13.837 -5.884 11.239 720 H ILE 99 H ILE 99 13.967 -7.575 9.551 721 HA ILE 99 HA ILE 99 16.397 -6.553 8.231 722 HB ILE 99 HB ILE 99 14.040 -7.800 6.826 723 HG12 ILE 99 2HG1 ILE 99 15.002 -9.487 8.291 724 HG13 ILE 99 3HG1 ILE 99 15.438 -9.836 6.622 725 HG21 ILE 99 1HG2 ILE 99 15.120 -7.356 4.927 726 HG22 ILE 99 2HG2 ILE 99 16.150 -6.291 5.883 727 HG23 ILE 99 3HG2 ILE 99 16.651 -7.953 5.568 728 HD11 ILE 99 3HD1 ILE 99 17.292 -10.183 8.189 729 HD12 ILE 99 1HD1 ILE 99 17.652 -8.951 6.980 730 HD13 ILE 99 2HD1 ILE 99 17.224 -8.476 8.624 731 H VAL 100 H VAL 100 16.363 -4.513 7.562 732 HA VAL 100 HA VAL 100 13.752 -3.171 7.296 733 HB VAL 100 HB VAL 100 14.925 -2.207 9.146 734 HG11 VAL 100 1HG1 VAL 100 17.232 -1.050 8.014 735 HG12 VAL 100 2HG1 VAL 100 17.141 -2.299 9.257 736 HG13 VAL 100 3HG1 VAL 100 17.236 -2.752 7.555 737 HG21 VAL 100 3HG2 VAL 100 13.754 -0.662 7.618 738 HG22 VAL 100 1HG2 VAL 100 15.111 0.101 8.447 739 HG23 VAL 100 2HG2 VAL 100 15.272 -0.392 6.761 740 H VAL 101 H VAL 101 13.261 -2.887 5.225 741 HA VAL 101 HA VAL 101 15.419 -2.390 3.295 742 HB VAL 101 HB VAL 101 12.539 -3.077 2.704 743 HG11 VAL 101 1HG1 VAL 101 13.459 -3.684 0.483 744 HG12 VAL 101 2HG1 VAL 101 13.625 -1.968 0.862 745 HG13 VAL 101 3HG1 VAL 101 15.020 -3.040 0.991 746 HG21 VAL 101 3HG2 VAL 101 14.952 -4.837 3.052 747 HG22 VAL 101 1HG2 VAL 101 13.380 -4.959 3.842 748 HG23 VAL 101 2HG2 VAL 101 13.538 -5.344 2.128 749 H GLY 102 H GLY 102 15.695 -0.432 2.441 750 HA2 GLY 102 2HA GLY 102 13.526 1.542 2.798 751 HA3 GLY 102 3HA GLY 102 15.237 1.943 2.825 752 H GLU 103 H GLU 103 12.468 1.850 0.949 753 HA GLU 103 HA GLU 103 13.479 1.290 -1.611 754 HB2 GLU 103 2HB GLU 103 11.221 3.166 -0.888 755 HB3 GLU 103 3HB GLU 103 11.498 2.429 -2.460 756 HG2 GLU 103 2HG GLU 103 10.530 1.173 0.069 757 HG3 GLU 103 3HG GLU 103 9.827 1.122 -1.547 758 H LEU 104 H LEU 104 13.412 4.245 0.294 759 HA LEU 104 HA LEU 104 15.593 5.390 -1.066 760 HB2 LEU 104 2HB LEU 104 14.653 7.040 -2.403 761 HB3 LEU 104 3HB LEU 104 13.688 5.609 -2.757 762 HG LEU 104 HG LEU 104 12.856 7.854 -0.919 763 HD11 LEU 104 1HD1 LEU 104 12.134 7.227 -3.773 764 HD12 LEU 104 2HD1 LEU 104 12.887 8.693 -3.146 765 HD13 LEU 104 3HD1 LEU 104 11.210 8.322 -2.745 766 HD21 LEU 104 3HD2 LEU 104 10.589 6.619 -1.451 767 HD22 LEU 104 1HD2 LEU 104 11.636 6.088 -0.135 768 HD23 LEU 104 2HD2 LEU 104 11.662 5.237 -1.680 769 H GLU 105 H GLU 105 15.849 7.775 -0.444 770 HA GLU 105 HA GLU 105 14.621 8.271 2.186 771 HB2 GLU 105 2HB GLU 105 16.775 9.166 2.974 772 HB3 GLU 105 3HB GLU 105 16.888 7.465 2.544 773 HG2 GLU 105 2HG GLU 105 17.651 8.465 0.225 774 HG3 GLU 105 3HG GLU 105 18.091 9.840 1.237 Start of MODEL 5 1 HA PRO 1 HA PRO 1 2.351 -0.234 -1.444 2 HB2 PRO 1 2HB PRO 1 4.823 -1.308 -1.120 3 HB3 PRO 1 3HB PRO 1 4.348 0.241 -0.413 4 HG2 PRO 1 2HG PRO 1 4.482 -2.463 0.865 5 HG3 PRO 1 3HG PRO 1 5.008 -0.895 1.506 6 HD2 PRO 1 2HD PRO 1 2.664 -2.049 2.217 7 HD3 PRO 1 3HD PRO 1 2.870 -0.288 2.119 8 H LEU 2 H LEU 2 2.576 -1.286 -3.378 9 HA LEU 2 HA LEU 2 2.807 -4.205 -3.373 10 HB2 LEU 2 2HB LEU 2 0.966 -4.455 -4.921 11 HB3 LEU 2 3HB LEU 2 0.417 -3.694 -3.429 12 HG LEU 2 HG LEU 2 1.139 -1.831 -5.590 13 HD11 LEU 2 1HD1 LEU 2 0.107 -3.143 -7.139 14 HD12 LEU 2 2HD1 LEU 2 -1.304 -2.319 -6.476 15 HD13 LEU 2 3HD1 LEU 2 -0.907 -3.953 -5.945 16 HD21 LEU 2 3HD2 LEU 2 -1.504 -1.573 -4.535 17 HD22 LEU 2 1HD2 LEU 2 -0.112 -0.511 -4.321 18 HD23 LEU 2 2HD2 LEU 2 -0.373 -1.858 -3.212 19 H THR 3 H THR 3 3.553 -5.100 -5.349 20 HA THR 3 HA THR 3 4.614 -3.152 -7.282 21 HB THR 3 HB THR 3 6.397 -3.985 -5.704 22 HG1 THR 3 HG1 THR 3 6.744 -3.286 -7.962 23 HG21 THR 3 3HG2 THR 3 6.964 -6.177 -5.526 24 HG22 THR 3 1HG2 THR 3 6.521 -6.540 -7.194 25 HG23 THR 3 2HG2 THR 3 5.270 -6.409 -5.957 26 H ARG 4 H ARG 4 5.322 -4.245 -9.348 27 HA ARG 4 HA ARG 4 3.163 -5.879 -10.297 28 HB2 ARG 4 2HB ARG 4 5.491 -4.481 -11.497 29 HB3 ARG 4 3HB ARG 4 4.848 -5.856 -12.384 30 HG2 ARG 4 2HG ARG 4 3.587 -4.218 -13.306 31 HG3 ARG 4 3HG ARG 4 2.559 -4.603 -11.925 32 HD2 ARG 4 2HD ARG 4 2.833 -2.196 -12.151 33 HD3 ARG 4 3HD ARG 4 3.577 -2.772 -10.660 34 HE ARG 4 HE ARG 4 5.596 -2.055 -11.447 35 HH11 ARG 4 1HH1 ARG 4 3.382 -2.326 -14.120 36 HH12 ARG 4 2HH1 ARG 4 4.473 -1.618 -15.265 37 HH21 ARG 4 2HH2 ARG 4 6.555 -0.934 -14.595 38 HH22 ARG 4 1HH2 ARG 4 7.042 -1.121 -12.945 39 HA PRO 5 HA PRO 5 4.893 -9.900 -10.010 40 HB2 PRO 5 2HB PRO 5 4.141 -11.034 -12.359 41 HB3 PRO 5 3HB PRO 5 3.003 -10.687 -11.052 42 HG2 PRO 5 2HG PRO 5 3.564 -9.121 -13.541 43 HG3 PRO 5 3HG PRO 5 2.005 -9.499 -12.785 44 HD2 PRO 5 2HD PRO 5 3.223 -7.098 -12.492 45 HD3 PRO 5 3HD PRO 5 2.215 -7.819 -11.221 46 H TYR 6 H TYR 6 7.096 -8.868 -10.164 47 HA TYR 6 HA TYR 6 8.445 -9.761 -12.626 48 HB2 TYR 6 2HB TYR 6 8.269 -7.166 -11.911 49 HB3 TYR 6 3HB TYR 6 9.725 -7.616 -11.031 50 HD1 TYR 6 HD1 TYR 6 11.676 -7.090 -12.126 51 HD2 TYR 6 HD2 TYR 6 8.309 -8.297 -14.431 52 HE1 TYR 6 HE1 TYR 6 13.001 -6.837 -14.183 53 HE2 TYR 6 HE2 TYR 6 9.625 -8.048 -16.494 54 HH TYR 6 HH TYR 6 11.573 -7.465 -17.376 55 H LEU 7 H LEU 7 10.354 -10.869 -12.406 56 HA LEU 7 HA LEU 7 11.106 -11.593 -9.651 57 HB2 LEU 7 2HB LEU 7 11.909 -13.720 -10.580 58 HB3 LEU 7 3HB LEU 7 10.182 -13.477 -10.831 59 HG LEU 7 HG LEU 7 11.659 -12.544 -13.116 60 HD11 LEU 7 1HD1 LEU 7 13.313 -14.218 -12.275 61 HD12 LEU 7 2HD1 LEU 7 12.655 -14.573 -13.872 62 HD13 LEU 7 3HD1 LEU 7 12.069 -15.455 -12.462 63 HD21 LEU 7 3HD2 LEU 7 9.437 -14.402 -12.472 64 HD22 LEU 7 1HD2 LEU 7 10.227 -14.579 -14.039 65 HD23 LEU 7 2HD2 LEU 7 9.489 -13.040 -13.592 66 H GLY 8 H GLY 8 13.051 -10.958 -9.004 67 HA2 GLY 8 2HA GLY 8 15.116 -10.483 -11.065 68 HA3 GLY 8 3HA GLY 8 14.880 -9.393 -9.707 69 H PHE 9 H PHE 9 14.535 -12.793 -9.187 70 HA PHE 9 HA PHE 9 17.281 -13.135 -8.320 71 HB2 PHE 9 2HB PHE 9 16.641 -13.789 -6.023 72 HB3 PHE 9 3HB PHE 9 16.285 -12.097 -6.355 73 HD1 PHE 9 HD1 PHE 9 13.916 -11.441 -6.884 74 HD2 PHE 9 HD2 PHE 9 14.959 -15.273 -5.354 75 HE1 PHE 9 HE1 PHE 9 11.583 -11.794 -6.186 76 HE2 PHE 9 HE2 PHE 9 12.628 -15.633 -4.654 77 HZ PHE 9 HZ PHE 9 10.936 -13.892 -5.070 78 H ARG 10 H ARG 10 17.523 -15.403 -7.298 79 HA ARG 10 HA ARG 10 15.855 -17.271 -8.850 80 HB2 ARG 10 2HB ARG 10 18.753 -17.051 -8.463 81 HB3 ARG 10 3HB ARG 10 18.129 -18.676 -8.209 82 HG2 ARG 10 2HG ARG 10 17.024 -17.472 -10.595 83 HG3 ARG 10 3HG ARG 10 18.788 -17.508 -10.630 84 HD2 ARG 10 2HD ARG 10 18.734 -19.907 -10.107 85 HD3 ARG 10 3HD ARG 10 16.972 -19.859 -10.110 86 HE ARG 10 HE ARG 10 17.966 -18.873 -12.560 87 HH11 ARG 10 1HH1 ARG 10 17.582 -21.838 -10.775 88 HH12 ARG 10 2HH1 ARG 10 17.487 -22.831 -12.192 89 HH21 ARG 10 2HH2 ARG 10 17.636 -21.881 -14.271 90 HH22 ARG 10 1HH2 ARG 10 17.842 -20.170 -14.432 91 H VAL 11 H VAL 11 15.127 -19.157 -7.880 92 HA VAL 11 HA VAL 11 15.640 -19.466 -5.004 93 HB VAL 11 HB VAL 11 13.477 -18.270 -5.339 94 HG11 VAL 11 1HG1 VAL 11 11.594 -19.383 -6.312 95 HG12 VAL 11 2HG1 VAL 11 12.913 -19.416 -7.484 96 HG13 VAL 11 3HG1 VAL 11 12.526 -20.861 -6.550 97 HG21 VAL 11 3HG2 VAL 11 12.289 -19.525 -3.723 98 HG22 VAL 11 1HG2 VAL 11 13.036 -21.036 -4.241 99 HG23 VAL 11 2HG2 VAL 11 13.999 -19.818 -3.405 100 H ALA 12 H ALA 12 15.890 -21.526 -4.335 101 HA ALA 12 HA ALA 12 15.280 -23.671 -6.263 102 HB1 ALA 12 1HB ALA 12 17.644 -23.597 -4.393 103 HB2 ALA 12 2HB ALA 12 17.282 -24.835 -5.597 104 HB3 ALA 12 3HB ALA 12 17.705 -23.202 -6.111 105 H VAL 13 H VAL 13 13.865 -25.098 -5.521 106 HA VAL 13 HA VAL 13 13.171 -25.141 -2.709 107 HB VAL 13 HB VAL 13 11.369 -25.206 -4.343 108 HG11 VAL 13 1HG1 VAL 13 13.061 -26.995 -5.699 109 HG12 VAL 13 2HG1 VAL 13 11.611 -27.906 -5.271 110 HG13 VAL 13 3HG1 VAL 13 11.475 -26.414 -6.203 111 HG21 VAL 13 3HG2 VAL 13 10.171 -27.210 -3.502 112 HG22 VAL 13 1HG2 VAL 13 11.681 -27.767 -2.781 113 HG23 VAL 13 2HG2 VAL 13 10.938 -26.267 -2.224 114 H GLY 14 H GLY 14 13.804 -26.612 -1.258 115 HA2 GLY 14 2HA GLY 14 14.597 -29.276 -2.057 116 HA3 GLY 14 3HA GLY 14 15.921 -28.277 -1.475 117 H ARG 15 H ARG 15 16.233 -29.725 0.272 118 HA ARG 15 HA ARG 15 14.303 -29.309 2.450 119 HB2 ARG 15 2HB ARG 15 15.460 -31.892 1.464 120 HB3 ARG 15 3HB ARG 15 15.046 -31.712 3.164 121 HG2 ARG 15 2HG ARG 15 13.184 -32.716 2.132 122 HG3 ARG 15 3HG ARG 15 12.740 -31.031 2.409 123 HD2 ARG 15 2HD ARG 15 12.402 -30.704 0.237 124 HD3 ARG 15 3HD ARG 15 14.009 -31.315 -0.152 125 HE ARG 15 HE ARG 15 12.617 -33.576 0.270 126 HH11 ARG 15 1HH1 ARG 15 11.983 -30.754 -1.667 127 HH12 ARG 15 2HH1 ARG 15 11.070 -31.617 -2.860 128 HH21 ARG 15 2HH2 ARG 15 10.748 -33.875 -2.647 129 HH22 ARG 15 1HH2 ARG 15 11.417 -34.724 -1.294 130 H ASP 16 H ASP 16 15.171 -29.067 4.488 131 HA ASP 16 HA ASP 16 18.065 -28.612 4.554 132 HB2 ASP 16 2HB ASP 16 17.438 -27.495 6.800 133 HB3 ASP 16 3HB ASP 16 16.975 -26.682 5.307 134 H SER 17 H SER 17 18.797 -28.875 7.070 135 HA SER 17 HA SER 17 18.884 -31.696 7.456 136 HB2 SER 17 2HB SER 17 20.621 -29.804 8.082 137 HB3 SER 17 3HB SER 17 19.736 -29.799 9.607 138 HG SER 17 HG SER 17 21.557 -31.269 9.519 139 H SER 18 H SER 18 16.939 -29.124 8.725 140 HA SER 18 HA SER 18 15.990 -30.583 11.011 141 HB2 SER 18 2HB SER 18 15.655 -28.401 11.522 142 HB3 SER 18 3HB SER 18 15.557 -27.920 9.828 143 HG SER 18 HG SER 18 13.509 -27.718 10.301 144 H GLY 19 H GLY 19 14.486 -29.544 7.945 145 HA2 GLY 19 2HA GLY 19 13.197 -31.107 6.630 146 HA3 GLY 19 3HA GLY 19 12.744 -31.915 8.123 147 H CYS 20 H CYS 20 12.663 -28.490 7.161 148 HA CYS 20 HA CYS 20 9.798 -28.482 7.846 149 HB2 CYS 20 2HB CYS 20 12.001 -26.619 8.442 150 HB3 CYS 20 3HB CYS 20 10.516 -25.849 7.897 151 HG CYS 20 HG CYS 20 11.227 -27.247 10.828 152 H THR 21 H THR 21 11.706 -28.633 5.257 153 HA THR 21 HA THR 21 11.522 -28.095 3.052 154 HB THR 21 HB THR 21 8.653 -27.329 3.482 155 HG1 THR 21 HG1 THR 21 8.326 -29.725 3.284 156 HG21 THR 21 3HG2 THR 21 10.227 -28.716 1.323 157 HG22 THR 21 1HG2 THR 21 9.334 -27.199 1.221 158 HG23 THR 21 2HG2 THR 21 8.464 -28.727 1.363 159 H THR 22 H THR 22 12.814 -26.282 2.956 160 HA THR 22 HA THR 22 11.372 -23.733 2.773 161 HB THR 22 HB THR 22 12.363 -23.457 4.881 162 HG1 THR 22 HG1 THR 22 14.070 -21.938 4.449 163 HG21 THR 22 3HG2 THR 22 13.817 -25.151 5.334 164 HG22 THR 22 1HG2 THR 22 14.998 -23.901 4.943 165 HG23 THR 22 2HG2 THR 22 14.548 -25.100 3.730 166 H LEU 23 H LEU 23 12.459 -22.119 1.475 167 HA LEU 23 HA LEU 23 14.167 -23.349 -0.578 168 HB2 LEU 23 2HB LEU 23 12.099 -21.210 -0.624 169 HB3 LEU 23 3HB LEU 23 13.415 -21.129 -1.793 170 HG LEU 23 HG LEU 23 12.764 -23.201 -2.781 171 HD11 LEU 23 1HD1 LEU 23 10.604 -24.288 -1.850 172 HD12 LEU 23 2HD1 LEU 23 11.034 -23.454 -0.357 173 HD13 LEU 23 3HD1 LEU 23 12.148 -24.622 -1.066 174 HD21 LEU 23 3HD2 LEU 23 11.047 -20.947 -2.635 175 HD22 LEU 23 1HD2 LEU 23 10.044 -22.396 -2.691 176 HD23 LEU 23 2HD2 LEU 23 11.239 -22.101 -3.955 177 H SER 24 H SER 24 16.107 -22.470 -1.129 178 HA SER 24 HA SER 24 17.119 -20.372 0.651 179 HB2 SER 24 2HB SER 24 18.208 -22.791 -0.013 180 HB3 SER 24 3HB SER 24 19.031 -21.714 -1.141 181 HG SER 24 HG SER 24 20.107 -21.927 0.900 182 H ILE 25 H ILE 25 18.276 -18.588 -0.152 183 HA ILE 25 HA ILE 25 17.465 -17.799 -2.849 184 HB ILE 25 HB ILE 25 17.003 -16.277 -0.928 185 HG12 ILE 25 2HG1 ILE 25 18.096 -14.231 -2.065 186 HG13 ILE 25 3HG1 ILE 25 18.747 -15.393 -3.217 187 HG21 ILE 25 1HG2 ILE 25 19.828 -15.405 -0.859 188 HG22 ILE 25 2HG2 ILE 25 18.607 -15.402 0.412 189 HG23 ILE 25 3HG2 ILE 25 19.432 -16.901 -0.014 190 HD11 ILE 25 3HD1 ILE 25 15.887 -15.693 -2.769 191 HD12 ILE 25 1HD1 ILE 25 16.341 -14.118 -3.418 192 HD13 ILE 25 2HD1 ILE 25 16.800 -15.590 -4.274 193 H GLN 26 H GLN 26 18.856 -17.509 -4.489 194 HA GLN 26 HA GLN 26 21.712 -17.942 -3.929 195 HB2 GLN 26 2HB GLN 26 20.065 -18.517 -6.391 196 HB3 GLN 26 3HB GLN 26 21.822 -18.587 -6.373 197 HG2 GLN 26 2HG GLN 26 21.606 -20.716 -5.802 198 HG3 GLN 26 3HG GLN 26 21.097 -20.140 -4.216 199 HE21 GLN 26 2HE2 GLN 26 18.184 -21.211 -6.893 200 HE22 GLN 26 1HE2 GLN 26 19.627 -20.434 -7.437 201 H GLU 27 H GLU 27 19.414 -15.697 -5.074 202 HA GLU 27 HA GLU 27 21.572 -13.986 -6.125 203 HB2 GLU 27 2HB GLU 27 19.432 -14.843 -7.550 204 HB3 GLU 27 3HB GLU 27 18.786 -13.352 -6.880 205 HG2 GLU 27 2HG GLU 27 20.069 -12.057 -8.180 206 HG3 GLU 27 3HG GLU 27 21.472 -13.113 -8.027 207 H VAL 28 H VAL 28 20.494 -11.568 -6.168 208 HA VAL 28 HA VAL 28 19.740 -11.059 -3.365 209 HB VAL 28 HB VAL 28 21.101 -9.086 -5.192 210 HG11 VAL 28 1HG1 VAL 28 19.788 -8.533 -2.968 211 HG12 VAL 28 2HG1 VAL 28 21.301 -9.057 -2.225 212 HG13 VAL 28 3HG1 VAL 28 21.298 -7.717 -3.373 213 HG21 VAL 28 3HG2 VAL 28 23.200 -9.655 -4.063 214 HG22 VAL 28 1HG2 VAL 28 22.379 -10.954 -3.197 215 HG23 VAL 28 2HG2 VAL 28 22.550 -11.033 -4.951 216 H THR 29 H THR 29 17.818 -10.173 -3.008 217 HA THR 29 HA THR 29 16.485 -8.769 -5.233 218 HB THR 29 HB THR 29 15.320 -10.839 -4.875 219 HG1 THR 29 HG1 THR 29 13.954 -9.057 -5.198 220 HG21 THR 29 3HG2 THR 29 15.461 -10.065 -1.977 221 HG22 THR 29 1HG2 THR 29 15.944 -11.578 -2.744 222 HG23 THR 29 2HG2 THR 29 14.234 -11.187 -2.564 223 H GLN 30 H GLN 30 17.919 -8.310 -2.335 224 HA GLN 30 HA GLN 30 15.995 -6.470 -1.193 225 HB2 GLN 30 2HB GLN 30 18.633 -7.583 -0.382 226 HB3 GLN 30 3HB GLN 30 18.163 -6.030 0.297 227 HG2 GLN 30 2HG GLN 30 17.587 -8.035 1.680 228 HG3 GLN 30 3HG GLN 30 16.246 -6.949 1.322 229 HE21 GLN 30 2HE2 GLN 30 16.236 -10.787 0.048 230 HE22 GLN 30 1HE2 GLN 30 17.595 -10.087 0.853 231 H THR 31 H THR 31 17.882 -6.239 -3.784 232 HA THR 31 HA THR 31 18.655 -3.442 -3.272 233 HB THR 31 HB THR 31 19.982 -3.942 -5.533 234 HG1 THR 31 HG1 THR 31 20.081 -6.004 -5.957 235 HG21 THR 31 3HG2 THR 31 21.665 -3.494 -4.146 236 HG22 THR 31 1HG2 THR 31 21.571 -5.123 -3.478 237 HG23 THR 31 2HG2 THR 31 20.610 -3.823 -2.772 238 H TYR 32 H TYR 32 16.045 -4.753 -4.245 239 HA TYR 32 HA TYR 32 15.742 -3.083 -6.655 240 HB2 TYR 32 2HB TYR 32 14.829 -5.851 -6.070 241 HB3 TYR 32 3HB TYR 32 13.733 -4.821 -6.984 242 HD1 TYR 32 HD1 TYR 32 14.326 -4.044 -9.219 243 HD2 TYR 32 HD2 TYR 32 16.927 -6.596 -7.022 244 HE1 TYR 32 HE1 TYR 32 15.580 -4.528 -11.278 245 HE2 TYR 32 HE2 TYR 32 18.189 -7.086 -9.075 246 HH TYR 32 HH TYR 32 17.308 -5.591 -12.176 247 H THR 33 H THR 33 13.854 -1.883 -6.867 248 HA THR 33 HA THR 33 11.928 -1.932 -4.671 249 HB THR 33 HB THR 33 13.223 0.656 -5.538 250 HG1 THR 33 HG1 THR 33 14.307 0.541 -3.519 251 HG21 THR 33 3HG2 THR 33 12.126 1.508 -3.472 252 HG22 THR 33 1HG2 THR 33 11.326 -0.054 -3.299 253 HG23 THR 33 2HG2 THR 33 10.984 0.962 -4.700 254 H GLY 34 H GLY 34 9.920 -0.914 -5.161 255 HA2 GLY 34 2HA GLY 34 9.489 0.180 -7.803 256 HA3 GLY 34 3HA GLY 34 8.781 -1.410 -7.560 257 H SER 35 H SER 35 8.150 -0.971 -4.764 258 HA SER 35 HA SER 35 5.826 0.788 -5.144 259 HB2 SER 35 2HB SER 35 5.861 -0.976 -2.785 260 HB3 SER 35 3HB SER 35 4.578 -0.687 -3.959 261 HG SER 35 HG SER 35 5.589 -2.851 -3.933 262 H ASN 36 H ASN 36 5.412 2.460 -3.783 263 HA ASN 36 HA ASN 36 5.796 4.106 -2.261 264 HB2 ASN 36 2HB ASN 36 6.020 1.695 -0.864 265 HB3 ASN 36 3HB ASN 36 7.428 2.630 -0.369 266 HD21 ASN 36 2HD2 ASN 36 3.791 3.494 1.048 267 HD22 ASN 36 1HD2 ASN 36 4.129 2.129 0.044 268 H GLY 37 H GLY 37 7.675 3.725 -4.405 269 HA2 GLY 37 2HA GLY 37 9.643 5.565 -3.722 270 HA3 GLY 37 3HA GLY 37 10.349 3.972 -3.493 271 H GLY 38 H GLY 38 10.007 2.450 -5.417 272 HA2 GLY 38 2HA GLY 38 10.217 1.994 -7.669 273 HA3 GLY 38 3HA GLY 38 9.672 3.631 -8.002 274 H ALA 39 H ALA 39 12.505 1.804 -6.883 275 HA ALA 39 HA ALA 39 14.268 2.922 -8.739 276 HB1 ALA 39 1HB ALA 39 14.012 4.419 -6.178 277 HB2 ALA 39 2HB ALA 39 15.607 4.257 -6.913 278 HB3 ALA 39 3HB ALA 39 14.294 5.017 -7.813 279 H ASP 40 H ASP 40 15.080 0.867 -8.872 280 HA ASP 40 HA ASP 40 15.886 -0.644 -6.588 281 HB2 ASP 40 2HB ASP 40 16.821 -2.221 -8.220 282 HB3 ASP 40 3HB ASP 40 15.188 -1.737 -8.671 283 H LEU 41 H LEU 41 17.788 -0.703 -5.559 284 HA LEU 41 HA LEU 41 20.259 0.037 -6.783 285 HB2 LEU 41 2HB LEU 41 18.838 2.181 -5.946 286 HB3 LEU 41 3HB LEU 41 19.739 1.799 -4.480 287 HG LEU 41 HG LEU 41 21.769 1.789 -6.203 288 HD11 LEU 41 1HD1 LEU 41 21.103 2.432 -8.235 289 HD12 LEU 41 2HD1 LEU 41 21.008 4.051 -7.544 290 HD13 LEU 41 3HD1 LEU 41 19.562 3.047 -7.638 291 HD21 LEU 41 3HD2 LEU 41 22.121 3.217 -4.486 292 HD22 LEU 41 1HD2 LEU 41 20.490 3.886 -4.562 293 HD23 LEU 41 2HD2 LEU 41 21.718 4.424 -5.708 294 H MET 42 H MET 42 21.800 0.606 -4.601 295 HA MET 42 HA MET 42 21.426 -1.784 -2.920 296 HB2 MET 42 2HB MET 42 23.412 -1.795 -4.447 297 HB3 MET 42 3HB MET 42 24.032 -0.402 -3.571 298 HG2 MET 42 2HG MET 42 23.320 -2.606 -1.818 299 HG3 MET 42 3HG MET 42 24.544 -3.041 -3.009 300 HE1 MET 42 3HE MET 42 26.949 -0.971 -3.190 301 HE2 MET 42 1HE MET 42 27.670 -1.767 -1.791 302 HE3 MET 42 2HE MET 42 26.704 -2.700 -2.934 303 H GLY 43 H GLY 43 20.993 -1.417 -0.850 304 HA2 GLY 43 2HA GLY 43 22.352 0.590 0.670 305 HA3 GLY 43 3HA GLY 43 20.688 1.045 0.337 306 HA PRO 44 HA PRO 44 19.183 -1.399 3.645 307 HB2 PRO 44 2HB PRO 44 17.061 -2.729 2.598 308 HB3 PRO 44 3HB PRO 44 17.043 -0.990 2.915 309 HG2 PRO 44 2HG PRO 44 17.505 -2.441 0.337 310 HG3 PRO 44 3HG PRO 44 16.529 -0.994 0.647 311 HD2 PRO 44 2HD PRO 44 19.016 -0.873 -0.416 312 HD3 PRO 44 3HD PRO 44 18.364 0.400 0.635 313 H ALA 45 H ALA 45 20.006 -3.089 0.711 314 HA ALA 45 HA ALA 45 19.751 -5.738 1.654 315 HB1 ALA 45 1HB ALA 45 19.928 -5.152 -0.728 316 HB2 ALA 45 2HB ALA 45 21.611 -4.689 -0.476 317 HB3 ALA 45 3HB ALA 45 21.114 -6.366 -0.249 318 H PHE 46 H PHE 46 22.540 -3.537 1.512 319 HA PHE 46 HA PHE 46 24.182 -5.436 2.974 320 HB2 PHE 46 2HB PHE 46 24.899 -3.801 1.034 321 HB3 PHE 46 3HB PHE 46 25.077 -2.650 2.354 322 HD1 PHE 46 HD1 PHE 46 27.242 -2.393 3.037 323 HD2 PHE 46 HD2 PHE 46 25.915 -6.253 1.829 324 HE1 PHE 46 HE1 PHE 46 29.470 -3.312 3.536 325 HE2 PHE 46 HE2 PHE 46 28.140 -7.177 2.327 326 HZ PHE 46 HZ PHE 46 29.920 -5.707 3.183 327 H ALA 47 H ALA 47 22.152 -2.768 3.620 328 HA ALA 47 HA ALA 47 23.372 -1.739 5.946 329 HB1 ALA 47 1HB ALA 47 21.159 -0.778 6.438 330 HB2 ALA 47 2HB ALA 47 21.659 -0.499 4.769 331 HB3 ALA 47 3HB ALA 47 20.468 -1.746 5.135 332 H ALA 48 H ALA 48 21.108 -4.386 5.414 333 HA ALA 48 HA ALA 48 21.055 -4.946 8.291 334 HB1 ALA 48 1HB ALA 48 19.472 -6.503 6.297 335 HB2 ALA 48 2HB ALA 48 19.093 -6.109 7.974 336 HB3 ALA 48 3HB ALA 48 18.968 -4.868 6.727 337 H GLY 49 H GLY 49 22.396 -6.068 5.319 338 HA2 GLY 49 2HA GLY 49 24.297 -7.522 5.325 339 HA3 GLY 49 3HA GLY 49 23.666 -8.282 6.779 340 H LEU 50 H LEU 50 21.335 -7.683 4.367 341 HA LEU 50 HA LEU 50 20.773 -10.442 4.036 342 HB2 LEU 50 2HB LEU 50 19.822 -8.249 2.217 343 HB3 LEU 50 3HB LEU 50 19.024 -9.772 2.601 344 HG LEU 50 HG LEU 50 19.271 -8.413 5.040 345 HD11 LEU 50 1HD1 LEU 50 19.747 -6.380 3.710 346 HD12 LEU 50 2HD1 LEU 50 18.257 -6.271 4.645 347 HD13 LEU 50 3HD1 LEU 50 18.188 -6.577 2.910 348 HD21 LEU 50 3HD2 LEU 50 16.730 -8.252 3.534 349 HD22 LEU 50 1HD2 LEU 50 17.049 -8.832 5.168 350 HD23 LEU 50 2HD2 LEU 50 17.410 -9.861 3.782 351 H ARG 51 H ARG 51 22.008 -11.797 2.923 352 HA ARG 51 HA ARG 51 22.928 -10.987 0.258 353 HB2 ARG 51 2HB ARG 51 24.650 -11.171 2.404 354 HB3 ARG 51 3HB ARG 51 24.804 -12.751 1.647 355 HG2 ARG 51 2HG ARG 51 24.923 -11.036 -0.494 356 HG3 ARG 51 3HG ARG 51 25.780 -10.156 0.773 357 HD2 ARG 51 2HD ARG 51 26.947 -12.468 1.163 358 HD3 ARG 51 3HD ARG 51 26.424 -12.782 -0.491 359 HE ARG 51 HE ARG 51 27.997 -11.290 -1.245 360 HH11 ARG 51 1HH1 ARG 51 27.627 -10.951 2.200 361 HH12 ARG 51 2HH1 ARG 51 28.994 -9.901 2.375 362 HH21 ARG 51 2HH2 ARG 51 30.228 -9.307 0.539 363 HH22 ARG 51 1HH2 ARG 51 29.798 -9.908 -1.027 364 H VAL 52 H VAL 52 23.840 -13.015 -0.915 365 HA VAL 52 HA VAL 52 21.733 -14.903 -1.083 366 HB VAL 52 HB VAL 52 23.177 -16.092 -2.694 367 HG11 VAL 52 1HG1 VAL 52 23.511 -14.084 -4.253 368 HG12 VAL 52 2HG1 VAL 52 21.878 -14.411 -3.669 369 HG13 VAL 52 3HG1 VAL 52 22.835 -13.122 -2.939 370 HG21 VAL 52 3HG2 VAL 52 25.300 -14.283 -3.029 371 HG22 VAL 52 1HG2 VAL 52 25.238 -14.660 -1.308 372 HG23 VAL 52 2HG2 VAL 52 25.387 -15.960 -2.491 373 H GLY 53 H GLY 53 21.428 -16.782 -0.067 374 HA2 GLY 53 2HA GLY 53 22.665 -18.886 0.618 375 HA3 GLY 53 3HA GLY 53 23.640 -17.804 1.600 376 H ASP 54 H ASP 54 20.962 -16.263 1.975 377 HA ASP 54 HA ASP 54 20.161 -17.818 4.324 378 HB2 ASP 54 2HB ASP 54 20.340 -14.974 3.687 379 HB3 ASP 54 3HB ASP 54 18.808 -15.406 4.442 380 H GLN 55 H GLN 55 18.381 -19.004 4.252 381 HA GLN 55 HA GLN 55 16.597 -18.945 2.043 382 HB2 GLN 55 2HB GLN 55 16.154 -20.281 4.714 383 HB3 GLN 55 3HB GLN 55 15.387 -20.687 3.185 384 HG2 GLN 55 2HG GLN 55 17.485 -21.461 2.288 385 HG3 GLN 55 3HG GLN 55 18.332 -20.945 3.745 386 HE21 GLN 55 2HE2 GLN 55 16.870 -24.604 3.536 387 HE22 GLN 55 1HE2 GLN 55 17.138 -23.548 2.195 388 H LEU 56 H LEU 56 15.212 -17.334 1.715 389 HA LEU 56 HA LEU 56 14.081 -15.869 3.952 390 HB2 LEU 56 2HB LEU 56 13.807 -15.525 0.972 391 HB3 LEU 56 3HB LEU 56 13.055 -14.472 2.168 392 HG LEU 56 HG LEU 56 15.730 -14.441 2.865 393 HD11 LEU 56 1HD1 LEU 56 15.454 -14.434 -0.135 394 HD12 LEU 56 2HD1 LEU 56 16.413 -15.542 0.846 395 HD13 LEU 56 3HD1 LEU 56 16.864 -13.840 0.743 396 HD21 LEU 56 3HD2 LEU 56 15.578 -12.183 2.441 397 HD22 LEU 56 1HD2 LEU 56 13.876 -12.626 2.580 398 HD23 LEU 56 2HD2 LEU 56 14.605 -12.410 0.988 399 H VAL 57 H VAL 57 12.395 -16.759 4.951 400 HA VAL 57 HA VAL 57 10.318 -18.058 3.311 401 HB VAL 57 HB VAL 57 9.639 -19.128 5.534 402 HG11 VAL 57 1HG1 VAL 57 10.629 -20.956 4.736 403 HG12 VAL 57 2HG1 VAL 57 11.388 -19.912 3.532 404 HG13 VAL 57 3HG1 VAL 57 12.239 -20.299 5.028 405 HG21 VAL 57 3HG2 VAL 57 12.418 -18.206 6.261 406 HG22 VAL 57 1HG2 VAL 57 10.910 -17.701 7.022 407 HG23 VAL 57 2HG2 VAL 57 11.462 -19.369 7.179 408 H ARG 58 H ARG 58 10.895 -15.918 6.069 409 HA ARG 58 HA ARG 58 9.570 -14.404 7.141 410 HB2 ARG 58 2HB ARG 58 9.746 -13.526 4.725 411 HB3 ARG 58 3HB ARG 58 8.093 -14.095 4.538 412 HG2 ARG 58 2HG ARG 58 8.127 -11.735 5.062 413 HG3 ARG 58 3HG ARG 58 7.390 -12.646 6.381 414 HD2 ARG 58 2HD ARG 58 10.307 -12.173 6.544 415 HD3 ARG 58 3HD ARG 58 9.261 -10.771 6.764 416 HE ARG 58 HE ARG 58 9.590 -12.995 8.565 417 HH11 ARG 58 1HH1 ARG 58 7.541 -10.358 7.583 418 HH12 ARG 58 2HH1 ARG 58 6.723 -10.254 9.107 419 HH21 ARG 58 2HH2 ARG 58 7.282 -11.682 10.809 420 HH22 ARG 58 1HH2 ARG 58 8.521 -12.868 10.576 421 H PHE 59 H PHE 59 8.684 -17.190 7.132 422 HA PHE 59 HA PHE 59 5.871 -16.704 7.806 423 HB2 PHE 59 2HB PHE 59 6.945 -18.876 6.019 424 HB3 PHE 59 3HB PHE 59 5.426 -19.072 6.888 425 HD1 PHE 59 HD1 PHE 59 4.079 -16.585 6.697 426 HD2 PHE 59 HD2 PHE 59 6.542 -18.493 3.797 427 HE1 PHE 59 HE1 PHE 59 2.897 -15.381 4.906 428 HE2 PHE 59 HE2 PHE 59 5.365 -17.292 2.002 429 HZ PHE 59 HZ PHE 59 3.540 -15.733 2.555 430 H ALA 60 H ALA 60 5.064 -17.940 9.501 431 HA ALA 60 HA ALA 60 6.995 -18.826 11.403 432 HB1 ALA 60 1HB ALA 60 5.195 -17.948 12.490 433 HB2 ALA 60 2HB ALA 60 4.036 -18.587 11.324 434 HB3 ALA 60 3HB ALA 60 4.749 -19.654 12.534 435 H GLY 61 H GLY 61 8.060 -20.685 11.160 436 HA2 GLY 61 2HA GLY 61 7.551 -23.144 11.572 437 HA3 GLY 61 3HA GLY 61 6.582 -23.014 10.113 438 H TYR 62 H TYR 62 9.146 -21.016 9.666 439 HA TYR 62 HA TYR 62 11.034 -21.110 8.402 440 HB2 TYR 62 2HB TYR 62 11.426 -23.986 9.148 441 HB3 TYR 62 3HB TYR 62 12.628 -22.717 8.942 442 HD1 TYR 62 HD1 TYR 62 11.733 -20.588 10.667 443 HD2 TYR 62 HD2 TYR 62 11.583 -24.791 11.310 444 HE1 TYR 62 HE1 TYR 62 11.756 -20.211 13.097 445 HE2 TYR 62 HE2 TYR 62 11.604 -24.425 13.742 446 HH TYR 62 HH TYR 62 12.106 -22.840 15.360 447 H THR 63 H THR 63 8.586 -21.663 7.126 448 HA THR 63 HA THR 63 9.534 -23.370 4.931 449 HB THR 63 HB THR 63 7.959 -24.766 6.068 450 HG1 THR 63 HG1 THR 63 7.657 -24.873 3.863 451 HG21 THR 63 3HG2 THR 63 5.506 -23.391 5.895 452 HG22 THR 63 1HG2 THR 63 6.651 -22.279 6.642 453 HG23 THR 63 2HG2 THR 63 6.374 -23.869 7.353 454 H VAL 64 H VAL 64 8.664 -22.859 2.858 455 HA VAL 64 HA VAL 64 7.092 -20.421 2.607 456 HB VAL 64 HB VAL 64 9.549 -19.776 2.678 457 HG11 VAL 64 1HG1 VAL 64 11.036 -20.581 1.213 458 HG12 VAL 64 2HG1 VAL 64 9.858 -21.866 0.939 459 HG13 VAL 64 3HG1 VAL 64 9.907 -20.469 -0.137 460 HG21 VAL 64 3HG2 VAL 64 8.632 -18.922 0.024 461 HG22 VAL 64 1HG2 VAL 64 7.449 -18.721 1.316 462 HG23 VAL 64 2HG2 VAL 64 9.036 -17.964 1.448 463 H THR 65 H THR 65 6.344 -20.044 0.408 464 HA THR 65 HA THR 65 5.747 -22.544 -0.920 465 HB THR 65 HB THR 65 4.827 -20.185 -2.336 466 HG1 THR 65 HG1 THR 65 3.336 -19.685 -0.473 467 HG21 THR 65 3HG2 THR 65 3.816 -22.375 -2.589 468 HG22 THR 65 1HG2 THR 65 2.630 -21.248 -1.932 469 HG23 THR 65 2HG2 THR 65 3.416 -22.419 -0.872 470 H GLU 66 H GLU 66 6.840 -19.382 -2.168 471 HA GLU 66 HA GLU 66 9.122 -20.320 -3.477 472 HB2 GLU 66 2HB GLU 66 8.251 -20.208 -5.851 473 HB3 GLU 66 3HB GLU 66 7.773 -21.624 -4.925 474 HG2 GLU 66 2HG GLU 66 5.579 -20.854 -4.661 475 HG3 GLU 66 3HG GLU 66 6.009 -19.211 -5.133 476 H LEU 67 H LEU 67 9.502 -18.743 -5.558 477 HA LEU 67 HA LEU 67 9.886 -16.201 -4.498 478 HB2 LEU 67 2HB LEU 67 10.286 -15.500 -6.857 479 HB3 LEU 67 3HB LEU 67 11.205 -16.912 -6.339 480 HG LEU 67 HG LEU 67 9.144 -18.166 -7.476 481 HD11 LEU 67 1HD1 LEU 67 7.896 -16.963 -8.865 482 HD12 LEU 67 2HD1 LEU 67 9.313 -16.203 -9.589 483 HD13 LEU 67 3HD1 LEU 67 8.598 -15.522 -8.128 484 HD21 LEU 67 3HD2 LEU 67 10.994 -18.894 -8.484 485 HD22 LEU 67 1HD2 LEU 67 11.800 -17.335 -8.309 486 HD23 LEU 67 2HD2 LEU 67 10.720 -17.621 -9.674 487 H ALA 68 H ALA 68 7.207 -17.508 -6.355 488 HA ALA 68 HA ALA 68 5.907 -15.083 -6.949 489 HB1 ALA 68 1HB ALA 68 3.840 -16.609 -7.055 490 HB2 ALA 68 2HB ALA 68 5.169 -16.924 -8.171 491 HB3 ALA 68 3HB ALA 68 4.971 -17.922 -6.730 492 H ALA 69 H ALA 69 5.600 -17.307 -4.203 493 HA ALA 69 HA ALA 69 3.509 -15.878 -2.921 494 HB1 ALA 69 1HB ALA 69 4.144 -17.237 -0.927 495 HB2 ALA 69 2HB ALA 69 3.833 -18.184 -2.383 496 HB3 ALA 69 3HB ALA 69 5.491 -17.885 -1.864 497 H PHE 70 H PHE 70 7.013 -15.705 -2.787 498 HA PHE 70 HA PHE 70 7.064 -13.928 -0.530 499 HB2 PHE 70 2HB PHE 70 8.929 -15.495 -1.103 500 HB3 PHE 70 3HB PHE 70 9.269 -14.503 -2.516 501 HD1 PHE 70 HD1 PHE 70 11.357 -13.587 -2.096 502 HD2 PHE 70 HD2 PHE 70 8.366 -13.448 0.929 503 HE1 PHE 70 HE1 PHE 70 12.809 -12.143 -0.732 504 HE2 PHE 70 HE2 PHE 70 9.813 -12.003 2.298 505 HZ PHE 70 HZ PHE 70 12.037 -11.348 1.468 506 H ASN 71 H ASN 71 6.808 -13.611 -3.962 507 HA ASN 71 HA ASN 71 7.780 -11.013 -4.322 508 HB2 ASN 71 2HB ASN 71 6.749 -12.908 -5.973 509 HB3 ASN 71 3HB ASN 71 5.415 -11.760 -5.928 510 HD21 ASN 71 2HD2 ASN 71 6.894 -9.855 -8.379 511 HD22 ASN 71 1HD2 ASN 71 5.487 -10.600 -7.708 512 H THR 72 H THR 72 4.602 -12.182 -3.331 513 HA THR 72 HA THR 72 3.345 -9.626 -3.361 514 HB THR 72 HB THR 72 1.603 -10.772 -1.920 515 HG1 THR 72 HG1 THR 72 3.026 -13.147 -2.536 516 HG21 THR 72 3HG2 THR 72 1.056 -12.471 -3.816 517 HG22 THR 72 1HG2 THR 72 2.444 -11.744 -4.624 518 HG23 THR 72 2HG2 THR 72 1.061 -10.745 -4.175 519 H VAL 73 H VAL 73 4.981 -11.545 -0.897 520 HA VAL 73 HA VAL 73 4.301 -9.860 1.292 521 HB VAL 73 HB VAL 73 6.582 -11.820 1.003 522 HG11 VAL 73 1HG1 VAL 73 7.332 -10.813 2.861 523 HG12 VAL 73 2HG1 VAL 73 5.795 -9.999 3.160 524 HG13 VAL 73 3HG1 VAL 73 6.020 -11.675 3.663 525 HG21 VAL 73 3HG2 VAL 73 3.750 -12.071 1.952 526 HG22 VAL 73 1HG2 VAL 73 4.638 -13.085 0.815 527 HG23 VAL 73 2HG2 VAL 73 5.003 -13.165 2.538 528 H VAL 74 H VAL 74 7.134 -10.102 -0.824 529 HA VAL 74 HA VAL 74 8.766 -8.235 0.461 530 HB VAL 74 HB VAL 74 8.600 -8.925 -2.475 531 HG11 VAL 74 1HG1 VAL 74 10.491 -7.186 -0.941 532 HG12 VAL 74 2HG1 VAL 74 11.042 -8.065 -2.369 533 HG13 VAL 74 3HG1 VAL 74 9.725 -6.898 -2.503 534 HG21 VAL 74 3HG2 VAL 74 10.879 -9.816 -0.851 535 HG22 VAL 74 1HG2 VAL 74 9.328 -10.535 -0.416 536 HG23 VAL 74 2HG2 VAL 74 9.939 -10.685 -2.064 537 H ALA 75 H ALA 75 6.329 -7.784 -2.073 538 HA ALA 75 HA ALA 75 6.765 -5.018 -2.443 539 HB1 ALA 75 1HB ALA 75 5.225 -5.223 -4.043 540 HB2 ALA 75 2HB ALA 75 5.218 -6.945 -3.657 541 HB3 ALA 75 3HB ALA 75 4.027 -5.871 -2.923 542 H ARG 76 H ARG 76 4.871 -6.846 -0.146 543 HA ARG 76 HA ARG 76 3.400 -4.557 0.802 544 HB2 ARG 76 2HB ARG 76 3.492 -7.449 1.390 545 HB3 ARG 76 3HB ARG 76 3.073 -6.417 2.750 546 HG2 ARG 76 2HG ARG 76 1.107 -7.252 1.529 547 HG3 ARG 76 3HG ARG 76 1.213 -5.490 1.538 548 HD2 ARG 76 2HD ARG 76 1.419 -5.383 -0.689 549 HD3 ARG 76 3HD ARG 76 2.563 -6.723 -0.735 550 HE ARG 76 HE ARG 76 -0.094 -7.617 -0.231 551 HH11 ARG 76 1HH1 ARG 76 2.066 -6.548 -2.744 552 HH12 ARG 76 2HH1 ARG 76 1.242 -7.412 -4.000 553 HH21 ARG 76 2HH2 ARG 76 -0.609 -8.669 -3.505 554 HH22 ARG 76 1HH2 ARG 76 -1.187 -8.759 -1.876 555 H HIS 77 H HIS 77 6.316 -6.276 1.665 556 HA HIS 77 HA HIS 77 6.609 -4.974 4.216 557 HB2 HIS 77 2HB HIS 77 8.359 -6.783 2.569 558 HB3 HIS 77 3HB HIS 77 8.978 -5.988 4.013 559 HD1 HIS 77 HD1 HIS 77 5.885 -6.451 5.259 560 HD2 HIS 77 HD2 HIS 77 8.747 -9.217 4.068 561 HE1 HIS 77 HE1 HIS 77 5.317 -8.575 6.480 562 H VAL 78 H VAL 78 8.175 -4.717 1.037 563 HA VAL 78 HA VAL 78 10.086 -2.821 1.545 564 HB VAL 78 HB VAL 78 9.751 -2.032 -0.808 565 HG11 VAL 78 1HG1 VAL 78 9.851 -4.659 -1.603 566 HG12 VAL 78 2HG1 VAL 78 11.219 -3.704 -1.027 567 HG13 VAL 78 3HG1 VAL 78 10.334 -4.743 0.090 568 HG21 VAL 78 3HG2 VAL 78 7.473 -2.174 -1.236 569 HG22 VAL 78 1HG2 VAL 78 8.121 -3.557 -2.117 570 HG23 VAL 78 2HG2 VAL 78 7.344 -3.795 -0.552 571 H ARG 79 H ARG 79 9.927 -0.947 2.576 572 HA ARG 79 HA ARG 79 7.901 0.972 1.758 573 HB2 ARG 79 2HB ARG 79 7.902 -0.416 4.353 574 HB3 ARG 79 3HB ARG 79 7.784 1.335 4.463 575 HG2 ARG 79 2HG ARG 79 5.924 1.027 2.653 576 HG3 ARG 79 3HG ARG 79 5.882 -0.623 3.276 577 HD2 ARG 79 2HD ARG 79 4.318 0.404 4.615 578 HD3 ARG 79 3HD ARG 79 5.773 0.566 5.598 579 HE ARG 79 HE ARG 79 5.708 2.840 5.278 580 HH11 ARG 79 1HH1 ARG 79 3.487 1.285 3.094 581 HH12 ARG 79 2HH1 ARG 79 2.744 2.766 2.587 582 HH21 ARG 79 2HH2 ARG 79 3.458 4.763 3.453 583 HH22 ARG 79 1HH2 ARG 79 4.739 4.797 4.618 584 HA PRO 80 HA PRO 80 11.072 3.935 2.397 585 HB2 PRO 80 2HB PRO 80 9.699 6.083 3.330 586 HB3 PRO 80 3HB PRO 80 9.602 5.535 1.652 587 HG2 PRO 80 2HG PRO 80 7.711 5.040 3.920 588 HG3 PRO 80 3HG PRO 80 7.352 5.461 2.235 589 HD2 PRO 80 2HD PRO 80 7.176 2.927 3.173 590 HD3 PRO 80 3HD PRO 80 7.643 3.296 1.500 591 H SER 81 H SER 81 12.507 3.480 3.971 592 HA SER 81 HA SER 81 13.488 3.321 6.021 593 HB2 SER 81 2HB SER 81 11.735 5.474 7.111 594 HB3 SER 81 3HB SER 81 13.484 5.277 7.232 595 HG SER 81 HG SER 81 13.699 6.462 5.518 596 H ALA 82 H ALA 82 11.350 1.554 5.630 597 HA ALA 82 HA ALA 82 10.113 1.450 8.303 598 HB1 ALA 82 1HB ALA 82 9.117 -0.032 5.887 599 HB2 ALA 82 2HB ALA 82 8.268 0.309 7.395 600 HB3 ALA 82 3HB ALA 82 8.609 1.616 6.261 601 H SER 83 H SER 83 11.165 0.099 9.599 602 HA SER 83 HA SER 83 12.682 -2.124 8.522 603 HB2 SER 83 2HB SER 83 13.051 -2.454 11.123 604 HB3 SER 83 3HB SER 83 13.891 -1.175 10.245 605 HG SER 83 HG SER 83 12.037 -0.987 12.224 606 H ILE 84 H ILE 84 12.283 -4.284 8.876 607 HA ILE 84 HA ILE 84 9.944 -5.078 10.414 608 HB ILE 84 HB ILE 84 10.199 -5.776 7.486 609 HG12 ILE 84 2HG1 ILE 84 8.190 -4.035 8.932 610 HG13 ILE 84 3HG1 ILE 84 9.437 -3.471 7.826 611 HG21 ILE 84 1HG2 ILE 84 8.030 -6.488 9.454 612 HG22 ILE 84 2HG2 ILE 84 8.107 -6.953 7.756 613 HG23 ILE 84 3HG2 ILE 84 9.292 -7.586 8.898 614 HD11 ILE 84 3HD1 ILE 84 7.403 -3.491 6.631 615 HD12 ILE 84 1HD1 ILE 84 8.341 -4.867 6.052 616 HD13 ILE 84 2HD1 ILE 84 7.012 -5.119 7.184 617 HA PRO 85 HA PRO 85 12.729 -8.385 11.349 618 HB2 PRO 85 2HB PRO 85 10.962 -9.962 12.675 619 HB3 PRO 85 3HB PRO 85 11.656 -8.496 13.377 620 HG2 PRO 85 2HG PRO 85 8.983 -8.898 12.090 621 HG3 PRO 85 3HG PRO 85 9.391 -8.003 13.565 622 HD2 PRO 85 2HD PRO 85 8.962 -6.777 11.189 623 HD3 PRO 85 3HD PRO 85 10.105 -6.150 12.394 624 H VAL 86 H VAL 86 13.379 -10.089 10.191 625 HA VAL 86 HA VAL 86 11.366 -11.566 8.622 626 HB VAL 86 HB VAL 86 13.289 -12.031 7.016 627 HG11 VAL 86 1HG1 VAL 86 12.404 -10.457 5.700 628 HG12 VAL 86 2HG1 VAL 86 11.397 -10.044 7.089 629 HG13 VAL 86 3HG1 VAL 86 12.888 -9.153 6.783 630 HG21 VAL 86 3HG2 VAL 86 15.116 -11.333 8.467 631 HG22 VAL 86 1HG2 VAL 86 15.097 -10.374 6.987 632 HG23 VAL 86 2HG2 VAL 86 14.486 -9.686 8.492 633 H VAL 87 H VAL 87 11.633 -13.796 8.403 634 HA VAL 87 HA VAL 87 13.433 -14.999 10.396 635 HB VAL 87 HB VAL 87 11.160 -15.532 10.895 636 HG11 VAL 87 1HG1 VAL 87 10.191 -17.044 8.766 637 HG12 VAL 87 2HG1 VAL 87 9.653 -15.438 9.261 638 HG13 VAL 87 3HG1 VAL 87 10.896 -15.609 8.021 639 HG21 VAL 87 3HG2 VAL 87 11.726 -18.087 9.590 640 HG22 VAL 87 1HG2 VAL 87 13.091 -17.427 10.490 641 HG23 VAL 87 2HG2 VAL 87 11.550 -17.702 11.302 642 H PHE 88 H PHE 88 15.131 -16.092 9.681 643 HA PHE 88 HA PHE 88 15.008 -17.286 6.990 644 HB2 PHE 88 2HB PHE 88 17.415 -15.997 8.296 645 HB3 PHE 88 3HB PHE 88 17.396 -16.774 6.716 646 HD1 PHE 88 HD1 PHE 88 18.078 -13.835 7.617 647 HD2 PHE 88 HD2 PHE 88 14.693 -15.695 5.829 648 HE1 PHE 88 HE1 PHE 88 17.456 -11.694 6.576 649 HE2 PHE 88 HE2 PHE 88 14.065 -13.557 4.785 650 HZ PHE 88 HZ PHE 88 15.448 -11.553 5.157 651 H SER 89 H SER 89 16.388 -19.152 6.666 652 HA SER 89 HA SER 89 17.169 -20.530 9.140 653 HB2 SER 89 2HB SER 89 14.997 -21.254 7.377 654 HB3 SER 89 3HB SER 89 16.213 -22.531 7.411 655 HG SER 89 HG SER 89 15.869 -22.832 9.518 656 H ARG 90 H ARG 90 18.866 -22.000 8.940 657 HA ARG 90 HA ARG 90 20.174 -22.153 6.314 658 HB2 ARG 90 2HB ARG 90 21.194 -20.902 8.763 659 HB3 ARG 90 3HB ARG 90 22.300 -22.069 8.052 660 HG2 ARG 90 2HG ARG 90 21.316 -20.477 5.943 661 HG3 ARG 90 3HG ARG 90 21.765 -19.389 7.257 662 HD2 ARG 90 2HD ARG 90 23.980 -20.037 7.214 663 HD3 ARG 90 3HD ARG 90 23.617 -21.595 6.474 664 HE ARG 90 HE ARG 90 22.977 -19.485 4.702 665 HH11 ARG 90 1HH1 ARG 90 25.686 -21.207 6.049 666 HH12 ARG 90 2HH1 ARG 90 26.718 -20.908 4.690 667 HH21 ARG 90 2HH2 ARG 90 25.944 -19.700 2.904 668 HH22 ARG 90 1HH2 ARG 90 24.326 -19.085 2.907 669 H ASP 91 H ASP 91 19.824 -24.275 5.925 670 HA ASP 91 HA ASP 91 20.049 -26.534 6.064 671 HB2 ASP 91 2HB ASP 91 22.086 -26.224 8.243 672 HB3 ASP 91 3HB ASP 91 22.044 -27.382 6.916 673 H GLY 92 H GLY 92 18.157 -25.137 7.794 674 HA2 GLY 92 2HA GLY 92 16.514 -26.246 9.126 675 HA3 GLY 92 3HA GLY 92 17.777 -27.298 9.749 676 H VAL 93 H VAL 93 19.316 -24.532 9.886 677 HA VAL 93 HA VAL 93 19.006 -24.207 12.678 678 HB VAL 93 HB VAL 93 20.323 -22.411 10.639 679 HG11 VAL 93 1HG1 VAL 93 19.828 -21.016 12.481 680 HG12 VAL 93 2HG1 VAL 93 20.263 -22.271 13.643 681 HG13 VAL 93 3HG1 VAL 93 21.515 -21.493 12.674 682 HG21 VAL 93 3HG2 VAL 93 21.126 -24.853 11.249 683 HG22 VAL 93 1HG2 VAL 93 22.276 -23.536 11.018 684 HG23 VAL 93 2HG2 VAL 93 21.810 -24.024 12.648 685 H VAL 94 H VAL 94 18.004 -22.621 13.882 686 HA VAL 94 HA VAL 94 15.978 -21.042 12.442 687 HB VAL 94 HB VAL 94 15.974 -22.006 15.306 688 HG11 VAL 94 1HG1 VAL 94 13.925 -20.388 13.794 689 HG12 VAL 94 2HG1 VAL 94 13.698 -21.076 15.403 690 HG13 VAL 94 3HG1 VAL 94 14.917 -19.828 15.140 691 HG21 VAL 94 3HG2 VAL 94 14.057 -23.365 14.586 692 HG22 VAL 94 1HG2 VAL 94 14.289 -22.799 12.932 693 HG23 VAL 94 2HG2 VAL 94 15.528 -23.785 13.709 694 H MET 95 H MET 95 16.528 -18.980 12.222 695 HA MET 95 HA MET 95 17.567 -17.541 14.547 696 HB2 MET 95 2HB MET 95 19.443 -18.279 12.955 697 HB3 MET 95 3HB MET 95 18.780 -17.105 11.826 698 HG2 MET 95 2HG MET 95 20.568 -16.058 12.969 699 HG3 MET 95 3HG MET 95 19.071 -15.363 13.586 700 HE1 MET 95 3HE MET 95 21.071 -18.885 15.069 701 HE2 MET 95 1HE MET 95 21.789 -17.798 13.880 702 HE3 MET 95 2HE MET 95 22.293 -17.714 15.568 703 H SER 96 H SER 96 17.234 -15.250 14.457 704 HA SER 96 HA SER 96 15.451 -14.290 12.343 705 HB2 SER 96 2HB SER 96 13.897 -13.328 13.990 706 HB3 SER 96 3HB SER 96 13.979 -15.083 14.146 707 HG SER 96 HG SER 96 15.553 -14.676 15.856 708 H ALA 97 H ALA 97 15.935 -12.288 11.699 709 HA ALA 97 HA ALA 97 17.327 -10.474 13.525 710 HB1 ALA 97 1HB ALA 97 19.155 -10.084 12.154 711 HB2 ALA 97 2HB ALA 97 18.937 -11.830 12.025 712 HB3 ALA 97 3HB ALA 97 18.366 -10.771 10.735 713 H THR 98 H THR 98 16.842 -8.347 13.231 714 HA THR 98 HA THR 98 14.624 -7.752 11.471 715 HB THR 98 HB THR 98 16.090 -5.918 13.377 716 HG1 THR 98 HG1 THR 98 14.782 -7.926 14.106 717 HG21 THR 98 3HG2 THR 98 14.865 -4.304 12.447 718 HG22 THR 98 1HG2 THR 98 13.424 -5.125 13.046 719 HG23 THR 98 2HG2 THR 98 14.022 -5.466 11.422 720 H ILE 99 H ILE 99 14.836 -6.982 9.483 721 HA ILE 99 HA ILE 99 17.339 -5.598 8.770 722 HB ILE 99 HB ILE 99 16.953 -6.315 6.453 723 HG12 ILE 99 2HG1 ILE 99 15.159 -8.410 6.618 724 HG13 ILE 99 3HG1 ILE 99 14.395 -7.161 7.595 725 HG21 ILE 99 1HG2 ILE 99 16.779 -8.913 7.784 726 HG22 ILE 99 2HG2 ILE 99 18.072 -8.223 6.805 727 HG23 ILE 99 3HG2 ILE 99 17.942 -7.807 8.513 728 HD11 ILE 99 3HD1 ILE 99 14.527 -7.402 4.760 729 HD12 ILE 99 1HD1 ILE 99 13.645 -6.232 5.740 730 HD13 ILE 99 2HD1 ILE 99 15.309 -5.902 5.257 731 H VAL 100 H VAL 100 17.191 -3.536 8.186 732 HA VAL 100 HA VAL 100 14.585 -2.298 7.947 733 HB VAL 100 HB VAL 100 17.288 -0.983 7.679 734 HG11 VAL 100 1HG1 VAL 100 16.208 1.053 7.934 735 HG12 VAL 100 2HG1 VAL 100 15.088 0.149 6.913 736 HG13 VAL 100 3HG1 VAL 100 14.770 0.316 8.640 737 HG21 VAL 100 3HG2 VAL 100 16.007 -2.128 9.994 738 HG22 VAL 100 1HG2 VAL 100 17.608 -1.403 9.840 739 HG23 VAL 100 2HG2 VAL 100 16.209 -0.386 10.185 740 H VAL 101 H VAL 101 13.568 -1.936 6.094 741 HA VAL 101 HA VAL 101 15.053 -2.230 3.583 742 HB VAL 101 HB VAL 101 12.058 -2.090 3.903 743 HG11 VAL 101 1HG1 VAL 101 12.929 -1.664 1.655 744 HG12 VAL 101 2HG1 VAL 101 13.801 -3.197 1.703 745 HG13 VAL 101 3HG1 VAL 101 12.037 -3.184 1.725 746 HG21 VAL 101 3HG2 VAL 101 12.343 -4.008 5.076 747 HG22 VAL 101 1HG2 VAL 101 12.494 -4.697 3.459 748 HG23 VAL 101 2HG2 VAL 101 13.940 -4.317 4.395 749 H GLY 102 H GLY 102 15.261 -0.612 2.126 750 HA2 GLY 102 2HA GLY 102 13.866 1.925 2.712 751 HA3 GLY 102 3HA GLY 102 15.582 1.889 2.333 752 H GLU 103 H GLU 103 12.499 2.257 1.082 753 HA GLU 103 HA GLU 103 12.965 1.241 -1.554 754 HB2 GLU 103 2HB GLU 103 10.838 2.949 -0.300 755 HB3 GLU 103 3HB GLU 103 10.900 2.741 -2.044 756 HG2 GLU 103 2HG GLU 103 9.539 1.137 -0.341 757 HG3 GLU 103 3HG GLU 103 10.086 0.665 -1.949 758 H LEU 104 H LEU 104 13.476 4.273 0.081 759 HA LEU 104 HA LEU 104 14.851 5.286 -2.287 760 HB2 LEU 104 2HB LEU 104 12.971 7.055 -0.754 761 HB3 LEU 104 3HB LEU 104 13.767 7.380 -2.292 762 HG LEU 104 HG LEU 104 12.255 5.212 -2.929 763 HD11 LEU 104 1HD1 LEU 104 11.088 6.445 -0.542 764 HD12 LEU 104 2HD1 LEU 104 10.813 4.855 -1.252 765 HD13 LEU 104 3HD1 LEU 104 9.972 6.264 -1.896 766 HD21 LEU 104 3HD2 LEU 104 10.909 7.845 -3.084 767 HD22 LEU 104 1HD2 LEU 104 11.207 6.645 -4.341 768 HD23 LEU 104 2HD2 LEU 104 12.509 7.713 -3.817 769 H GLU 105 H GLU 105 16.461 6.836 -1.843 770 HA GLU 105 HA GLU 105 17.086 7.210 1.010 771 HB2 GLU 105 2HB GLU 105 18.524 5.604 -0.731 772 HB3 GLU 105 3HB GLU 105 19.433 7.109 -0.718 773 HG2 GLU 105 2HG GLU 105 19.487 6.995 1.757 774 HG3 GLU 105 3HG GLU 105 18.704 5.419 1.662 Start of MODEL 6 1 HA PRO 1 HA PRO 1 1.355 0.818 -1.721 2 HB2 PRO 1 2HB PRO 1 3.816 -0.275 -1.380 3 HB3 PRO 1 3HB PRO 1 3.373 1.313 -0.743 4 HG2 PRO 1 2HG PRO 1 3.489 -1.327 0.663 5 HG3 PRO 1 3HG PRO 1 4.045 0.261 1.220 6 HD2 PRO 1 2HD PRO 1 1.696 -0.821 2.020 7 HD3 PRO 1 3HD PRO 1 1.926 0.929 1.833 8 H LEU 2 H LEU 2 2.685 -0.585 -3.358 9 HA LEU 2 HA LEU 2 2.487 -3.396 -3.265 10 HB2 LEU 2 2HB LEU 2 0.716 -3.755 -4.898 11 HB3 LEU 2 3HB LEU 2 0.103 -2.980 -3.438 12 HG LEU 2 HG LEU 2 0.707 -0.890 -5.205 13 HD11 LEU 2 1HD1 LEU 2 -0.260 -3.314 -6.602 14 HD12 LEU 2 2HD1 LEU 2 0.719 -1.974 -7.196 15 HD13 LEU 2 3HD1 LEU 2 -1.025 -1.781 -7.020 16 HD21 LEU 2 3HD2 LEU 2 -1.130 -0.413 -4.005 17 HD22 LEU 2 1HD2 LEU 2 -1.632 -2.101 -3.908 18 HD23 LEU 2 2HD2 LEU 2 -1.990 -1.157 -5.355 19 H THR 3 H THR 3 3.271 -4.412 -5.184 20 HA THR 3 HA THR 3 4.419 -2.565 -7.168 21 HB THR 3 HB THR 3 6.131 -3.370 -5.492 22 HG1 THR 3 HG1 THR 3 6.943 -2.693 -7.427 23 HG21 THR 3 3HG2 THR 3 6.501 -5.932 -6.799 24 HG22 THR 3 1HG2 THR 3 4.953 -5.843 -5.960 25 HG23 THR 3 2HG2 THR 3 6.452 -5.543 -5.080 26 H ARG 4 H ARG 4 5.169 -3.753 -9.164 27 HA ARG 4 HA ARG 4 3.014 -5.400 -10.106 28 HB2 ARG 4 2HB ARG 4 4.323 -5.395 -12.247 29 HB3 ARG 4 3HB ARG 4 3.911 -3.799 -11.635 30 HG2 ARG 4 2HG ARG 4 6.428 -4.489 -10.553 31 HG3 ARG 4 3HG ARG 4 6.467 -4.861 -12.277 32 HD2 ARG 4 2HD ARG 4 5.724 -2.608 -12.801 33 HD3 ARG 4 3HD ARG 4 5.601 -2.231 -11.083 34 HE ARG 4 HE ARG 4 7.863 -1.898 -11.033 35 HH11 ARG 4 1HH1 ARG 4 7.035 -3.639 -13.932 36 HH12 ARG 4 2HH1 ARG 4 8.627 -3.531 -14.607 37 HH21 ARG 4 2HH2 ARG 4 10.292 -2.457 -13.457 38 HH22 ARG 4 1HH2 ARG 4 9.963 -1.750 -11.911 39 HA PRO 5 HA PRO 5 4.707 -9.405 -9.508 40 HB2 PRO 5 2HB PRO 5 3.794 -10.706 -11.708 41 HB3 PRO 5 3HB PRO 5 2.744 -10.235 -10.366 42 HG2 PRO 5 2HG PRO 5 3.171 -8.882 -13.002 43 HG3 PRO 5 3HG PRO 5 1.657 -9.169 -12.124 44 HD2 PRO 5 2HD PRO 5 2.924 -6.776 -12.098 45 HD3 PRO 5 3HD PRO 5 1.987 -7.375 -10.714 46 H TYR 6 H TYR 6 6.914 -8.456 -9.865 47 HA TYR 6 HA TYR 6 8.089 -9.542 -12.340 48 HB2 TYR 6 2HB TYR 6 8.108 -6.865 -11.459 49 HB3 TYR 6 3HB TYR 6 9.733 -7.479 -11.180 50 HD1 TYR 6 HD1 TYR 6 11.241 -7.758 -12.967 51 HD2 TYR 6 HD2 TYR 6 7.124 -7.058 -13.784 52 HE1 TYR 6 HE1 TYR 6 11.772 -7.447 -15.348 53 HE2 TYR 6 HE2 TYR 6 7.644 -6.747 -16.167 54 HH TYR 6 HH TYR 6 9.235 -6.663 -17.709 55 H LEU 7 H LEU 7 9.718 -10.944 -12.098 56 HA LEU 7 HA LEU 7 10.831 -11.295 -9.393 57 HB2 LEU 7 2HB LEU 7 11.198 -13.638 -9.982 58 HB3 LEU 7 3HB LEU 7 9.496 -13.190 -10.079 59 HG LEU 7 HG LEU 7 10.495 -12.840 -12.665 60 HD11 LEU 7 1HD1 LEU 7 11.681 -14.762 -13.246 61 HD12 LEU 7 2HD1 LEU 7 11.308 -15.567 -11.723 62 HD13 LEU 7 3HD1 LEU 7 12.449 -14.223 -11.752 63 HD21 LEU 7 3HD2 LEU 7 8.260 -13.622 -11.998 64 HD22 LEU 7 1HD2 LEU 7 8.961 -15.166 -11.513 65 HD23 LEU 7 2HD2 LEU 7 9.003 -14.672 -13.205 66 H GLY 8 H GLY 8 12.918 -10.848 -9.162 67 HA2 GLY 8 2HA GLY 8 14.647 -11.012 -11.553 68 HA3 GLY 8 3HA GLY 8 14.779 -9.707 -10.385 69 H PHE 9 H PHE 9 14.216 -13.059 -9.519 70 HA PHE 9 HA PHE 9 17.005 -13.431 -8.774 71 HB2 PHE 9 2HB PHE 9 16.338 -14.123 -6.451 72 HB3 PHE 9 3HB PHE 9 16.169 -12.400 -6.776 73 HD1 PHE 9 HD1 PHE 9 13.912 -11.443 -7.181 74 HD2 PHE 9 HD2 PHE 9 14.478 -15.453 -5.871 75 HE1 PHE 9 HE1 PHE 9 11.561 -11.536 -6.463 76 HE2 PHE 9 HE2 PHE 9 12.127 -15.553 -5.152 77 HZ PHE 9 HZ PHE 9 10.665 -13.593 -5.448 78 H ARG 10 H ARG 10 17.301 -15.683 -7.786 79 HA ARG 10 HA ARG 10 15.546 -17.563 -9.223 80 HB2 ARG 10 2HB ARG 10 18.503 -17.591 -8.696 81 HB3 ARG 10 3HB ARG 10 17.637 -19.083 -9.034 82 HG2 ARG 10 2HG ARG 10 17.121 -16.900 -10.926 83 HG3 ARG 10 3HG ARG 10 18.777 -17.509 -10.912 84 HD2 ARG 10 2HD ARG 10 16.994 -19.726 -10.823 85 HD3 ARG 10 3HD ARG 10 16.485 -18.652 -12.125 86 HE ARG 10 HE ARG 10 19.170 -18.876 -12.476 87 HH11 ARG 10 1HH1 ARG 10 16.558 -21.159 -12.182 88 HH12 ARG 10 2HH1 ARG 10 17.314 -22.352 -13.185 89 HH21 ARG 10 2HH2 ARG 10 19.373 -21.942 -14.104 90 HH22 ARG 10 1HH2 ARG 10 20.176 -20.439 -13.799 91 H VAL 11 H VAL 11 14.875 -19.439 -8.199 92 HA VAL 11 HA VAL 11 15.563 -19.732 -5.357 93 HB VAL 11 HB VAL 11 13.392 -18.544 -5.537 94 HG11 VAL 11 1HG1 VAL 11 12.373 -21.097 -6.775 95 HG12 VAL 11 2HG1 VAL 11 11.447 -19.635 -6.427 96 HG13 VAL 11 3HG1 VAL 11 12.696 -19.614 -7.672 97 HG21 VAL 11 3HG2 VAL 11 12.129 -20.098 -4.058 98 HG22 VAL 11 1HG2 VAL 11 13.329 -21.340 -4.414 99 HG23 VAL 11 2HG2 VAL 11 13.809 -19.864 -3.576 100 H ALA 12 H ALA 12 15.916 -21.778 -4.722 101 HA ALA 12 HA ALA 12 15.133 -23.946 -6.559 102 HB1 ALA 12 1HB ALA 12 17.587 -24.240 -4.909 103 HB2 ALA 12 2HB ALA 12 17.200 -24.912 -6.494 104 HB3 ALA 12 3HB ALA 12 17.661 -23.216 -6.344 105 H VAL 13 H VAL 13 13.828 -25.385 -5.653 106 HA VAL 13 HA VAL 13 13.375 -25.378 -2.805 107 HB VAL 13 HB VAL 13 11.502 -25.641 -4.387 108 HG11 VAL 13 1HG1 VAL 13 13.147 -27.358 -5.730 109 HG12 VAL 13 2HG1 VAL 13 12.029 -28.466 -4.933 110 HG13 VAL 13 3HG1 VAL 13 11.411 -27.199 -5.994 111 HG21 VAL 13 3HG2 VAL 13 10.316 -26.945 -2.960 112 HG22 VAL 13 1HG2 VAL 13 11.517 -28.236 -2.968 113 HG23 VAL 13 2HG2 VAL 13 11.779 -26.794 -1.988 114 H GLY 14 H GLY 14 14.139 -26.776 -1.335 115 HA2 GLY 14 2HA GLY 14 15.152 -29.377 -2.141 116 HA3 GLY 14 3HA GLY 14 16.361 -28.260 -1.526 117 H ARG 15 H ARG 15 16.749 -29.774 0.182 118 HA ARG 15 HA ARG 15 14.786 -29.507 2.354 119 HB2 ARG 15 2HB ARG 15 16.325 -32.028 1.704 120 HB3 ARG 15 3HB ARG 15 15.214 -31.811 3.050 121 HG2 ARG 15 2HG ARG 15 13.969 -31.168 0.518 122 HG3 ARG 15 3HG ARG 15 14.609 -32.813 0.546 123 HD2 ARG 15 2HD ARG 15 12.908 -31.698 2.760 124 HD3 ARG 15 3HD ARG 15 12.218 -32.495 1.347 125 HE ARG 15 HE ARG 15 14.215 -34.105 2.570 126 HH11 ARG 15 1HH1 ARG 15 10.909 -33.062 2.889 127 HH12 ARG 15 2HH1 ARG 15 10.411 -34.474 3.761 128 HH21 ARG 15 2HH2 ARG 15 11.926 -36.126 4.233 129 HH22 ARG 15 1HH2 ARG 15 13.571 -35.969 3.718 130 H ASP 16 H ASP 16 15.622 -29.195 4.381 131 HA ASP 16 HA ASP 16 18.496 -28.636 4.487 132 HB2 ASP 16 2HB ASP 16 17.814 -27.519 6.705 133 HB3 ASP 16 3HB ASP 16 17.301 -26.747 5.206 134 H SER 17 H SER 17 19.202 -28.862 7.014 135 HA SER 17 HA SER 17 19.339 -31.689 7.420 136 HB2 SER 17 2HB SER 17 20.225 -29.860 9.585 137 HB3 SER 17 3HB SER 17 21.055 -31.237 8.859 138 HG SER 17 HG SER 17 21.180 -28.583 8.218 139 H SER 18 H SER 18 17.408 -29.103 8.683 140 HA SER 18 HA SER 18 16.537 -30.444 11.048 141 HB2 SER 18 2HB SER 18 16.125 -28.222 11.337 142 HB3 SER 18 3HB SER 18 15.857 -27.942 9.617 143 HG SER 18 HG SER 18 14.044 -28.222 11.523 144 H GLY 19 H GLY 19 14.698 -29.575 8.110 145 HA2 GLY 19 2HA GLY 19 13.570 -31.408 6.899 146 HA3 GLY 19 3HA GLY 19 13.177 -32.084 8.473 147 H CYS 20 H CYS 20 12.933 -28.761 7.231 148 HA CYS 20 HA CYS 20 10.072 -28.829 7.927 149 HB2 CYS 20 2HB CYS 20 12.189 -26.826 8.365 150 HB3 CYS 20 3HB CYS 20 10.665 -26.171 7.780 151 HG CYS 20 HG CYS 20 11.062 -28.046 10.616 152 H THR 21 H THR 21 12.228 -28.710 5.378 153 HA THR 21 HA THR 21 11.980 -28.403 3.135 154 HB THR 21 HB THR 21 9.090 -27.838 3.177 155 HG1 THR 21 HG1 THR 21 10.187 -30.184 4.344 156 HG21 THR 21 3HG2 THR 21 10.763 -29.966 1.836 157 HG22 THR 21 1HG2 THR 21 10.327 -28.408 1.135 158 HG23 THR 21 2HG2 THR 21 9.074 -29.600 1.482 159 H THR 22 H THR 22 13.027 -26.490 2.839 160 HA THR 22 HA THR 22 11.331 -24.126 2.532 161 HB THR 22 HB THR 22 12.188 -23.628 4.658 162 HG1 THR 22 HG1 THR 22 12.565 -21.897 3.241 163 HG21 THR 22 3HG2 THR 22 13.794 -25.181 5.197 164 HG22 THR 22 1HG2 THR 22 14.806 -23.762 4.932 165 HG23 THR 22 2HG2 THR 22 14.653 -24.984 3.670 166 H LEU 23 H LEU 23 12.287 -22.464 1.190 167 HA LEU 23 HA LEU 23 14.121 -23.614 -0.786 168 HB2 LEU 23 2HB LEU 23 12.006 -21.523 -0.857 169 HB3 LEU 23 3HB LEU 23 13.338 -21.403 -2.003 170 HG LEU 23 HG LEU 23 12.756 -23.492 -3.007 171 HD11 LEU 23 1HD1 LEU 23 12.147 -24.871 -1.214 172 HD12 LEU 23 2HD1 LEU 23 10.673 -24.691 -2.164 173 HD13 LEU 23 3HD1 LEU 23 10.882 -23.765 -0.678 174 HD21 LEU 23 3HD2 LEU 23 10.887 -21.307 -2.795 175 HD22 LEU 23 1HD2 LEU 23 10.049 -22.830 -3.093 176 HD23 LEU 23 2HD2 LEU 23 11.314 -22.290 -4.197 177 H SER 24 H SER 24 15.908 -22.435 -1.571 178 HA SER 24 HA SER 24 16.864 -20.347 0.277 179 HB2 SER 24 2HB SER 24 18.042 -22.756 -0.115 180 HB3 SER 24 3HB SER 24 18.855 -21.805 -1.358 181 HG SER 24 HG SER 24 19.384 -21.854 1.213 182 H ILE 25 H ILE 25 18.087 -18.617 -0.597 183 HA ILE 25 HA ILE 25 17.339 -17.986 -3.353 184 HB ILE 25 HB ILE 25 17.843 -15.694 -2.849 185 HG12 ILE 25 2HG1 ILE 25 18.919 -16.748 -0.226 186 HG13 ILE 25 3HG1 ILE 25 19.842 -15.973 -1.508 187 HG21 ILE 25 1HG2 ILE 25 16.471 -16.598 -0.355 188 HG22 ILE 25 2HG2 ILE 25 16.088 -15.246 -1.419 189 HG23 ILE 25 3HG2 ILE 25 15.728 -16.897 -1.926 190 HD11 ILE 25 3HD1 ILE 25 17.735 -14.676 0.203 191 HD12 ILE 25 1HD1 ILE 25 19.479 -14.444 0.324 192 HD13 ILE 25 2HD1 ILE 25 18.612 -13.891 -1.109 193 H GLN 26 H GLN 26 18.773 -17.764 -4.973 194 HA GLN 26 HA GLN 26 21.549 -18.462 -4.412 195 HB2 GLN 26 2HB GLN 26 19.974 -18.275 -6.980 196 HB3 GLN 26 3HB GLN 26 21.700 -18.610 -6.929 197 HG2 GLN 26 2HG GLN 26 20.779 -20.714 -7.095 198 HG3 GLN 26 3HG GLN 26 21.048 -20.549 -5.361 199 HE21 GLN 26 2HE2 GLN 26 17.265 -20.667 -6.882 200 HE22 GLN 26 1HE2 GLN 26 18.623 -20.330 -7.895 201 H GLU 27 H GLU 27 19.603 -15.763 -5.355 202 HA GLU 27 HA GLU 27 22.042 -14.133 -5.590 203 HB2 GLU 27 2HB GLU 27 20.288 -14.639 -7.668 204 HB3 GLU 27 3HB GLU 27 19.751 -13.079 -7.062 205 HG2 GLU 27 2HG GLU 27 21.298 -12.275 -8.461 206 HG3 GLU 27 3HG GLU 27 22.415 -12.673 -7.157 207 H VAL 28 H VAL 28 20.952 -11.650 -5.737 208 HA VAL 28 HA VAL 28 19.518 -11.422 -3.172 209 HB VAL 28 HB VAL 28 20.482 -9.051 -3.178 210 HG11 VAL 28 1HG1 VAL 28 21.585 -10.113 -1.552 211 HG12 VAL 28 2HG1 VAL 28 21.725 -11.595 -2.500 212 HG13 VAL 28 3HG1 VAL 28 22.895 -10.294 -2.720 213 HG21 VAL 28 3HG2 VAL 28 21.304 -9.704 -5.698 214 HG22 VAL 28 1HG2 VAL 28 21.965 -8.391 -4.725 215 HG23 VAL 28 2HG2 VAL 28 22.774 -9.957 -4.758 216 H THR 29 H THR 29 17.605 -10.414 -3.122 217 HA THR 29 HA THR 29 16.746 -8.961 -5.539 218 HB THR 29 HB THR 29 15.518 -11.040 -5.410 219 HG1 THR 29 HG1 THR 29 14.421 -8.879 -5.798 220 HG21 THR 29 3HG2 THR 29 14.971 -12.002 -3.477 221 HG22 THR 29 1HG2 THR 29 13.971 -10.619 -3.034 222 HG23 THR 29 2HG2 THR 29 15.686 -10.634 -2.624 223 H GLN 30 H GLN 30 17.676 -8.488 -2.482 224 HA GLN 30 HA GLN 30 15.576 -6.642 -1.686 225 HB2 GLN 30 2HB GLN 30 18.196 -7.098 -0.271 226 HB3 GLN 30 3HB GLN 30 16.696 -6.473 0.400 227 HG2 GLN 30 2HG GLN 30 16.553 -8.577 1.195 228 HG3 GLN 30 3HG GLN 30 15.818 -8.857 -0.383 229 HE21 GLN 30 2HE2 GLN 30 18.080 -11.561 -0.403 230 HE22 GLN 30 1HE2 GLN 30 16.468 -11.076 -0.014 231 H THR 31 H THR 31 17.758 -6.377 -3.941 232 HA THR 31 HA THR 31 18.632 -3.664 -3.194 233 HB THR 31 HB THR 31 20.212 -4.094 -5.266 234 HG1 THR 31 HG1 THR 31 20.013 -6.739 -4.274 235 HG21 THR 31 3HG2 THR 31 21.898 -4.323 -3.761 236 HG22 THR 31 1HG2 THR 31 21.097 -5.638 -2.900 237 HG23 THR 31 2HG2 THR 31 20.605 -3.968 -2.615 238 H TYR 32 H TYR 32 16.080 -4.754 -4.519 239 HA TYR 32 HA TYR 32 16.155 -2.961 -6.857 240 HB2 TYR 32 2HB TYR 32 15.203 -5.722 -6.588 241 HB3 TYR 32 3HB TYR 32 14.035 -4.644 -7.343 242 HD1 TYR 32 HD1 TYR 32 17.740 -5.155 -7.537 243 HD2 TYR 32 HD2 TYR 32 14.069 -4.703 -9.640 244 HE1 TYR 32 HE1 TYR 32 18.946 -5.355 -9.672 245 HE2 TYR 32 HE2 TYR 32 15.264 -4.903 -11.781 246 HH TYR 32 HH TYR 32 17.439 -4.677 -12.702 247 H THR 33 H THR 33 14.370 -1.643 -7.223 248 HA THR 33 HA THR 33 12.138 -1.702 -5.368 249 HB THR 33 HB THR 33 13.773 0.826 -5.587 250 HG1 THR 33 HG1 THR 33 15.066 -0.357 -4.327 251 HG21 THR 33 3HG2 THR 33 12.419 1.419 -3.554 252 HG22 THR 33 1HG2 THR 33 11.453 -0.025 -3.857 253 HG23 THR 33 2HG2 THR 33 11.490 1.278 -5.046 254 H GLY 34 H GLY 34 10.368 -0.362 -6.020 255 HA2 GLY 34 2HA GLY 34 10.547 1.101 -8.509 256 HA3 GLY 34 3HA GLY 34 9.643 -0.402 -8.623 257 H SER 35 H SER 35 8.520 -0.278 -5.979 258 HA SER 35 HA SER 35 6.538 1.842 -6.453 259 HB2 SER 35 2HB SER 35 5.162 0.384 -4.808 260 HB3 SER 35 3HB SER 35 5.396 -0.207 -6.453 261 HG SER 35 HG SER 35 5.885 -1.577 -4.395 262 H ASN 36 H ASN 36 5.781 3.114 -4.728 263 HA ASN 36 HA ASN 36 6.047 4.448 -2.904 264 HB2 ASN 36 2HB ASN 36 5.785 1.913 -1.979 265 HB3 ASN 36 3HB ASN 36 7.345 2.343 -1.283 266 HD21 ASN 36 2HD2 ASN 36 4.561 3.256 1.022 267 HD22 ASN 36 1HD2 ASN 36 5.011 1.810 0.191 268 H GLY 37 H GLY 37 8.253 4.242 -4.818 269 HA2 GLY 37 2HA GLY 37 10.134 5.871 -3.585 270 HA3 GLY 37 3HA GLY 37 10.740 4.227 -3.450 271 H GLY 38 H GLY 38 10.693 2.973 -5.583 272 HA2 GLY 38 2HA GLY 38 11.215 2.805 -7.831 273 HA3 GLY 38 3HA GLY 38 10.882 4.523 -7.998 274 H ALA 39 H ALA 39 13.304 2.202 -6.873 275 HA ALA 39 HA ALA 39 15.443 3.478 -8.149 276 HB1 ALA 39 1HB ALA 39 14.800 4.494 -5.470 277 HB2 ALA 39 2HB ALA 39 16.492 4.062 -5.720 278 HB3 ALA 39 3HB ALA 39 15.716 5.239 -6.780 279 H ASP 40 H ASP 40 15.962 1.367 -8.678 280 HA ASP 40 HA ASP 40 16.431 -0.595 -6.608 281 HB2 ASP 40 2HB ASP 40 17.002 -2.101 -8.449 282 HB3 ASP 40 3HB ASP 40 15.483 -1.271 -8.776 283 H LEU 41 H LEU 41 18.254 -0.712 -5.494 284 HA LEU 41 HA LEU 41 20.816 -0.590 -6.749 285 HB2 LEU 41 2HB LEU 41 19.844 1.857 -6.111 286 HB3 LEU 41 3HB LEU 41 20.679 1.434 -4.618 287 HG LEU 41 HG LEU 41 22.560 0.852 -6.524 288 HD11 LEU 41 1HD1 LEU 41 21.034 1.912 -8.213 289 HD12 LEU 41 2HD1 LEU 41 22.648 2.616 -8.108 290 HD13 LEU 41 3HD1 LEU 41 21.277 3.440 -7.366 291 HD21 LEU 41 3HD2 LEU 41 22.617 2.177 -4.311 292 HD22 LEU 41 1HD2 LEU 41 22.338 3.590 -5.330 293 HD23 LEU 41 2HD2 LEU 41 23.772 2.594 -5.578 294 H MET 42 H MET 42 22.425 -0.098 -4.569 295 HA MET 42 HA MET 42 21.625 -2.252 -2.726 296 HB2 MET 42 2HB MET 42 23.558 -2.876 -4.047 297 HB3 MET 42 3HB MET 42 24.381 -1.385 -3.611 298 HG2 MET 42 2HG MET 42 23.522 -3.083 -1.365 299 HG3 MET 42 3HG MET 42 24.794 -3.739 -2.393 300 HE1 MET 42 3HE MET 42 27.723 -1.352 -2.001 301 HE2 MET 42 1HE MET 42 27.378 -3.082 -1.981 302 HE3 MET 42 2HE MET 42 26.712 -2.065 -3.259 303 H GLY 43 H GLY 43 21.167 -1.624 -0.727 304 HA2 GLY 43 2HA GLY 43 22.826 0.246 0.686 305 HA3 GLY 43 3HA GLY 43 21.254 0.919 0.278 306 HA PRO 44 HA PRO 44 19.348 -1.008 3.718 307 HB2 PRO 44 2HB PRO 44 17.068 -2.091 2.717 308 HB3 PRO 44 3HB PRO 44 17.305 -0.349 2.900 309 HG2 PRO 44 2HG PRO 44 17.587 -2.053 0.455 310 HG3 PRO 44 3HG PRO 44 16.831 -0.458 0.626 311 HD2 PRO 44 2HD PRO 44 19.325 -0.789 -0.375 312 HD3 PRO 44 3HD PRO 44 18.853 0.647 0.557 313 H ALA 45 H ALA 45 20.030 -3.013 0.967 314 HA ALA 45 HA ALA 45 19.422 -5.508 2.253 315 HB1 ALA 45 1HB ALA 45 21.154 -5.123 -0.176 316 HB2 ALA 45 2HB ALA 45 20.232 -6.552 0.290 317 HB3 ALA 45 3HB ALA 45 19.391 -5.094 -0.236 318 H PHE 46 H PHE 46 22.410 -3.759 1.443 319 HA PHE 46 HA PHE 46 24.129 -5.685 2.645 320 HB2 PHE 46 2HB PHE 46 24.718 -3.938 0.855 321 HB3 PHE 46 3HB PHE 46 24.834 -2.792 2.186 322 HD1 PHE 46 HD1 PHE 46 26.354 -5.676 0.556 323 HD2 PHE 46 HD2 PHE 46 26.612 -2.968 3.829 324 HE1 PHE 46 HE1 PHE 46 28.669 -6.400 0.967 325 HE2 PHE 46 HE2 PHE 46 28.928 -3.686 4.245 326 HZ PHE 46 HZ PHE 46 29.960 -5.404 2.813 327 H ALA 47 H ALA 47 22.235 -3.096 3.856 328 HA ALA 47 HA ALA 47 23.761 -2.574 6.216 329 HB1 ALA 47 1HB ALA 47 20.901 -1.941 5.508 330 HB2 ALA 47 2HB ALA 47 21.714 -1.381 6.970 331 HB3 ALA 47 3HB ALA 47 22.295 -0.867 5.386 332 H ALA 48 H ALA 48 21.179 -4.777 5.355 333 HA ALA 48 HA ALA 48 20.872 -5.654 8.121 334 HB1 ALA 48 1HB ALA 48 19.079 -5.419 6.069 335 HB2 ALA 48 2HB ALA 48 19.419 -7.150 6.076 336 HB3 ALA 48 3HB ALA 48 18.831 -6.361 7.539 337 H GLY 49 H GLY 49 22.473 -6.570 5.205 338 HA2 GLY 49 2HA GLY 49 24.281 -8.120 5.219 339 HA3 GLY 49 3HA GLY 49 23.525 -8.943 6.576 340 H LEU 50 H LEU 50 21.398 -8.088 4.050 341 HA LEU 50 HA LEU 50 20.734 -10.788 3.511 342 HB2 LEU 50 2HB LEU 50 20.041 -8.337 1.901 343 HB3 LEU 50 3HB LEU 50 19.227 -9.899 1.837 344 HG LEU 50 HG LEU 50 19.297 -8.448 4.436 345 HD11 LEU 50 1HD1 LEU 50 18.368 -7.200 2.095 346 HD12 LEU 50 2HD1 LEU 50 18.124 -6.692 3.766 347 HD13 LEU 50 3HD1 LEU 50 16.940 -7.737 2.980 348 HD21 LEU 50 3HD2 LEU 50 18.098 -10.298 4.839 349 HD22 LEU 50 1HD2 LEU 50 17.785 -10.587 3.127 350 HD23 LEU 50 2HD2 LEU 50 16.791 -9.437 4.023 351 H ARG 51 H ARG 51 21.985 -12.145 2.418 352 HA ARG 51 HA ARG 51 23.072 -11.293 -0.159 353 HB2 ARG 51 2HB ARG 51 24.654 -12.251 2.186 354 HB3 ARG 51 3HB ARG 51 25.164 -12.738 0.575 355 HG2 ARG 51 2HG ARG 51 24.637 -9.941 0.552 356 HG3 ARG 51 3HG ARG 51 25.684 -10.315 1.923 357 HD2 ARG 51 2HD ARG 51 26.387 -11.656 -0.598 358 HD3 ARG 51 3HD ARG 51 26.557 -9.901 -0.610 359 HE ARG 51 HE ARG 51 27.742 -11.060 1.705 360 HH11 ARG 51 1HH1 ARG 51 28.234 -10.487 -1.693 361 HH12 ARG 51 2HH1 ARG 51 29.963 -10.501 -1.578 362 HH21 ARG 51 2HH2 ARG 51 30.976 -10.841 0.448 363 HH22 ARG 51 1HH2 ARG 51 30.017 -11.081 1.869 364 H VAL 52 H VAL 52 24.022 -13.265 -1.337 365 HA VAL 52 HA VAL 52 22.023 -15.150 -1.741 366 HB VAL 52 HB VAL 52 23.582 -16.382 -3.098 367 HG11 VAL 52 1HG1 VAL 52 24.450 -13.534 -3.430 368 HG12 VAL 52 2HG1 VAL 52 24.095 -14.742 -4.667 369 HG13 VAL 52 3HG1 VAL 52 22.782 -14.016 -3.739 370 HG21 VAL 52 3HG2 VAL 52 25.588 -16.702 -2.117 371 HG22 VAL 52 1HG2 VAL 52 26.031 -15.246 -3.008 372 HG23 VAL 52 2HG2 VAL 52 25.562 -15.134 -1.311 373 H GLY 53 H GLY 53 21.498 -17.060 -0.846 374 HA2 GLY 53 2HA GLY 53 22.101 -19.136 0.215 375 HA3 GLY 53 3HA GLY 53 23.403 -18.288 1.036 376 H ASP 54 H ASP 54 20.729 -16.332 1.078 377 HA ASP 54 HA ASP 54 20.116 -17.147 3.829 378 HB2 ASP 54 2HB ASP 54 20.268 -14.582 2.421 379 HB3 ASP 54 3HB ASP 54 18.829 -14.744 3.424 380 H GLN 55 H GLN 55 18.392 -18.396 4.069 381 HA GLN 55 HA GLN 55 16.337 -18.558 2.070 382 HB2 GLN 55 2HB GLN 55 16.398 -19.800 4.824 383 HB3 GLN 55 3HB GLN 55 15.354 -20.266 3.487 384 HG2 GLN 55 2HG GLN 55 17.313 -20.973 2.208 385 HG3 GLN 55 3HG GLN 55 18.353 -20.516 3.555 386 HE21 GLN 55 2HE2 GLN 55 16.463 -24.066 3.498 387 HE22 GLN 55 1HE2 GLN 55 16.328 -22.909 2.222 388 H LEU 56 H LEU 56 14.362 -17.648 2.061 389 HA LEU 56 HA LEU 56 13.535 -16.128 4.442 390 HB2 LEU 56 2HB LEU 56 12.392 -14.719 2.439 391 HB3 LEU 56 3HB LEU 56 13.927 -14.307 3.201 392 HG LEU 56 HG LEU 56 15.076 -15.562 1.361 393 HD11 LEU 56 1HD1 LEU 56 13.502 -15.665 -0.737 394 HD12 LEU 56 2HD1 LEU 56 12.248 -15.865 0.486 395 HD13 LEU 56 3HD1 LEU 56 13.587 -17.010 0.401 396 HD21 LEU 56 3HD2 LEU 56 13.752 -13.625 -0.260 397 HD22 LEU 56 1HD2 LEU 56 15.346 -13.541 0.490 398 HD23 LEU 56 2HD2 LEU 56 13.926 -12.982 1.374 399 H VAL 57 H VAL 57 11.726 -16.956 5.232 400 HA VAL 57 HA VAL 57 9.741 -18.059 3.349 401 HB VAL 57 HB VAL 57 8.979 -19.527 5.190 402 HG11 VAL 57 1HG1 VAL 57 11.765 -20.334 5.127 403 HG12 VAL 57 2HG1 VAL 57 10.346 -21.114 4.425 404 HG13 VAL 57 3HG1 VAL 57 11.179 -19.834 3.541 405 HG21 VAL 57 3HG2 VAL 57 9.550 -18.882 7.256 406 HG22 VAL 57 1HG2 VAL 57 11.094 -19.672 6.932 407 HG23 VAL 57 2HG2 VAL 57 10.921 -17.935 6.678 408 H ARG 58 H ARG 58 10.275 -16.178 6.271 409 HA ARG 58 HA ARG 58 8.940 -14.773 7.469 410 HB2 ARG 58 2HB ARG 58 9.053 -13.663 5.193 411 HB3 ARG 58 3HB ARG 58 7.473 -14.361 4.865 412 HG2 ARG 58 2HG ARG 58 6.686 -12.439 5.685 413 HG3 ARG 58 3HG ARG 58 7.043 -13.148 7.261 414 HD2 ARG 58 2HD ARG 58 7.944 -10.881 7.065 415 HD3 ARG 58 3HD ARG 58 9.225 -12.075 7.269 416 HE ARG 58 HE ARG 58 9.071 -11.813 4.589 417 HH11 ARG 58 1HH1 ARG 58 9.358 -9.513 7.187 418 HH12 ARG 58 2HH1 ARG 58 10.241 -8.360 6.242 419 HH21 ARG 58 2HH2 ARG 58 10.737 -8.809 4.051 420 HH22 ARG 58 1HH2 ARG 58 10.233 -10.302 3.335 421 H PHE 59 H PHE 59 8.122 -17.578 7.280 422 HA PHE 59 HA PHE 59 5.310 -17.213 8.036 423 HB2 PHE 59 2HB PHE 59 5.319 -18.146 5.769 424 HB3 PHE 59 3HB PHE 59 6.364 -19.459 6.304 425 HD1 PHE 59 HD1 PHE 59 5.493 -21.325 7.513 426 HD2 PHE 59 HD2 PHE 59 2.979 -18.050 6.477 427 HE1 PHE 59 HE1 PHE 59 3.513 -22.666 8.091 428 HE2 PHE 59 HE2 PHE 59 0.995 -19.385 7.054 429 HZ PHE 59 HZ PHE 59 1.260 -21.696 7.863 430 H ALA 60 H ALA 60 4.547 -18.624 9.635 431 HA ALA 60 HA ALA 60 6.519 -19.503 11.496 432 HB1 ALA 60 1HB ALA 60 3.613 -19.223 11.432 433 HB2 ALA 60 2HB ALA 60 4.173 -20.600 12.382 434 HB3 ALA 60 3HB ALA 60 4.749 -18.976 12.758 435 H GLY 61 H GLY 61 7.720 -21.252 11.075 436 HA2 GLY 61 2HA GLY 61 7.365 -23.768 11.355 437 HA3 GLY 61 3HA GLY 61 6.391 -23.608 9.901 438 H TYR 62 H TYR 62 8.791 -21.418 9.554 439 HA TYR 62 HA TYR 62 10.671 -21.307 8.280 440 HB2 TYR 62 2HB TYR 62 11.254 -24.169 9.003 441 HB3 TYR 62 3HB TYR 62 12.391 -22.860 8.697 442 HD1 TYR 62 HD1 TYR 62 11.764 -24.888 11.162 443 HD2 TYR 62 HD2 TYR 62 11.287 -20.726 10.418 444 HE1 TYR 62 HE1 TYR 62 11.897 -24.448 13.578 445 HE2 TYR 62 HE2 TYR 62 11.420 -20.274 12.832 446 HH TYR 62 HH TYR 62 11.161 -21.350 14.923 447 H THR 63 H THR 63 8.279 -22.014 6.983 448 HA THR 63 HA THR 63 9.359 -23.564 4.732 449 HB THR 63 HB THR 63 7.905 -25.124 5.805 450 HG1 THR 63 HG1 THR 63 7.527 -25.265 3.654 451 HG21 THR 63 3HG2 THR 63 5.353 -23.910 5.700 452 HG22 THR 63 1HG2 THR 63 6.430 -22.783 6.525 453 HG23 THR 63 2HG2 THR 63 6.251 -24.432 7.126 454 H VAL 64 H VAL 64 8.572 -22.986 2.680 455 HA VAL 64 HA VAL 64 6.726 -20.744 2.477 456 HB VAL 64 HB VAL 64 9.077 -19.813 2.719 457 HG11 VAL 64 1HG1 VAL 64 10.720 -20.306 1.271 458 HG12 VAL 64 2HG1 VAL 64 9.755 -21.743 0.926 459 HG13 VAL 64 3HG1 VAL 64 9.630 -20.324 -0.114 460 HG21 VAL 64 3HG2 VAL 64 7.121 -18.627 1.693 461 HG22 VAL 64 1HG2 VAL 64 8.699 -18.086 1.119 462 HG23 VAL 64 2HG2 VAL 64 7.712 -19.149 0.116 463 H THR 65 H THR 65 6.054 -20.321 0.258 464 HA THR 65 HA THR 65 5.702 -22.766 -1.199 465 HB THR 65 HB THR 65 4.868 -19.944 -1.897 466 HG1 THR 65 HG1 THR 65 3.131 -20.362 -0.740 467 HG21 THR 65 3HG2 THR 65 3.219 -21.898 -3.116 468 HG22 THR 65 1HG2 THR 65 4.892 -22.318 -3.481 469 HG23 THR 65 2HG2 THR 65 4.272 -20.720 -3.898 470 H GLU 66 H GLU 66 6.688 -19.605 -2.503 471 HA GLU 66 HA GLU 66 9.171 -20.493 -3.525 472 HB2 GLU 66 2HB GLU 66 8.658 -20.606 -5.896 473 HB3 GLU 66 3HB GLU 66 7.707 -21.797 -5.020 474 HG2 GLU 66 2HG GLU 66 5.754 -20.823 -5.545 475 HG3 GLU 66 3HG GLU 66 6.407 -19.192 -5.405 476 H LEU 67 H LEU 67 9.535 -18.899 -5.695 477 HA LEU 67 HA LEU 67 9.994 -16.391 -4.626 478 HB2 LEU 67 2HB LEU 67 10.470 -15.648 -6.847 479 HB3 LEU 67 3HB LEU 67 11.043 -17.305 -6.671 480 HG LEU 67 HG LEU 67 8.679 -17.839 -7.756 481 HD11 LEU 67 1HD1 LEU 67 8.733 -15.047 -7.890 482 HD12 LEU 67 2HD1 LEU 67 7.608 -16.140 -8.697 483 HD13 LEU 67 3HD1 LEU 67 9.071 -15.610 -9.527 484 HD21 LEU 67 3HD2 LEU 67 10.422 -18.718 -8.919 485 HD22 LEU 67 1HD2 LEU 67 11.333 -17.208 -8.917 486 HD23 LEU 67 2HD2 LEU 67 9.985 -17.422 -10.034 487 H ALA 68 H ALA 68 7.173 -17.601 -6.339 488 HA ALA 68 HA ALA 68 5.853 -15.187 -6.816 489 HB1 ALA 68 1HB ALA 68 4.914 -17.000 -7.898 490 HB2 ALA 68 2HB ALA 68 4.927 -18.006 -6.449 491 HB3 ALA 68 3HB ALA 68 3.753 -16.699 -6.605 492 H ALA 69 H ALA 69 5.936 -17.233 -3.942 493 HA ALA 69 HA ALA 69 3.942 -15.826 -2.498 494 HB1 ALA 69 1HB ALA 69 4.291 -17.930 -1.646 495 HB2 ALA 69 2HB ALA 69 6.045 -17.818 -1.793 496 HB3 ALA 69 3HB ALA 69 5.211 -16.949 -0.505 497 H PHE 70 H PHE 70 7.416 -15.453 -2.834 498 HA PHE 70 HA PHE 70 7.725 -13.589 -0.701 499 HB2 PHE 70 2HB PHE 70 9.642 -14.846 -1.469 500 HB3 PHE 70 3HB PHE 70 9.467 -14.197 -3.096 501 HD1 PHE 70 HD1 PHE 70 10.250 -12.007 -3.651 502 HD2 PHE 70 HD2 PHE 70 10.483 -13.446 0.347 503 HE1 PHE 70 HE1 PHE 70 11.760 -10.151 -3.075 504 HE2 PHE 70 HE2 PHE 70 11.993 -11.593 0.930 505 HZ PHE 70 HZ PHE 70 12.633 -9.942 -0.781 506 H ASN 71 H ASN 71 6.962 -13.335 -4.106 507 HA ASN 71 HA ASN 71 7.460 -10.609 -4.492 508 HB2 ASN 71 2HB ASN 71 6.993 -12.180 -6.332 509 HB3 ASN 71 3HB ASN 71 5.325 -12.322 -5.783 510 HD21 ASN 71 2HD2 ASN 71 6.280 -9.503 -8.360 511 HD22 ASN 71 1HD2 ASN 71 7.217 -10.912 -8.008 512 H THR 72 H THR 72 4.680 -12.291 -3.147 513 HA THR 72 HA THR 72 2.987 -9.998 -3.034 514 HB THR 72 HB THR 72 2.145 -11.787 -1.037 515 HG1 THR 72 HG1 THR 72 2.920 -13.218 -3.374 516 HG21 THR 72 3HG2 THR 72 0.617 -12.496 -3.107 517 HG22 THR 72 1HG2 THR 72 1.336 -11.040 -3.792 518 HG23 THR 72 2HG2 THR 72 0.430 -10.949 -2.282 519 H VAL 73 H VAL 73 5.200 -11.560 -0.773 520 HA VAL 73 HA VAL 73 4.495 -9.961 1.474 521 HB VAL 73 HB VAL 73 7.000 -11.556 0.920 522 HG11 VAL 73 1HG1 VAL 73 6.104 -9.997 3.309 523 HG12 VAL 73 2HG1 VAL 73 7.093 -11.444 3.514 524 HG13 VAL 73 3HG1 VAL 73 7.700 -10.087 2.564 525 HG21 VAL 73 3HG2 VAL 73 5.382 -13.166 1.087 526 HG22 VAL 73 1HG2 VAL 73 5.783 -12.962 2.793 527 HG23 VAL 73 2HG2 VAL 73 4.351 -12.180 2.123 528 H VAL 74 H VAL 74 7.230 -9.858 -0.804 529 HA VAL 74 HA VAL 74 8.466 -7.581 0.293 530 HB VAL 74 HB VAL 74 9.651 -9.068 -1.234 531 HG11 VAL 74 1HG1 VAL 74 9.048 -9.520 -3.382 532 HG12 VAL 74 2HG1 VAL 74 7.447 -9.188 -2.716 533 HG13 VAL 74 3HG1 VAL 74 8.303 -7.940 -3.623 534 HG21 VAL 74 3HG2 VAL 74 9.927 -6.394 -1.091 535 HG22 VAL 74 1HG2 VAL 74 10.985 -7.435 -2.044 536 HG23 VAL 74 2HG2 VAL 74 9.653 -6.581 -2.823 537 H ALA 75 H ALA 75 6.014 -7.958 -2.220 538 HA ALA 75 HA ALA 75 5.956 -5.313 -3.140 539 HB1 ALA 75 1HB ALA 75 3.737 -7.351 -3.023 540 HB2 ALA 75 2HB ALA 75 3.682 -5.846 -3.943 541 HB3 ALA 75 3HB ALA 75 4.863 -7.090 -4.355 542 H ARG 76 H ARG 76 4.171 -6.887 -0.512 543 HA ARG 76 HA ARG 76 2.738 -4.488 0.169 544 HB2 ARG 76 2HB ARG 76 2.882 -7.272 1.212 545 HB3 ARG 76 3HB ARG 76 2.325 -6.020 2.314 546 HG2 ARG 76 2HG ARG 76 0.495 -7.180 1.135 547 HG3 ARG 76 3HG ARG 76 0.525 -5.440 0.838 548 HD2 ARG 76 2HD ARG 76 1.623 -5.814 -1.305 549 HD3 ARG 76 3HD ARG 76 1.647 -7.550 -1.003 550 HE ARG 76 HE ARG 76 -0.513 -7.643 -1.720 551 HH11 ARG 76 1HH1 ARG 76 0.201 -4.369 -0.777 552 HH12 ARG 76 2HH1 ARG 76 -1.326 -3.745 -1.308 553 HH21 ARG 76 2HH2 ARG 76 -2.877 -5.148 -2.243 554 HH22 ARG 76 1HH2 ARG 76 -2.527 -6.834 -2.423 555 H HIS 77 H HIS 77 5.709 -6.016 1.111 556 HA HIS 77 HA HIS 77 6.029 -4.548 3.556 557 HB2 HIS 77 2HB HIS 77 7.118 -6.690 3.358 558 HB3 HIS 77 3HB HIS 77 7.968 -6.175 1.904 559 HD1 HIS 77 HD1 HIS 77 7.741 -4.123 5.062 560 HD2 HIS 77 HD2 HIS 77 10.522 -6.333 2.908 561 HE1 HIS 77 HE1 HIS 77 9.960 -3.652 6.148 562 H VAL 78 H VAL 78 6.808 -4.048 0.210 563 HA VAL 78 HA VAL 78 8.873 -2.223 0.320 564 HB VAL 78 HB VAL 78 6.532 -2.441 -1.554 565 HG11 VAL 78 1HG1 VAL 78 8.023 -0.862 -2.999 566 HG12 VAL 78 2HG1 VAL 78 6.917 -0.181 -1.805 567 HG13 VAL 78 3HG1 VAL 78 8.635 -0.325 -1.435 568 HG21 VAL 78 3HG2 VAL 78 9.099 -2.703 -2.765 569 HG22 VAL 78 1HG2 VAL 78 9.045 -3.714 -1.321 570 HG23 VAL 78 2HG2 VAL 78 7.832 -3.917 -2.585 571 H ARG 79 H ARG 79 8.926 -0.647 1.821 572 HA ARG 79 HA ARG 79 7.051 1.541 1.547 573 HB2 ARG 79 2HB ARG 79 6.826 -0.379 3.695 574 HB3 ARG 79 3HB ARG 79 7.190 1.219 4.331 575 HG2 ARG 79 2HG ARG 79 5.243 1.793 2.523 576 HG3 ARG 79 3HG ARG 79 4.748 0.195 3.087 577 HD2 ARG 79 2HD ARG 79 5.263 2.648 4.762 578 HD3 ARG 79 3HD ARG 79 3.712 1.858 4.475 579 HE ARG 79 HE ARG 79 5.537 0.043 5.644 580 HH11 ARG 79 1HH1 ARG 79 3.565 2.810 6.402 581 HH12 ARG 79 2HH1 ARG 79 3.375 2.381 8.070 582 HH21 ARG 79 2HH2 ARG 79 4.360 0.480 8.886 583 HH22 ARG 79 1HH2 ARG 79 5.295 -0.532 7.838 584 HA PRO 80 HA PRO 80 10.591 3.950 2.508 585 HB2 PRO 80 2HB PRO 80 9.461 6.125 3.675 586 HB3 PRO 80 3HB PRO 80 9.346 5.796 1.942 587 HG2 PRO 80 2HG PRO 80 7.345 5.272 4.107 588 HG3 PRO 80 3HG PRO 80 7.087 5.930 2.480 589 HD2 PRO 80 2HD PRO 80 6.582 3.344 3.102 590 HD3 PRO 80 3HD PRO 80 7.137 3.848 1.493 591 H SER 81 H SER 81 12.028 3.483 4.041 592 HA SER 81 HA SER 81 12.967 3.015 6.064 593 HB2 SER 81 2HB SER 81 12.720 4.672 7.708 594 HB3 SER 81 3HB SER 81 12.308 5.517 6.216 595 HG SER 81 HG SER 81 10.835 5.766 8.085 596 H ALA 82 H ALA 82 10.914 1.257 5.310 597 HA ALA 82 HA ALA 82 9.457 0.720 7.799 598 HB1 ALA 82 1HB ALA 82 7.875 0.573 6.166 599 HB2 ALA 82 2HB ALA 82 9.021 0.012 4.948 600 HB3 ALA 82 3HB ALA 82 8.429 -1.102 6.180 601 H SER 83 H SER 83 10.605 -0.473 9.183 602 HA SER 83 HA SER 83 12.108 -2.775 8.120 603 HB2 SER 83 2HB SER 83 12.744 -1.817 10.846 604 HB3 SER 83 3HB SER 83 13.821 -2.362 9.560 605 HG SER 83 HG SER 83 12.730 0.185 10.014 606 H ILE 84 H ILE 84 11.706 -4.769 8.918 607 HA ILE 84 HA ILE 84 10.165 -5.107 11.354 608 HB ILE 84 HB ILE 84 8.561 -6.673 10.144 609 HG12 ILE 84 2HG1 ILE 84 9.510 -5.053 7.770 610 HG13 ILE 84 3HG1 ILE 84 9.791 -6.773 8.015 611 HG21 ILE 84 1HG2 ILE 84 8.289 -3.749 9.472 612 HG22 ILE 84 2HG2 ILE 84 6.994 -4.920 9.712 613 HG23 ILE 84 3HG2 ILE 84 7.998 -4.425 11.074 614 HD11 ILE 84 3HD1 ILE 84 8.015 -6.693 6.526 615 HD12 ILE 84 1HD1 ILE 84 7.241 -6.977 8.085 616 HD13 ILE 84 2HD1 ILE 84 7.234 -5.361 7.379 617 HA PRO 85 HA PRO 85 12.551 -8.773 11.726 618 HB2 PRO 85 2HB PRO 85 10.865 -10.364 13.139 619 HB3 PRO 85 3HB PRO 85 11.695 -8.974 13.849 620 HG2 PRO 85 2HG PRO 85 8.886 -9.189 12.838 621 HG3 PRO 85 3HG PRO 85 9.488 -8.407 14.311 622 HD2 PRO 85 2HD PRO 85 8.865 -7.015 12.074 623 HD3 PRO 85 3HD PRO 85 10.157 -6.512 13.183 624 H VAL 86 H VAL 86 12.874 -10.792 10.821 625 HA VAL 86 HA VAL 86 10.680 -12.010 9.314 626 HB VAL 86 HB VAL 86 11.974 -10.508 7.773 627 HG11 VAL 86 1HG1 VAL 86 14.183 -10.821 8.765 628 HG12 VAL 86 2HG1 VAL 86 14.176 -12.513 8.262 629 HG13 VAL 86 3HG1 VAL 86 14.193 -11.231 7.050 630 HG21 VAL 86 3HG2 VAL 86 10.966 -13.050 7.369 631 HG22 VAL 86 1HG2 VAL 86 11.386 -11.881 6.116 632 HG23 VAL 86 2HG2 VAL 86 12.556 -13.104 6.609 633 H VAL 87 H VAL 87 10.921 -14.228 8.920 634 HA VAL 87 HA VAL 87 12.845 -15.536 10.694 635 HB VAL 87 HB VAL 87 10.603 -16.263 11.060 636 HG11 VAL 87 1HG1 VAL 87 9.125 -16.074 9.409 637 HG12 VAL 87 2HG1 VAL 87 10.403 -16.007 8.193 638 HG13 VAL 87 3HG1 VAL 87 9.781 -17.566 8.737 639 HG21 VAL 87 3HG2 VAL 87 11.035 -18.480 11.147 640 HG22 VAL 87 1HG2 VAL 87 11.462 -18.572 9.438 641 HG23 VAL 87 2HG2 VAL 87 12.635 -17.970 10.609 642 H PHE 88 H PHE 88 14.715 -16.104 9.806 643 HA PHE 88 HA PHE 88 14.692 -17.171 7.059 644 HB2 PHE 88 2HB PHE 88 16.868 -16.255 6.690 645 HB3 PHE 88 3HB PHE 88 15.881 -14.966 7.372 646 HD1 PHE 88 HD1 PHE 88 16.271 -14.158 9.626 647 HD2 PHE 88 HD2 PHE 88 18.694 -17.218 7.926 648 HE1 PHE 88 HE1 PHE 88 17.942 -13.816 11.400 649 HE2 PHE 88 HE2 PHE 88 20.367 -16.881 9.698 650 HZ PHE 88 HZ PHE 88 19.992 -15.180 11.438 651 H SER 89 H SER 89 16.300 -18.813 6.586 652 HA SER 89 HA SER 89 17.268 -20.272 8.944 653 HB2 SER 89 2HB SER 89 15.243 -21.144 7.041 654 HB3 SER 89 3HB SER 89 16.598 -22.268 7.126 655 HG SER 89 HG SER 89 15.348 -22.923 8.755 656 H ARG 90 H ARG 90 19.216 -21.288 8.707 657 HA ARG 90 HA ARG 90 20.537 -20.993 6.088 658 HB2 ARG 90 2HB ARG 90 21.380 -20.190 8.785 659 HB3 ARG 90 3HB ARG 90 22.601 -21.082 7.889 660 HG2 ARG 90 2HG ARG 90 21.948 -19.382 5.981 661 HG3 ARG 90 3HG ARG 90 21.433 -18.406 7.359 662 HD2 ARG 90 2HD ARG 90 24.147 -19.688 7.233 663 HD3 ARG 90 3HD ARG 90 23.829 -18.103 6.530 664 HE ARG 90 HE ARG 90 24.076 -18.744 9.320 665 HH11 ARG 90 1HH1 ARG 90 22.730 -16.520 7.004 666 HH12 ARG 90 2HH1 ARG 90 22.634 -15.204 8.128 667 HH21 ARG 90 2HH2 ARG 90 23.331 -15.490 10.291 668 HH22 ARG 90 1HH2 ARG 90 23.954 -17.020 10.808 669 H ASP 91 H ASP 91 20.057 -23.091 5.424 670 HA ASP 91 HA ASP 91 20.426 -25.318 5.148 671 HB2 ASP 91 2HB ASP 91 22.696 -25.233 7.103 672 HB3 ASP 91 3HB ASP 91 22.552 -26.143 5.601 673 H GLY 92 H GLY 92 18.565 -24.516 7.113 674 HA2 GLY 92 2HA GLY 92 17.225 -26.013 8.409 675 HA3 GLY 92 3HA GLY 92 18.687 -26.877 8.861 676 H VAL 93 H VAL 93 19.849 -24.008 9.244 677 HA VAL 93 HA VAL 93 19.555 -23.957 12.057 678 HB VAL 93 HB VAL 93 20.628 -21.841 10.188 679 HG11 VAL 93 1HG1 VAL 93 20.233 -20.603 12.080 680 HG12 VAL 93 2HG1 VAL 93 20.438 -21.984 13.159 681 HG13 VAL 93 3HG1 VAL 93 21.848 -21.220 12.425 682 HG21 VAL 93 3HG2 VAL 93 22.340 -23.505 11.960 683 HG22 VAL 93 1HG2 VAL 93 21.689 -24.242 10.496 684 HG23 VAL 93 2HG2 VAL 93 22.695 -22.798 10.384 685 H VAL 94 H VAL 94 18.447 -22.547 13.400 686 HA VAL 94 HA VAL 94 16.259 -21.052 12.111 687 HB VAL 94 HB VAL 94 16.309 -22.302 14.862 688 HG11 VAL 94 1HG1 VAL 94 13.969 -21.639 15.006 689 HG12 VAL 94 2HG1 VAL 94 15.006 -20.228 14.790 690 HG13 VAL 94 3HG1 VAL 94 14.080 -20.860 13.428 691 HG21 VAL 94 3HG2 VAL 94 14.935 -23.092 12.301 692 HG22 VAL 94 1HG2 VAL 94 16.093 -24.029 13.245 693 HG23 VAL 94 2HG2 VAL 94 14.477 -23.724 13.882 694 H MET 95 H MET 95 16.631 -18.937 12.134 695 HA MET 95 HA MET 95 17.263 -17.612 14.622 696 HB2 MET 95 2HB MET 95 19.500 -18.133 13.791 697 HB3 MET 95 3HB MET 95 19.118 -17.386 12.245 698 HG2 MET 95 2HG MET 95 20.431 -15.850 13.483 699 HG3 MET 95 3HG MET 95 18.781 -15.234 13.449 700 HE1 MET 95 3HE MET 95 21.272 -16.717 16.903 701 HE2 MET 95 1HE MET 95 21.626 -16.690 15.175 702 HE3 MET 95 2HE MET 95 21.632 -15.188 16.099 703 H SER 96 H SER 96 16.662 -15.450 14.649 704 HA SER 96 HA SER 96 15.266 -14.510 12.228 705 HB2 SER 96 2HB SER 96 13.672 -13.370 13.674 706 HB3 SER 96 3HB SER 96 13.742 -15.078 14.107 707 HG SER 96 HG SER 96 14.228 -12.941 15.641 708 H ALA 97 H ALA 97 15.665 -12.484 11.502 709 HA ALA 97 HA ALA 97 17.257 -10.666 13.154 710 HB1 ALA 97 1HB ALA 97 18.751 -10.197 11.214 711 HB2 ALA 97 2HB ALA 97 18.937 -11.813 11.896 712 HB3 ALA 97 3HB ALA 97 18.040 -11.588 10.395 713 H THR 98 H THR 98 16.843 -8.527 12.816 714 HA THR 98 HA THR 98 14.501 -7.901 11.236 715 HB THR 98 HB THR 98 16.138 -5.864 12.721 716 HG1 THR 98 HG1 THR 98 14.224 -7.666 13.831 717 HG21 THR 98 3HG2 THR 98 13.940 -5.556 11.216 718 HG22 THR 98 1HG2 THR 98 14.279 -4.560 12.631 719 HG23 THR 98 2HG2 THR 98 13.178 -5.932 12.760 720 H ILE 99 H ILE 99 14.476 -6.969 9.290 721 HA ILE 99 HA ILE 99 17.019 -5.921 8.230 722 HB ILE 99 HB ILE 99 14.756 -7.309 6.800 723 HG12 ILE 99 2HG1 ILE 99 16.824 -8.676 6.007 724 HG13 ILE 99 3HG1 ILE 99 17.634 -7.945 7.388 725 HG21 ILE 99 1HG2 ILE 99 16.103 -6.928 4.733 726 HG22 ILE 99 2HG2 ILE 99 15.380 -5.470 5.410 727 HG23 ILE 99 3HG2 ILE 99 17.096 -5.798 5.654 728 HD11 ILE 99 3HD1 ILE 99 16.723 -9.417 8.758 729 HD12 ILE 99 1HD1 ILE 99 15.102 -9.012 8.194 730 HD13 ILE 99 2HD1 ILE 99 16.047 -10.241 7.353 731 H VAL 100 H VAL 100 17.079 -3.840 7.703 732 HA VAL 100 HA VAL 100 14.588 -2.311 7.716 733 HB VAL 100 HB VAL 100 16.108 -0.318 7.716 734 HG11 VAL 100 1HG1 VAL 100 17.154 -1.214 10.078 735 HG12 VAL 100 2HG1 VAL 100 15.524 -0.571 9.865 736 HG13 VAL 100 3HG1 VAL 100 15.798 -2.313 9.830 737 HG21 VAL 100 3HG2 VAL 100 18.039 -2.263 7.042 738 HG22 VAL 100 1HG2 VAL 100 18.273 -0.531 7.278 739 HG23 VAL 100 2HG2 VAL 100 18.466 -1.640 8.635 740 H VAL 101 H VAL 101 13.609 -1.928 5.850 741 HA VAL 101 HA VAL 101 15.187 -1.906 3.377 742 HB VAL 101 HB VAL 101 12.195 -2.100 3.757 743 HG11 VAL 101 1HG1 VAL 101 12.260 -2.741 1.317 744 HG12 VAL 101 2HG1 VAL 101 12.579 -1.042 1.672 745 HG13 VAL 101 3HG1 VAL 101 13.914 -2.129 1.287 746 HG21 VAL 101 3HG2 VAL 101 13.022 -4.158 4.449 747 HG22 VAL 101 1HG2 VAL 101 12.698 -4.423 2.736 748 HG23 VAL 101 2HG2 VAL 101 14.348 -4.129 3.287 749 H GLY 102 H GLY 102 15.392 -0.128 2.131 750 HA2 GLY 102 2HA GLY 102 13.855 2.266 2.929 751 HA3 GLY 102 3HA GLY 102 15.571 2.340 2.558 752 H GLU 103 H GLU 103 12.475 2.698 1.333 753 HA GLU 103 HA GLU 103 13.078 2.030 -1.406 754 HB2 GLU 103 2HB GLU 103 10.721 3.146 0.050 755 HB3 GLU 103 3HB GLU 103 10.820 3.373 -1.690 756 HG2 GLU 103 2HG GLU 103 9.530 1.357 -0.843 757 HG3 GLU 103 3HG GLU 103 10.717 1.083 -2.118 758 H LEU 104 H LEU 104 13.233 4.831 0.629 759 HA LEU 104 HA LEU 104 14.161 6.408 -1.676 760 HB2 LEU 104 2HB LEU 104 12.388 7.285 0.591 761 HB3 LEU 104 3HB LEU 104 13.231 8.416 -0.466 762 HG LEU 104 HG LEU 104 11.019 8.294 -1.267 763 HD11 LEU 104 1HD1 LEU 104 13.117 7.722 -2.859 764 HD12 LEU 104 2HD1 LEU 104 11.469 7.943 -3.444 765 HD13 LEU 104 3HD1 LEU 104 12.095 6.318 -3.165 766 HD21 LEU 104 3HD2 LEU 104 9.689 6.446 -1.348 767 HD22 LEU 104 1HD2 LEU 104 10.761 5.965 -0.033 768 HD23 LEU 104 2HD2 LEU 104 11.036 5.351 -1.663 769 H GLU 105 H GLU 105 16.155 5.278 -0.652 770 HA GLU 105 HA GLU 105 18.130 5.469 0.462 771 HB2 GLU 105 2HB GLU 105 17.571 7.936 -0.553 772 HB3 GLU 105 3HB GLU 105 17.763 8.310 1.154 773 HG2 GLU 105 2HG GLU 105 19.964 7.121 1.074 774 HG3 GLU 105 3HG GLU 105 19.771 7.026 -0.675 Start of MODEL 7 1 HA PRO 1 HA PRO 1 1.785 1.360 -2.029 2 HB2 PRO 1 2HB PRO 1 4.077 -0.073 -1.773 3 HB3 PRO 1 3HB PRO 1 3.851 1.518 -1.037 4 HG2 PRO 1 2HG PRO 1 3.608 -1.195 0.204 5 HG3 PRO 1 3HG PRO 1 4.373 0.267 0.853 6 HD2 PRO 1 2HD PRO 1 1.898 -0.536 1.602 7 HD3 PRO 1 3HD PRO 1 2.363 1.176 1.521 8 H LEU 2 H LEU 2 3.147 -0.266 -3.605 9 HA LEU 2 HA LEU 2 2.134 -2.948 -3.666 10 HB2 LEU 2 2HB LEU 2 0.953 -2.700 -5.825 11 HB3 LEU 2 3HB LEU 2 0.161 -1.876 -4.484 12 HG LEU 2 HG LEU 2 1.940 -0.103 -5.930 13 HD11 LEU 2 1HD1 LEU 2 0.124 -1.828 -7.477 14 HD12 LEU 2 2HD1 LEU 2 1.562 -0.943 -7.984 15 HD13 LEU 2 3HD1 LEU 2 0.022 -0.100 -7.818 16 HD21 LEU 2 3HD2 LEU 2 -0.962 -0.145 -5.152 17 HD22 LEU 2 1HD2 LEU 2 -0.256 1.168 -6.094 18 HD23 LEU 2 2HD2 LEU 2 0.346 0.824 -4.472 19 H THR 3 H THR 3 3.066 -4.219 -5.352 20 HA THR 3 HA THR 3 5.274 -2.913 -6.796 21 HB THR 3 HB THR 3 6.085 -4.179 -4.776 22 HG1 THR 3 HG1 THR 3 7.714 -5.309 -6.052 23 HG21 THR 3 3HG2 THR 3 4.304 -6.098 -5.555 24 HG22 THR 3 1HG2 THR 3 5.644 -6.360 -4.440 25 HG23 THR 3 2HG2 THR 3 5.827 -6.758 -6.148 26 H ARG 4 H ARG 4 5.951 -3.975 -8.737 27 HA ARG 4 HA ARG 4 3.744 -5.311 -10.077 28 HB2 ARG 4 2HB ARG 4 6.084 -3.737 -10.890 29 HB3 ARG 4 3HB ARG 4 5.754 -5.112 -11.935 30 HG2 ARG 4 2HG ARG 4 4.219 -3.903 -12.969 31 HG3 ARG 4 3HG ARG 4 3.281 -3.869 -11.474 32 HD2 ARG 4 2HD ARG 4 4.504 -1.867 -10.763 33 HD3 ARG 4 3HD ARG 4 5.426 -1.901 -12.266 34 HE ARG 4 HE ARG 4 2.665 -1.848 -12.836 35 HH11 ARG 4 1HH1 ARG 4 5.231 0.177 -11.641 36 HH12 ARG 4 2HH1 ARG 4 4.506 1.649 -12.198 37 HH21 ARG 4 2HH2 ARG 4 2.496 1.594 -13.296 38 HH22 ARG 4 1HH2 ARG 4 1.699 0.082 -13.574 39 HA PRO 5 HA PRO 5 5.373 -9.384 -10.064 40 HB2 PRO 5 2HB PRO 5 4.798 -10.254 -12.570 41 HB3 PRO 5 3HB PRO 5 3.562 -10.012 -11.330 42 HG2 PRO 5 2HG PRO 5 4.354 -8.217 -13.592 43 HG3 PRO 5 3HG PRO 5 2.732 -8.629 -13.006 44 HD2 PRO 5 2HD PRO 5 3.963 -6.303 -12.370 45 HD3 PRO 5 3HD PRO 5 2.841 -7.122 -11.265 46 H TYR 6 H TYR 6 7.601 -8.430 -9.925 47 HA TYR 6 HA TYR 6 9.129 -9.066 -12.363 48 HB2 TYR 6 2HB TYR 6 9.125 -6.660 -10.734 49 HB3 TYR 6 3HB TYR 6 10.735 -7.361 -10.853 50 HD1 TYR 6 HD1 TYR 6 8.228 -5.411 -12.505 51 HD2 TYR 6 HD2 TYR 6 11.658 -7.837 -13.182 52 HE1 TYR 6 HE1 TYR 6 8.493 -4.406 -14.734 53 HE2 TYR 6 HE2 TYR 6 11.932 -6.838 -15.412 54 HH TYR 6 HH TYR 6 11.282 -5.127 -16.756 55 H LEU 7 H LEU 7 10.689 -10.546 -12.159 56 HA LEU 7 HA LEU 7 11.418 -11.407 -9.437 57 HB2 LEU 7 2HB LEU 7 10.701 -12.879 -11.872 58 HB3 LEU 7 3HB LEU 7 12.120 -13.499 -11.030 59 HG LEU 7 HG LEU 7 9.985 -14.628 -10.423 60 HD11 LEU 7 1HD1 LEU 7 11.129 -15.125 -8.593 61 HD12 LEU 7 2HD1 LEU 7 10.505 -13.664 -7.828 62 HD13 LEU 7 3HD1 LEU 7 12.031 -13.613 -8.710 63 HD21 LEU 7 3HD2 LEU 7 8.181 -13.536 -9.675 64 HD22 LEU 7 1HD2 LEU 7 8.939 -12.101 -10.368 65 HD23 LEU 7 2HD2 LEU 7 9.138 -12.462 -8.653 66 H GLY 8 H GLY 8 13.455 -11.064 -8.854 67 HA2 GLY 8 2HA GLY 8 15.502 -10.896 -10.978 68 HA3 GLY 8 3HA GLY 8 15.466 -9.772 -9.628 69 H PHE 9 H PHE 9 14.687 -13.123 -9.146 70 HA PHE 9 HA PHE 9 17.371 -13.811 -8.297 71 HB2 PHE 9 2HB PHE 9 16.729 -14.368 -6.004 72 HB3 PHE 9 3HB PHE 9 16.455 -12.658 -6.322 73 HD1 PHE 9 HD1 PHE 9 15.044 -15.655 -5.092 74 HD2 PHE 9 HD2 PHE 9 14.055 -11.990 -7.017 75 HE1 PHE 9 HE1 PHE 9 12.712 -15.898 -4.348 76 HE2 PHE 9 HE2 PHE 9 11.721 -12.227 -6.275 77 HZ PHE 9 HZ PHE 9 11.047 -14.182 -4.938 78 H ARG 10 H ARG 10 17.406 -16.104 -7.406 79 HA ARG 10 HA ARG 10 15.446 -17.728 -8.891 80 HB2 ARG 10 2HB ARG 10 18.390 -17.992 -8.489 81 HB3 ARG 10 3HB ARG 10 17.437 -19.463 -8.626 82 HG2 ARG 10 2HG ARG 10 16.476 -18.304 -10.756 83 HG3 ARG 10 3HG ARG 10 17.954 -17.345 -10.656 84 HD2 ARG 10 2HD ARG 10 18.223 -20.284 -10.391 85 HD3 ARG 10 3HD ARG 10 17.813 -19.655 -11.987 86 HE ARG 10 HE ARG 10 20.006 -18.253 -10.831 87 HH11 ARG 10 1HH1 ARG 10 19.126 -21.192 -12.476 88 HH12 ARG 10 2HH1 ARG 10 20.703 -21.441 -13.148 89 HH21 ARG 10 2HH2 ARG 10 22.386 -19.951 -12.711 90 HH22 ARG 10 1HH2 ARG 10 22.086 -18.571 -11.710 91 H VAL 11 H VAL 11 14.649 -19.621 -7.940 92 HA VAL 11 HA VAL 11 15.251 -20.014 -5.091 93 HB VAL 11 HB VAL 11 12.774 -20.482 -4.757 94 HG11 VAL 11 1HG1 VAL 11 13.020 -18.561 -3.666 95 HG12 VAL 11 2HG1 VAL 11 14.221 -17.991 -4.827 96 HG13 VAL 11 3HG1 VAL 11 12.503 -17.730 -5.133 97 HG21 VAL 11 3HG2 VAL 11 12.617 -18.982 -7.369 98 HG22 VAL 11 1HG2 VAL 11 12.093 -20.638 -7.067 99 HG23 VAL 11 2HG2 VAL 11 11.249 -19.293 -6.301 100 H ALA 12 H ALA 12 15.734 -22.060 -4.669 101 HA ALA 12 HA ALA 12 14.722 -24.145 -6.492 102 HB1 ALA 12 1HB ALA 12 17.401 -23.625 -5.405 103 HB2 ALA 12 2HB ALA 12 16.883 -25.310 -5.344 104 HB3 ALA 12 3HB ALA 12 16.914 -24.452 -6.885 105 H VAL 13 H VAL 13 13.340 -25.523 -5.607 106 HA VAL 13 HA VAL 13 12.917 -25.572 -2.757 107 HB VAL 13 HB VAL 13 10.980 -25.692 -4.194 108 HG11 VAL 13 1HG1 VAL 13 10.950 -26.847 -6.089 109 HG12 VAL 13 2HG1 VAL 13 12.589 -27.403 -5.743 110 HG13 VAL 13 3HG1 VAL 13 11.203 -28.357 -5.214 111 HG21 VAL 13 3HG2 VAL 13 11.468 -28.314 -2.782 112 HG22 VAL 13 1HG2 VAL 13 10.832 -26.838 -2.056 113 HG23 VAL 13 2HG2 VAL 13 9.892 -27.696 -3.277 114 H GLY 14 H GLY 14 13.796 -26.941 -1.349 115 HA2 GLY 14 2HA GLY 14 14.474 -29.649 -2.104 116 HA3 GLY 14 3HA GLY 14 15.865 -28.631 -1.763 117 H ARG 15 H ARG 15 16.473 -29.861 0.029 118 HA ARG 15 HA ARG 15 14.796 -29.407 2.401 119 HB2 ARG 15 2HB ARG 15 16.309 -31.965 1.850 120 HB3 ARG 15 3HB ARG 15 15.280 -31.627 3.235 121 HG2 ARG 15 2HG ARG 15 13.812 -31.231 0.804 122 HG3 ARG 15 3HG ARG 15 14.558 -32.830 0.817 123 HD2 ARG 15 2HD ARG 15 13.629 -32.977 3.227 124 HD3 ARG 15 3HD ARG 15 12.582 -31.648 2.731 125 HE ARG 15 HE ARG 15 12.434 -33.698 0.818 126 HH11 ARG 15 1HH1 ARG 15 11.505 -33.022 4.104 127 HH12 ARG 15 2HH1 ARG 15 10.131 -34.076 4.071 128 HH21 ARG 15 2HH2 ARG 15 9.633 -35.252 2.169 129 HH22 ARG 15 1HH2 ARG 15 10.627 -35.089 0.761 130 H ASP 16 H ASP 16 15.882 -28.945 4.284 131 HA ASP 16 HA ASP 16 18.730 -28.334 3.964 132 HB2 ASP 16 2HB ASP 16 18.308 -27.069 6.175 133 HB3 ASP 16 3HB ASP 16 17.608 -26.413 4.698 134 H SER 17 H SER 17 19.765 -28.353 6.387 135 HA SER 17 HA SER 17 20.259 -31.055 6.933 136 HB2 SER 17 2HB SER 17 21.708 -29.012 7.499 137 HB3 SER 17 3HB SER 17 20.699 -28.844 8.936 138 HG SER 17 HG SER 17 22.790 -30.310 8.766 139 H SER 18 H SER 18 17.845 -28.877 8.134 140 HA SER 18 HA SER 18 17.126 -30.607 10.354 141 HB2 SER 18 2HB SER 18 16.618 -28.535 11.114 142 HB3 SER 18 3HB SER 18 16.472 -27.870 9.487 143 HG SER 18 HG SER 18 14.470 -27.905 10.620 144 H GLY 19 H GLY 19 15.256 -29.194 7.657 145 HA2 GLY 19 2HA GLY 19 14.124 -30.700 6.091 146 HA3 GLY 19 3HA GLY 19 13.833 -31.775 7.450 147 H CYS 20 H CYS 20 13.275 -28.328 6.710 148 HA CYS 20 HA CYS 20 10.550 -28.659 7.780 149 HB2 CYS 20 2HB CYS 20 12.591 -26.679 8.277 150 HB3 CYS 20 3HB CYS 20 11.143 -25.913 7.635 151 HG CYS 20 HG CYS 20 10.375 -28.105 9.994 152 H THR 21 H THR 21 11.927 -28.801 4.960 153 HA THR 21 HA THR 21 11.354 -28.350 2.802 154 HB THR 21 HB THR 21 8.612 -27.652 3.852 155 HG1 THR 21 HG1 THR 21 9.962 -30.098 3.755 156 HG21 THR 21 3HG2 THR 21 7.861 -27.955 1.734 157 HG22 THR 21 1HG2 THR 21 9.029 -29.228 1.386 158 HG23 THR 21 2HG2 THR 21 9.523 -27.536 1.322 159 H THR 22 H THR 22 12.765 -26.469 2.899 160 HA THR 22 HA THR 22 11.243 -23.977 2.540 161 HB THR 22 HB THR 22 12.241 -23.632 4.651 162 HG1 THR 22 HG1 THR 22 13.650 -21.939 4.194 163 HG21 THR 22 3HG2 THR 22 14.541 -25.106 3.467 164 HG22 THR 22 1HG2 THR 22 13.795 -25.269 5.056 165 HG23 THR 22 2HG2 THR 22 14.872 -23.913 4.723 166 H LEU 23 H LEU 23 12.313 -22.383 1.188 167 HA LEU 23 HA LEU 23 13.951 -23.674 -0.875 168 HB2 LEU 23 2HB LEU 23 12.106 -21.318 -0.861 169 HB3 LEU 23 3HB LEU 23 13.324 -21.489 -2.124 170 HG LEU 23 HG LEU 23 12.317 -23.675 -2.730 171 HD11 LEU 23 1HD1 LEU 23 10.065 -24.188 -1.875 172 HD12 LEU 23 2HD1 LEU 23 10.223 -22.867 -0.718 173 HD13 LEU 23 3HD1 LEU 23 11.301 -24.260 -0.619 174 HD21 LEU 23 3HD2 LEU 23 10.067 -22.572 -3.500 175 HD22 LEU 23 1HD2 LEU 23 11.609 -22.027 -4.161 176 HD23 LEU 23 2HD2 LEU 23 10.821 -21.101 -2.883 177 H SER 24 H SER 24 15.813 -22.666 -1.704 178 HA SER 24 HA SER 24 17.013 -20.682 0.115 179 HB2 SER 24 2HB SER 24 19.157 -21.773 -1.161 180 HB3 SER 24 3HB SER 24 18.537 -22.340 0.390 181 HG SER 24 HG SER 24 18.830 -23.835 -1.607 182 H ILE 25 H ILE 25 17.759 -18.817 -0.708 183 HA ILE 25 HA ILE 25 17.272 -18.289 -3.524 184 HB ILE 25 HB ILE 25 18.278 -16.345 -1.451 185 HG12 ILE 25 2HG1 ILE 25 16.170 -17.348 -0.686 186 HG13 ILE 25 3HG1 ILE 25 15.939 -15.664 -1.145 187 HG21 ILE 25 1HG2 ILE 25 17.493 -14.647 -2.937 188 HG22 ILE 25 2HG2 ILE 25 18.502 -15.754 -3.865 189 HG23 ILE 25 3HG2 ILE 25 16.746 -15.844 -3.995 190 HD11 ILE 25 3HD1 ILE 25 14.125 -17.171 -1.886 191 HD12 ILE 25 1HD1 ILE 25 14.913 -16.309 -3.208 192 HD13 ILE 25 2HD1 ILE 25 15.289 -18.007 -2.914 193 H GLN 26 H GLN 26 18.794 -18.091 -5.048 194 HA GLN 26 HA GLN 26 21.579 -18.486 -4.255 195 HB2 GLN 26 2HB GLN 26 20.160 -18.709 -6.908 196 HB3 GLN 26 3HB GLN 26 21.907 -18.831 -6.744 197 HG2 GLN 26 2HG GLN 26 21.732 -20.973 -6.245 198 HG3 GLN 26 3HG GLN 26 20.711 -20.586 -4.860 199 HE21 GLN 26 2HE2 GLN 26 17.660 -21.154 -6.622 200 HE22 GLN 26 1HE2 GLN 26 18.387 -20.108 -5.455 201 H GLU 27 H GLU 27 19.455 -16.081 -5.520 202 HA GLU 27 HA GLU 27 21.757 -14.315 -6.038 203 HB2 GLU 27 2HB GLU 27 18.981 -13.902 -7.133 204 HB3 GLU 27 3HB GLU 27 20.477 -13.139 -7.652 205 HG2 GLU 27 2HG GLU 27 19.821 -16.059 -7.975 206 HG3 GLU 27 3HG GLU 27 19.665 -14.834 -9.233 207 H VAL 28 H VAL 28 20.515 -11.888 -6.062 208 HA VAL 28 HA VAL 28 19.543 -11.635 -3.290 209 HB VAL 28 HB VAL 28 20.860 -9.406 -4.817 210 HG11 VAL 28 1HG1 VAL 28 20.853 -8.271 -2.862 211 HG12 VAL 28 2HG1 VAL 28 19.506 -9.351 -2.498 212 HG13 VAL 28 3HG1 VAL 28 21.122 -9.720 -1.894 213 HG21 VAL 28 3HG2 VAL 28 22.974 -10.007 -3.695 214 HG22 VAL 28 1HG2 VAL 28 22.219 -11.492 -3.114 215 HG23 VAL 28 2HG2 VAL 28 22.446 -11.236 -4.844 216 H THR 29 H THR 29 17.639 -10.664 -2.935 217 HA THR 29 HA THR 29 16.320 -9.348 -5.221 218 HB THR 29 HB THR 29 15.169 -11.411 -4.800 219 HG1 THR 29 HG1 THR 29 13.100 -10.519 -4.082 220 HG21 THR 29 3HG2 THR 29 14.071 -11.179 -2.243 221 HG22 THR 29 1HG2 THR 29 15.781 -10.799 -2.044 222 HG23 THR 29 2HG2 THR 29 15.297 -12.331 -2.771 223 H GLN 30 H GLN 30 17.489 -8.987 -2.083 224 HA GLN 30 HA GLN 30 15.613 -6.935 -1.274 225 HB2 GLN 30 2HB GLN 30 18.060 -8.160 -0.039 226 HB3 GLN 30 3HB GLN 30 17.371 -6.682 0.620 227 HG2 GLN 30 2HG GLN 30 16.434 -8.388 1.897 228 HG3 GLN 30 3HG GLN 30 15.172 -7.957 0.744 229 HE21 GLN 30 2HE2 GLN 30 17.220 -11.430 0.018 230 HE22 GLN 30 1HE2 GLN 30 18.055 -10.016 0.553 231 H THR 31 H THR 31 17.924 -6.948 -3.512 232 HA THR 31 HA THR 31 18.884 -4.235 -2.879 233 HB THR 31 HB THR 31 20.564 -4.837 -4.804 234 HG1 THR 31 HG1 THR 31 20.184 -6.822 -5.468 235 HG21 THR 31 3HG2 THR 31 21.200 -6.366 -2.350 236 HG22 THR 31 1HG2 THR 31 20.794 -4.663 -2.137 237 HG23 THR 31 2HG2 THR 31 22.134 -5.126 -3.186 238 H TYR 32 H TYR 32 16.354 -5.280 -4.276 239 HA TYR 32 HA TYR 32 16.644 -3.647 -6.712 240 HB2 TYR 32 2HB TYR 32 15.964 -6.339 -6.581 241 HB3 TYR 32 3HB TYR 32 14.418 -5.523 -6.779 242 HD1 TYR 32 HD1 TYR 32 13.996 -4.138 -8.784 243 HD2 TYR 32 HD2 TYR 32 17.562 -6.420 -8.361 244 HE1 TYR 32 HE1 TYR 32 14.421 -3.910 -11.195 245 HE2 TYR 32 HE2 TYR 32 17.997 -6.197 -10.772 246 HH TYR 32 HH TYR 32 16.462 -3.985 -12.720 247 H THR 33 H THR 33 14.961 -2.258 -7.250 248 HA THR 33 HA THR 33 12.567 -2.111 -5.667 249 HB THR 33 HB THR 33 14.351 0.307 -5.500 250 HG1 THR 33 HG1 THR 33 14.051 -1.561 -3.389 251 HG21 THR 33 3HG2 THR 33 12.140 0.891 -5.011 252 HG22 THR 33 1HG2 THR 33 12.856 0.611 -3.424 253 HG23 THR 33 2HG2 THR 33 11.831 -0.622 -4.159 254 H GLY 34 H GLY 34 11.122 -0.371 -6.390 255 HA2 GLY 34 2HA GLY 34 11.652 1.325 -8.550 256 HA3 GLY 34 3HA GLY 34 11.042 -0.188 -9.203 257 H SER 35 H SER 35 9.368 -0.595 -6.762 258 HA SER 35 HA SER 35 7.187 1.201 -7.568 259 HB2 SER 35 2HB SER 35 6.770 -1.254 -5.896 260 HB3 SER 35 3HB SER 35 5.667 -0.479 -7.032 261 HG SER 35 HG SER 35 7.966 -2.024 -7.630 262 H ASN 36 H ASN 36 6.343 2.631 -6.184 263 HA ASN 36 HA ASN 36 6.161 3.957 -4.341 264 HB2 ASN 36 2HB ASN 36 6.004 1.176 -3.215 265 HB3 ASN 36 3HB ASN 36 5.931 2.575 -2.147 266 HD21 ASN 36 2HD2 ASN 36 2.828 1.665 -4.620 267 HD22 ASN 36 1HD2 ASN 36 4.387 0.952 -4.839 268 H GLY 37 H GLY 37 8.865 3.326 -5.291 269 HA2 GLY 37 2HA GLY 37 10.304 4.394 -3.038 270 HA3 GLY 37 3HA GLY 37 10.763 2.743 -3.427 271 H GLY 38 H GLY 38 11.234 2.407 -5.850 272 HA2 GLY 38 2HA GLY 38 12.448 2.953 -7.729 273 HA3 GLY 38 3HA GLY 38 12.157 4.645 -7.358 274 H ALA 39 H ALA 39 14.204 1.873 -6.592 275 HA ALA 39 HA ALA 39 16.593 3.314 -6.673 276 HB1 ALA 39 1HB ALA 39 16.169 4.491 -4.734 277 HB2 ALA 39 2HB ALA 39 15.318 3.145 -3.976 278 HB3 ALA 39 3HB ALA 39 17.074 3.106 -4.125 279 H ASP 40 H ASP 40 16.702 1.253 -7.889 280 HA ASP 40 HA ASP 40 16.984 -1.176 -6.343 281 HB2 ASP 40 2HB ASP 40 17.443 -2.243 -8.511 282 HB3 ASP 40 3HB ASP 40 15.972 -1.276 -8.570 283 H LEU 41 H LEU 41 18.777 -1.507 -5.211 284 HA LEU 41 HA LEU 41 21.312 -1.725 -6.372 285 HB2 LEU 41 2HB LEU 41 20.724 0.897 -6.047 286 HB3 LEU 41 3HB LEU 41 21.486 0.540 -4.498 287 HG LEU 41 HG LEU 41 23.205 -0.549 -6.402 288 HD11 LEU 41 1HD1 LEU 41 23.622 1.684 -7.688 289 HD12 LEU 41 2HD1 LEU 41 21.907 1.952 -7.380 290 HD13 LEU 41 3HD1 LEU 41 22.429 0.527 -8.278 291 HD21 LEU 41 3HD2 LEU 41 23.517 0.815 -4.198 292 HD22 LEU 41 1HD2 LEU 41 23.610 2.194 -5.294 293 HD23 LEU 41 2HD2 LEU 41 24.757 0.863 -5.452 294 H MET 42 H MET 42 23.005 -1.258 -4.271 295 HA MET 42 HA MET 42 21.890 -2.998 -2.171 296 HB2 MET 42 2HB MET 42 23.774 -3.902 -3.619 297 HB3 MET 42 3HB MET 42 24.813 -2.707 -2.856 298 HG2 MET 42 2HG MET 42 23.904 -3.783 -0.648 299 HG3 MET 42 3HG MET 42 23.568 -5.151 -1.707 300 HE1 MET 42 3HE MET 42 24.925 -6.916 -1.852 301 HE2 MET 42 1HE MET 42 25.814 -6.332 -3.259 302 HE3 MET 42 2HE MET 42 26.687 -6.993 -1.877 303 H GLY 43 H GLY 43 21.658 -2.111 -0.229 304 HA2 GLY 43 2HA GLY 43 23.628 -0.353 0.892 305 HA3 GLY 43 3HA GLY 43 22.154 0.494 0.449 306 HA PRO 44 HA PRO 44 20.240 -0.644 4.219 307 HB2 PRO 44 2HB PRO 44 17.691 -1.207 3.472 308 HB3 PRO 44 3HB PRO 44 18.346 0.435 3.493 309 HG2 PRO 44 2HG PRO 44 18.005 -1.439 1.183 310 HG3 PRO 44 3HG PRO 44 17.664 0.299 1.274 311 HD2 PRO 44 2HD PRO 44 19.914 -0.687 0.134 312 HD3 PRO 44 3HD PRO 44 19.876 0.876 0.974 313 H ALA 45 H ALA 45 20.100 -2.924 1.586 314 HA ALA 45 HA ALA 45 19.118 -5.107 3.186 315 HB1 ALA 45 1HB ALA 45 19.660 -6.474 1.173 316 HB2 ALA 45 2HB ALA 45 18.582 -5.114 0.854 317 HB3 ALA 45 3HB ALA 45 20.286 -5.011 0.411 318 H PHE 46 H PHE 46 22.241 -3.923 2.102 319 HA PHE 46 HA PHE 46 23.761 -6.194 2.820 320 HB2 PHE 46 2HB PHE 46 24.486 -4.270 1.326 321 HB3 PHE 46 3HB PHE 46 24.762 -3.347 2.800 322 HD1 PHE 46 HD1 PHE 46 25.485 -6.893 1.908 323 HD2 PHE 46 HD2 PHE 46 27.029 -3.108 3.095 324 HE1 PHE 46 HE1 PHE 46 27.735 -7.873 2.093 325 HE2 PHE 46 HE2 PHE 46 29.281 -4.081 3.280 326 HZ PHE 46 HZ PHE 46 29.637 -6.466 2.779 327 H ALA 47 H ALA 47 22.302 -3.709 4.670 328 HA ALA 47 HA ALA 47 24.048 -3.828 6.929 329 HB1 ALA 47 1HB ALA 47 21.866 -2.242 6.112 330 HB2 ALA 47 2HB ALA 47 21.431 -2.954 7.666 331 HB3 ALA 47 3HB ALA 47 22.915 -2.013 7.512 332 H ALA 48 H ALA 48 21.341 -5.678 5.821 333 HA ALA 48 HA ALA 48 20.884 -6.912 8.412 334 HB1 ALA 48 1HB ALA 48 19.469 -6.784 5.855 335 HB2 ALA 48 2HB ALA 48 19.397 -8.361 6.643 336 HB3 ALA 48 3HB ALA 48 18.840 -6.923 7.498 337 H GLY 49 H GLY 49 22.687 -7.492 5.529 338 HA2 GLY 49 2HA GLY 49 24.475 -9.055 5.459 339 HA3 GLY 49 3HA GLY 49 23.652 -10.010 6.683 340 H LEU 50 H LEU 50 21.640 -8.893 4.171 341 HA LEU 50 HA LEU 50 21.028 -11.524 3.312 342 HB2 LEU 50 2HB LEU 50 20.360 -8.912 1.966 343 HB3 LEU 50 3HB LEU 50 19.572 -10.464 1.690 344 HG LEU 50 HG LEU 50 19.468 -9.611 4.477 345 HD11 LEU 50 1HD1 LEU 50 18.648 -7.748 2.332 346 HD12 LEU 50 2HD1 LEU 50 19.157 -7.423 3.989 347 HD13 LEU 50 3HD1 LEU 50 17.516 -7.983 3.665 348 HD21 LEU 50 3HD2 LEU 50 18.064 -11.255 2.733 349 HD22 LEU 50 1HD2 LEU 50 16.963 -9.919 3.068 350 HD23 LEU 50 2HD2 LEU 50 17.632 -10.864 4.398 351 H ARG 51 H ARG 51 22.347 -12.734 2.128 352 HA ARG 51 HA ARG 51 23.504 -11.593 -0.301 353 HB2 ARG 51 2HB ARG 51 25.015 -12.347 2.049 354 HB3 ARG 51 3HB ARG 51 25.485 -13.323 0.664 355 HG2 ARG 51 2HG ARG 51 25.410 -10.814 -0.410 356 HG3 ARG 51 3HG ARG 51 25.978 -10.503 1.231 357 HD2 ARG 51 2HD ARG 51 27.470 -12.669 0.554 358 HD3 ARG 51 3HD ARG 51 27.304 -11.867 -1.007 359 HE ARG 51 HE ARG 51 28.068 -10.068 1.082 360 HH11 ARG 51 1HH1 ARG 51 29.247 -12.429 -1.189 361 HH12 ARG 51 2HH1 ARG 51 30.848 -11.771 -1.242 362 HH21 ARG 51 2HH2 ARG 51 31.375 -9.930 0.016 363 HH22 ARG 51 1HH2 ARG 51 30.173 -9.192 1.021 364 H VAL 52 H VAL 52 24.427 -13.345 -1.722 365 HA VAL 52 HA VAL 52 22.503 -15.263 -2.300 366 HB VAL 52 HB VAL 52 24.147 -16.296 -3.789 367 HG11 VAL 52 1HG1 VAL 52 24.166 -14.576 -5.281 368 HG12 VAL 52 2HG1 VAL 52 23.050 -13.895 -4.096 369 HG13 VAL 52 3HG1 VAL 52 24.745 -13.406 -4.095 370 HG21 VAL 52 3HG2 VAL 52 26.086 -14.597 -2.246 371 HG22 VAL 52 1HG2 VAL 52 26.140 -16.334 -2.550 372 HG23 VAL 52 2HG2 VAL 52 26.450 -15.199 -3.864 373 H GLY 53 H GLY 53 22.064 -17.254 -1.575 374 HA2 GLY 53 2HA GLY 53 22.947 -19.432 -0.854 375 HA3 GLY 53 3HA GLY 53 24.061 -18.547 0.178 376 H ASP 54 H ASP 54 22.208 -16.648 1.191 377 HA ASP 54 HA ASP 54 21.134 -18.125 3.351 378 HB2 ASP 54 2HB ASP 54 21.218 -15.298 2.513 379 HB3 ASP 54 3HB ASP 54 19.841 -15.735 3.520 380 H GLN 55 H GLN 55 18.963 -18.473 3.947 381 HA GLN 55 HA GLN 55 17.147 -18.675 1.648 382 HB2 GLN 55 2HB GLN 55 17.004 -20.090 4.315 383 HB3 GLN 55 3HB GLN 55 15.954 -20.372 2.933 384 HG2 GLN 55 2HG GLN 55 18.217 -20.880 1.715 385 HG3 GLN 55 3HG GLN 55 18.786 -21.169 3.358 386 HE21 GLN 55 2HE2 GLN 55 17.036 -24.160 3.797 387 HE22 GLN 55 1HE2 GLN 55 17.892 -22.865 4.555 388 H LEU 56 H LEU 56 15.077 -17.859 1.715 389 HA LEU 56 HA LEU 56 14.368 -16.249 4.074 390 HB2 LEU 56 2HB LEU 56 14.053 -15.477 1.178 391 HB3 LEU 56 3HB LEU 56 13.389 -14.575 2.539 392 HG LEU 56 HG LEU 56 15.867 -14.431 3.315 393 HD11 LEU 56 1HD1 LEU 56 16.200 -15.906 0.965 394 HD12 LEU 56 2HD1 LEU 56 17.458 -15.168 1.957 395 HD13 LEU 56 3HD1 LEU 56 16.777 -14.281 0.593 396 HD21 LEU 56 3HD2 LEU 56 14.520 -12.883 1.139 397 HD22 LEU 56 1HD2 LEU 56 16.157 -12.466 1.648 398 HD23 LEU 56 2HD2 LEU 56 14.833 -12.423 2.813 399 H VAL 57 H VAL 57 12.511 -16.889 4.924 400 HA VAL 57 HA VAL 57 10.495 -18.109 3.151 401 HB VAL 57 HB VAL 57 9.688 -19.320 5.202 402 HG11 VAL 57 1HG1 VAL 57 11.796 -19.915 3.449 403 HG12 VAL 57 2HG1 VAL 57 12.324 -20.443 5.047 404 HG13 VAL 57 3HG1 VAL 57 10.810 -21.048 4.373 405 HG21 VAL 57 3HG2 VAL 57 12.292 -18.287 6.318 406 HG22 VAL 57 1HG2 VAL 57 10.668 -17.962 6.924 407 HG23 VAL 57 2HG2 VAL 57 11.344 -19.587 7.040 408 H ARG 58 H ARG 58 11.066 -16.020 5.930 409 HA ARG 58 HA ARG 58 9.763 -14.487 7.000 410 HB2 ARG 58 2HB ARG 58 9.847 -13.788 4.425 411 HB3 ARG 58 3HB ARG 58 8.117 -14.072 4.557 412 HG2 ARG 58 2HG ARG 58 9.295 -12.426 6.691 413 HG3 ARG 58 3HG ARG 58 9.304 -11.715 5.076 414 HD2 ARG 58 2HD ARG 58 7.171 -11.163 5.346 415 HD3 ARG 58 3HD ARG 58 6.767 -12.878 5.426 416 HE ARG 58 HE ARG 58 7.693 -11.853 7.928 417 HH11 ARG 58 1HH1 ARG 58 4.922 -12.111 5.837 418 HH12 ARG 58 2HH1 ARG 58 3.773 -11.971 7.126 419 HH21 ARG 58 2HH2 ARG 58 4.495 -11.719 9.286 420 HH22 ARG 58 1HH2 ARG 58 6.190 -11.668 9.634 421 H PHE 59 H PHE 59 8.852 -17.265 7.010 422 HA PHE 59 HA PHE 59 6.043 -16.751 7.685 423 HB2 PHE 59 2HB PHE 59 7.109 -18.961 5.940 424 HB3 PHE 59 3HB PHE 59 5.588 -19.133 6.809 425 HD1 PHE 59 HD1 PHE 59 4.287 -16.607 6.570 426 HD2 PHE 59 HD2 PHE 59 6.683 -18.654 3.709 427 HE1 PHE 59 HE1 PHE 59 3.116 -15.431 4.753 428 HE2 PHE 59 HE2 PHE 59 5.517 -17.480 1.888 429 HZ PHE 59 HZ PHE 59 3.731 -15.866 2.409 430 H ALA 60 H ALA 60 5.220 -17.977 9.389 431 HA ALA 60 HA ALA 60 7.145 -18.823 11.316 432 HB1 ALA 60 1HB ALA 60 5.026 -19.545 12.574 433 HB2 ALA 60 2HB ALA 60 5.247 -17.828 12.233 434 HB3 ALA 60 3HB ALA 60 4.148 -18.790 11.243 435 H GLY 61 H GLY 61 8.219 -20.681 11.092 436 HA2 GLY 61 2HA GLY 61 7.735 -23.133 11.546 437 HA3 GLY 61 3HA GLY 61 6.738 -23.035 10.103 438 H TYR 62 H TYR 62 9.288 -21.032 9.580 439 HA TYR 62 HA TYR 62 11.148 -21.140 8.277 440 HB2 TYR 62 2HB TYR 62 11.555 -23.997 9.101 441 HB3 TYR 62 3HB TYR 62 12.759 -22.750 8.797 442 HD1 TYR 62 HD1 TYR 62 11.848 -24.713 11.285 443 HD2 TYR 62 HD2 TYR 62 11.882 -20.538 10.464 444 HE1 TYR 62 HE1 TYR 62 11.963 -24.245 13.697 445 HE2 TYR 62 HE2 TYR 62 11.999 -20.059 12.873 446 HH TYR 62 HH TYR 62 11.262 -21.385 15.051 447 H THR 63 H THR 63 8.677 -21.739 7.063 448 HA THR 63 HA THR 63 9.592 -23.503 4.895 449 HB THR 63 HB THR 63 8.003 -24.831 6.116 450 HG1 THR 63 HG1 THR 63 7.805 -24.878 3.823 451 HG21 THR 63 3HG2 THR 63 5.572 -23.413 5.825 452 HG22 THR 63 1HG2 THR 63 6.729 -22.316 6.576 453 HG23 THR 63 2HG2 THR 63 6.387 -23.880 7.317 454 H VAL 64 H VAL 64 8.855 -22.972 2.818 455 HA VAL 64 HA VAL 64 7.208 -20.594 2.485 456 HB VAL 64 HB VAL 64 9.603 -19.824 2.671 457 HG11 VAL 64 1HG1 VAL 64 10.158 -20.659 -0.092 458 HG12 VAL 64 2HG1 VAL 64 11.235 -20.550 1.301 459 HG13 VAL 64 3HG1 VAL 64 10.186 -21.954 1.103 460 HG21 VAL 64 3HG2 VAL 64 7.806 -18.555 1.514 461 HG22 VAL 64 1HG2 VAL 64 9.417 -18.249 0.865 462 HG23 VAL 64 2HG2 VAL 64 8.303 -19.308 -0.001 463 H THR 65 H THR 65 6.451 -20.297 0.314 464 HA THR 65 HA THR 65 6.153 -22.821 -1.086 465 HB THR 65 HB THR 65 4.881 -20.722 -2.518 466 HG1 THR 65 HG1 THR 65 3.963 -20.659 0.136 467 HG21 THR 65 3HG2 THR 65 4.059 -22.997 -2.396 468 HG22 THR 65 1HG2 THR 65 2.830 -21.895 -1.778 469 HG23 THR 65 2HG2 THR 65 3.807 -22.845 -0.658 470 H GLU 66 H GLU 66 6.678 -19.522 -2.328 471 HA GLU 66 HA GLU 66 9.107 -20.084 -3.635 472 HB2 GLU 66 2HB GLU 66 8.401 -20.249 -5.941 473 HB3 GLU 66 3HB GLU 66 7.646 -21.536 -5.011 474 HG2 GLU 66 2HG GLU 66 5.792 -19.516 -4.875 475 HG3 GLU 66 3HG GLU 66 6.441 -19.354 -6.506 476 H LEU 67 H LEU 67 9.056 -18.422 -5.786 477 HA LEU 67 HA LEU 67 9.298 -15.893 -4.691 478 HB2 LEU 67 2HB LEU 67 9.348 -15.057 -6.983 479 HB3 LEU 67 3HB LEU 67 10.320 -16.515 -6.798 480 HG LEU 67 HG LEU 67 8.077 -17.649 -7.676 481 HD11 LEU 67 1HD1 LEU 67 7.620 -15.777 -9.644 482 HD12 LEU 67 2HD1 LEU 67 7.718 -14.809 -8.174 483 HD13 LEU 67 3HD1 LEU 67 6.560 -16.135 -8.281 484 HD21 LEU 67 3HD2 LEU 67 9.458 -16.513 -9.948 485 HD22 LEU 67 1HD2 LEU 67 9.409 -18.181 -9.376 486 HD23 LEU 67 2HD2 LEU 67 10.589 -17.053 -8.706 487 H ALA 68 H ALA 68 6.512 -17.412 -6.213 488 HA ALA 68 HA ALA 68 4.863 -15.184 -6.500 489 HB1 ALA 68 1HB ALA 68 4.367 -17.397 -7.446 490 HB2 ALA 68 2HB ALA 68 4.019 -18.000 -5.825 491 HB3 ALA 68 3HB ALA 68 3.005 -16.743 -6.535 492 H ALA 69 H ALA 69 5.436 -17.257 -3.698 493 HA ALA 69 HA ALA 69 3.427 -16.113 -2.053 494 HB1 ALA 69 1HB ALA 69 5.078 -18.288 -1.865 495 HB2 ALA 69 2HB ALA 69 5.740 -17.203 -0.642 496 HB3 ALA 69 3HB ALA 69 4.042 -17.676 -0.576 497 H PHE 70 H PHE 70 6.789 -15.330 -2.681 498 HA PHE 70 HA PHE 70 6.960 -13.408 -0.544 499 HB2 PHE 70 2HB PHE 70 8.933 -14.682 -1.389 500 HB3 PHE 70 3HB PHE 70 8.816 -13.789 -2.901 501 HD1 PHE 70 HD1 PHE 70 9.133 -13.231 0.767 502 HD2 PHE 70 HD2 PHE 70 10.027 -11.845 -3.157 503 HE1 PHE 70 HE1 PHE 70 10.534 -11.446 1.720 504 HE2 PHE 70 HE2 PHE 70 11.429 -10.059 -2.211 505 HZ PHE 70 HZ PHE 70 11.684 -9.858 0.230 506 H ASN 71 H ASN 71 5.693 -13.420 -3.681 507 HA ASN 71 HA ASN 71 6.229 -10.825 -4.574 508 HB2 ASN 71 2HB ASN 71 4.758 -12.988 -5.496 509 HB3 ASN 71 3HB ASN 71 3.540 -11.742 -5.240 510 HD21 ASN 71 2HD2 ASN 71 4.649 -9.660 -7.830 511 HD22 ASN 71 1HD2 ASN 71 3.754 -9.751 -6.355 512 H THR 72 H THR 72 3.574 -12.065 -2.575 513 HA THR 72 HA THR 72 2.296 -9.525 -2.303 514 HB THR 72 HB THR 72 1.048 -11.633 -2.050 515 HG1 THR 72 HG1 THR 72 -0.182 -10.893 -0.340 516 HG21 THR 72 3HG2 THR 72 1.533 -13.243 -0.542 517 HG22 THR 72 1HG2 THR 72 1.987 -12.082 0.706 518 HG23 THR 72 2HG2 THR 72 3.137 -12.510 -0.561 519 H VAL 73 H VAL 73 4.670 -11.327 -0.449 520 HA VAL 73 HA VAL 73 4.572 -9.760 1.903 521 HB VAL 73 HB VAL 73 6.858 -11.388 0.781 522 HG11 VAL 73 1HG1 VAL 73 6.436 -10.202 3.521 523 HG12 VAL 73 2HG1 VAL 73 7.672 -11.400 3.130 524 HG13 VAL 73 3HG1 VAL 73 7.716 -9.807 2.374 525 HG21 VAL 73 3HG2 VAL 73 4.603 -12.042 2.661 526 HG22 VAL 73 1HG2 VAL 73 5.039 -12.843 1.151 527 HG23 VAL 73 2HG2 VAL 73 6.074 -13.010 2.569 528 H VAL 74 H VAL 74 6.730 -9.650 -0.924 529 HA VAL 74 HA VAL 74 8.247 -7.436 -0.037 530 HB VAL 74 HB VAL 74 8.983 -9.007 -1.818 531 HG11 VAL 74 1HG1 VAL 74 7.024 -7.497 -3.545 532 HG12 VAL 74 2HG1 VAL 74 8.166 -8.727 -4.090 533 HG13 VAL 74 3HG1 VAL 74 6.842 -9.167 -3.010 534 HG21 VAL 74 3HG2 VAL 74 9.394 -6.243 -1.622 535 HG22 VAL 74 1HG2 VAL 74 10.439 -7.431 -2.402 536 HG23 VAL 74 2HG2 VAL 74 9.215 -6.580 -3.344 537 H ALA 75 H ALA 75 5.277 -7.721 -1.888 538 HA ALA 75 HA ALA 75 5.142 -5.046 -2.791 539 HB1 ALA 75 1HB ALA 75 3.806 -7.066 -3.603 540 HB2 ALA 75 2HB ALA 75 2.737 -6.754 -2.235 541 HB3 ALA 75 3HB ALA 75 2.957 -5.525 -3.481 542 H ARG 76 H ARG 76 3.897 -6.664 0.102 543 HA ARG 76 HA ARG 76 2.675 -4.240 1.093 544 HB2 ARG 76 2HB ARG 76 2.872 -7.069 2.017 545 HB3 ARG 76 3HB ARG 76 2.520 -5.828 3.212 546 HG2 ARG 76 2HG ARG 76 0.496 -6.888 2.313 547 HG3 ARG 76 3HG ARG 76 0.552 -5.153 1.995 548 HD2 ARG 76 2HD ARG 76 1.376 -5.624 -0.279 549 HD3 ARG 76 3HD ARG 76 1.247 -7.351 0.050 550 HE ARG 76 HE ARG 76 -1.246 -6.475 0.556 551 HH11 ARG 76 1HH1 ARG 76 0.911 -6.007 -2.136 552 HH12 ARG 76 2HH1 ARG 76 -0.364 -5.861 -3.300 553 HH21 ARG 76 2HH2 ARG 76 -2.550 -6.018 -2.634 554 HH22 ARG 76 1HH2 ARG 76 -2.933 -6.285 -0.967 555 H HIS 77 H HIS 77 5.691 -5.911 1.411 556 HA HIS 77 HA HIS 77 6.498 -4.596 3.835 557 HB2 HIS 77 2HB HIS 77 7.852 -6.380 1.840 558 HB3 HIS 77 3HB HIS 77 8.811 -5.508 3.033 559 HD1 HIS 77 HD1 HIS 77 9.459 -7.862 4.027 560 HD2 HIS 77 HD2 HIS 77 5.438 -6.863 4.327 561 HE1 HIS 77 HE1 HIS 77 8.490 -9.471 5.699 562 H VAL 78 H VAL 78 7.333 -4.275 0.395 563 HA VAL 78 HA VAL 78 9.241 -2.327 0.468 564 HB VAL 78 HB VAL 78 8.539 -3.300 -1.629 565 HG11 VAL 78 1HG1 VAL 78 6.211 -1.776 -2.241 566 HG12 VAL 78 2HG1 VAL 78 6.400 -3.529 -2.173 567 HG13 VAL 78 3HG1 VAL 78 5.945 -2.633 -0.723 568 HG21 VAL 78 3HG2 VAL 78 8.362 -1.235 -3.010 569 HG22 VAL 78 1HG2 VAL 78 8.143 -0.314 -1.522 570 HG23 VAL 78 2HG2 VAL 78 9.652 -1.180 -1.809 571 H ARG 79 H ARG 79 9.202 -0.625 1.810 572 HA ARG 79 HA ARG 79 7.238 1.443 1.353 573 HB2 ARG 79 2HB ARG 79 7.073 -0.323 3.656 574 HB3 ARG 79 3HB ARG 79 7.260 1.358 4.136 575 HG2 ARG 79 2HG ARG 79 5.353 1.503 2.170 576 HG3 ARG 79 3HG ARG 79 4.969 -0.014 2.985 577 HD2 ARG 79 2HD ARG 79 4.494 1.018 4.977 578 HD3 ARG 79 3HD ARG 79 5.557 2.385 4.645 579 HE ARG 79 HE ARG 79 3.571 2.638 2.806 580 HH11 ARG 79 1HH1 ARG 79 3.650 2.324 6.272 581 HH12 ARG 79 2HH1 ARG 79 2.205 3.247 6.519 582 HH21 ARG 79 2HH2 ARG 79 1.077 4.116 4.724 583 HH22 ARG 79 1HH2 ARG 79 1.667 3.855 3.118 584 HA PRO 80 HA PRO 80 10.584 4.112 2.316 585 HB2 PRO 80 2HB PRO 80 9.336 6.211 3.503 586 HB3 PRO 80 3HB PRO 80 9.212 5.873 1.772 587 HG2 PRO 80 2HG PRO 80 7.287 5.223 3.971 588 HG3 PRO 80 3HG PRO 80 6.959 5.861 2.350 589 HD2 PRO 80 2HD PRO 80 6.633 3.248 2.980 590 HD3 PRO 80 3HD PRO 80 7.126 3.785 1.362 591 H SER 81 H SER 81 12.030 3.537 3.819 592 HA SER 81 HA SER 81 13.013 3.108 5.829 593 HB2 SER 81 2HB SER 81 11.174 5.101 7.113 594 HB3 SER 81 3HB SER 81 12.894 4.830 7.394 595 HG SER 81 HG SER 81 12.113 6.747 6.066 596 H ALA 82 H ALA 82 10.909 1.376 5.179 597 HA ALA 82 HA ALA 82 9.553 0.923 7.747 598 HB1 ALA 82 1HB ALA 82 8.932 0.074 4.941 599 HB2 ALA 82 2HB ALA 82 8.214 -0.750 6.326 600 HB3 ALA 82 3HB ALA 82 7.928 0.973 6.079 601 H SER 83 H SER 83 10.364 -0.566 9.055 602 HA SER 83 HA SER 83 12.080 -2.666 7.913 603 HB2 SER 83 2HB SER 83 12.069 -2.178 10.844 604 HB3 SER 83 3HB SER 83 13.413 -2.564 9.770 605 HG SER 83 HG SER 83 13.399 -0.376 10.623 606 H ILE 84 H ILE 84 11.519 -4.748 8.089 607 HA ILE 84 HA ILE 84 9.351 -5.465 9.944 608 HB ILE 84 HB ILE 84 9.609 -6.465 7.105 609 HG12 ILE 84 2HG1 ILE 84 8.793 -4.160 7.184 610 HG13 ILE 84 3HG1 ILE 84 7.497 -5.256 6.717 611 HG21 ILE 84 1HG2 ILE 84 7.544 -7.651 7.514 612 HG22 ILE 84 2HG2 ILE 84 8.750 -8.132 8.708 613 HG23 ILE 84 3HG2 ILE 84 7.466 -7.009 9.155 614 HD11 ILE 84 3HD1 ILE 84 7.581 -3.392 8.858 615 HD12 ILE 84 1HD1 ILE 84 6.250 -4.425 8.336 616 HD13 ILE 84 2HD1 ILE 84 7.413 -5.016 9.524 617 HA PRO 85 HA PRO 85 12.225 -8.584 11.199 618 HB2 PRO 85 2HB PRO 85 10.506 -10.056 12.700 619 HB3 PRO 85 3HB PRO 85 11.167 -8.507 13.237 620 HG2 PRO 85 2HG PRO 85 8.498 -9.108 12.023 621 HG3 PRO 85 3HG PRO 85 8.892 -8.052 13.392 622 HD2 PRO 85 2HD PRO 85 8.418 -7.096 10.903 623 HD3 PRO 85 3HD PRO 85 9.552 -6.317 12.026 624 H VAL 86 H VAL 86 12.851 -9.939 9.614 625 HA VAL 86 HA VAL 86 10.888 -11.864 8.560 626 HB VAL 86 HB VAL 86 12.608 -12.199 6.722 627 HG11 VAL 86 1HG1 VAL 86 11.666 -9.368 6.702 628 HG12 VAL 86 2HG1 VAL 86 11.626 -10.578 5.417 629 HG13 VAL 86 3HG1 VAL 86 10.483 -10.675 6.758 630 HG21 VAL 86 3HG2 VAL 86 13.733 -9.548 7.061 631 HG22 VAL 86 1HG2 VAL 86 14.185 -10.635 8.374 632 HG23 VAL 86 2HG2 VAL 86 14.536 -11.077 6.703 633 H VAL 87 H VAL 87 11.430 -14.055 8.394 634 HA VAL 87 HA VAL 87 13.562 -14.897 10.234 635 HB VAL 87 HB VAL 87 11.140 -16.416 9.258 636 HG11 VAL 87 1HG1 VAL 87 12.055 -17.837 11.357 637 HG12 VAL 87 2HG1 VAL 87 12.473 -18.188 9.679 638 HG13 VAL 87 3HG1 VAL 87 13.578 -17.253 10.687 639 HG21 VAL 87 3HG2 VAL 87 11.794 -15.308 11.987 640 HG22 VAL 87 1HG2 VAL 87 10.627 -14.625 10.854 641 HG23 VAL 87 2HG2 VAL 87 10.349 -16.221 11.551 642 H PHE 88 H PHE 88 15.302 -15.917 9.485 643 HA PHE 88 HA PHE 88 15.188 -17.081 6.781 644 HB2 PHE 88 2HB PHE 88 17.518 -16.380 6.446 645 HB3 PHE 88 3HB PHE 88 16.475 -14.995 6.751 646 HD1 PHE 88 HD1 PHE 88 16.446 -14.005 9.078 647 HD2 PHE 88 HD2 PHE 88 19.387 -16.795 7.780 648 HE1 PHE 88 HE1 PHE 88 17.925 -13.293 10.911 649 HE2 PHE 88 HE2 PHE 88 20.871 -16.089 9.611 650 HZ PHE 88 HZ PHE 88 20.140 -14.336 11.180 651 H SER 89 H SER 89 16.832 -18.764 6.385 652 HA SER 89 HA SER 89 17.584 -20.202 8.841 653 HB2 SER 89 2HB SER 89 15.890 -21.099 6.607 654 HB3 SER 89 3HB SER 89 17.163 -22.234 7.057 655 HG SER 89 HG SER 89 15.247 -22.575 8.260 656 H ARG 90 H ARG 90 19.481 -21.424 8.749 657 HA ARG 90 HA ARG 90 21.168 -20.923 6.385 658 HB2 ARG 90 2HB ARG 90 21.694 -19.754 8.670 659 HB3 ARG 90 3HB ARG 90 22.334 -21.331 9.113 660 HG2 ARG 90 2HG ARG 90 23.332 -20.577 6.538 661 HG3 ARG 90 3HG ARG 90 23.623 -19.282 7.702 662 HD2 ARG 90 2HD ARG 90 24.219 -22.085 8.507 663 HD3 ARG 90 3HD ARG 90 25.326 -21.274 7.400 664 HE ARG 90 HE ARG 90 24.838 -19.563 9.553 665 HH11 ARG 90 1HH1 ARG 90 26.366 -22.623 8.902 666 HH12 ARG 90 2HH1 ARG 90 27.520 -22.468 10.186 667 HH21 ARG 90 2HH2 ARG 90 27.510 -20.605 11.519 668 HH22 ARG 90 1HH2 ARG 90 26.352 -19.348 11.246 669 H ASP 91 H ASP 91 20.378 -22.966 5.564 670 HA ASP 91 HA ASP 91 20.603 -25.183 5.109 671 HB2 ASP 91 2HB ASP 91 22.967 -25.355 6.945 672 HB3 ASP 91 3HB ASP 91 22.701 -26.148 5.394 673 H GLY 92 H GLY 92 18.872 -24.461 7.206 674 HA2 GLY 92 2HA GLY 92 17.525 -25.997 8.449 675 HA3 GLY 92 3HA GLY 92 18.969 -26.942 8.780 676 H VAL 93 H VAL 93 19.463 -23.608 9.114 677 HA VAL 93 HA VAL 93 19.502 -23.901 12.026 678 HB VAL 93 HB VAL 93 20.715 -21.798 10.231 679 HG11 VAL 93 1HG1 VAL 93 20.645 -22.030 13.229 680 HG12 VAL 93 2HG1 VAL 93 21.854 -21.071 12.373 681 HG13 VAL 93 3HG1 VAL 93 20.143 -20.669 12.226 682 HG21 VAL 93 3HG2 VAL 93 22.787 -22.792 10.649 683 HG22 VAL 93 1HG2 VAL 93 22.175 -23.706 12.027 684 HG23 VAL 93 2HG2 VAL 93 21.709 -24.162 10.389 685 H VAL 94 H VAL 94 18.448 -22.491 13.411 686 HA VAL 94 HA VAL 94 16.253 -20.970 12.182 687 HB VAL 94 HB VAL 94 16.533 -22.012 15.005 688 HG11 VAL 94 1HG1 VAL 94 15.281 -19.925 14.951 689 HG12 VAL 94 2HG1 VAL 94 14.235 -20.570 13.685 690 HG13 VAL 94 3HG1 VAL 94 14.212 -21.284 15.298 691 HG21 VAL 94 3HG2 VAL 94 16.137 -23.789 13.400 692 HG22 VAL 94 1HG2 VAL 94 14.690 -23.514 14.370 693 HG23 VAL 94 2HG2 VAL 94 14.775 -22.900 12.719 694 H MET 95 H MET 95 16.638 -18.867 11.997 695 HA MET 95 HA MET 95 17.658 -17.406 14.306 696 HB2 MET 95 2HB MET 95 19.552 -18.023 12.666 697 HB3 MET 95 3HB MET 95 18.821 -16.839 11.591 698 HG2 MET 95 2HG MET 95 20.587 -15.773 12.767 699 HG3 MET 95 3HG MET 95 19.063 -15.145 13.391 700 HE1 MET 95 3HE MET 95 22.320 -16.127 13.987 701 HE2 MET 95 1HE MET 95 22.477 -16.560 15.690 702 HE3 MET 95 2HE MET 95 22.104 -17.803 14.495 703 H SER 96 H SER 96 17.277 -15.090 14.165 704 HA SER 96 HA SER 96 15.349 -14.264 12.123 705 HB2 SER 96 2HB SER 96 13.739 -13.484 13.692 706 HB3 SER 96 3HB SER 96 14.150 -15.121 14.201 707 HG SER 96 HG SER 96 14.108 -13.457 15.890 708 H ALA 97 H ALA 97 15.722 -12.266 11.397 709 HA ALA 97 HA ALA 97 17.124 -10.342 13.098 710 HB1 ALA 97 1HB ALA 97 18.069 -11.212 10.373 711 HB2 ALA 97 2HB ALA 97 18.632 -9.753 11.190 712 HB3 ALA 97 3HB ALA 97 18.934 -11.337 11.905 713 H THR 98 H THR 98 16.542 -8.246 12.759 714 HA THR 98 HA THR 98 14.225 -7.796 11.086 715 HB THR 98 HB THR 98 15.705 -5.894 12.914 716 HG1 THR 98 HG1 THR 98 13.736 -6.301 14.203 717 HG21 THR 98 3HG2 THR 98 13.319 -4.785 12.749 718 HG22 THR 98 1HG2 THR 98 13.289 -5.605 11.188 719 HG23 THR 98 2HG2 THR 98 14.563 -4.439 11.549 720 H ILE 99 H ILE 99 14.217 -6.872 9.139 721 HA ILE 99 HA ILE 99 16.702 -5.592 8.205 722 HB ILE 99 HB ILE 99 14.614 -6.866 6.443 723 HG12 ILE 99 2HG1 ILE 99 17.187 -8.039 7.518 724 HG13 ILE 99 3HG1 ILE 99 15.555 -8.602 7.861 725 HG21 ILE 99 1HG2 ILE 99 16.040 -5.167 5.399 726 HG22 ILE 99 2HG2 ILE 99 17.470 -6.064 5.907 727 HG23 ILE 99 3HG2 ILE 99 16.351 -6.775 4.745 728 HD11 ILE 99 3HD1 ILE 99 17.195 -8.922 5.402 729 HD12 ILE 99 1HD1 ILE 99 16.234 -10.110 6.282 730 HD13 ILE 99 2HD1 ILE 99 15.437 -8.904 5.271 731 H VAL 100 H VAL 100 16.601 -3.508 7.695 732 HA VAL 100 HA VAL 100 13.945 -2.288 7.327 733 HB VAL 100 HB VAL 100 15.017 -1.358 9.254 734 HG11 VAL 100 1HG1 VAL 100 17.230 -1.359 9.431 735 HG12 VAL 100 2HG1 VAL 100 17.398 -1.723 7.713 736 HG13 VAL 100 3HG1 VAL 100 17.301 -0.047 8.255 737 HG21 VAL 100 3HG2 VAL 100 15.388 0.601 6.992 738 HG22 VAL 100 1HG2 VAL 100 13.831 0.189 7.710 739 HG23 VAL 100 2HG2 VAL 100 15.071 0.975 8.686 740 H VAL 101 H VAL 101 13.505 -1.936 5.255 741 HA VAL 101 HA VAL 101 15.694 -1.254 3.419 742 HB VAL 101 HB VAL 101 12.869 -2.024 2.686 743 HG11 VAL 101 1HG1 VAL 101 14.267 -0.755 1.027 744 HG12 VAL 101 2HG1 VAL 101 15.374 -2.129 1.017 745 HG13 VAL 101 3HG1 VAL 101 13.705 -2.335 0.482 746 HG21 VAL 101 3HG2 VAL 101 15.280 -3.699 3.247 747 HG22 VAL 101 1HG2 VAL 101 13.598 -3.963 3.708 748 HG23 VAL 101 2HG2 VAL 101 14.106 -4.222 2.039 749 H GLY 102 H GLY 102 15.718 0.624 2.259 750 HA2 GLY 102 2HA GLY 102 13.709 2.632 3.046 751 HA3 GLY 102 3HA GLY 102 15.352 2.994 2.536 752 H GLU 103 H GLU 103 12.146 2.855 1.582 753 HA GLU 103 HA GLU 103 12.724 2.456 -1.244 754 HB2 GLU 103 2HB GLU 103 10.222 2.718 0.383 755 HB3 GLU 103 3HB GLU 103 10.161 2.988 -1.354 756 HG2 GLU 103 2HG GLU 103 9.619 0.653 -0.484 757 HG3 GLU 103 3HG GLU 103 10.733 0.789 -1.843 758 H LEU 104 H LEU 104 11.799 5.013 0.984 759 HA LEU 104 HA LEU 104 12.557 6.988 -1.024 760 HB2 LEU 104 2HB LEU 104 9.973 7.206 0.507 761 HB3 LEU 104 3HB LEU 104 10.584 8.320 -0.715 762 HG LEU 104 HG LEU 104 9.942 5.470 -1.398 763 HD11 LEU 104 1HD1 LEU 104 8.079 7.646 -0.750 764 HD12 LEU 104 2HD1 LEU 104 7.824 5.902 -0.790 765 HD13 LEU 104 3HD1 LEU 104 7.781 6.834 -2.287 766 HD21 LEU 104 3HD2 LEU 104 11.265 7.028 -2.912 767 HD22 LEU 104 1HD2 LEU 104 9.766 7.938 -3.103 768 HD23 LEU 104 2HD2 LEU 104 9.845 6.251 -3.613 769 H GLU 105 H GLU 105 13.378 8.884 -0.180 770 HA GLU 105 HA GLU 105 14.362 8.741 2.498 771 HB2 GLU 105 2HB GLU 105 14.728 10.488 0.160 772 HB3 GLU 105 3HB GLU 105 14.876 11.307 1.708 773 HG2 GLU 105 2HG GLU 105 16.792 10.241 2.249 774 HG3 GLU 105 3HG GLU 105 16.329 8.754 1.424 Start of MODEL 8 1 HA PRO 1 HA PRO 1 1.526 -0.005 -1.155 2 HB2 PRO 1 2HB PRO 1 4.051 -1.000 -1.141 3 HB3 PRO 1 3HB PRO 1 3.596 0.478 -0.285 4 HG2 PRO 1 2HG PRO 1 3.941 -2.297 0.781 5 HG3 PRO 1 3HG PRO 1 4.475 -0.757 1.478 6 HD2 PRO 1 2HD PRO 1 2.249 -2.046 2.325 7 HD3 PRO 1 3HD PRO 1 2.388 -0.276 2.331 8 H LEU 2 H LEU 2 3.027 -1.254 -2.928 9 HA LEU 2 HA LEU 2 2.621 -4.065 -3.117 10 HB2 LEU 2 2HB LEU 2 1.129 -3.933 -5.137 11 HB3 LEU 2 3HB LEU 2 0.365 -3.581 -3.588 12 HG LEU 2 HG LEU 2 1.212 -1.110 -4.649 13 HD11 LEU 2 1HD1 LEU 2 0.292 -3.016 -6.709 14 HD12 LEU 2 2HD1 LEU 2 1.321 -1.592 -6.854 15 HD13 LEU 2 3HD1 LEU 2 -0.429 -1.407 -6.740 16 HD21 LEU 2 3HD2 LEU 2 -1.554 -2.309 -4.598 17 HD22 LEU 2 1HD2 LEU 2 -1.134 -0.596 -4.597 18 HD23 LEU 2 2HD2 LEU 2 -0.744 -1.600 -3.200 19 H THR 3 H THR 3 3.569 -4.977 -5.010 20 HA THR 3 HA THR 3 5.141 -3.092 -6.634 21 HB THR 3 HB THR 3 6.558 -4.160 -4.866 22 HG1 THR 3 HG1 THR 3 8.195 -4.289 -6.272 23 HG21 THR 3 3HG2 THR 3 5.216 -6.498 -5.736 24 HG22 THR 3 1HG2 THR 3 6.439 -6.349 -4.474 25 HG23 THR 3 2HG2 THR 3 6.923 -6.690 -6.135 26 H ARG 4 H ARG 4 5.759 -3.869 -8.725 27 HA ARG 4 HA ARG 4 3.718 -5.438 -9.968 28 HB2 ARG 4 2HB ARG 4 6.017 -3.815 -10.835 29 HB3 ARG 4 3HB ARG 4 5.643 -5.176 -11.884 30 HG2 ARG 4 2HG ARG 4 3.320 -4.366 -12.055 31 HG3 ARG 4 3HG ARG 4 3.765 -2.965 -11.079 32 HD2 ARG 4 2HD ARG 4 5.438 -3.527 -13.454 33 HD3 ARG 4 3HD ARG 4 3.797 -2.959 -13.757 34 HE ARG 4 HE ARG 4 5.054 -1.328 -11.822 35 HH11 ARG 4 1HH1 ARG 4 5.064 -2.021 -15.234 36 HH12 ARG 4 2HH1 ARG 4 5.606 -0.439 -15.686 37 HH21 ARG 4 2HH2 ARG 4 6.007 1.141 -14.077 38 HH22 ARG 4 1HH2 ARG 4 5.768 0.759 -12.405 39 HA PRO 5 HA PRO 5 5.485 -9.453 -9.993 40 HB2 PRO 5 2HB PRO 5 4.889 -10.341 -12.488 41 HB3 PRO 5 3HB PRO 5 3.671 -10.141 -11.224 42 HG2 PRO 5 2HG PRO 5 4.357 -8.320 -13.498 43 HG3 PRO 5 3HG PRO 5 2.762 -8.787 -12.881 44 HD2 PRO 5 2HD PRO 5 3.926 -6.420 -12.267 45 HD3 PRO 5 3HD PRO 5 2.854 -7.278 -11.141 46 H TYR 6 H TYR 6 7.685 -8.460 -9.887 47 HA TYR 6 HA TYR 6 9.178 -8.979 -12.375 48 HB2 TYR 6 2HB TYR 6 9.067 -6.601 -10.831 49 HB3 TYR 6 3HB TYR 6 10.671 -7.292 -10.608 50 HD1 TYR 6 HD1 TYR 6 12.084 -7.765 -12.637 51 HD2 TYR 6 HD2 TYR 6 8.475 -5.521 -12.846 52 HE1 TYR 6 HE1 TYR 6 12.783 -6.855 -14.813 53 HE2 TYR 6 HE2 TYR 6 9.164 -4.605 -15.023 54 HH TYR 6 HH TYR 6 11.883 -4.343 -16.130 55 H LEU 7 H LEU 7 10.683 -10.512 -12.271 56 HA LEU 7 HA LEU 7 11.538 -11.440 -9.608 57 HB2 LEU 7 2HB LEU 7 10.249 -13.131 -10.699 58 HB3 LEU 7 3HB LEU 7 11.174 -12.949 -12.188 59 HG LEU 7 HG LEU 7 13.182 -13.758 -10.804 60 HD11 LEU 7 1HD1 LEU 7 12.870 -14.226 -8.662 61 HD12 LEU 7 2HD1 LEU 7 11.648 -15.422 -9.093 62 HD13 LEU 7 3HD1 LEU 7 11.178 -13.748 -8.796 63 HD21 LEU 7 3HD2 LEU 7 10.867 -15.416 -11.723 64 HD22 LEU 7 1HD2 LEU 7 12.282 -16.180 -10.999 65 HD23 LEU 7 2HD2 LEU 7 12.456 -15.205 -12.459 66 H GLY 8 H GLY 8 13.606 -11.138 -9.123 67 HA2 GLY 8 2HA GLY 8 15.546 -10.952 -11.345 68 HA3 GLY 8 3HA GLY 8 15.592 -9.852 -9.975 69 H PHE 9 H PHE 9 14.756 -13.152 -9.402 70 HA PHE 9 HA PHE 9 17.459 -13.989 -8.826 71 HB2 PHE 9 2HB PHE 9 17.207 -14.292 -6.467 72 HB3 PHE 9 3HB PHE 9 16.749 -12.630 -6.824 73 HD1 PHE 9 HD1 PHE 9 15.884 -15.435 -4.995 74 HD2 PHE 9 HD2 PHE 9 14.134 -12.383 -7.391 75 HE1 PHE 9 HE1 PHE 9 13.725 -15.796 -3.872 76 HE2 PHE 9 HE2 PHE 9 11.973 -12.738 -6.271 77 HZ PHE 9 HZ PHE 9 11.766 -14.446 -4.509 78 H ARG 10 H ARG 10 17.500 -16.242 -7.943 79 HA ARG 10 HA ARG 10 15.197 -17.763 -8.975 80 HB2 ARG 10 2HB ARG 10 18.120 -18.531 -8.869 81 HB3 ARG 10 3HB ARG 10 16.823 -19.608 -9.370 82 HG2 ARG 10 2HG ARG 10 16.295 -17.736 -11.095 83 HG3 ARG 10 3HG ARG 10 17.954 -17.229 -10.768 84 HD2 ARG 10 2HD ARG 10 17.840 -20.073 -11.155 85 HD3 ARG 10 3HD ARG 10 17.085 -19.245 -12.516 86 HE ARG 10 HE ARG 10 19.862 -19.340 -11.906 87 HH11 ARG 10 1HH1 ARG 10 17.376 -17.312 -13.257 88 HH12 ARG 10 2HH1 ARG 10 18.468 -16.418 -14.261 89 HH21 ARG 10 2HH2 ARG 10 20.706 -16.907 -14.242 90 HH22 ARG 10 1HH2 ARG 10 21.311 -18.170 -13.223 91 H VAL 11 H VAL 11 14.584 -19.679 -7.866 92 HA VAL 11 HA VAL 11 15.642 -19.967 -5.140 93 HB VAL 11 HB VAL 11 13.349 -20.302 -4.277 94 HG11 VAL 11 1HG1 VAL 11 13.170 -18.123 -3.755 95 HG12 VAL 11 2HG1 VAL 11 14.668 -17.962 -4.674 96 HG13 VAL 11 3HG1 VAL 11 13.118 -17.618 -5.443 97 HG21 VAL 11 3HG2 VAL 11 11.848 -18.951 -6.265 98 HG22 VAL 11 1HG2 VAL 11 12.701 -20.283 -7.046 99 HG23 VAL 11 2HG2 VAL 11 11.644 -20.598 -5.669 100 H ALA 12 H ALA 12 15.888 -22.025 -4.467 101 HA ALA 12 HA ALA 12 14.836 -24.153 -6.217 102 HB1 ALA 12 1HB ALA 12 17.217 -24.043 -6.455 103 HB2 ALA 12 2HB ALA 12 17.440 -24.050 -4.705 104 HB3 ALA 12 3HB ALA 12 16.819 -25.485 -5.521 105 H VAL 13 H VAL 13 13.400 -25.446 -5.290 106 HA VAL 13 HA VAL 13 12.935 -25.345 -2.448 107 HB VAL 13 HB VAL 13 11.018 -25.476 -3.917 108 HG11 VAL 13 1HG1 VAL 13 11.167 -28.199 -4.784 109 HG12 VAL 13 2HG1 VAL 13 10.987 -26.732 -5.748 110 HG13 VAL 13 3HG1 VAL 13 12.596 -27.326 -5.335 111 HG21 VAL 13 3HG2 VAL 13 10.897 -26.544 -1.688 112 HG22 VAL 13 1HG2 VAL 13 9.817 -27.289 -2.866 113 HG23 VAL 13 2HG2 VAL 13 11.330 -28.084 -2.431 114 H GLY 14 H GLY 14 13.691 -26.701 -0.952 115 HA2 GLY 14 2HA GLY 14 14.411 -29.429 -1.654 116 HA3 GLY 14 3HA GLY 14 15.741 -28.405 -1.134 117 H ARG 15 H ARG 15 16.084 -29.792 0.660 118 HA ARG 15 HA ARG 15 14.200 -29.283 2.857 119 HB2 ARG 15 2HB ARG 15 15.419 -31.924 2.064 120 HB3 ARG 15 3HB ARG 15 14.786 -31.629 3.678 121 HG2 ARG 15 2HG ARG 15 13.026 -32.664 2.584 122 HG3 ARG 15 3HG ARG 15 12.618 -30.950 2.481 123 HD2 ARG 15 2HD ARG 15 12.865 -30.894 0.242 124 HD3 ARG 15 3HD ARG 15 14.253 -31.981 0.267 125 HE ARG 15 HE ARG 15 12.180 -33.614 0.856 126 HH11 ARG 15 1HH1 ARG 15 12.769 -31.321 -1.697 127 HH12 ARG 15 2HH1 ARG 15 11.820 -32.179 -2.864 128 HH21 ARG 15 2HH2 ARG 15 10.771 -34.131 -2.281 129 HH22 ARG 15 1HH2 ARG 15 10.927 -34.753 -0.673 130 H ASP 16 H ASP 16 15.114 -28.789 4.788 131 HA ASP 16 HA ASP 16 18.031 -28.517 4.816 132 HB2 ASP 16 2HB ASP 16 17.517 -27.088 6.885 133 HB3 ASP 16 3HB ASP 16 17.023 -26.450 5.320 134 H SER 17 H SER 17 18.739 -28.525 7.359 135 HA SER 17 HA SER 17 18.873 -31.228 8.056 136 HB2 SER 17 2HB SER 17 20.445 -29.355 8.768 137 HB3 SER 17 3HB SER 17 19.251 -28.948 10.000 138 HG SER 17 HG SER 17 21.072 -30.512 10.494 139 H SER 18 H SER 18 16.536 -28.789 8.829 140 HA SER 18 HA SER 18 15.346 -30.343 10.973 141 HB2 SER 18 2HB SER 18 15.471 -27.802 10.957 142 HB3 SER 18 3HB SER 18 14.226 -27.839 9.708 143 HG SER 18 HG SER 18 14.059 -28.510 12.419 144 H GLY 19 H GLY 19 14.580 -29.371 7.656 145 HA2 GLY 19 2HA GLY 19 13.365 -30.649 6.110 146 HA3 GLY 19 3HA GLY 19 12.807 -31.671 7.427 147 H CYS 20 H CYS 20 12.587 -28.183 6.712 148 HA CYS 20 HA CYS 20 9.690 -28.384 7.205 149 HB2 CYS 20 2HB CYS 20 11.594 -26.081 7.653 150 HB3 CYS 20 3HB CYS 20 9.844 -25.927 7.749 151 HG CYS 20 HG CYS 20 11.003 -28.400 9.652 152 H THR 21 H THR 21 11.623 -28.443 4.714 153 HA THR 21 HA THR 21 11.486 -27.878 2.513 154 HB THR 21 HB THR 21 8.676 -26.925 3.046 155 HG1 THR 21 HG1 THR 21 8.068 -28.944 3.336 156 HG21 THR 21 3HG2 THR 21 10.280 -27.342 0.706 157 HG22 THR 21 1HG2 THR 21 8.639 -26.710 0.828 158 HG23 THR 21 2HG2 THR 21 8.906 -28.447 0.685 159 H THR 22 H THR 22 12.893 -26.208 2.291 160 HA THR 22 HA THR 22 11.742 -23.501 2.415 161 HB THR 22 HB THR 22 13.604 -22.576 3.458 162 HG1 THR 22 HG1 THR 22 15.313 -23.398 2.346 163 HG21 THR 22 3HG2 THR 22 13.376 -25.335 4.666 164 HG22 THR 22 1HG2 THR 22 12.330 -23.963 5.030 165 HG23 THR 22 2HG2 THR 22 14.039 -23.908 5.463 166 H LEU 23 H LEU 23 13.294 -21.913 1.237 167 HA LEU 23 HA LEU 23 14.369 -23.197 -1.182 168 HB2 LEU 23 2HB LEU 23 12.553 -20.809 -0.989 169 HB3 LEU 23 3HB LEU 23 13.520 -21.155 -2.422 170 HG LEU 23 HG LEU 23 12.226 -23.514 -2.107 171 HD11 LEU 23 1HD1 LEU 23 9.870 -23.000 -1.638 172 HD12 LEU 23 2HD1 LEU 23 10.331 -21.363 -1.173 173 HD13 LEU 23 3HD1 LEU 23 10.903 -22.741 -0.232 174 HD21 LEU 23 3HD2 LEU 23 11.584 -21.034 -3.654 175 HD22 LEU 23 1HD2 LEU 23 10.554 -22.460 -3.782 176 HD23 LEU 23 2HD2 LEU 23 12.260 -22.563 -4.218 177 H SER 24 H SER 24 16.431 -22.707 -1.478 178 HA SER 24 HA SER 24 17.634 -20.514 -0.016 179 HB2 SER 24 2HB SER 24 19.356 -21.947 -1.904 180 HB3 SER 24 3HB SER 24 19.551 -21.695 -0.169 181 HG SER 24 HG SER 24 18.806 -23.626 0.146 182 H ILE 25 H ILE 25 18.649 -18.736 -0.904 183 HA ILE 25 HA ILE 25 17.728 -18.004 -3.572 184 HB ILE 25 HB ILE 25 19.235 -16.255 -1.635 185 HG12 ILE 25 2HG1 ILE 25 17.253 -17.064 -0.491 186 HG13 ILE 25 3HG1 ILE 25 17.008 -15.384 -0.957 187 HG21 ILE 25 1HG2 ILE 25 17.234 -15.201 -3.542 188 HG22 ILE 25 2HG2 ILE 25 18.769 -14.515 -3.010 189 HG23 ILE 25 3HG2 ILE 25 18.749 -15.797 -4.221 190 HD11 ILE 25 3HD1 ILE 25 15.431 -17.670 -1.575 191 HD12 ILE 25 1HD1 ILE 25 15.123 -15.973 -1.943 192 HD13 ILE 25 2HD1 ILE 25 16.042 -16.968 -3.073 193 H GLN 26 H GLN 26 19.011 -17.804 -5.310 194 HA GLN 26 HA GLN 26 21.875 -18.352 -4.942 195 HB2 GLN 26 2HB GLN 26 19.973 -18.869 -7.209 196 HB3 GLN 26 3HB GLN 26 21.710 -18.837 -7.480 197 HG2 GLN 26 2HG GLN 26 22.047 -20.809 -6.450 198 HG3 GLN 26 3HG GLN 26 20.793 -20.519 -5.246 199 HE21 GLN 26 2HE2 GLN 26 18.165 -21.729 -7.383 200 HE22 GLN 26 1HE2 GLN 26 18.520 -20.422 -6.310 201 H GLU 27 H GLU 27 19.603 -16.007 -6.030 202 HA GLU 27 HA GLU 27 21.809 -14.348 -7.061 203 HB2 GLU 27 2HB GLU 27 19.451 -15.109 -8.362 204 HB3 GLU 27 3HB GLU 27 19.186 -13.439 -7.882 205 HG2 GLU 27 2HG GLU 27 20.104 -13.318 -10.024 206 HG3 GLU 27 3HG GLU 27 21.436 -12.933 -8.936 207 H VAL 28 H VAL 28 20.604 -11.914 -7.149 208 HA VAL 28 HA VAL 28 19.891 -11.396 -4.335 209 HB VAL 28 HB VAL 28 21.389 -9.490 -6.132 210 HG11 VAL 28 1HG1 VAL 28 19.981 -8.735 -4.085 211 HG12 VAL 28 2HG1 VAL 28 21.312 -9.411 -3.144 212 HG13 VAL 28 3HG1 VAL 28 21.616 -8.107 -4.292 213 HG21 VAL 28 3HG2 VAL 28 22.729 -11.507 -5.717 214 HG22 VAL 28 1HG2 VAL 28 23.403 -10.091 -4.909 215 HG23 VAL 28 2HG2 VAL 28 22.503 -11.291 -3.982 216 H THR 29 H THR 29 17.944 -10.548 -4.057 217 HA THR 29 HA THR 29 16.729 -9.049 -6.287 218 HB THR 29 HB THR 29 15.623 -11.237 -5.810 219 HG1 THR 29 HG1 THR 29 13.893 -10.228 -6.474 220 HG21 THR 29 3HG2 THR 29 16.009 -11.237 -3.366 221 HG22 THR 29 1HG2 THR 29 14.318 -11.505 -3.785 222 HG23 THR 29 2HG2 THR 29 14.842 -9.925 -3.204 223 H GLN 30 H GLN 30 17.780 -8.940 -3.071 224 HA GLN 30 HA GLN 30 15.957 -6.966 -2.094 225 HB2 GLN 30 2HB GLN 30 18.709 -7.685 -1.071 226 HB3 GLN 30 3HB GLN 30 17.479 -6.781 -0.198 227 HG2 GLN 30 2HG GLN 30 17.095 -8.803 0.716 228 HG3 GLN 30 3HG GLN 30 16.075 -8.983 -0.710 229 HE21 GLN 30 2HE2 GLN 30 18.082 -12.026 -0.466 230 HE22 GLN 30 1HE2 GLN 30 16.848 -11.231 0.444 231 H THR 31 H THR 31 18.494 -6.856 -4.282 232 HA THR 31 HA THR 31 19.195 -4.081 -3.675 233 HB THR 31 HB THR 31 20.748 -4.504 -5.750 234 HG1 THR 31 HG1 THR 31 21.241 -6.674 -6.044 235 HG21 THR 31 3HG2 THR 31 22.223 -5.936 -3.992 236 HG22 THR 31 1HG2 THR 31 21.017 -5.244 -2.908 237 HG23 THR 31 2HG2 THR 31 22.017 -4.187 -3.905 238 H TYR 32 H TYR 32 16.625 -5.209 -4.966 239 HA TYR 32 HA TYR 32 16.644 -3.395 -7.289 240 HB2 TYR 32 2HB TYR 32 15.383 -6.100 -6.949 241 HB3 TYR 32 3HB TYR 32 14.719 -4.943 -8.097 242 HD1 TYR 32 HD1 TYR 32 15.485 -5.023 -10.272 243 HD2 TYR 32 HD2 TYR 32 18.013 -6.445 -7.159 244 HE1 TYR 32 HE1 TYR 32 17.141 -5.729 -11.948 245 HE2 TYR 32 HE2 TYR 32 19.676 -7.155 -8.825 246 HH TYR 32 HH TYR 32 20.318 -6.644 -11.120 247 H THR 33 H THR 33 14.769 -2.174 -7.670 248 HA THR 33 HA THR 33 12.521 -2.309 -5.882 249 HB THR 33 HB THR 33 14.158 0.223 -5.774 250 HG1 THR 33 HG1 THR 33 14.931 -0.494 -3.800 251 HG21 THR 33 3HG2 THR 33 12.167 0.956 -5.017 252 HG22 THR 33 1HG2 THR 33 12.616 0.119 -3.531 253 HG23 THR 33 2HG2 THR 33 11.571 -0.675 -4.710 254 H GLY 34 H GLY 34 10.798 -0.881 -6.490 255 HA2 GLY 34 2HA GLY 34 11.091 0.852 -8.767 256 HA3 GLY 34 3HA GLY 34 10.273 -0.654 -9.155 257 H SER 35 H SER 35 8.931 -0.935 -6.632 258 HA SER 35 HA SER 35 6.904 1.166 -6.979 259 HB2 SER 35 2HB SER 35 6.629 -1.587 -7.004 260 HB3 SER 35 3HB SER 35 6.111 -1.148 -5.376 261 HG SER 35 HG SER 35 4.740 0.452 -6.447 262 H ASN 36 H ASN 36 5.970 2.171 -5.177 263 HA ASN 36 HA ASN 36 6.015 3.221 -3.159 264 HB2 ASN 36 2HB ASN 36 5.813 0.551 -2.643 265 HB3 ASN 36 3HB ASN 36 7.252 0.966 -1.717 266 HD21 ASN 36 2HD2 ASN 36 3.801 2.951 -0.757 267 HD22 ASN 36 1HD2 ASN 36 4.205 2.649 -2.409 268 H GLY 37 H GLY 37 8.397 3.329 -4.878 269 HA2 GLY 37 2HA GLY 37 10.093 4.823 -3.258 270 HA3 GLY 37 3HA GLY 37 10.749 3.194 -3.301 271 H GLY 38 H GLY 38 10.886 2.261 -5.610 272 HA2 GLY 38 2HA GLY 38 11.613 2.435 -7.797 273 HA3 GLY 38 3HA GLY 38 11.249 4.154 -7.740 274 H ALA 39 H ALA 39 13.643 1.709 -6.897 275 HA ALA 39 HA ALA 39 15.830 3.242 -7.714 276 HB1 ALA 39 1HB ALA 39 16.798 3.511 -5.303 277 HB2 ALA 39 2HB ALA 39 15.707 4.729 -5.964 278 HB3 ALA 39 3HB ALA 39 15.097 3.519 -4.836 279 H ASP 40 H ASP 40 16.386 1.251 -8.607 280 HA ASP 40 HA ASP 40 16.852 -1.020 -6.859 281 HB2 ASP 40 2HB ASP 40 17.435 -2.215 -8.930 282 HB3 ASP 40 3HB ASP 40 15.873 -1.413 -9.066 283 H LEU 41 H LEU 41 18.660 -1.082 -5.706 284 HA LEU 41 HA LEU 41 21.218 -0.996 -6.933 285 HB2 LEU 41 2HB LEU 41 20.286 1.492 -6.382 286 HB3 LEU 41 3HB LEU 41 21.124 1.106 -4.881 287 HG LEU 41 HG LEU 41 22.983 0.424 -6.774 288 HD11 LEU 41 1HD1 LEU 41 21.409 1.479 -8.465 289 HD12 LEU 41 2HD1 LEU 41 23.075 2.059 -8.458 290 HD13 LEU 41 3HD1 LEU 41 21.803 3.023 -7.709 291 HD21 LEU 41 3HD2 LEU 41 22.873 3.225 -5.752 292 HD22 LEU 41 1HD2 LEU 41 24.238 2.112 -5.846 293 HD23 LEU 41 2HD2 LEU 41 23.002 1.890 -4.607 294 H MET 42 H MET 42 22.790 -0.383 -4.713 295 HA MET 42 HA MET 42 21.987 -2.512 -2.843 296 HB2 MET 42 2HB MET 42 24.816 -1.578 -3.252 297 HB3 MET 42 3HB MET 42 24.253 -3.088 -2.550 298 HG2 MET 42 2HG MET 42 23.220 -3.139 -5.106 299 HG3 MET 42 3HG MET 42 24.812 -2.411 -5.311 300 HE1 MET 42 3HE MET 42 26.826 -3.726 -5.699 301 HE2 MET 42 1HE MET 42 27.010 -3.614 -3.948 302 HE3 MET 42 2HE MET 42 27.281 -5.153 -4.766 303 H GLY 43 H GLY 43 21.252 -1.701 -0.992 304 HA2 GLY 43 2HA GLY 43 22.873 0.092 0.558 305 HA3 GLY 43 3HA GLY 43 21.416 0.861 -0.052 306 HA PRO 44 HA PRO 44 18.979 -0.800 3.185 307 HB2 PRO 44 2HB PRO 44 16.758 -1.755 1.949 308 HB3 PRO 44 3HB PRO 44 17.100 -0.028 2.110 309 HG2 PRO 44 2HG PRO 44 17.540 -1.836 -0.235 310 HG3 PRO 44 3HG PRO 44 16.891 -0.186 -0.201 311 HD2 PRO 44 2HD PRO 44 19.454 -0.729 -0.885 312 HD3 PRO 44 3HD PRO 44 18.983 0.769 -0.057 313 H ALA 45 H ALA 45 19.837 -2.946 0.597 314 HA ALA 45 HA ALA 45 18.913 -5.339 1.907 315 HB1 ALA 45 1HB ALA 45 18.938 -5.350 -0.478 316 HB2 ALA 45 2HB ALA 45 20.642 -4.897 -0.519 317 HB3 ALA 45 3HB ALA 45 20.167 -6.489 0.073 318 H PHE 46 H PHE 46 22.074 -3.837 1.281 319 HA PHE 46 HA PHE 46 23.596 -5.817 2.605 320 HB2 PHE 46 2HB PHE 46 24.442 -4.080 0.955 321 HB3 PHE 46 3HB PHE 46 24.381 -2.921 2.278 322 HD1 PHE 46 HD1 PHE 46 26.322 -2.548 3.433 323 HD2 PHE 46 HD2 PHE 46 25.717 -6.339 1.596 324 HE1 PHE 46 HE1 PHE 46 28.567 -3.251 4.154 325 HE2 PHE 46 HE2 PHE 46 27.960 -7.049 2.315 326 HZ PHE 46 HZ PHE 46 29.388 -5.505 3.596 327 H ALA 47 H ALA 47 21.721 -3.160 3.738 328 HA ALA 47 HA ALA 47 23.000 -2.689 6.208 329 HB1 ALA 47 1HB ALA 47 20.133 -2.271 5.376 330 HB2 ALA 47 2HB ALA 47 20.837 -1.674 6.879 331 HB3 ALA 47 3HB ALA 47 21.439 -1.087 5.329 332 H ALA 48 H ALA 48 20.726 -5.111 5.143 333 HA ALA 48 HA ALA 48 20.398 -6.096 7.884 334 HB1 ALA 48 1HB ALA 48 18.553 -5.806 5.925 335 HB2 ALA 48 2HB ALA 48 19.005 -7.498 5.709 336 HB3 ALA 48 3HB ALA 48 18.405 -6.938 7.270 337 H GLY 49 H GLY 49 22.021 -6.778 4.918 338 HA2 GLY 49 2HA GLY 49 23.866 -8.249 4.772 339 HA3 GLY 49 3HA GLY 49 23.246 -9.127 6.163 340 H LEU 50 H LEU 50 20.909 -8.382 3.796 341 HA LEU 50 HA LEU 50 20.390 -11.117 3.258 342 HB2 LEU 50 2HB LEU 50 19.405 -8.822 1.593 343 HB3 LEU 50 3HB LEU 50 18.624 -10.373 1.891 344 HG LEU 50 HG LEU 50 18.938 -9.041 4.386 345 HD11 LEU 50 1HD1 LEU 50 18.244 -7.286 2.125 346 HD12 LEU 50 2HD1 LEU 50 18.910 -6.893 3.710 347 HD13 LEU 50 3HD1 LEU 50 17.182 -7.192 3.530 348 HD21 LEU 50 3HD2 LEU 50 16.392 -9.069 4.202 349 HD22 LEU 50 1HD2 LEU 50 17.228 -10.620 4.120 350 HD23 LEU 50 2HD2 LEU 50 16.634 -9.859 2.643 351 H ARG 51 H ARG 51 21.660 -12.362 2.057 352 HA ARG 51 HA ARG 51 22.477 -11.409 -0.582 353 HB2 ARG 51 2HB ARG 51 24.283 -11.999 1.659 354 HB3 ARG 51 3HB ARG 51 24.695 -12.833 0.166 355 HG2 ARG 51 2HG ARG 51 24.118 -9.915 0.067 356 HG3 ARG 51 3HG ARG 51 25.669 -10.464 0.707 357 HD2 ARG 51 2HD ARG 51 25.543 -11.955 -1.522 358 HD3 ARG 51 3HD ARG 51 24.603 -10.560 -2.048 359 HE ARG 51 HE ARG 51 27.060 -9.800 -0.811 360 HH11 ARG 51 1HH1 ARG 51 25.647 -10.951 -3.777 361 HH12 ARG 51 2HH1 ARG 51 26.888 -10.277 -4.782 362 HH21 ARG 51 2HH2 ARG 51 28.623 -9.116 -3.839 363 HH22 ARG 51 1HH2 ARG 51 28.699 -8.908 -2.122 364 H VAL 52 H VAL 52 23.678 -13.376 -1.715 365 HA VAL 52 HA VAL 52 21.750 -15.405 -2.017 366 HB VAL 52 HB VAL 52 23.403 -16.539 -3.442 367 HG11 VAL 52 1HG1 VAL 52 22.138 -14.872 -4.532 368 HG12 VAL 52 2HG1 VAL 52 23.069 -13.570 -3.788 369 HG13 VAL 52 3HG1 VAL 52 23.810 -14.596 -5.017 370 HG21 VAL 52 3HG2 VAL 52 25.434 -16.197 -2.252 371 HG22 VAL 52 1HG2 VAL 52 25.604 -15.380 -3.806 372 HG23 VAL 52 2HG2 VAL 52 25.271 -14.443 -2.350 373 H GLY 53 H GLY 53 21.441 -17.284 -0.997 374 HA2 GLY 53 2HA GLY 53 22.633 -19.307 -0.111 375 HA3 GLY 53 3HA GLY 53 23.542 -18.177 0.880 376 H ASP 54 H ASP 54 21.857 -16.571 2.044 377 HA ASP 54 HA ASP 54 20.540 -18.180 3.961 378 HB2 ASP 54 2HB ASP 54 19.679 -16.007 4.842 379 HB3 ASP 54 3HB ASP 54 21.425 -16.032 4.607 380 H GLN 55 H GLN 55 18.388 -18.600 4.315 381 HA GLN 55 HA GLN 55 16.643 -18.201 1.995 382 HB2 GLN 55 2HB GLN 55 16.291 -20.042 4.366 383 HB3 GLN 55 3HB GLN 55 15.274 -19.994 2.932 384 HG2 GLN 55 2HG GLN 55 16.756 -21.136 1.670 385 HG3 GLN 55 3HG GLN 55 18.155 -20.432 2.479 386 HE21 GLN 55 2HE2 GLN 55 17.711 -24.087 3.271 387 HE22 GLN 55 1HE2 GLN 55 17.669 -23.196 1.791 388 H LEU 56 H LEU 56 14.716 -17.143 2.110 389 HA LEU 56 HA LEU 56 14.133 -15.776 4.652 390 HB2 LEU 56 2HB LEU 56 13.316 -14.898 1.891 391 HB3 LEU 56 3HB LEU 56 13.177 -13.981 3.390 392 HG LEU 56 HG LEU 56 15.806 -14.245 3.387 393 HD11 LEU 56 1HD1 LEU 56 16.749 -14.967 1.516 394 HD12 LEU 56 2HD1 LEU 56 15.812 -13.831 0.546 395 HD13 LEU 56 3HD1 LEU 56 15.146 -15.417 0.933 396 HD21 LEU 56 3HD2 LEU 56 15.960 -12.072 2.342 397 HD22 LEU 56 1HD2 LEU 56 14.513 -12.144 3.348 398 HD23 LEU 56 2HD2 LEU 56 14.375 -12.285 1.595 399 H VAL 57 H VAL 57 12.347 -16.379 5.667 400 HA VAL 57 HA VAL 57 10.161 -17.569 4.085 401 HB VAL 57 HB VAL 57 11.128 -19.299 5.437 402 HG11 VAL 57 1HG1 VAL 57 10.677 -17.561 7.857 403 HG12 VAL 57 2HG1 VAL 57 11.449 -19.147 7.805 404 HG13 VAL 57 3HG1 VAL 57 12.235 -17.757 7.055 405 HG21 VAL 57 3HG2 VAL 57 8.895 -18.862 7.239 406 HG22 VAL 57 1HG2 VAL 57 8.471 -18.542 5.557 407 HG23 VAL 57 2HG2 VAL 57 9.132 -20.111 6.017 408 H ARG 58 H ARG 58 10.981 -15.654 6.948 409 HA ARG 58 HA ARG 58 9.788 -14.161 8.188 410 HB2 ARG 58 2HB ARG 58 9.887 -13.099 5.861 411 HB3 ARG 58 3HB ARG 58 8.219 -13.623 5.674 412 HG2 ARG 58 2HG ARG 58 8.507 -12.261 8.170 413 HG3 ARG 58 3HG ARG 58 9.175 -11.269 6.872 414 HD2 ARG 58 2HD ARG 58 7.159 -10.995 5.859 415 HD3 ARG 58 3HD ARG 58 6.574 -12.583 6.353 416 HE ARG 58 HE ARG 58 6.840 -10.812 8.570 417 HH11 ARG 58 1HH1 ARG 58 4.791 -11.640 5.880 418 HH12 ARG 58 2HH1 ARG 58 3.346 -11.050 6.632 419 HH21 ARG 58 2HH2 ARG 58 3.434 -10.135 8.730 420 HH22 ARG 58 1HH2 ARG 58 4.944 -10.032 9.570 421 H PHE 59 H PHE 59 8.773 -16.901 8.035 422 HA PHE 59 HA PHE 59 6.061 -16.351 8.977 423 HB2 PHE 59 2HB PHE 59 5.760 -17.077 6.669 424 HB3 PHE 59 3HB PHE 59 6.748 -18.504 6.966 425 HD1 PHE 59 HD1 PHE 59 3.523 -16.886 7.661 426 HD2 PHE 59 HD2 PHE 59 5.853 -20.426 8.051 427 HE1 PHE 59 HE1 PHE 59 1.508 -18.135 8.321 428 HE2 PHE 59 HE2 PHE 59 3.842 -21.681 8.709 429 HZ PHE 59 HZ PHE 59 1.666 -20.536 8.844 430 H ALA 60 H ALA 60 5.303 -17.782 10.547 431 HA ALA 60 HA ALA 60 7.341 -19.065 12.094 432 HB1 ALA 60 1HB ALA 60 4.947 -19.857 13.195 433 HB2 ALA 60 2HB ALA 60 5.860 -18.411 13.630 434 HB3 ALA 60 3HB ALA 60 4.554 -18.307 12.450 435 H GLY 61 H GLY 61 8.191 -20.908 11.316 436 HA2 GLY 61 2HA GLY 61 7.426 -23.369 11.527 437 HA3 GLY 61 3HA GLY 61 6.373 -22.929 10.191 438 H TYR 62 H TYR 62 8.908 -21.096 9.557 439 HA TYR 62 HA TYR 62 10.625 -21.180 8.070 440 HB2 TYR 62 2HB TYR 62 11.089 -24.060 8.772 441 HB3 TYR 62 3HB TYR 62 12.266 -22.809 8.393 442 HD1 TYR 62 HD1 TYR 62 12.713 -21.006 10.095 443 HD2 TYR 62 HD2 TYR 62 10.435 -24.483 11.001 444 HE1 TYR 62 HE1 TYR 62 13.062 -20.601 12.496 445 HE2 TYR 62 HE2 TYR 62 10.776 -24.087 13.405 446 HH TYR 62 HH TYR 62 11.804 -22.847 14.939 447 H THR 63 H THR 63 8.038 -21.741 7.095 448 HA THR 63 HA THR 63 8.574 -23.740 4.998 449 HB THR 63 HB THR 63 6.619 -24.395 6.183 450 HG1 THR 63 HG1 THR 63 6.554 -24.117 3.730 451 HG21 THR 63 3HG2 THR 63 4.748 -22.342 5.864 452 HG22 THR 63 1HG2 THR 63 6.213 -21.548 6.440 453 HG23 THR 63 2HG2 THR 63 5.503 -22.869 7.368 454 H VAL 64 H VAL 64 8.527 -23.160 2.892 455 HA VAL 64 HA VAL 64 7.550 -20.491 2.175 456 HB VAL 64 HB VAL 64 10.208 -21.505 1.177 457 HG11 VAL 64 1HG1 VAL 64 8.775 -18.862 1.009 458 HG12 VAL 64 2HG1 VAL 64 10.476 -19.076 0.592 459 HG13 VAL 64 3HG1 VAL 64 9.230 -19.933 -0.316 460 HG21 VAL 64 3HG2 VAL 64 11.156 -19.712 2.700 461 HG22 VAL 64 1HG2 VAL 64 9.591 -19.715 3.514 462 HG23 VAL 64 2HG2 VAL 64 10.573 -21.179 3.488 463 H THR 65 H THR 65 7.084 -20.226 -0.076 464 HA THR 65 HA THR 65 6.398 -22.767 -1.364 465 HB THR 65 HB THR 65 5.446 -19.965 -1.990 466 HG1 THR 65 HG1 THR 65 4.187 -20.394 -0.341 467 HG21 THR 65 3HG2 THR 65 4.676 -20.783 -3.912 468 HG22 THR 65 1HG2 THR 65 3.719 -21.961 -3.015 469 HG23 THR 65 2HG2 THR 65 5.356 -22.365 -3.533 470 H GLU 66 H GLU 66 7.261 -19.558 -2.652 471 HA GLU 66 HA GLU 66 9.651 -20.364 -3.896 472 HB2 GLU 66 2HB GLU 66 8.933 -20.450 -6.238 473 HB3 GLU 66 3HB GLU 66 8.191 -21.734 -5.294 474 HG2 GLU 66 2HG GLU 66 6.112 -20.936 -5.587 475 HG3 GLU 66 3HG GLU 66 6.628 -19.253 -5.495 476 H LEU 67 H LEU 67 9.882 -18.762 -6.030 477 HA LEU 67 HA LEU 67 10.224 -16.221 -4.973 478 HB2 LEU 67 2HB LEU 67 10.558 -15.468 -7.267 479 HB3 LEU 67 3HB LEU 67 11.389 -16.990 -6.955 480 HG LEU 67 HG LEU 67 9.010 -17.841 -8.007 481 HD11 LEU 67 1HD1 LEU 67 8.153 -16.438 -9.540 482 HD12 LEU 67 2HD1 LEU 67 9.729 -15.773 -9.970 483 HD13 LEU 67 3HD1 LEU 67 8.891 -15.194 -8.531 484 HD21 LEU 67 3HD2 LEU 67 10.527 -17.818 -10.200 485 HD22 LEU 67 1HD2 LEU 67 10.818 -18.919 -8.853 486 HD23 LEU 67 2HD2 LEU 67 11.770 -17.442 -9.006 487 H ALA 68 H ALA 68 7.410 -17.682 -6.372 488 HA ALA 68 HA ALA 68 5.976 -15.326 -7.005 489 HB1 ALA 68 1HB ALA 68 5.109 -18.148 -6.437 490 HB2 ALA 68 2HB ALA 68 3.967 -16.866 -6.842 491 HB3 ALA 68 3HB ALA 68 5.220 -17.326 -7.994 492 H ALA 69 H ALA 69 6.078 -17.365 -4.106 493 HA ALA 69 HA ALA 69 4.091 -15.965 -2.666 494 HB1 ALA 69 1HB ALA 69 5.558 -17.028 -0.689 495 HB2 ALA 69 2HB ALA 69 4.420 -17.962 -1.661 496 HB3 ALA 69 3HB ALA 69 6.142 -17.995 -2.044 497 H PHE 70 H PHE 70 7.557 -15.522 -3.015 498 HA PHE 70 HA PHE 70 7.867 -13.654 -0.902 499 HB2 PHE 70 2HB PHE 70 9.805 -14.814 -1.736 500 HB3 PHE 70 3HB PHE 70 9.534 -14.197 -3.363 501 HD1 PHE 70 HD1 PHE 70 10.386 -12.111 -4.031 502 HD2 PHE 70 HD2 PHE 70 10.478 -13.228 0.076 503 HE1 PHE 70 HE1 PHE 70 11.840 -10.186 -3.543 504 HE2 PHE 70 HE2 PHE 70 11.931 -11.305 0.570 505 HZ PHE 70 HZ PHE 70 12.614 -9.781 -1.240 506 H ASN 71 H ASN 71 7.011 -13.378 -4.289 507 HA ASN 71 HA ASN 71 7.374 -10.621 -4.620 508 HB2 ASN 71 2HB ASN 71 6.871 -12.376 -6.407 509 HB3 ASN 71 3HB ASN 71 5.179 -12.213 -5.943 510 HD21 ASN 71 2HD2 ASN 71 6.766 -9.680 -8.533 511 HD22 ASN 71 1HD2 ASN 71 7.467 -11.184 -8.050 512 H THR 72 H THR 72 4.749 -12.466 -3.209 513 HA THR 72 HA THR 72 2.903 -10.294 -3.066 514 HB THR 72 HB THR 72 2.521 -12.368 -1.046 515 HG1 THR 72 HG1 THR 72 2.471 -14.101 -2.377 516 HG21 THR 72 3HG2 THR 72 1.008 -10.935 -3.123 517 HG22 THR 72 1HG2 THR 72 0.527 -11.411 -1.495 518 HG23 THR 72 2HG2 THR 72 0.471 -12.585 -2.810 519 H VAL 73 H VAL 73 5.203 -11.750 -0.803 520 HA VAL 73 HA VAL 73 4.472 -10.121 1.413 521 HB VAL 73 HB VAL 73 7.004 -11.679 0.879 522 HG11 VAL 73 1HG1 VAL 73 6.095 -10.094 3.250 523 HG12 VAL 73 2HG1 VAL 73 7.140 -11.500 3.458 524 HG13 VAL 73 3HG1 VAL 73 7.679 -10.137 2.476 525 HG21 VAL 73 3HG2 VAL 73 5.306 -13.253 1.060 526 HG22 VAL 73 1HG2 VAL 73 5.901 -13.130 2.716 527 HG23 VAL 73 2HG2 VAL 73 4.415 -12.303 2.249 528 H VAL 74 H VAL 74 7.156 -9.988 -0.916 529 HA VAL 74 HA VAL 74 8.452 -7.741 0.112 530 HB VAL 74 HB VAL 74 9.371 -9.244 -1.654 531 HG11 VAL 74 1HG1 VAL 74 7.576 -7.661 -3.490 532 HG12 VAL 74 2HG1 VAL 74 8.780 -8.855 -3.981 533 HG13 VAL 74 3HG1 VAL 74 7.362 -9.357 -3.059 534 HG21 VAL 74 3HG2 VAL 74 10.866 -7.639 -2.020 535 HG22 VAL 74 1HG2 VAL 74 9.731 -6.746 -3.032 536 HG23 VAL 74 2HG2 VAL 74 9.744 -6.494 -1.286 537 H ALA 75 H ALA 75 5.669 -8.013 -2.009 538 HA ALA 75 HA ALA 75 5.542 -5.361 -2.911 539 HB1 ALA 75 1HB ALA 75 2.949 -6.020 -2.897 540 HB2 ALA 75 2HB ALA 75 4.087 -6.619 -4.105 541 HB3 ALA 75 3HB ALA 75 3.654 -7.627 -2.725 542 H ARG 76 H ARG 76 4.119 -6.906 -0.050 543 HA ARG 76 HA ARG 76 2.983 -4.408 0.864 544 HB2 ARG 76 2HB ARG 76 3.177 -6.954 2.460 545 HB3 ARG 76 3HB ARG 76 2.001 -5.655 2.617 546 HG2 ARG 76 2HG ARG 76 2.188 -7.744 0.472 547 HG3 ARG 76 3HG ARG 76 0.864 -7.440 1.599 548 HD2 ARG 76 2HD ARG 76 0.826 -5.090 0.451 549 HD3 ARG 76 3HD ARG 76 1.660 -5.934 -0.853 550 HE ARG 76 HE ARG 76 -0.311 -6.956 -1.395 551 HH11 ARG 76 1HH1 ARG 76 -0.562 -5.650 1.822 552 HH12 ARG 76 2HH1 ARG 76 -2.252 -6.001 1.973 553 HH21 ARG 76 2HH2 ARG 76 -3.373 -7.011 0.249 554 HH22 ARG 76 1HH2 ARG 76 -2.535 -7.424 -1.208 555 H HIS 77 H HIS 77 5.913 -6.150 1.238 556 HA HIS 77 HA HIS 77 6.656 -5.016 3.770 557 HB2 HIS 77 2HB HIS 77 7.492 -7.222 2.737 558 HB3 HIS 77 3HB HIS 77 8.568 -6.213 1.775 559 HD1 HIS 77 HD1 HIS 77 8.724 -8.177 4.640 560 HD2 HIS 77 HD2 HIS 77 9.961 -4.299 3.805 561 HE1 HIS 77 HE1 HIS 77 10.475 -7.643 6.364 562 H VAL 78 H VAL 78 7.612 -4.464 0.390 563 HA VAL 78 HA VAL 78 9.522 -2.527 0.691 564 HB VAL 78 HB VAL 78 8.690 -1.564 -1.486 565 HG11 VAL 78 1HG1 VAL 78 10.277 -3.108 -1.950 566 HG12 VAL 78 2HG1 VAL 78 9.491 -4.366 -0.994 567 HG13 VAL 78 3HG1 VAL 78 8.899 -3.987 -2.612 568 HG21 VAL 78 3HG2 VAL 78 6.305 -2.793 -0.714 569 HG22 VAL 78 1HG2 VAL 78 6.652 -2.012 -2.257 570 HG23 VAL 78 2HG2 VAL 78 6.901 -3.748 -2.072 571 H ARG 79 H ARG 79 9.449 -0.831 2.017 572 HA ARG 79 HA ARG 79 7.417 1.187 1.620 573 HB2 ARG 79 2HB ARG 79 7.337 -0.636 3.887 574 HB3 ARG 79 3HB ARG 79 7.459 1.043 4.397 575 HG2 ARG 79 2HG ARG 79 5.533 1.088 2.411 576 HG3 ARG 79 3HG ARG 79 5.208 -0.403 3.298 577 HD2 ARG 79 2HD ARG 79 5.767 2.025 4.898 578 HD3 ARG 79 3HD ARG 79 4.230 1.972 4.035 579 HE ARG 79 HE ARG 79 4.624 -0.445 5.430 580 HH11 ARG 79 1HH1 ARG 79 3.900 2.916 5.979 581 HH12 ARG 79 2HH1 ARG 79 3.020 2.622 7.442 582 HH21 ARG 79 2HH2 ARG 79 2.774 0.483 8.224 583 HH22 ARG 79 1HH2 ARG 79 3.467 -0.845 7.355 584 HA PRO 80 HA PRO 80 10.677 3.944 2.629 585 HB2 PRO 80 2HB PRO 80 9.373 5.960 3.896 586 HB3 PRO 80 3HB PRO 80 9.237 5.671 2.158 587 HG2 PRO 80 2HG PRO 80 7.367 4.887 4.360 588 HG3 PRO 80 3HG PRO 80 6.995 5.563 2.764 589 HD2 PRO 80 2HD PRO 80 6.768 2.922 3.317 590 HD3 PRO 80 3HD PRO 80 7.220 3.525 1.710 591 H SER 81 H SER 81 12.040 3.005 4.094 592 HA SER 81 HA SER 81 13.078 2.604 6.078 593 HB2 SER 81 2HB SER 81 11.305 4.673 7.360 594 HB3 SER 81 3HB SER 81 12.981 4.273 7.735 595 HG SER 81 HG SER 81 12.354 5.230 5.178 596 H ALA 82 H ALA 82 10.918 0.950 5.432 597 HA ALA 82 HA ALA 82 9.354 0.582 7.854 598 HB1 ALA 82 1HB ALA 82 8.648 -1.517 6.349 599 HB2 ALA 82 2HB ALA 82 7.946 0.090 6.153 600 HB3 ALA 82 3HB ALA 82 9.245 -0.441 5.085 601 H SER 83 H SER 83 10.679 -0.162 9.452 602 HA SER 83 HA SER 83 12.476 -2.389 8.923 603 HB2 SER 83 2HB SER 83 11.977 -0.877 11.498 604 HB3 SER 83 3HB SER 83 13.274 -2.035 11.208 605 HG SER 83 HG SER 83 13.961 0.142 10.949 606 H ILE 84 H ILE 84 11.704 -4.385 8.990 607 HA ILE 84 HA ILE 84 9.827 -5.099 11.134 608 HB ILE 84 HB ILE 84 9.568 -6.017 8.268 609 HG12 ILE 84 2HG1 ILE 84 7.678 -4.286 9.870 610 HG13 ILE 84 3HG1 ILE 84 8.867 -3.642 8.744 611 HG21 ILE 84 1HG2 ILE 84 7.579 -7.178 8.993 612 HG22 ILE 84 2HG2 ILE 84 8.956 -7.713 9.955 613 HG23 ILE 84 3HG2 ILE 84 7.791 -6.578 10.638 614 HD11 ILE 84 3HD1 ILE 84 7.770 -5.064 6.974 615 HD12 ILE 84 1HD1 ILE 84 6.477 -5.350 8.138 616 HD13 ILE 84 2HD1 ILE 84 6.821 -3.710 7.588 617 HA PRO 85 HA PRO 85 12.789 -8.316 11.796 618 HB2 PRO 85 2HB PRO 85 11.312 -9.797 13.527 619 HB3 PRO 85 3HB PRO 85 12.094 -8.280 13.986 620 HG2 PRO 85 2HG PRO 85 9.243 -8.788 13.227 621 HG3 PRO 85 3HG PRO 85 9.890 -7.784 14.537 622 HD2 PRO 85 2HD PRO 85 9.026 -6.740 12.193 623 HD3 PRO 85 3HD PRO 85 10.353 -6.020 13.127 624 H VAL 86 H VAL 86 13.215 -9.877 10.379 625 HA VAL 86 HA VAL 86 11.000 -11.590 9.454 626 HB VAL 86 HB VAL 86 13.554 -10.876 8.005 627 HG11 VAL 86 1HG1 VAL 86 13.186 -12.939 7.132 628 HG12 VAL 86 2HG1 VAL 86 11.465 -12.921 7.524 629 HG13 VAL 86 3HG1 VAL 86 12.062 -12.031 6.123 630 HG21 VAL 86 3HG2 VAL 86 10.683 -10.071 7.557 631 HG22 VAL 86 1HG2 VAL 86 12.038 -9.022 7.977 632 HG23 VAL 86 2HG2 VAL 86 11.981 -9.798 6.394 633 H VAL 87 H VAL 87 11.300 -13.804 9.355 634 HA VAL 87 HA VAL 87 13.398 -14.837 11.087 635 HB VAL 87 HB VAL 87 11.050 -16.245 9.810 636 HG11 VAL 87 1HG1 VAL 87 12.710 -17.883 10.190 637 HG12 VAL 87 2HG1 VAL 87 13.145 -17.187 11.752 638 HG13 VAL 87 3HG1 VAL 87 11.593 -18.001 11.549 639 HG21 VAL 87 3HG2 VAL 87 10.195 -16.264 12.169 640 HG22 VAL 87 1HG2 VAL 87 11.492 -15.141 12.577 641 HG23 VAL 87 2HG2 VAL 87 10.253 -14.671 11.414 642 H PHE 88 H PHE 88 15.204 -15.740 10.363 643 HA PHE 88 HA PHE 88 15.292 -16.636 7.557 644 HB2 PHE 88 2HB PHE 88 17.494 -15.440 9.251 645 HB3 PHE 88 3HB PHE 88 17.731 -16.112 7.641 646 HD1 PHE 88 HD1 PHE 88 17.123 -14.896 5.692 647 HD2 PHE 88 HD2 PHE 88 16.166 -13.390 9.557 648 HE1 PHE 88 HE1 PHE 88 16.561 -12.716 4.700 649 HE2 PHE 88 HE2 PHE 88 15.602 -11.208 8.570 650 HZ PHE 88 HZ PHE 88 15.798 -10.868 6.139 651 H SER 89 H SER 89 16.564 -18.484 7.068 652 HA SER 89 HA SER 89 17.310 -20.154 9.366 653 HB2 SER 89 2HB SER 89 15.286 -20.723 7.283 654 HB3 SER 89 3HB SER 89 16.390 -22.046 7.659 655 HG SER 89 HG SER 89 15.731 -21.977 9.780 656 H ARG 90 H ARG 90 19.128 -21.360 9.106 657 HA ARG 90 HA ARG 90 20.414 -21.299 6.457 658 HB2 ARG 90 2HB ARG 90 21.378 -20.305 9.022 659 HB3 ARG 90 3HB ARG 90 22.491 -21.450 8.287 660 HG2 ARG 90 2HG ARG 90 22.158 -20.007 6.154 661 HG3 ARG 90 3HG ARG 90 21.591 -18.785 7.295 662 HD2 ARG 90 2HD ARG 90 24.194 -20.213 7.713 663 HD3 ARG 90 3HD ARG 90 24.086 -18.811 6.650 664 HE ARG 90 HE ARG 90 22.978 -18.390 9.275 665 HH11 ARG 90 1HH1 ARG 90 25.845 -18.266 7.304 666 HH12 ARG 90 2HH1 ARG 90 26.647 -17.108 8.313 667 HH21 ARG 90 2HH2 ARG 90 25.609 -16.312 10.195 668 HH22 ARG 90 1HH2 ARG 90 24.022 -16.865 10.611 669 H ASP 91 H ASP 91 20.034 -23.360 5.816 670 HA ASP 91 HA ASP 91 20.248 -25.620 5.680 671 HB2 ASP 91 2HB ASP 91 22.292 -25.595 7.871 672 HB3 ASP 91 3HB ASP 91 22.243 -26.570 6.405 673 H GLY 92 H GLY 92 18.371 -24.431 7.578 674 HA2 GLY 92 2HA GLY 92 16.728 -25.685 8.774 675 HA3 GLY 92 3HA GLY 92 17.986 -26.813 9.256 676 H VAL 93 H VAL 93 19.536 -24.082 9.717 677 HA VAL 93 HA VAL 93 19.252 -24.104 12.530 678 HB VAL 93 HB VAL 93 20.558 -22.081 10.709 679 HG11 VAL 93 1HG1 VAL 93 21.785 -21.529 12.930 680 HG12 VAL 93 2HG1 VAL 93 20.195 -20.827 12.620 681 HG13 VAL 93 3HG1 VAL 93 20.352 -22.222 13.689 682 HG21 VAL 93 3HG2 VAL 93 21.324 -24.635 11.214 683 HG22 VAL 93 1HG2 VAL 93 22.430 -23.323 10.806 684 HG23 VAL 93 2HG2 VAL 93 22.172 -23.767 12.493 685 H VAL 94 H VAL 94 18.196 -22.750 13.922 686 HA VAL 94 HA VAL 94 16.138 -21.034 12.718 687 HB VAL 94 HB VAL 94 16.299 -22.199 15.501 688 HG11 VAL 94 1HG1 VAL 94 14.163 -20.519 14.194 689 HG12 VAL 94 2HG1 VAL 94 13.985 -21.356 15.737 690 HG13 VAL 94 3HG1 VAL 94 15.175 -20.065 15.565 691 HG21 VAL 94 3HG2 VAL 94 14.248 -23.447 14.688 692 HG22 VAL 94 1HG2 VAL 94 14.697 -22.930 13.063 693 HG23 VAL 94 2HG2 VAL 94 15.791 -23.950 13.998 694 H MET 95 H MET 95 16.647 -18.951 12.627 695 HA MET 95 HA MET 95 17.734 -17.655 15.005 696 HB2 MET 95 2HB MET 95 19.586 -18.300 13.323 697 HB3 MET 95 3HB MET 95 18.923 -17.017 12.319 698 HG2 MET 95 2HG MET 95 20.753 -16.125 13.544 699 HG3 MET 95 3HG MET 95 19.270 -15.443 14.207 700 HE1 MET 95 3HE MET 95 22.540 -16.532 14.965 701 HE2 MET 95 1HE MET 95 21.962 -15.209 15.978 702 HE3 MET 95 2HE MET 95 22.488 -16.721 16.719 703 H SER 96 H SER 96 17.489 -15.313 14.965 704 HA SER 96 HA SER 96 15.432 -14.394 13.069 705 HB2 SER 96 2HB SER 96 14.143 -13.417 14.771 706 HB3 SER 96 3HB SER 96 14.619 -14.970 15.459 707 HG SER 96 HG SER 96 15.197 -12.459 16.305 708 H ALA 97 H ALA 97 15.848 -12.504 12.113 709 HA ALA 97 HA ALA 97 17.706 -10.624 13.369 710 HB1 ALA 97 1HB ALA 97 18.148 -10.939 10.486 711 HB2 ALA 97 2HB ALA 97 19.308 -10.728 11.799 712 HB3 ALA 97 3HB ALA 97 18.635 -12.323 11.464 713 H THR 98 H THR 98 17.259 -8.508 12.970 714 HA THR 98 HA THR 98 14.734 -7.937 11.666 715 HB THR 98 HB THR 98 16.552 -5.868 12.877 716 HG1 THR 98 HG1 THR 98 14.691 -7.533 14.257 717 HG21 THR 98 3HG2 THR 98 13.777 -6.018 11.958 718 HG22 THR 98 1HG2 THR 98 14.821 -4.615 12.179 719 HG23 THR 98 2HG2 THR 98 13.959 -5.299 13.558 720 H ILE 99 H ILE 99 14.509 -7.183 9.665 721 HA ILE 99 HA ILE 99 16.898 -6.130 8.297 722 HB ILE 99 HB ILE 99 15.888 -6.875 6.185 723 HG12 ILE 99 2HG1 ILE 99 13.982 -8.740 6.884 724 HG13 ILE 99 3HG1 ILE 99 13.614 -7.396 7.959 725 HG21 ILE 99 1HG2 ILE 99 15.758 -9.419 7.555 726 HG22 ILE 99 2HG2 ILE 99 16.953 -8.815 6.409 727 HG23 ILE 99 3HG2 ILE 99 17.108 -8.438 8.124 728 HD11 ILE 99 3HD1 ILE 99 12.695 -7.668 5.421 729 HD12 ILE 99 1HD1 ILE 99 12.806 -6.143 6.299 730 HD13 ILE 99 2HD1 ILE 99 14.089 -6.614 5.184 731 H VAL 100 H VAL 100 16.832 -4.085 7.644 732 HA VAL 100 HA VAL 100 14.257 -2.678 7.702 733 HB VAL 100 HB VAL 100 17.021 -1.468 7.596 734 HG11 VAL 100 1HG1 VAL 100 15.543 0.439 8.671 735 HG12 VAL 100 2HG1 VAL 100 15.659 0.238 6.921 736 HG13 VAL 100 3HG1 VAL 100 14.258 -0.388 7.792 737 HG21 VAL 100 3HG2 VAL 100 17.168 -2.322 9.685 738 HG22 VAL 100 1HG2 VAL 100 16.166 -0.928 10.086 739 HG23 VAL 100 2HG2 VAL 100 15.422 -2.509 9.849 740 H VAL 101 H VAL 101 13.275 -2.529 5.799 741 HA VAL 101 HA VAL 101 14.894 -2.336 3.358 742 HB VAL 101 HB VAL 101 11.943 -2.922 3.639 743 HG11 VAL 101 1HG1 VAL 101 13.582 -2.206 1.383 744 HG12 VAL 101 2HG1 VAL 101 12.904 -3.822 1.175 745 HG13 VAL 101 3HG1 VAL 101 11.838 -2.449 1.470 746 HG21 VAL 101 3HG2 VAL 101 14.355 -4.650 3.568 747 HG22 VAL 101 1HG2 VAL 101 12.826 -4.871 4.420 748 HG23 VAL 101 2HG2 VAL 101 12.927 -5.198 2.690 749 H GLY 102 H GLY 102 15.371 -0.242 2.989 750 HA2 GLY 102 2HA GLY 102 13.131 1.685 3.059 751 HA3 GLY 102 3HA GLY 102 14.796 2.117 3.417 752 H GLU 103 H GLU 103 12.422 2.034 1.056 753 HA GLU 103 HA GLU 103 14.252 1.914 -1.197 754 HB2 GLU 103 2HB GLU 103 11.318 2.596 -1.294 755 HB3 GLU 103 3HB GLU 103 12.327 1.971 -2.591 756 HG2 GLU 103 2HG GLU 103 11.191 0.087 -2.000 757 HG3 GLU 103 3HG GLU 103 12.615 -0.065 -0.973 758 H LEU 104 H LEU 104 13.006 4.253 0.912 759 HA LEU 104 HA LEU 104 14.102 6.379 -0.767 760 HB2 LEU 104 2HB LEU 104 11.450 6.696 0.614 761 HB3 LEU 104 3HB LEU 104 12.223 7.807 -0.514 762 HG LEU 104 HG LEU 104 11.402 5.071 -1.413 763 HD11 LEU 104 1HD1 LEU 104 9.211 5.592 -1.650 764 HD12 LEU 104 2HD1 LEU 104 9.523 7.318 -1.828 765 HD13 LEU 104 3HD1 LEU 104 9.549 6.578 -0.228 766 HD21 LEU 104 3HD2 LEU 104 11.928 5.835 -3.439 767 HD22 LEU 104 1HD2 LEU 104 12.704 7.190 -2.617 768 HD23 LEU 104 2HD2 LEU 104 11.042 7.340 -3.189 769 H GLU 105 H GLU 105 15.818 6.682 0.601 770 HA GLU 105 HA GLU 105 15.462 6.934 3.443 771 HB2 GLU 105 2HB GLU 105 17.538 6.048 2.255 772 HB3 GLU 105 3HB GLU 105 17.908 7.723 1.867 773 HG2 GLU 105 2HG GLU 105 18.150 8.292 4.156 774 HG3 GLU 105 3HG GLU 105 17.486 6.744 4.676 Start of MODEL 9 1 HA PRO 1 HA PRO 1 1.940 1.365 -1.943 2 HB2 PRO 1 2HB PRO 1 4.275 0.082 -1.419 3 HB3 PRO 1 3HB PRO 1 3.943 1.732 -0.878 4 HG2 PRO 1 2HG PRO 1 3.752 -0.838 0.647 5 HG3 PRO 1 3HG PRO 1 4.418 0.723 1.163 6 HD2 PRO 1 2HD PRO 1 1.944 -0.113 1.880 7 HD3 PRO 1 3HD PRO 1 2.338 1.600 1.629 8 H LEU 2 H LEU 2 3.252 -0.240 -3.421 9 HA LEU 2 HA LEU 2 2.876 -3.001 -3.246 10 HB2 LEU 2 2HB LEU 2 0.483 -1.731 -3.748 11 HB3 LEU 2 3HB LEU 2 1.028 -2.209 -5.354 12 HG LEU 2 HG LEU 2 1.246 -4.376 -3.432 13 HD11 LEU 2 1HD1 LEU 2 -1.302 -2.867 -3.631 14 HD12 LEU 2 2HD1 LEU 2 -0.624 -3.774 -2.280 15 HD13 LEU 2 3HD1 LEU 2 -1.378 -4.629 -3.625 16 HD21 LEU 2 3HD2 LEU 2 -0.024 -5.544 -5.203 17 HD22 LEU 2 1HD2 LEU 2 1.409 -4.716 -5.813 18 HD23 LEU 2 2HD2 LEU 2 -0.189 -4.010 -6.059 19 H THR 3 H THR 3 3.581 -4.129 -5.134 20 HA THR 3 HA THR 3 4.772 -2.415 -7.210 21 HB THR 3 HB THR 3 6.472 -3.236 -5.525 22 HG1 THR 3 HG1 THR 3 7.945 -3.777 -7.196 23 HG21 THR 3 3HG2 THR 3 6.721 -5.849 -6.754 24 HG22 THR 3 1HG2 THR 3 5.185 -5.672 -5.906 25 HG23 THR 3 2HG2 THR 3 6.702 -5.407 -5.047 26 H ARG 4 H ARG 4 5.433 -3.713 -9.168 27 HA ARG 4 HA ARG 4 3.198 -5.359 -9.961 28 HB2 ARG 4 2HB ARG 4 5.392 -3.926 -11.301 29 HB3 ARG 4 3HB ARG 4 4.928 -5.436 -12.073 30 HG2 ARG 4 2HG ARG 4 2.545 -4.582 -11.996 31 HG3 ARG 4 3HG ARG 4 3.231 -3.015 -11.561 32 HD2 ARG 4 2HD ARG 4 3.920 -4.590 -14.039 33 HD3 ARG 4 3HD ARG 4 2.794 -3.235 -13.981 34 HE ARG 4 HE ARG 4 5.110 -2.241 -12.937 35 HH11 ARG 4 1HH1 ARG 4 4.232 -3.820 -15.913 36 HH12 ARG 4 2HH1 ARG 4 5.442 -3.009 -16.852 37 HH21 ARG 4 2HH2 ARG 4 6.849 -1.501 -15.855 38 HH22 ARG 4 1HH2 ARG 4 6.706 -1.167 -14.163 39 HA PRO 5 HA PRO 5 4.962 -9.349 -9.508 40 HB2 PRO 5 2HB PRO 5 4.124 -10.621 -11.755 41 HB3 PRO 5 3HB PRO 5 3.036 -10.202 -10.426 42 HG2 PRO 5 2HG PRO 5 3.490 -8.782 -13.022 43 HG3 PRO 5 3HG PRO 5 1.964 -9.121 -12.183 44 HD2 PRO 5 2HD PRO 5 3.179 -6.703 -12.079 45 HD3 PRO 5 3HD PRO 5 2.226 -7.351 -10.729 46 H TYR 6 H TYR 6 7.164 -8.414 -9.768 47 HA TYR 6 HA TYR 6 8.406 -9.366 -12.265 48 HB2 TYR 6 2HB TYR 6 8.369 -6.740 -11.308 49 HB3 TYR 6 3HB TYR 6 9.974 -7.340 -10.905 50 HD1 TYR 6 HD1 TYR 6 8.099 -5.739 -13.366 51 HD2 TYR 6 HD2 TYR 6 11.127 -8.693 -12.910 52 HE1 TYR 6 HE1 TYR 6 8.819 -5.350 -15.685 53 HE2 TYR 6 HE2 TYR 6 11.856 -8.311 -15.228 54 HH TYR 6 HH TYR 6 10.537 -7.345 -17.436 55 H LEU 7 H LEU 7 10.088 -10.726 -12.069 56 HA LEU 7 HA LEU 7 11.088 -11.260 -9.349 57 HB2 LEU 7 2HB LEU 7 11.490 -13.541 -10.035 58 HB3 LEU 7 3HB LEU 7 9.803 -13.107 -10.309 59 HG LEU 7 HG LEU 7 11.158 -12.602 -12.726 60 HD11 LEU 7 1HD1 LEU 7 12.998 -13.935 -12.302 61 HD12 LEU 7 2HD1 LEU 7 11.894 -15.057 -13.097 62 HD13 LEU 7 3HD1 LEU 7 12.073 -15.090 -11.343 63 HD21 LEU 7 3HD2 LEU 7 9.636 -15.113 -12.402 64 HD22 LEU 7 1HD2 LEU 7 9.457 -13.818 -13.586 65 HD23 LEU 7 2HD2 LEU 7 8.801 -13.623 -11.961 66 H GLY 8 H GLY 8 13.194 -10.980 -8.971 67 HA2 GLY 8 2HA GLY 8 15.004 -10.809 -11.300 68 HA3 GLY 8 3HA GLY 8 15.085 -9.656 -9.976 69 H PHE 9 H PHE 9 14.499 -13.084 -9.532 70 HA PHE 9 HA PHE 9 17.243 -13.680 -8.901 71 HB2 PHE 9 2HB PHE 9 16.985 -14.096 -6.559 72 HB3 PHE 9 3HB PHE 9 16.390 -12.467 -6.864 73 HD1 PHE 9 HD1 PHE 9 13.813 -12.294 -7.319 74 HD2 PHE 9 HD2 PHE 9 15.703 -15.530 -5.301 75 HE1 PHE 9 HE1 PHE 9 11.674 -12.874 -6.251 76 HE2 PHE 9 HE2 PHE 9 13.567 -16.116 -4.231 77 HZ PHE 9 HZ PHE 9 11.548 -14.788 -4.706 78 H ARG 10 H ARG 10 17.407 -15.956 -7.959 79 HA ARG 10 HA ARG 10 15.330 -17.637 -9.201 80 HB2 ARG 10 2HB ARG 10 17.232 -19.365 -9.282 81 HB3 ARG 10 3HB ARG 10 17.288 -18.029 -10.425 82 HG2 ARG 10 2HG ARG 10 19.069 -17.024 -9.376 83 HG3 ARG 10 3HG ARG 10 18.717 -17.784 -7.822 84 HD2 ARG 10 2HD ARG 10 20.715 -18.752 -8.801 85 HD3 ARG 10 3HD ARG 10 19.423 -19.949 -8.736 86 HE ARG 10 HE ARG 10 19.309 -18.743 -11.237 87 HH11 ARG 10 1HH1 ARG 10 21.507 -20.718 -9.397 88 HH12 ARG 10 2HH1 ARG 10 22.203 -21.473 -10.792 89 HH21 ARG 10 2HH2 ARG 10 21.470 -20.909 -12.888 90 HH22 ARG 10 1HH2 ARG 10 20.218 -19.729 -13.082 91 H VAL 11 H VAL 11 14.737 -19.582 -8.154 92 HA VAL 11 HA VAL 11 15.585 -19.843 -5.352 93 HB VAL 11 HB VAL 11 13.436 -18.635 -5.382 94 HG11 VAL 11 1HG1 VAL 11 11.627 -19.265 -6.561 95 HG12 VAL 11 2HG1 VAL 11 12.799 -20.164 -7.526 96 HG13 VAL 11 3HG1 VAL 11 11.894 -20.981 -6.251 97 HG21 VAL 11 3HG2 VAL 11 14.106 -20.340 -3.607 98 HG22 VAL 11 1HG2 VAL 11 12.400 -19.900 -3.695 99 HG23 VAL 11 2HG2 VAL 11 12.953 -21.427 -4.382 100 H ALA 12 H ALA 12 15.750 -21.909 -4.601 101 HA ALA 12 HA ALA 12 15.013 -24.068 -6.469 102 HB1 ALA 12 1HB ALA 12 17.335 -24.401 -4.634 103 HB2 ALA 12 2HB ALA 12 17.030 -25.123 -6.215 104 HB3 ALA 12 3HB ALA 12 17.537 -23.438 -6.098 105 H VAL 13 H VAL 13 13.589 -25.445 -5.653 106 HA VAL 13 HA VAL 13 12.969 -25.413 -2.828 107 HB VAL 13 HB VAL 13 11.116 -25.515 -4.373 108 HG11 VAL 13 1HG1 VAL 13 11.181 -26.688 -6.257 109 HG12 VAL 13 2HG1 VAL 13 12.780 -27.280 -5.804 110 HG13 VAL 13 3HG1 VAL 13 11.340 -28.193 -5.352 111 HG21 VAL 13 3HG2 VAL 13 11.333 -28.224 -3.076 112 HG22 VAL 13 1HG2 VAL 13 11.026 -26.740 -2.173 113 HG23 VAL 13 2HG2 VAL 13 9.874 -27.285 -3.392 114 H GLY 14 H GLY 14 13.504 -26.912 -1.345 115 HA2 GLY 14 2HA GLY 14 14.271 -29.586 -2.055 116 HA3 GLY 14 3HA GLY 14 15.645 -28.596 -1.586 117 H ARG 15 H ARG 15 15.986 -30.012 0.198 118 HA ARG 15 HA ARG 15 14.202 -29.413 2.455 119 HB2 ARG 15 2HB ARG 15 15.255 -32.098 1.597 120 HB3 ARG 15 3HB ARG 15 14.773 -31.790 3.260 121 HG2 ARG 15 2HG ARG 15 12.906 -32.772 2.246 122 HG3 ARG 15 3HG ARG 15 12.536 -31.048 2.318 123 HD2 ARG 15 2HD ARG 15 12.507 -30.842 0.083 124 HD3 ARG 15 3HD ARG 15 13.924 -31.871 -0.123 125 HE ARG 15 HE ARG 15 11.640 -33.396 0.604 126 HH11 ARG 15 1HH1 ARG 15 13.137 -31.746 -2.071 127 HH12 ARG 15 2HH1 ARG 15 12.397 -32.750 -3.273 128 HH21 ARG 15 2HH2 ARG 15 10.986 -34.443 -2.646 129 HH22 ARG 15 1HH2 ARG 15 10.659 -34.724 -0.969 130 H ASP 16 H ASP 16 15.191 -29.185 4.451 131 HA ASP 16 HA ASP 16 18.096 -28.820 4.336 132 HB2 ASP 16 2HB ASP 16 17.656 -27.638 6.582 133 HB3 ASP 16 3HB ASP 16 17.088 -26.848 5.114 134 H SER 17 H SER 17 18.966 -29.063 6.813 135 HA SER 17 HA SER 17 19.076 -31.861 7.229 136 HB2 SER 17 2HB SER 17 20.769 -29.933 7.857 137 HB3 SER 17 3HB SER 17 19.888 -29.951 9.384 138 HG SER 17 HG SER 17 21.802 -31.401 9.120 139 H SER 18 H SER 18 17.073 -29.341 8.515 140 HA SER 18 HA SER 18 16.150 -30.880 10.772 141 HB2 SER 18 2HB SER 18 15.780 -28.750 11.416 142 HB3 SER 18 3HB SER 18 15.803 -28.156 9.756 143 HG SER 18 HG SER 18 13.670 -28.912 11.341 144 H GLY 19 H GLY 19 14.481 -29.548 7.907 145 HA2 GLY 19 2HA GLY 19 13.195 -31.039 6.473 146 HA3 GLY 19 3HA GLY 19 12.796 -31.972 7.907 147 H CYS 20 H CYS 20 12.619 -28.514 7.051 148 HA CYS 20 HA CYS 20 9.826 -28.545 7.984 149 HB2 CYS 20 2HB CYS 20 12.046 -26.751 8.522 150 HB3 CYS 20 3HB CYS 20 10.652 -25.883 7.892 151 HG CYS 20 HG CYS 20 9.053 -27.441 9.928 152 H THR 21 H THR 21 11.319 -28.854 5.237 153 HA THR 21 HA THR 21 10.960 -28.299 3.054 154 HB THR 21 HB THR 21 8.175 -27.494 3.870 155 HG1 THR 21 HG1 THR 21 9.124 -30.153 3.464 156 HG21 THR 21 3HG2 THR 21 7.637 -28.628 1.701 157 HG22 THR 21 1HG2 THR 21 9.371 -28.781 1.417 158 HG23 THR 21 2HG2 THR 21 8.635 -27.183 1.540 159 H THR 22 H THR 22 12.358 -26.505 2.989 160 HA THR 22 HA THR 22 10.955 -23.946 2.704 161 HB THR 22 HB THR 22 11.877 -23.579 4.818 162 HG1 THR 22 HG1 THR 22 13.492 -22.055 4.419 163 HG21 THR 22 3HG2 THR 22 14.118 -25.282 3.832 164 HG22 THR 22 1HG2 THR 22 13.223 -25.368 5.349 165 HG23 THR 22 2HG2 THR 22 14.439 -24.112 5.111 166 H LEU 23 H LEU 23 12.096 -22.388 1.386 167 HA LEU 23 HA LEU 23 13.796 -23.708 -0.610 168 HB2 LEU 23 2HB LEU 23 11.894 -21.417 -0.681 169 HB3 LEU 23 3HB LEU 23 13.219 -21.456 -1.842 170 HG LEU 23 HG LEU 23 12.408 -23.509 -2.787 171 HD11 LEU 23 1HD1 LEU 23 10.649 -23.517 -0.383 172 HD12 LEU 23 2HD1 LEU 23 11.572 -24.831 -1.111 173 HD13 LEU 23 3HD1 LEU 23 10.079 -24.277 -1.869 174 HD21 LEU 23 3HD2 LEU 23 10.983 -22.358 -4.040 175 HD22 LEU 23 1HD2 LEU 23 11.003 -21.077 -2.828 176 HD23 LEU 23 2HD2 LEU 23 9.786 -22.351 -2.745 177 H SER 24 H SER 24 15.556 -22.449 -1.566 178 HA SER 24 HA SER 24 16.765 -20.594 0.380 179 HB2 SER 24 2HB SER 24 17.807 -22.960 0.047 180 HB3 SER 24 3HB SER 24 18.417 -22.293 -1.467 181 HG SER 24 HG SER 24 19.983 -21.767 -0.094 182 H ILE 25 H ILE 25 18.019 -18.878 -0.447 183 HA ILE 25 HA ILE 25 17.213 -18.061 -3.137 184 HB ILE 25 HB ILE 25 16.898 -16.532 -1.155 185 HG12 ILE 25 2HG1 ILE 25 18.621 -15.543 -3.437 186 HG13 ILE 25 3HG1 ILE 25 16.868 -15.699 -3.458 187 HG21 ILE 25 1HG2 ILE 25 19.142 -17.124 -0.162 188 HG22 ILE 25 2HG2 ILE 25 19.861 -16.073 -1.381 189 HG23 ILE 25 3HG2 ILE 25 18.743 -15.407 -0.191 190 HD11 ILE 25 3HD1 ILE 25 18.441 -13.858 -1.672 191 HD12 ILE 25 1HD1 ILE 25 17.573 -13.391 -3.134 192 HD13 ILE 25 2HD1 ILE 25 16.684 -13.996 -1.736 193 H GLN 26 H GLN 26 18.597 -17.826 -4.796 194 HA GLN 26 HA GLN 26 21.431 -18.431 -4.278 195 HB2 GLN 26 2HB GLN 26 19.600 -19.054 -6.559 196 HB3 GLN 26 3HB GLN 26 21.324 -18.894 -6.866 197 HG2 GLN 26 2HG GLN 26 21.636 -20.972 -6.196 198 HG3 GLN 26 3HG GLN 26 21.016 -20.554 -4.600 199 HE21 GLN 26 2HE2 GLN 26 17.631 -21.545 -5.553 200 HE22 GLN 26 1HE2 GLN 26 18.425 -20.143 -4.931 201 H GLU 27 H GLU 27 19.228 -16.093 -5.510 202 HA GLU 27 HA GLU 27 21.484 -14.478 -6.505 203 HB2 GLU 27 2HB GLU 27 19.252 -15.234 -7.908 204 HB3 GLU 27 3HB GLU 27 18.789 -13.644 -7.318 205 HG2 GLU 27 2HG GLU 27 19.775 -13.006 -9.243 206 HG3 GLU 27 3HG GLU 27 21.211 -13.034 -8.221 207 H VAL 28 H VAL 28 20.303 -12.023 -6.632 208 HA VAL 28 HA VAL 28 19.704 -11.451 -3.803 209 HB VAL 28 HB VAL 28 20.914 -9.499 -5.754 210 HG11 VAL 28 1HG1 VAL 28 20.814 -9.547 -2.740 211 HG12 VAL 28 2HG1 VAL 28 21.556 -8.293 -3.735 212 HG13 VAL 28 3HG1 VAL 28 19.811 -8.546 -3.788 213 HG21 VAL 28 3HG2 VAL 28 23.086 -9.993 -4.737 214 HG22 VAL 28 1HG2 VAL 28 22.348 -11.284 -3.790 215 HG23 VAL 28 2HG2 VAL 28 22.418 -11.409 -5.547 216 H THR 29 H THR 29 17.767 -10.637 -3.375 217 HA THR 29 HA THR 29 16.283 -9.319 -5.556 218 HB THR 29 HB THR 29 15.126 -11.336 -5.122 219 HG1 THR 29 HG1 THR 29 13.826 -9.366 -5.091 220 HG21 THR 29 3HG2 THR 29 15.255 -10.684 -2.176 221 HG22 THR 29 1HG2 THR 29 16.245 -11.891 -2.996 222 HG23 THR 29 2HG2 THR 29 14.497 -12.102 -2.899 223 H GLN 30 H GLN 30 17.670 -8.948 -2.512 224 HA GLN 30 HA GLN 30 15.830 -6.925 -1.560 225 HB2 GLN 30 2HB GLN 30 17.902 -8.540 -0.422 226 HB3 GLN 30 3HB GLN 30 18.256 -6.849 -0.096 227 HG2 GLN 30 2HG GLN 30 15.607 -8.144 0.491 228 HG3 GLN 30 3HG GLN 30 16.920 -8.010 1.660 229 HE21 GLN 30 2HE2 GLN 30 16.658 -4.347 1.604 230 HE22 GLN 30 1HE2 GLN 30 17.871 -5.529 1.267 231 H THR 31 H THR 31 17.953 -6.894 -3.970 232 HA THR 31 HA THR 31 18.931 -4.175 -3.397 233 HB THR 31 HB THR 31 20.496 -4.696 -5.396 234 HG1 THR 31 HG1 THR 31 19.950 -6.610 -6.192 235 HG21 THR 31 3HG2 THR 31 21.045 -6.328 -2.936 236 HG22 THR 31 1HG2 THR 31 21.041 -4.566 -2.886 237 HG23 THR 31 2HG2 THR 31 22.177 -5.416 -3.933 238 H TYR 32 H TYR 32 16.304 -5.221 -4.580 239 HA TYR 32 HA TYR 32 16.386 -3.595 -7.038 240 HB2 TYR 32 2HB TYR 32 16.003 -5.968 -7.541 241 HB3 TYR 32 3HB TYR 32 14.620 -5.982 -6.452 242 HD1 TYR 32 HD1 TYR 32 15.847 -3.981 -9.369 243 HD2 TYR 32 HD2 TYR 32 12.545 -5.842 -7.436 244 HE1 TYR 32 HE1 TYR 32 14.386 -3.305 -11.228 245 HE2 TYR 32 HE2 TYR 32 11.075 -5.171 -9.290 246 HH TYR 32 HH TYR 32 11.209 -3.146 -11.104 247 H THR 33 H THR 33 14.684 -2.186 -7.425 248 HA THR 33 HA THR 33 12.426 -2.019 -5.658 249 HB THR 33 HB THR 33 14.262 0.367 -5.605 250 HG1 THR 33 HG1 THR 33 14.144 -1.820 -3.781 251 HG21 THR 33 3HG2 THR 33 12.934 0.814 -3.512 252 HG22 THR 33 1HG2 THR 33 11.891 -0.530 -3.972 253 HG23 THR 33 2HG2 THR 33 12.011 0.888 -5.013 254 H GLY 34 H GLY 34 10.945 -0.271 -6.259 255 HA2 GLY 34 2HA GLY 34 11.389 1.374 -8.521 256 HA3 GLY 34 3HA GLY 34 10.546 -0.089 -9.010 257 H SER 35 H SER 35 9.100 -0.333 -6.485 258 HA SER 35 HA SER 35 7.110 1.775 -6.974 259 HB2 SER 35 2HB SER 35 6.509 -0.707 -5.405 260 HB3 SER 35 3HB SER 35 5.432 0.272 -6.402 261 HG SER 35 HG SER 35 7.463 -1.499 -7.288 262 H ASN 36 H ASN 36 6.462 3.123 -5.386 263 HA ASN 36 HA ASN 36 6.618 4.332 -3.459 264 HB2 ASN 36 2HB ASN 36 5.334 2.158 -2.824 265 HB3 ASN 36 3HB ASN 36 6.811 1.733 -1.964 266 HD21 ASN 36 2HD2 ASN 36 4.807 5.082 -0.719 267 HD22 ASN 36 1HD2 ASN 36 4.929 4.712 -2.403 268 H GLY 37 H GLY 37 9.132 3.575 -4.773 269 HA2 GLY 37 2HA GLY 37 10.913 4.423 -2.692 270 HA3 GLY 37 3HA GLY 37 11.170 2.743 -3.140 271 H GLY 38 H GLY 38 11.089 2.542 -5.725 272 HA2 GLY 38 2HA GLY 38 12.316 2.888 -7.635 273 HA3 GLY 38 3HA GLY 38 12.025 4.597 -7.345 274 H ALA 39 H ALA 39 14.217 1.917 -6.740 275 HA ALA 39 HA ALA 39 16.533 3.449 -7.039 276 HB1 ALA 39 1HB ALA 39 16.325 4.585 -5.061 277 HB2 ALA 39 2HB ALA 39 15.503 3.250 -4.252 278 HB3 ALA 39 3HB ALA 39 17.244 3.178 -4.526 279 H ASP 40 H ASP 40 16.100 1.186 -8.190 280 HA ASP 40 HA ASP 40 16.778 -1.161 -6.746 281 HB2 ASP 40 2HB ASP 40 17.011 -2.210 -8.953 282 HB3 ASP 40 3HB ASP 40 15.541 -1.245 -8.862 283 H LEU 41 H LEU 41 18.682 -1.469 -5.805 284 HA LEU 41 HA LEU 41 21.085 -1.661 -7.219 285 HB2 LEU 41 2HB LEU 41 20.501 0.959 -6.832 286 HB3 LEU 41 3HB LEU 41 21.441 0.610 -5.383 287 HG LEU 41 HG LEU 41 23.139 -0.393 -7.132 288 HD11 LEU 41 1HD1 LEU 41 21.456 1.501 -8.749 289 HD12 LEU 41 2HD1 LEU 41 21.908 -0.161 -9.128 290 HD13 LEU 41 3HD1 LEU 41 23.126 1.113 -9.165 291 HD21 LEU 41 3HD2 LEU 41 24.153 1.913 -7.301 292 HD22 LEU 41 1HD2 LEU 41 23.779 1.354 -5.671 293 HD23 LEU 41 2HD2 LEU 41 22.717 2.512 -6.470 294 H MET 42 H MET 42 22.966 -1.114 -5.273 295 HA MET 42 HA MET 42 22.112 -2.901 -3.093 296 HB2 MET 42 2HB MET 42 24.970 -2.492 -3.933 297 HB3 MET 42 3HB MET 42 24.279 -3.818 -3.007 298 HG2 MET 42 2HG MET 42 22.908 -4.101 -5.294 299 HG3 MET 42 3HG MET 42 24.395 -3.392 -5.918 300 HE1 MET 42 3HE MET 42 24.112 -5.472 -7.285 301 HE2 MET 42 1HE MET 42 25.854 -5.693 -7.111 302 HE3 MET 42 2HE MET 42 24.762 -7.053 -6.848 303 H GLY 43 H GLY 43 21.787 -1.826 -1.260 304 HA2 GLY 43 2HA GLY 43 23.850 -0.167 -0.149 305 HA3 GLY 43 3HA GLY 43 22.442 0.757 -0.649 306 HA PRO 44 HA PRO 44 20.297 -0.196 3.048 307 HB2 PRO 44 2HB PRO 44 17.806 -0.900 2.230 308 HB3 PRO 44 3HB PRO 44 18.410 0.759 2.149 309 HG2 PRO 44 2HG PRO 44 18.239 -1.303 -0.015 310 HG3 PRO 44 3HG PRO 44 17.844 0.424 -0.082 311 HD2 PRO 44 2HD PRO 44 20.175 -0.574 -1.031 312 HD3 PRO 44 3HD PRO 44 20.049 1.049 -0.322 313 H ALA 45 H ALA 45 20.574 -2.672 0.667 314 HA ALA 45 HA ALA 45 19.399 -4.785 2.198 315 HB1 ALA 45 1HB ALA 45 19.663 -4.736 -0.314 316 HB2 ALA 45 2HB ALA 45 21.368 -5.107 -0.053 317 HB3 ALA 45 3HB ALA 45 20.126 -6.240 0.483 318 H PHE 46 H PHE 46 22.713 -3.681 1.595 319 HA PHE 46 HA PHE 46 23.991 -5.740 3.049 320 HB2 PHE 46 2HB PHE 46 25.207 -4.385 1.428 321 HB3 PHE 46 3HB PHE 46 24.935 -2.941 2.397 322 HD1 PHE 46 HD1 PHE 46 26.711 -6.165 2.257 323 HD2 PHE 46 HD2 PHE 46 26.305 -2.432 4.261 324 HE1 PHE 46 HE1 PHE 46 28.805 -6.595 3.474 325 HE2 PHE 46 HE2 PHE 46 28.399 -2.855 5.481 326 HZ PHE 46 HZ PHE 46 29.653 -4.938 5.088 327 H ALA 47 H ALA 47 22.217 -3.007 4.040 328 HA ALA 47 HA ALA 47 23.477 -2.414 6.491 329 HB1 ALA 47 1HB ALA 47 20.615 -2.021 6.580 330 HB2 ALA 47 2HB ALA 47 21.918 -0.832 6.605 331 HB3 ALA 47 3HB ALA 47 21.304 -1.435 5.066 332 H ALA 48 H ALA 48 20.978 -4.740 5.603 333 HA ALA 48 HA ALA 48 20.785 -5.660 8.371 334 HB1 ALA 48 1HB ALA 48 18.746 -6.500 7.867 335 HB2 ALA 48 2HB ALA 48 18.843 -5.319 6.560 336 HB3 ALA 48 3HB ALA 48 19.233 -7.011 6.250 337 H GLY 49 H GLY 49 22.232 -6.506 5.356 338 HA2 GLY 49 2HA GLY 49 24.031 -8.060 5.235 339 HA3 GLY 49 3HA GLY 49 23.348 -8.912 6.612 340 H LEU 50 H LEU 50 21.075 -8.004 4.243 341 HA LEU 50 HA LEU 50 20.402 -10.698 3.666 342 HB2 LEU 50 2HB LEU 50 19.558 -8.319 2.041 343 HB3 LEU 50 3HB LEU 50 18.693 -9.834 2.292 344 HG LEU 50 HG LEU 50 19.078 -8.535 4.814 345 HD11 LEU 50 1HD1 LEU 50 18.402 -6.409 4.540 346 HD12 LEU 50 2HD1 LEU 50 17.326 -6.810 3.202 347 HD13 LEU 50 3HD1 LEU 50 19.055 -6.616 2.915 348 HD21 LEU 50 3HD2 LEU 50 16.481 -8.473 4.529 349 HD22 LEU 50 1HD2 LEU 50 17.321 -10.014 4.706 350 HD23 LEU 50 2HD2 LEU 50 16.813 -9.465 3.109 351 H ARG 51 H ARG 51 21.618 -11.994 2.460 352 HA ARG 51 HA ARG 51 22.485 -11.060 -0.169 353 HB2 ARG 51 2HB ARG 51 24.261 -11.812 2.064 354 HB3 ARG 51 3HB ARG 51 24.645 -12.558 0.519 355 HG2 ARG 51 2HG ARG 51 24.129 -9.657 0.463 356 HG3 ARG 51 3HG ARG 51 25.594 -10.178 1.298 357 HD2 ARG 51 2HD ARG 51 26.412 -11.272 -0.648 358 HD3 ARG 51 3HD ARG 51 24.865 -11.093 -1.475 359 HE ARG 51 HE ARG 51 25.484 -8.980 -2.088 360 HH11 ARG 51 1HH1 ARG 51 27.532 -10.048 0.517 361 HH12 ARG 51 2HH1 ARG 51 28.590 -8.680 0.420 362 HH21 ARG 51 2HH2 ARG 51 28.212 -7.045 -1.140 363 HH22 ARG 51 1HH2 ARG 51 26.870 -7.174 -2.226 364 H VAL 52 H VAL 52 23.597 -13.076 -1.312 365 HA VAL 52 HA VAL 52 21.562 -15.049 -1.528 366 HB VAL 52 HB VAL 52 22.969 -16.113 -3.184 367 HG11 VAL 52 1HG1 VAL 52 23.653 -13.414 -3.981 368 HG12 VAL 52 2HG1 VAL 52 22.479 -14.533 -4.677 369 HG13 VAL 52 3HG1 VAL 52 22.023 -13.508 -3.315 370 HG21 VAL 52 3HG2 VAL 52 25.113 -16.050 -2.137 371 HG22 VAL 52 1HG2 VAL 52 25.241 -15.165 -3.657 372 HG23 VAL 52 2HG2 VAL 52 25.124 -14.286 -2.133 373 H GLY 53 H GLY 53 21.388 -17.028 -0.644 374 HA2 GLY 53 2HA GLY 53 22.637 -19.050 0.101 375 HA3 GLY 53 3HA GLY 53 23.637 -17.951 1.039 376 H ASP 54 H ASP 54 21.003 -16.412 1.545 377 HA ASP 54 HA ASP 54 20.300 -17.961 3.923 378 HB2 ASP 54 2HB ASP 54 19.635 -15.106 3.170 379 HB3 ASP 54 3HB ASP 54 19.225 -15.879 4.699 380 H GLN 55 H GLN 55 18.508 -19.133 3.993 381 HA GLN 55 HA GLN 55 16.653 -19.178 1.840 382 HB2 GLN 55 2HB GLN 55 16.587 -20.460 4.574 383 HB3 GLN 55 3HB GLN 55 15.383 -20.757 3.327 384 HG2 GLN 55 2HG GLN 55 16.913 -21.853 1.944 385 HG3 GLN 55 3HG GLN 55 18.299 -21.215 2.826 386 HE21 GLN 55 2HE2 GLN 55 16.551 -24.668 3.918 387 HE22 GLN 55 1HE2 GLN 55 16.019 -23.731 2.568 388 H LEU 56 H LEU 56 15.244 -17.592 1.494 389 HA LEU 56 HA LEU 56 14.282 -15.895 3.593 390 HB2 LEU 56 2HB LEU 56 13.808 -16.114 0.652 391 HB3 LEU 56 3HB LEU 56 12.739 -15.120 1.639 392 HG LEU 56 HG LEU 56 14.425 -13.740 0.602 393 HD11 LEU 56 1HD1 LEU 56 15.325 -13.934 3.443 394 HD12 LEU 56 2HD1 LEU 56 13.666 -13.465 3.072 395 HD13 LEU 56 3HD1 LEU 56 15.012 -12.505 2.458 396 HD21 LEU 56 3HD2 LEU 56 16.701 -14.813 2.092 397 HD22 LEU 56 1HD2 LEU 56 16.593 -14.265 0.419 398 HD23 LEU 56 2HD2 LEU 56 16.081 -15.898 0.847 399 H VAL 57 H VAL 57 12.813 -16.582 5.000 400 HA VAL 57 HA VAL 57 10.639 -18.321 4.036 401 HB VAL 57 HB VAL 57 11.687 -17.982 6.849 402 HG11 VAL 57 1HG1 VAL 57 10.084 -20.273 6.644 403 HG12 VAL 57 2HG1 VAL 57 9.729 -18.785 7.525 404 HG13 VAL 57 3HG1 VAL 57 9.182 -18.977 5.858 405 HG21 VAL 57 3HG2 VAL 57 11.778 -20.631 5.631 406 HG22 VAL 57 1HG2 VAL 57 12.782 -19.443 4.799 407 HG23 VAL 57 2HG2 VAL 57 13.021 -19.749 6.519 408 H ARG 58 H ARG 58 11.218 -15.834 6.532 409 HA ARG 58 HA ARG 58 9.857 -14.237 7.421 410 HB2 ARG 58 2HB ARG 58 10.205 -13.505 4.977 411 HB3 ARG 58 3HB ARG 58 8.559 -14.063 4.712 412 HG2 ARG 58 2HG ARG 58 7.725 -12.486 6.346 413 HG3 ARG 58 3HG ARG 58 9.371 -11.967 6.715 414 HD2 ARG 58 2HD ARG 58 9.042 -11.764 3.918 415 HD3 ARG 58 3HD ARG 58 7.610 -11.051 4.659 416 HE ARG 58 HE ARG 58 9.594 -9.922 6.068 417 HH11 ARG 58 1HH1 ARG 58 9.091 -10.307 2.645 418 HH12 ARG 58 2HH1 ARG 58 9.942 -8.858 2.224 419 HH21 ARG 58 2HH2 ARG 58 10.868 -7.554 3.864 420 HH22 ARG 58 1HH2 ARG 58 10.718 -8.012 5.527 421 H PHE 59 H PHE 59 8.917 -17.016 7.487 422 HA PHE 59 HA PHE 59 6.112 -16.440 8.068 423 HB2 PHE 59 2HB PHE 59 7.080 -18.665 6.274 424 HB3 PHE 59 3HB PHE 59 5.497 -18.684 7.043 425 HD1 PHE 59 HD1 PHE 59 6.815 -18.283 4.027 426 HD2 PHE 59 HD2 PHE 59 4.518 -16.007 6.796 427 HE1 PHE 59 HE1 PHE 59 5.903 -16.950 2.171 428 HE2 PHE 59 HE2 PHE 59 3.602 -14.672 4.944 429 HZ PHE 59 HZ PHE 59 4.294 -15.143 2.627 430 H ALA 60 H ALA 60 5.247 -17.640 9.743 431 HA ALA 60 HA ALA 60 7.118 -18.739 11.595 432 HB1 ALA 60 1HB ALA 60 5.302 -17.601 12.551 433 HB2 ALA 60 2HB ALA 60 4.125 -18.493 11.586 434 HB3 ALA 60 3HB ALA 60 4.996 -19.306 12.886 435 H GLY 61 H GLY 61 8.040 -20.655 11.195 436 HA2 GLY 61 2HA GLY 61 7.259 -23.085 11.571 437 HA3 GLY 61 3HA GLY 61 6.377 -22.811 10.076 438 H TYR 62 H TYR 62 9.039 -21.030 9.663 439 HA TYR 62 HA TYR 62 10.948 -21.257 8.448 440 HB2 TYR 62 2HB TYR 62 11.171 -24.111 9.355 441 HB3 TYR 62 3HB TYR 62 12.452 -22.940 9.061 442 HD1 TYR 62 HD1 TYR 62 11.373 -24.779 11.567 443 HD2 TYR 62 HD2 TYR 62 11.614 -20.635 10.633 444 HE1 TYR 62 HE1 TYR 62 11.429 -24.247 13.968 445 HE2 TYR 62 HE2 TYR 62 11.672 -20.092 13.031 446 HH TYR 62 HH TYR 62 10.696 -21.885 15.346 447 H THR 63 H THR 63 8.503 -21.764 7.142 448 HA THR 63 HA THR 63 9.341 -23.763 5.143 449 HB THR 63 HB THR 63 7.405 -24.679 6.156 450 HG1 THR 63 HG1 THR 63 7.227 -24.815 3.932 451 HG21 THR 63 3HG2 THR 63 6.045 -23.348 7.318 452 HG22 THR 63 1HG2 THR 63 5.334 -22.830 5.790 453 HG23 THR 63 2HG2 THR 63 6.664 -21.914 6.499 454 H VAL 64 H VAL 64 8.688 -23.331 2.942 455 HA VAL 64 HA VAL 64 7.918 -20.572 2.350 456 HB VAL 64 HB VAL 64 10.281 -21.829 0.965 457 HG11 VAL 64 1HG1 VAL 64 10.699 -19.427 0.353 458 HG12 VAL 64 2HG1 VAL 64 9.251 -20.143 -0.358 459 HG13 VAL 64 3HG1 VAL 64 9.111 -19.055 1.024 460 HG21 VAL 64 3HG2 VAL 64 10.169 -20.167 3.449 461 HG22 VAL 64 1HG2 VAL 64 11.161 -21.580 3.089 462 HG23 VAL 64 2HG2 VAL 64 11.542 -20.024 2.351 463 H THR 65 H THR 65 7.156 -20.257 0.185 464 HA THR 65 HA THR 65 6.086 -22.730 -0.978 465 HB THR 65 HB THR 65 4.961 -20.433 -2.231 466 HG1 THR 65 HG1 THR 65 4.040 -19.472 -0.310 467 HG21 THR 65 3HG2 THR 65 4.010 -22.634 -0.441 468 HG22 THR 65 1HG2 THR 65 3.624 -22.323 -2.133 469 HG23 THR 65 2HG2 THR 65 2.919 -21.316 -0.869 470 H GLU 66 H GLU 66 6.981 -19.540 -2.301 471 HA GLU 66 HA GLU 66 9.012 -20.544 -3.998 472 HB2 GLU 66 2HB GLU 66 7.902 -20.337 -6.157 473 HB3 GLU 66 3HB GLU 66 7.097 -21.546 -5.167 474 HG2 GLU 66 2HG GLU 66 5.794 -19.129 -4.627 475 HG3 GLU 66 3HG GLU 66 6.032 -19.176 -6.373 476 H LEU 67 H LEU 67 9.266 -18.813 -5.941 477 HA LEU 67 HA LEU 67 10.074 -16.440 -4.769 478 HB2 LEU 67 2HB LEU 67 10.198 -15.536 -7.057 479 HB3 LEU 67 3HB LEU 67 10.925 -17.135 -6.902 480 HG LEU 67 HG LEU 67 8.585 -17.940 -7.777 481 HD11 LEU 67 1HD1 LEU 67 8.447 -15.061 -8.074 482 HD12 LEU 67 2HD1 LEU 67 7.181 -16.277 -8.238 483 HD13 LEU 67 3HD1 LEU 67 8.226 -15.902 -9.609 484 HD21 LEU 67 3HD2 LEU 67 9.533 -18.195 -9.871 485 HD22 LEU 67 1HD2 LEU 67 10.949 -17.967 -8.845 486 HD23 LEU 67 2HD2 LEU 67 10.338 -16.625 -9.813 487 H ALA 68 H ALA 68 6.952 -17.348 -6.023 488 HA ALA 68 HA ALA 68 5.832 -14.762 -6.242 489 HB1 ALA 68 1HB ALA 68 4.118 -17.090 -5.535 490 HB2 ALA 68 2HB ALA 68 3.855 -15.809 -6.720 491 HB3 ALA 68 3HB ALA 68 4.988 -17.114 -7.070 492 H ALA 69 H ALA 69 6.120 -17.036 -3.574 493 HA ALA 69 HA ALA 69 4.374 -15.683 -1.794 494 HB1 ALA 69 1HB ALA 69 4.933 -17.274 -0.263 495 HB2 ALA 69 2HB ALA 69 5.445 -18.103 -1.733 496 HB3 ALA 69 3HB ALA 69 6.635 -17.281 -0.724 497 H PHE 70 H PHE 70 7.790 -15.390 -2.536 498 HA PHE 70 HA PHE 70 8.302 -13.590 -0.337 499 HB2 PHE 70 2HB PHE 70 10.037 -15.148 -1.202 500 HB3 PHE 70 3HB PHE 70 10.051 -14.248 -2.715 501 HD1 PHE 70 HD1 PHE 70 10.758 -14.010 0.903 502 HD2 PHE 70 HD2 PHE 70 11.296 -12.266 -2.942 503 HE1 PHE 70 HE1 PHE 70 12.441 -12.478 1.838 504 HE2 PHE 70 HE2 PHE 70 12.981 -10.732 -2.014 505 HZ PHE 70 HZ PHE 70 13.556 -10.837 0.379 506 H ASN 71 H ASN 71 7.463 -13.372 -3.705 507 HA ASN 71 HA ASN 71 8.203 -10.635 -4.046 508 HB2 ASN 71 2HB ASN 71 7.760 -12.513 -5.830 509 HB3 ASN 71 3HB ASN 71 6.094 -11.951 -5.718 510 HD21 ASN 71 2HD2 ASN 71 6.634 -9.356 -7.903 511 HD22 ASN 71 1HD2 ASN 71 5.577 -10.523 -7.191 512 H THR 72 H THR 72 5.210 -12.329 -3.245 513 HA THR 72 HA THR 72 3.511 -10.072 -3.335 514 HB THR 72 HB THR 72 2.564 -12.299 -3.394 515 HG1 THR 72 HG1 THR 72 1.144 -10.840 -2.521 516 HG21 THR 72 3HG2 THR 72 4.282 -13.354 -1.920 517 HG22 THR 72 1HG2 THR 72 2.626 -13.814 -1.529 518 HG23 THR 72 2HG2 THR 72 3.470 -12.628 -0.533 519 H VAL 73 H VAL 73 5.369 -11.568 -0.723 520 HA VAL 73 HA VAL 73 4.370 -9.875 1.333 521 HB VAL 73 HB VAL 73 6.303 -10.692 2.658 522 HG11 VAL 73 1HG1 VAL 73 4.512 -12.087 2.955 523 HG12 VAL 73 2HG1 VAL 73 4.427 -12.524 1.248 524 HG13 VAL 73 3HG1 VAL 73 5.679 -13.222 2.277 525 HG21 VAL 73 3HG2 VAL 73 7.714 -12.480 1.636 526 HG22 VAL 73 1HG2 VAL 73 7.034 -12.048 0.067 527 HG23 VAL 73 2HG2 VAL 73 7.991 -10.872 0.968 528 H VAL 74 H VAL 74 7.213 -9.778 -0.762 529 HA VAL 74 HA VAL 74 8.477 -7.579 0.485 530 HB VAL 74 HB VAL 74 8.698 -8.745 -2.281 531 HG11 VAL 74 1HG1 VAL 74 10.777 -7.258 -2.426 532 HG12 VAL 74 2HG1 VAL 74 9.208 -6.501 -2.706 533 HG13 VAL 74 3HG1 VAL 74 10.022 -6.299 -1.154 534 HG21 VAL 74 3HG2 VAL 74 10.325 -10.010 -1.424 535 HG22 VAL 74 1HG2 VAL 74 11.067 -8.635 -0.605 536 HG23 VAL 74 2HG2 VAL 74 9.740 -9.508 0.163 537 H ALA 75 H ALA 75 6.174 -7.818 -2.187 538 HA ALA 75 HA ALA 75 6.213 -5.172 -3.051 539 HB1 ALA 75 1HB ALA 75 3.952 -5.602 -3.925 540 HB2 ALA 75 2HB ALA 75 5.076 -6.910 -4.294 541 HB3 ALA 75 3HB ALA 75 3.897 -7.102 -2.998 542 H ARG 76 H ARG 76 4.287 -6.688 -0.486 543 HA ARG 76 HA ARG 76 2.954 -4.227 0.182 544 HB2 ARG 76 2HB ARG 76 2.950 -7.019 1.239 545 HB3 ARG 76 3HB ARG 76 2.358 -5.730 2.279 546 HG2 ARG 76 2HG ARG 76 0.563 -6.843 1.026 547 HG3 ARG 76 3HG ARG 76 0.688 -5.123 0.649 548 HD2 ARG 76 2HD ARG 76 1.803 -5.593 -1.418 549 HD3 ARG 76 3HD ARG 76 1.937 -7.304 -1.013 550 HE ARG 76 HE ARG 76 -0.303 -6.000 -2.185 551 HH11 ARG 76 1HH1 ARG 76 0.605 -8.572 -0.022 552 HH12 ARG 76 2HH1 ARG 76 -0.824 -9.505 -0.322 553 HH21 ARG 76 2HH2 ARG 76 -2.412 -8.734 -1.783 554 HH22 ARG 76 1HH2 ARG 76 -2.189 -7.218 -2.588 555 H HIS 77 H HIS 77 5.835 -5.882 1.155 556 HA HIS 77 HA HIS 77 6.151 -4.490 3.647 557 HB2 HIS 77 2HB HIS 77 7.696 -6.466 2.075 558 HB3 HIS 77 3HB HIS 77 8.640 -5.402 3.113 559 HD1 HIS 77 HD1 HIS 77 6.972 -8.543 3.184 560 HD2 HIS 77 HD2 HIS 77 7.478 -5.445 5.906 561 HE1 HIS 77 HE1 HIS 77 6.508 -9.550 5.441 562 H VAL 78 H VAL 78 7.025 -3.941 0.332 563 HA VAL 78 HA VAL 78 9.148 -2.179 0.566 564 HB VAL 78 HB VAL 78 6.888 -2.236 -1.428 565 HG11 VAL 78 1HG1 VAL 78 8.977 -0.231 -1.029 566 HG12 VAL 78 2HG1 VAL 78 8.926 -0.894 -2.663 567 HG13 VAL 78 3HG1 VAL 78 7.487 -0.147 -1.969 568 HG21 VAL 78 3HG2 VAL 78 8.066 -3.840 -2.418 569 HG22 VAL 78 1HG2 VAL 78 9.493 -2.805 -2.470 570 HG23 VAL 78 2HG2 VAL 78 9.189 -3.817 -1.058 571 H ARG 79 H ARG 79 9.198 -0.564 2.008 572 HA ARG 79 HA ARG 79 7.331 1.625 1.690 573 HB2 ARG 79 2HB ARG 79 7.102 -0.267 3.872 574 HB3 ARG 79 3HB ARG 79 7.426 1.354 4.473 575 HG2 ARG 79 2HG ARG 79 5.509 1.948 2.722 576 HG3 ARG 79 3HG ARG 79 5.048 0.283 3.081 577 HD2 ARG 79 2HD ARG 79 5.725 1.784 5.473 578 HD3 ARG 79 3HD ARG 79 4.409 2.530 4.567 579 HE ARG 79 HE ARG 79 3.983 -0.257 4.845 580 HH11 ARG 79 1HH1 ARG 79 3.857 2.737 6.616 581 HH12 ARG 79 2HH1 ARG 79 2.641 2.184 7.720 582 HH21 ARG 79 2HH2 ARG 79 1.804 0.059 7.536 583 HH22 ARG 79 1HH2 ARG 79 2.383 -0.997 6.292 584 HA PRO 80 HA PRO 80 10.845 4.057 2.684 585 HB2 PRO 80 2HB PRO 80 9.709 6.207 3.891 586 HB3 PRO 80 3HB PRO 80 9.583 5.902 2.154 587 HG2 PRO 80 2HG PRO 80 7.602 5.333 4.326 588 HG3 PRO 80 3HG PRO 80 7.328 6.013 2.711 589 HD2 PRO 80 2HD PRO 80 6.844 3.415 3.300 590 HD3 PRO 80 3HD PRO 80 7.384 3.946 1.694 591 H SER 81 H SER 81 12.185 3.231 4.189 592 HA SER 81 HA SER 81 13.158 2.803 6.200 593 HB2 SER 81 2HB SER 81 11.318 4.829 7.456 594 HB3 SER 81 3HB SER 81 12.985 4.443 7.881 595 HG SER 81 HG SER 81 12.223 6.387 6.367 596 H ALA 82 H ALA 82 11.024 1.147 5.448 597 HA ALA 82 HA ALA 82 9.475 0.688 7.883 598 HB1 ALA 82 1HB ALA 82 7.936 0.282 6.313 599 HB2 ALA 82 2HB ALA 82 9.148 0.047 5.053 600 HB3 ALA 82 3HB ALA 82 8.732 -1.282 6.135 601 H SER 83 H SER 83 10.345 -0.547 9.404 602 HA SER 83 HA SER 83 12.253 -2.639 8.634 603 HB2 SER 83 2HB SER 83 11.741 -1.801 11.472 604 HB3 SER 83 3HB SER 83 13.211 -2.462 10.756 605 HG SER 83 HG SER 83 12.335 0.139 10.898 606 H ILE 84 H ILE 84 11.928 -4.763 9.097 607 HA ILE 84 HA ILE 84 9.704 -5.582 10.771 608 HB ILE 84 HB ILE 84 8.672 -5.273 8.545 609 HG12 ILE 84 2HG1 ILE 84 8.007 -7.841 8.342 610 HG13 ILE 84 3HG1 ILE 84 8.863 -7.935 9.877 611 HG21 ILE 84 1HG2 ILE 84 9.566 -6.026 6.642 612 HG22 ILE 84 2HG2 ILE 84 11.039 -6.278 7.577 613 HG23 ILE 84 3HG2 ILE 84 9.911 -7.611 7.333 614 HD11 ILE 84 3HD1 ILE 84 6.245 -6.818 9.249 615 HD12 ILE 84 1HD1 ILE 84 6.889 -7.425 10.774 616 HD13 ILE 84 2HD1 ILE 84 7.245 -5.775 10.260 617 HA PRO 85 HA PRO 85 12.713 -8.702 11.670 618 HB2 PRO 85 2HB PRO 85 11.127 -10.258 13.231 619 HB3 PRO 85 3HB PRO 85 11.815 -8.727 13.785 620 HG2 PRO 85 2HG PRO 85 9.065 -9.306 12.752 621 HG3 PRO 85 3HG PRO 85 9.554 -8.306 14.133 622 HD2 PRO 85 2HD PRO 85 8.882 -7.247 11.734 623 HD3 PRO 85 3HD PRO 85 10.092 -6.505 12.800 624 H VAL 86 H VAL 86 13.231 -9.987 9.992 625 HA VAL 86 HA VAL 86 11.195 -11.804 8.908 626 HB VAL 86 HB VAL 86 13.915 -11.173 7.758 627 HG11 VAL 86 1HG1 VAL 86 11.538 -12.716 6.773 628 HG12 VAL 86 2HG1 VAL 86 12.729 -12.040 5.660 629 HG13 VAL 86 3HG1 VAL 86 13.223 -13.223 6.871 630 HG21 VAL 86 3HG2 VAL 86 12.628 -9.144 7.778 631 HG22 VAL 86 1HG2 VAL 86 12.652 -9.778 6.132 632 HG23 VAL 86 2HG2 VAL 86 11.216 -9.982 7.134 633 H VAL 87 H VAL 87 11.600 -14.019 8.672 634 HA VAL 87 HA VAL 87 13.608 -15.065 10.543 635 HB VAL 87 HB VAL 87 11.156 -16.389 9.377 636 HG11 VAL 87 1HG1 VAL 87 12.725 -18.117 9.677 637 HG12 VAL 87 2HG1 VAL 87 13.315 -17.429 11.192 638 HG13 VAL 87 3HG1 VAL 87 11.709 -18.156 11.118 639 HG21 VAL 87 3HG2 VAL 87 11.752 -15.000 11.935 640 HG22 VAL 87 1HG2 VAL 87 10.267 -15.035 10.984 641 HG23 VAL 87 2HG2 VAL 87 10.704 -16.417 11.988 642 H PHE 88 H PHE 88 15.298 -16.217 9.854 643 HA PHE 88 HA PHE 88 15.292 -17.162 7.063 644 HB2 PHE 88 2HB PHE 88 17.720 -16.164 8.559 645 HB3 PHE 88 3HB PHE 88 17.615 -16.582 6.852 646 HD1 PHE 88 HD1 PHE 88 16.796 -15.035 5.250 647 HD2 PHE 88 HD2 PHE 88 16.621 -14.124 9.404 648 HE1 PHE 88 HE1 PHE 88 16.251 -12.697 4.711 649 HE2 PHE 88 HE2 PHE 88 16.075 -11.785 8.872 650 HZ PHE 88 HZ PHE 88 15.888 -11.069 6.522 651 H SER 89 H SER 89 16.465 -19.075 6.620 652 HA SER 89 HA SER 89 17.163 -20.678 8.990 653 HB2 SER 89 2HB SER 89 15.225 -21.255 6.840 654 HB3 SER 89 3HB SER 89 16.318 -22.582 7.233 655 HG SER 89 HG SER 89 14.524 -21.223 8.949 656 H ARG 90 H ARG 90 18.846 -22.158 8.748 657 HA ARG 90 HA ARG 90 20.284 -22.152 6.194 658 HB2 ARG 90 2HB ARG 90 21.279 -21.146 8.814 659 HB3 ARG 90 3HB ARG 90 22.403 -22.046 7.805 660 HG2 ARG 90 2HG ARG 90 22.088 -20.480 5.992 661 HG3 ARG 90 3HG ARG 90 20.871 -19.608 6.927 662 HD2 ARG 90 2HD ARG 90 22.505 -18.938 8.545 663 HD3 ARG 90 3HD ARG 90 23.729 -19.972 7.808 664 HE ARG 90 HE ARG 90 23.070 -18.316 5.791 665 HH11 ARG 90 1HH1 ARG 90 23.954 -17.751 9.111 666 HH12 ARG 90 2HH1 ARG 90 24.682 -16.212 8.791 667 HH21 ARG 90 2HH2 ARG 90 24.722 -15.382 6.656 668 HH22 ARG 90 1HH2 ARG 90 24.026 -16.291 5.358 669 H ASP 91 H ASP 91 19.931 -24.270 5.743 670 HA ASP 91 HA ASP 91 20.169 -26.531 5.826 671 HB2 ASP 91 2HB ASP 91 22.193 -26.260 8.022 672 HB3 ASP 91 3HB ASP 91 22.165 -27.386 6.667 673 H GLY 92 H GLY 92 18.258 -25.193 7.585 674 HA2 GLY 92 2HA GLY 92 16.617 -26.340 8.882 675 HA3 GLY 92 3HA GLY 92 17.878 -27.413 9.470 676 H VAL 93 H VAL 93 19.417 -24.653 9.702 677 HA VAL 93 HA VAL 93 19.107 -24.423 12.504 678 HB VAL 93 HB VAL 93 20.421 -22.558 10.526 679 HG11 VAL 93 1HG1 VAL 93 21.600 -21.674 12.564 680 HG12 VAL 93 2HG1 VAL 93 19.892 -21.246 12.437 681 HG13 VAL 93 3HG1 VAL 93 20.402 -22.527 13.537 682 HG21 VAL 93 3HG2 VAL 93 22.320 -23.759 10.766 683 HG22 VAL 93 1HG2 VAL 93 21.995 -24.133 12.459 684 HG23 VAL 93 2HG2 VAL 93 21.197 -25.053 11.183 685 H VAL 94 H VAL 94 18.095 -22.890 13.761 686 HA VAL 94 HA VAL 94 16.063 -21.269 12.379 687 HB VAL 94 HB VAL 94 16.077 -22.285 15.225 688 HG11 VAL 94 1HG1 VAL 94 14.977 -20.114 15.037 689 HG12 VAL 94 2HG1 VAL 94 13.967 -20.732 13.728 690 HG13 VAL 94 3HG1 VAL 94 13.805 -21.393 15.355 691 HG21 VAL 94 3HG2 VAL 94 14.154 -23.650 14.461 692 HG22 VAL 94 1HG2 VAL 94 14.465 -23.107 12.812 693 HG23 VAL 94 2HG2 VAL 94 15.668 -24.077 13.663 694 H MET 95 H MET 95 16.611 -19.201 12.209 695 HA MET 95 HA MET 95 17.699 -17.838 14.563 696 HB2 MET 95 2HB MET 95 19.468 -18.501 12.759 697 HB3 MET 95 3HB MET 95 18.780 -17.163 11.849 698 HG2 MET 95 2HG MET 95 20.675 -16.347 13.019 699 HG3 MET 95 3HG MET 95 19.239 -15.688 13.799 700 HE1 MET 95 3HE MET 95 22.074 -15.605 15.264 701 HE2 MET 95 1HE MET 95 22.554 -17.081 16.102 702 HE3 MET 95 2HE MET 95 22.569 -17.025 14.340 703 H SER 96 H SER 96 17.431 -15.496 14.487 704 HA SER 96 HA SER 96 15.440 -14.542 12.562 705 HB2 SER 96 2HB SER 96 13.910 -13.808 14.177 706 HB3 SER 96 3HB SER 96 14.402 -15.388 14.785 707 HG SER 96 HG SER 96 15.619 -14.434 16.322 708 H ALA 97 H ALA 97 15.874 -12.556 11.838 709 HA ALA 97 HA ALA 97 17.458 -10.727 13.482 710 HB1 ALA 97 1HB ALA 97 18.872 -10.182 11.475 711 HB2 ALA 97 2HB ALA 97 19.164 -11.764 12.198 712 HB3 ALA 97 3HB ALA 97 18.219 -11.634 10.715 713 H THR 98 H THR 98 16.956 -8.603 13.207 714 HA THR 98 HA THR 98 14.584 -8.019 11.653 715 HB THR 98 HB THR 98 16.223 -6.163 13.390 716 HG1 THR 98 HG1 THR 98 13.941 -7.772 13.954 717 HG21 THR 98 3HG2 THR 98 14.943 -4.638 12.324 718 HG22 THR 98 1HG2 THR 98 13.686 -5.210 13.419 719 HG23 THR 98 2HG2 THR 98 13.780 -5.844 11.776 720 H ILE 99 H ILE 99 14.578 -7.185 9.675 721 HA ILE 99 HA ILE 99 17.039 -5.892 8.695 722 HB ILE 99 HB ILE 99 16.328 -6.547 6.423 723 HG12 ILE 99 2HG1 ILE 99 14.531 -8.640 6.926 724 HG13 ILE 99 3HG1 ILE 99 13.913 -7.272 7.846 725 HG21 ILE 99 1HG2 ILE 99 17.475 -8.459 6.605 726 HG22 ILE 99 2HG2 ILE 99 17.557 -8.080 8.325 727 HG23 ILE 99 3HG2 ILE 99 16.304 -9.163 7.719 728 HD11 ILE 99 3HD1 ILE 99 12.861 -7.041 5.811 729 HD12 ILE 99 1HD1 ILE 99 14.244 -5.959 5.646 730 HD13 ILE 99 2HD1 ILE 99 14.281 -7.557 4.900 731 H VAL 100 H VAL 100 16.910 -3.816 8.159 732 HA VAL 100 HA VAL 100 14.240 -2.615 7.856 733 HB VAL 100 HB VAL 100 16.824 -1.189 8.491 734 HG11 VAL 100 1HG1 VAL 100 15.463 0.462 7.678 735 HG12 VAL 100 2HG1 VAL 100 13.983 -0.357 8.181 736 HG13 VAL 100 3HG1 VAL 100 14.983 0.472 9.375 737 HG21 VAL 100 3HG2 VAL 100 15.126 -1.106 10.711 738 HG22 VAL 100 1HG2 VAL 100 15.124 -2.786 10.177 739 HG23 VAL 100 2HG2 VAL 100 16.647 -1.985 10.561 740 H VAL 101 H VAL 101 13.670 -2.260 5.820 741 HA VAL 101 HA VAL 101 15.750 -1.714 3.821 742 HB VAL 101 HB VAL 101 12.851 -2.390 3.322 743 HG11 VAL 101 1HG1 VAL 101 14.075 -3.146 1.101 744 HG12 VAL 101 2HG1 VAL 101 13.537 -1.483 1.343 745 HG13 VAL 101 3HG1 VAL 101 15.228 -1.911 1.605 746 HG21 VAL 101 3HG2 VAL 101 13.573 -4.659 2.865 747 HG22 VAL 101 1HG2 VAL 101 15.240 -4.231 3.251 748 HG23 VAL 101 2HG2 VAL 101 14.009 -4.212 4.514 749 H GLY 102 H GLY 102 15.990 0.259 2.991 750 HA2 GLY 102 2HA GLY 102 13.912 2.262 3.587 751 HA3 GLY 102 3HA GLY 102 15.611 2.618 3.313 752 H GLU 103 H GLU 103 12.558 2.573 1.943 753 HA GLU 103 HA GLU 103 13.502 2.290 -0.799 754 HB2 GLU 103 2HB GLU 103 10.888 2.247 0.561 755 HB3 GLU 103 3HB GLU 103 10.885 3.021 -1.018 756 HG2 GLU 103 2HG GLU 103 10.472 0.908 -1.689 757 HG3 GLU 103 3HG GLU 103 12.233 0.822 -1.660 758 H LEU 104 H LEU 104 12.574 4.753 1.471 759 HA LEU 104 HA LEU 104 13.449 6.798 -0.405 760 HB2 LEU 104 2HB LEU 104 10.783 6.984 0.988 761 HB3 LEU 104 3HB LEU 104 11.498 8.188 -0.081 762 HG LEU 104 HG LEU 104 10.753 5.422 -1.007 763 HD11 LEU 104 1HD1 LEU 104 9.081 7.860 -0.661 764 HD12 LEU 104 2HD1 LEU 104 8.661 6.162 -0.447 765 HD13 LEU 104 3HD1 LEU 104 8.812 6.834 -2.070 766 HD21 LEU 104 3HD2 LEU 104 11.125 7.981 -2.553 767 HD22 LEU 104 1HD2 LEU 104 10.914 6.353 -3.198 768 HD23 LEU 104 2HD2 LEU 104 12.391 6.772 -2.329 769 H GLU 105 H GLU 105 14.680 8.261 0.591 770 HA GLU 105 HA GLU 105 14.993 8.124 3.458 771 HB2 GLU 105 2HB GLU 105 16.358 9.937 1.461 772 HB3 GLU 105 3HB GLU 105 16.847 9.675 3.129 773 HG2 GLU 105 2HG GLU 105 16.703 7.418 1.166 774 HG3 GLU 105 3HG GLU 105 18.127 8.449 1.294 Start of MODEL 10 1 HA PRO 1 HA PRO 1 2.387 2.260 -2.420 2 HB2 PRO 1 2HB PRO 1 4.542 0.712 -1.845 3 HB3 PRO 1 3HB PRO 1 4.384 2.383 -1.290 4 HG2 PRO 1 2HG PRO 1 3.852 -0.164 0.191 5 HG3 PRO 1 3HG PRO 1 4.676 1.304 0.749 6 HD2 PRO 1 2HD PRO 1 2.101 0.749 1.379 7 HD3 PRO 1 3HD PRO 1 2.696 2.408 1.165 8 H LEU 2 H LEU 2 3.519 0.555 -3.908 9 HA LEU 2 HA LEU 2 2.636 -2.148 -3.733 10 HB2 LEU 2 2HB LEU 2 0.847 -0.256 -4.896 11 HB3 LEU 2 3HB LEU 2 1.440 -1.327 -6.163 12 HG LEU 2 HG LEU 2 0.570 -2.749 -3.767 13 HD11 LEU 2 1HD1 LEU 2 -1.222 -1.442 -3.376 14 HD12 LEU 2 2HD1 LEU 2 -1.892 -2.308 -4.758 15 HD13 LEU 2 3HD1 LEU 2 -1.176 -0.712 -4.981 16 HD21 LEU 2 3HD2 LEU 2 0.177 -4.336 -5.283 17 HD22 LEU 2 1HD2 LEU 2 0.948 -3.264 -6.452 18 HD23 LEU 2 2HD2 LEU 2 -0.807 -3.257 -6.274 19 H THR 3 H THR 3 3.421 -3.457 -5.468 20 HA THR 3 HA THR 3 5.341 -2.108 -7.246 21 HB THR 3 HB THR 3 6.397 -3.298 -5.230 22 HG1 THR 3 HG1 THR 3 8.098 -4.037 -6.580 23 HG21 THR 3 3HG2 THR 3 6.241 -5.530 -4.978 24 HG22 THR 3 1HG2 THR 3 6.335 -5.830 -6.712 25 HG23 THR 3 2HG2 THR 3 4.797 -5.377 -5.978 26 H ARG 4 H ARG 4 6.063 -3.578 -9.057 27 HA ARG 4 HA ARG 4 3.698 -4.862 -10.181 28 HB2 ARG 4 2HB ARG 4 6.091 -3.536 -11.250 29 HB3 ARG 4 3HB ARG 4 5.620 -4.983 -12.132 30 HG2 ARG 4 2HG ARG 4 3.234 -3.835 -11.989 31 HG3 ARG 4 3HG ARG 4 4.230 -2.383 -11.865 32 HD2 ARG 4 2HD ARG 4 5.356 -2.940 -13.934 33 HD3 ARG 4 3HD ARG 4 4.470 -4.461 -14.037 34 HE ARG 4 HE ARG 4 2.683 -2.266 -13.905 35 HH11 ARG 4 1HH1 ARG 4 4.866 -3.912 -16.061 36 HH12 ARG 4 2HH1 ARG 4 4.014 -3.441 -17.494 37 HH21 ARG 4 2HH2 ARG 4 2.130 -2.147 -17.336 38 HH22 ARG 4 1HH2 ARG 4 1.553 -1.639 -15.785 39 HA PRO 5 HA PRO 5 5.092 -9.004 -9.799 40 HB2 PRO 5 2HB PRO 5 4.353 -10.094 -12.173 41 HB3 PRO 5 3HB PRO 5 3.191 -9.648 -10.918 42 HG2 PRO 5 2HG PRO 5 3.980 -8.151 -13.387 43 HG3 PRO 5 3HG PRO 5 2.365 -8.399 -12.697 44 HD2 PRO 5 2HD PRO 5 3.755 -6.099 -12.362 45 HD3 PRO 5 3HD PRO 5 2.640 -6.728 -11.133 46 H TYR 6 H TYR 6 7.374 -8.157 -9.859 47 HA TYR 6 HA TYR 6 8.751 -9.166 -12.260 48 HB2 TYR 6 2HB TYR 6 8.913 -6.569 -10.994 49 HB3 TYR 6 3HB TYR 6 10.488 -7.356 -11.011 50 HD1 TYR 6 HD1 TYR 6 8.190 -5.415 -12.874 51 HD2 TYR 6 HD2 TYR 6 11.242 -8.349 -13.299 52 HE1 TYR 6 HE1 TYR 6 8.484 -4.760 -15.227 53 HE2 TYR 6 HE2 TYR 6 11.545 -7.702 -15.652 54 HH TYR 6 HH TYR 6 9.413 -6.062 -17.397 55 H LEU 7 H LEU 7 10.663 -10.312 -11.949 56 HA LEU 7 HA LEU 7 11.146 -11.179 -9.175 57 HB2 LEU 7 2HB LEU 7 11.960 -13.292 -10.127 58 HB3 LEU 7 3HB LEU 7 10.269 -12.977 -10.512 59 HG LEU 7 HG LEU 7 11.821 -11.968 -12.654 60 HD11 LEU 7 1HD1 LEU 7 12.443 -14.857 -12.403 61 HD12 LEU 7 2HD1 LEU 7 13.442 -13.718 -11.501 62 HD13 LEU 7 3HD1 LEU 7 13.310 -13.578 -13.254 63 HD21 LEU 7 3HD2 LEU 7 9.679 -12.695 -13.134 64 HD22 LEU 7 1HD2 LEU 7 9.871 -14.194 -12.224 65 HD23 LEU 7 2HD2 LEU 7 10.671 -14.001 -13.784 66 H GLY 8 H GLY 8 13.107 -10.847 -8.333 67 HA2 GLY 8 2HA GLY 8 15.317 -10.221 -10.191 68 HA3 GLY 8 3HA GLY 8 15.036 -9.279 -8.734 69 H PHE 9 H PHE 9 14.692 -12.766 -8.917 70 HA PHE 9 HA PHE 9 17.269 -13.453 -8.016 71 HB2 PHE 9 2HB PHE 9 16.922 -13.867 -5.685 72 HB3 PHE 9 3HB PHE 9 16.422 -12.208 -5.996 73 HD1 PHE 9 HD1 PHE 9 13.949 -11.737 -6.274 74 HD2 PHE 9 HD2 PHE 9 15.455 -15.403 -4.723 75 HE1 PHE 9 HE1 PHE 9 11.753 -12.211 -5.272 76 HE2 PHE 9 HE2 PHE 9 13.261 -15.883 -3.719 77 HZ PHE 9 HZ PHE 9 11.406 -14.287 -3.993 78 H ARG 10 H ARG 10 17.306 -15.740 -7.117 79 HA ARG 10 HA ARG 10 15.164 -17.303 -8.404 80 HB2 ARG 10 2HB ARG 10 18.116 -17.615 -8.331 81 HB3 ARG 10 3HB ARG 10 17.161 -19.090 -8.253 82 HG2 ARG 10 2HG ARG 10 16.117 -17.426 -10.318 83 HG3 ARG 10 3HG ARG 10 17.862 -17.579 -10.524 84 HD2 ARG 10 2HD ARG 10 17.750 -19.916 -10.681 85 HD3 ARG 10 3HD ARG 10 16.123 -19.968 -10.004 86 HE ARG 10 HE ARG 10 16.079 -18.509 -12.406 87 HH11 ARG 10 1HH1 ARG 10 16.492 -21.765 -11.244 88 HH12 ARG 10 2HH1 ARG 10 15.875 -22.497 -12.687 89 HH21 ARG 10 2HH2 ARG 10 15.177 -21.186 -14.432 90 HH22 ARG 10 1HH2 ARG 10 15.264 -19.461 -14.311 91 H VAL 11 H VAL 11 14.399 -19.166 -7.369 92 HA VAL 11 HA VAL 11 15.244 -19.560 -4.583 93 HB VAL 11 HB VAL 11 13.233 -18.181 -4.502 94 HG11 VAL 11 1HG1 VAL 11 12.458 -19.582 -6.746 95 HG12 VAL 11 2HG1 VAL 11 11.370 -20.181 -5.492 96 HG13 VAL 11 3HG1 VAL 11 11.461 -18.452 -5.830 97 HG21 VAL 11 3HG2 VAL 11 11.937 -19.535 -3.003 98 HG22 VAL 11 1HG2 VAL 11 12.571 -21.016 -3.721 99 HG23 VAL 11 2HG2 VAL 11 13.637 -19.956 -2.800 100 H ALA 12 H ALA 12 15.607 -21.626 -4.108 101 HA ALA 12 HA ALA 12 14.423 -23.688 -5.853 102 HB1 ALA 12 1HB ALA 12 16.847 -23.441 -6.183 103 HB2 ALA 12 2HB ALA 12 17.103 -23.793 -4.473 104 HB3 ALA 12 3HB ALA 12 16.419 -25.025 -5.534 105 H VAL 13 H VAL 13 13.062 -25.012 -4.862 106 HA VAL 13 HA VAL 13 12.822 -25.012 -1.991 107 HB VAL 13 HB VAL 13 10.793 -25.092 -3.299 108 HG11 VAL 13 1HG1 VAL 13 10.873 -27.775 -4.294 109 HG12 VAL 13 2HG1 VAL 13 10.611 -26.268 -5.174 110 HG13 VAL 13 3HG1 VAL 13 12.250 -26.870 -4.922 111 HG21 VAL 13 3HG2 VAL 13 11.125 -27.807 -2.043 112 HG22 VAL 13 1HG2 VAL 13 10.969 -26.324 -1.102 113 HG23 VAL 13 2HG2 VAL 13 9.658 -26.836 -2.165 114 H GLY 14 H GLY 14 13.683 -26.423 -0.606 115 HA2 GLY 14 2HA GLY 14 14.341 -29.123 -1.459 116 HA3 GLY 14 3HA GLY 14 15.711 -28.118 -1.007 117 H ARG 15 H ARG 15 16.103 -29.715 0.656 118 HA ARG 15 HA ARG 15 14.482 -29.178 3.048 119 HB2 ARG 15 2HB ARG 15 14.965 -31.749 1.734 120 HB3 ARG 15 3HB ARG 15 15.378 -31.754 3.443 121 HG2 ARG 15 2HG ARG 15 13.177 -32.405 3.489 122 HG3 ARG 15 3HG ARG 15 13.036 -30.663 3.737 123 HD2 ARG 15 2HD ARG 15 11.910 -30.389 1.831 124 HD3 ARG 15 3HD ARG 15 13.059 -31.372 0.924 125 HE ARG 15 HE ARG 15 10.531 -32.207 1.979 126 HH11 ARG 15 1HH1 ARG 15 13.720 -33.273 1.078 127 HH12 ARG 15 2HH1 ARG 15 13.232 -34.909 0.783 128 HH21 ARG 15 2HH2 ARG 15 11.044 -35.524 1.076 129 HH22 ARG 15 1HH2 ARG 15 9.875 -34.357 1.593 130 H ASP 16 H ASP 16 15.611 -28.842 4.893 131 HA ASP 16 HA ASP 16 18.532 -28.825 4.655 132 HB2 ASP 16 2HB ASP 16 18.414 -27.401 6.729 133 HB3 ASP 16 3HB ASP 16 17.639 -26.702 5.310 134 H SER 17 H SER 17 19.578 -29.110 6.985 135 HA SER 17 HA SER 17 19.459 -31.813 7.604 136 HB2 SER 17 2HB SER 17 20.283 -29.795 9.672 137 HB3 SER 17 3HB SER 17 20.992 -31.369 9.312 138 HG SER 17 HG SER 17 22.147 -29.403 8.560 139 H SER 18 H SER 18 17.515 -29.178 8.745 140 HA SER 18 HA SER 18 16.492 -30.506 11.062 141 HB2 SER 18 2HB SER 18 16.279 -28.206 11.251 142 HB3 SER 18 3HB SER 18 15.810 -28.006 9.562 143 HG SER 18 HG SER 18 14.200 -29.211 11.566 144 H GLY 19 H GLY 19 15.344 -30.018 7.746 145 HA2 GLY 19 2HA GLY 19 14.012 -31.520 6.533 146 HA3 GLY 19 3HA GLY 19 13.633 -32.359 8.030 147 H CYS 20 H CYS 20 13.289 -28.922 7.223 148 HA CYS 20 HA CYS 20 10.407 -29.190 7.772 149 HB2 CYS 20 2HB CYS 20 12.306 -26.900 8.277 150 HB3 CYS 20 3HB CYS 20 10.558 -26.712 8.330 151 HG CYS 20 HG CYS 20 10.205 -27.603 10.720 152 H THR 21 H THR 21 12.260 -29.181 5.237 153 HA THR 21 HA THR 21 12.135 -28.489 3.069 154 HB THR 21 HB THR 21 9.252 -27.778 3.527 155 HG1 THR 21 HG1 THR 21 9.077 -30.213 3.027 156 HG21 THR 21 3HG2 THR 21 10.899 -28.056 1.270 157 HG22 THR 21 1HG2 THR 21 9.149 -27.847 1.301 158 HG23 THR 21 2HG2 THR 21 9.843 -29.468 1.276 159 H THR 22 H THR 22 13.460 -26.660 3.278 160 HA THR 22 HA THR 22 12.024 -24.091 3.450 161 HB THR 22 HB THR 22 13.879 -23.066 4.421 162 HG1 THR 22 HG1 THR 22 15.561 -25.293 3.952 163 HG21 THR 22 3HG2 THR 22 14.127 -24.179 6.405 164 HG22 THR 22 1HG2 THR 22 14.411 -25.734 5.625 165 HG23 THR 22 2HG2 THR 22 12.773 -25.089 5.736 166 H LEU 23 H LEU 23 13.255 -22.293 2.260 167 HA LEU 23 HA LEU 23 14.220 -23.322 -0.327 168 HB2 LEU 23 2HB LEU 23 12.241 -21.188 0.313 169 HB3 LEU 23 3HB LEU 23 13.239 -21.020 -1.130 170 HG LEU 23 HG LEU 23 12.339 -23.079 -2.033 171 HD11 LEU 23 1HD1 LEU 23 11.083 -23.286 0.667 172 HD12 LEU 23 2HD1 LEU 23 11.925 -24.513 -0.278 173 HD13 LEU 23 3HD1 LEU 23 10.294 -24.018 -0.730 174 HD21 LEU 23 3HD2 LEU 23 9.755 -22.043 -1.390 175 HD22 LEU 23 1HD2 LEU 23 10.679 -21.880 -2.884 176 HD23 LEU 23 2HD2 LEU 23 10.887 -20.704 -1.587 177 H SER 24 H SER 24 16.223 -22.730 -0.798 178 HA SER 24 HA SER 24 17.467 -20.568 0.714 179 HB2 SER 24 2HB SER 24 19.090 -22.047 -1.260 180 HB3 SER 24 3HB SER 24 19.439 -21.656 0.423 181 HG SER 24 HG SER 24 19.081 -23.746 0.606 182 H ILE 25 H ILE 25 18.251 -18.711 -0.167 183 HA ILE 25 HA ILE 25 17.368 -18.103 -2.886 184 HB ILE 25 HB ILE 25 18.534 -16.173 -0.885 185 HG12 ILE 25 2HG1 ILE 25 16.588 -17.221 0.133 186 HG13 ILE 25 3HG1 ILE 25 16.192 -15.573 -0.343 187 HG21 ILE 25 1HG2 ILE 25 17.704 -14.472 -2.245 188 HG22 ILE 25 2HG2 ILE 25 18.351 -15.645 -3.391 189 HG23 ILE 25 3HG2 ILE 25 16.613 -15.560 -3.102 190 HD11 ILE 25 3HD1 ILE 25 14.863 -17.966 -1.017 191 HD12 ILE 25 1HD1 ILE 25 14.478 -16.319 -1.515 192 HD13 ILE 25 2HD1 ILE 25 15.557 -17.309 -2.499 193 H GLN 26 H GLN 26 18.719 -17.835 -4.551 194 HA GLN 26 HA GLN 26 21.581 -18.151 -4.056 195 HB2 GLN 26 2HB GLN 26 19.928 -18.344 -6.576 196 HB3 GLN 26 3HB GLN 26 21.682 -18.471 -6.552 197 HG2 GLN 26 2HG GLN 26 21.461 -20.640 -6.206 198 HG3 GLN 26 3HG GLN 26 20.781 -20.274 -4.622 199 HE21 GLN 26 2HE2 GLN 26 17.401 -20.693 -5.689 200 HE22 GLN 26 1HE2 GLN 26 18.400 -19.706 -4.684 201 H GLU 27 H GLU 27 19.256 -15.841 -5.228 202 HA GLU 27 HA GLU 27 21.442 -13.970 -5.857 203 HB2 GLU 27 2HB GLU 27 19.181 -14.677 -7.354 204 HB3 GLU 27 3HB GLU 27 18.831 -13.075 -6.722 205 HG2 GLU 27 2HG GLU 27 19.962 -12.314 -8.475 206 HG3 GLU 27 3HG GLU 27 21.409 -12.808 -7.597 207 H VAL 28 H VAL 28 20.125 -11.591 -5.758 208 HA VAL 28 HA VAL 28 19.252 -11.406 -2.947 209 HB VAL 28 HB VAL 28 20.745 -9.255 -4.446 210 HG11 VAL 28 1HG1 VAL 28 20.492 -9.537 -1.474 211 HG12 VAL 28 2HG1 VAL 28 20.856 -8.099 -2.431 212 HG13 VAL 28 3HG1 VAL 28 19.222 -8.763 -2.422 213 HG21 VAL 28 3HG2 VAL 28 21.839 -11.254 -2.468 214 HG22 VAL 28 1HG2 VAL 28 22.165 -11.235 -4.201 215 HG23 VAL 28 2HG2 VAL 28 22.727 -9.909 -3.183 216 H THR 29 H THR 29 17.426 -10.299 -2.521 217 HA THR 29 HA THR 29 16.060 -9.036 -4.805 218 HB THR 29 HB THR 29 14.786 -10.916 -4.041 219 HG1 THR 29 HG1 THR 29 13.662 -8.861 -4.433 220 HG21 THR 29 3HG2 THR 29 14.929 -11.630 -1.938 221 HG22 THR 29 1HG2 THR 29 14.029 -10.211 -1.405 222 HG23 THR 29 2HG2 THR 29 15.791 -10.162 -1.478 223 H GLN 30 H GLN 30 17.307 -8.550 -1.635 224 HA GLN 30 HA GLN 30 15.765 -6.230 -0.992 225 HB2 GLN 30 2HB GLN 30 17.271 -7.892 0.488 226 HB3 GLN 30 3HB GLN 30 18.439 -6.601 0.236 227 HG2 GLN 30 2HG GLN 30 17.507 -5.743 2.081 228 HG3 GLN 30 3HG GLN 30 16.283 -5.159 0.956 229 HE21 GLN 30 2HE2 GLN 30 15.161 -7.422 3.950 230 HE22 GLN 30 1HE2 GLN 30 16.607 -6.482 3.853 231 H THR 31 H THR 31 18.171 -6.770 -3.224 232 HA THR 31 HA THR 31 19.263 -4.056 -3.046 233 HB THR 31 HB THR 31 20.646 -5.047 -5.089 234 HG1 THR 31 HG1 THR 31 20.164 -7.093 -5.346 235 HG21 THR 31 3HG2 THR 31 21.201 -4.475 -2.509 236 HG22 THR 31 1HG2 THR 31 22.384 -5.127 -3.641 237 HG23 THR 31 2HG2 THR 31 21.542 -6.205 -2.527 238 H TYR 32 H TYR 32 16.530 -4.990 -4.102 239 HA TYR 32 HA TYR 32 16.718 -3.618 -6.704 240 HB2 TYR 32 2HB TYR 32 15.766 -6.214 -6.177 241 HB3 TYR 32 3HB TYR 32 14.338 -5.231 -6.480 242 HD1 TYR 32 HD1 TYR 32 13.605 -5.148 -8.659 243 HD2 TYR 32 HD2 TYR 32 17.762 -5.681 -7.926 244 HE1 TYR 32 HE1 TYR 32 14.005 -5.306 -11.081 245 HE2 TYR 32 HE2 TYR 32 18.174 -5.839 -10.346 246 HH TYR 32 HH TYR 32 16.374 -6.595 -12.473 247 H THR 33 H THR 33 15.141 -2.114 -7.211 248 HA THR 33 HA THR 33 12.898 -1.625 -5.487 249 HB THR 33 HB THR 33 14.407 0.855 -5.563 250 HG1 THR 33 HG1 THR 33 16.119 0.274 -4.337 251 HG21 THR 33 3HG2 THR 33 13.954 0.551 -3.015 252 HG22 THR 33 1HG2 THR 33 12.953 -0.803 -3.538 253 HG23 THR 33 2HG2 THR 33 12.600 0.828 -4.111 254 H GLY 34 H GLY 34 11.613 0.262 -6.216 255 HA2 GLY 34 2HA GLY 34 12.093 1.788 -8.468 256 HA3 GLY 34 3HA GLY 34 11.419 0.277 -9.060 257 H SER 35 H SER 35 9.799 0.005 -6.559 258 HA SER 35 HA SER 35 7.683 1.900 -7.329 259 HB2 SER 35 2HB SER 35 6.949 -0.436 -5.678 260 HB3 SER 35 3HB SER 35 6.146 0.244 -7.093 261 HG SER 35 HG SER 35 8.331 -1.542 -6.989 262 H ASN 36 H ASN 36 7.160 3.440 -5.935 263 HA ASN 36 HA ASN 36 7.139 4.718 -4.046 264 HB2 ASN 36 2HB ASN 36 6.581 2.022 -2.787 265 HB3 ASN 36 3HB ASN 36 6.286 3.582 -2.025 266 HD21 ASN 36 2HD2 ASN 36 3.400 4.313 -3.898 267 HD22 ASN 36 1HD2 ASN 36 4.719 4.990 -3.009 268 H GLY 37 H GLY 37 9.720 3.974 -4.849 269 HA2 GLY 37 2HA GLY 37 11.105 4.263 -2.312 270 HA3 GLY 37 3HA GLY 37 11.494 2.808 -3.217 271 H GLY 38 H GLY 38 12.249 3.139 -5.479 272 HA2 GLY 38 2HA GLY 38 13.103 5.591 -6.496 273 HA3 GLY 38 3HA GLY 38 14.417 4.955 -5.517 274 H ALA 39 H ALA 39 15.318 2.880 -6.095 275 HA ALA 39 HA ALA 39 14.611 1.548 -8.497 276 HB1 ALA 39 1HB ALA 39 16.219 3.865 -8.823 277 HB2 ALA 39 2HB ALA 39 17.213 2.451 -9.175 278 HB3 ALA 39 3HB ALA 39 15.700 2.703 -10.045 279 H ASP 40 H ASP 40 16.334 -0.070 -9.134 280 HA ASP 40 HA ASP 40 17.157 -1.494 -6.822 281 HB2 ASP 40 2HB ASP 40 18.166 -3.081 -8.410 282 HB3 ASP 40 3HB ASP 40 16.525 -2.649 -8.883 283 H LEU 41 H LEU 41 19.039 -1.518 -5.753 284 HA LEU 41 HA LEU 41 21.538 -0.821 -6.910 285 HB2 LEU 41 2HB LEU 41 20.064 1.371 -6.245 286 HB3 LEU 41 3HB LEU 41 20.986 1.105 -4.767 287 HG LEU 41 HG LEU 41 22.896 0.942 -6.758 288 HD11 LEU 41 1HD1 LEU 41 22.439 2.290 -8.476 289 HD12 LEU 41 2HD1 LEU 41 21.688 3.504 -7.442 290 HD13 LEU 41 3HD1 LEU 41 20.750 2.118 -7.997 291 HD21 LEU 41 3HD2 LEU 41 22.219 3.498 -5.341 292 HD22 LEU 41 1HD2 LEU 41 23.804 2.839 -5.745 293 HD23 LEU 41 2HD2 LEU 41 22.841 2.096 -4.467 294 H MET 42 H MET 42 23.015 -0.116 -4.743 295 HA MET 42 HA MET 42 22.544 -2.345 -2.875 296 HB2 MET 42 2HB MET 42 25.134 -1.136 -3.848 297 HB3 MET 42 3HB MET 42 25.035 -2.286 -2.522 298 HG2 MET 42 2HG MET 42 24.904 -4.014 -3.905 299 HG3 MET 42 3HG MET 42 23.655 -3.239 -4.877 300 HE1 MET 42 3HE MET 42 24.892 -3.649 -7.778 301 HE2 MET 42 1HE MET 42 26.237 -4.651 -7.231 302 HE3 MET 42 2HE MET 42 24.663 -4.784 -6.447 303 H GLY 43 H GLY 43 22.330 -1.890 -0.771 304 HA2 GLY 43 2HA GLY 43 23.649 0.048 0.695 305 HA3 GLY 43 3HA GLY 43 22.184 0.817 0.101 306 HA PRO 44 HA PRO 44 19.764 -0.938 3.301 307 HB2 PRO 44 2HB PRO 44 17.547 -1.871 2.043 308 HB3 PRO 44 3HB PRO 44 17.881 -0.148 2.249 309 HG2 PRO 44 2HG PRO 44 18.326 -1.891 -0.144 310 HG3 PRO 44 3HG PRO 44 17.668 -0.246 -0.064 311 HD2 PRO 44 2HD PRO 44 20.233 -0.757 -0.767 312 HD3 PRO 44 3HD PRO 44 19.757 0.716 0.102 313 H ALA 45 H ALA 45 20.447 -3.037 0.585 314 HA ALA 45 HA ALA 45 19.529 -5.464 1.688 315 HB1 ALA 45 1HB ALA 45 20.127 -5.036 -0.718 316 HB2 ALA 45 2HB ALA 45 21.820 -5.176 -0.243 317 HB3 ALA 45 3HB ALA 45 20.732 -6.550 -0.044 318 H PHE 46 H PHE 46 22.738 -3.936 1.701 319 HA PHE 46 HA PHE 46 23.879 -6.021 3.324 320 HB2 PHE 46 2HB PHE 46 24.840 -3.567 1.990 321 HB3 PHE 46 3HB PHE 46 25.693 -4.008 3.465 322 HD1 PHE 46 HD1 PHE 46 25.796 -4.301 0.052 323 HD2 PHE 46 HD2 PHE 46 26.154 -6.694 3.554 324 HE1 PHE 46 HE1 PHE 46 27.115 -5.949 -1.212 325 HE2 PHE 46 HE2 PHE 46 27.475 -8.345 2.295 326 HZ PHE 46 HZ PHE 46 27.958 -7.973 -0.091 327 H ALA 47 H ALA 47 22.074 -3.204 3.902 328 HA ALA 47 HA ALA 47 23.128 -2.378 6.382 329 HB1 ALA 47 1HB ALA 47 20.712 -1.486 6.683 330 HB2 ALA 47 2HB ALA 47 21.728 -0.819 5.405 331 HB3 ALA 47 3HB ALA 47 20.494 -2.017 5.015 332 H ALA 48 H ALA 48 20.717 -4.797 5.511 333 HA ALA 48 HA ALA 48 20.299 -5.451 8.333 334 HB1 ALA 48 1HB ALA 48 18.897 -6.579 5.915 335 HB2 ALA 48 2HB ALA 48 18.429 -6.777 7.604 336 HB3 ALA 48 3HB ALA 48 18.335 -5.189 6.844 337 H GLY 49 H GLY 49 21.948 -6.567 5.519 338 HA2 GLY 49 2HA GLY 49 23.777 -8.125 5.825 339 HA3 GLY 49 3HA GLY 49 22.797 -8.959 7.022 340 H LEU 50 H LEU 50 21.081 -7.959 4.258 341 HA LEU 50 HA LEU 50 20.461 -10.627 3.518 342 HB2 LEU 50 2HB LEU 50 19.785 -7.915 2.553 343 HB3 LEU 50 3HB LEU 50 19.615 -9.229 1.391 344 HG LEU 50 HG LEU 50 17.517 -8.621 2.597 345 HD11 LEU 50 1HD1 LEU 50 16.757 -10.803 2.687 346 HD12 LEU 50 2HD1 LEU 50 18.280 -11.418 3.329 347 HD13 LEU 50 3HD1 LEU 50 18.167 -10.936 1.636 348 HD21 LEU 50 3HD2 LEU 50 17.222 -9.054 4.878 349 HD22 LEU 50 1HD2 LEU 50 18.778 -8.228 4.786 350 HD23 LEU 50 2HD2 LEU 50 18.720 -9.979 4.989 351 H ARG 51 H ARG 51 21.832 -11.950 2.531 352 HA ARG 51 HA ARG 51 23.254 -10.995 0.162 353 HB2 ARG 51 2HB ARG 51 24.498 -11.789 2.689 354 HB3 ARG 51 3HB ARG 51 25.114 -12.681 1.304 355 HG2 ARG 51 2HG ARG 51 24.889 -9.741 1.033 356 HG3 ARG 51 3HG ARG 51 26.150 -10.371 2.093 357 HD2 ARG 51 2HD ARG 51 27.375 -10.549 0.229 358 HD3 ARG 51 3HD ARG 51 26.392 -11.972 -0.110 359 HE ARG 51 HE ARG 51 25.081 -9.682 -1.080 360 HH11 ARG 51 1HH1 ARG 51 27.861 -11.674 -1.731 361 HH12 ARG 51 2HH1 ARG 51 27.872 -11.330 -3.429 362 HH21 ARG 51 2HH2 ARG 51 26.294 -9.935 -4.329 363 HH22 ARG 51 1HH2 ARG 51 25.085 -9.222 -3.314 364 H VAL 52 H VAL 52 24.166 -12.819 -1.119 365 HA VAL 52 HA VAL 52 22.193 -14.863 -1.424 366 HB VAL 52 HB VAL 52 23.583 -15.688 -3.259 367 HG11 VAL 52 1HG1 VAL 52 23.222 -13.907 -4.699 368 HG12 VAL 52 2HG1 VAL 52 22.114 -13.556 -3.371 369 HG13 VAL 52 3HG1 VAL 52 23.655 -12.705 -3.484 370 HG21 VAL 52 3HG2 VAL 52 25.634 -14.030 -3.696 371 HG22 VAL 52 1HG2 VAL 52 25.620 -14.002 -1.933 372 HG23 VAL 52 2HG2 VAL 52 25.797 -15.534 -2.788 373 H GLY 53 H GLY 53 22.177 -16.899 -0.682 374 HA2 GLY 53 2HA GLY 53 23.704 -18.887 -0.297 375 HA3 GLY 53 3HA GLY 53 24.561 -17.813 0.799 376 H ASP 54 H ASP 54 22.439 -16.554 2.061 377 HA ASP 54 HA ASP 54 21.655 -18.602 3.911 378 HB2 ASP 54 2HB ASP 54 20.811 -15.698 3.817 379 HB3 ASP 54 3HB ASP 54 20.647 -16.791 5.189 380 H GLN 55 H GLN 55 19.482 -19.103 4.529 381 HA GLN 55 HA GLN 55 17.687 -19.167 2.235 382 HB2 GLN 55 2HB GLN 55 17.740 -20.616 4.874 383 HB3 GLN 55 3HB GLN 55 16.342 -20.685 3.809 384 HG2 GLN 55 2HG GLN 55 17.417 -21.948 2.243 385 HG3 GLN 55 3HG GLN 55 19.009 -21.325 2.672 386 HE21 GLN 55 2HE2 GLN 55 18.172 -24.888 3.883 387 HE22 GLN 55 1HE2 GLN 55 17.659 -24.079 2.446 388 H LEU 56 H LEU 56 15.723 -18.191 2.140 389 HA LEU 56 HA LEU 56 14.968 -16.501 4.434 390 HB2 LEU 56 2HB LEU 56 15.630 -15.000 2.779 391 HB3 LEU 56 3HB LEU 56 14.921 -15.967 1.488 392 HG LEU 56 HG LEU 56 13.033 -14.832 3.460 393 HD11 LEU 56 1HD1 LEU 56 14.895 -13.183 1.884 394 HD12 LEU 56 2HD1 LEU 56 13.991 -12.797 3.348 395 HD13 LEU 56 3HD1 LEU 56 13.192 -12.737 1.777 396 HD21 LEU 56 3HD2 LEU 56 11.667 -15.498 1.844 397 HD22 LEU 56 1HD2 LEU 56 13.033 -15.891 0.800 398 HD23 LEU 56 2HD2 LEU 56 12.356 -14.262 0.790 399 H VAL 57 H VAL 57 13.163 -17.166 5.371 400 HA VAL 57 HA VAL 57 11.094 -18.445 3.703 401 HB VAL 57 HB VAL 57 10.351 -19.575 5.829 402 HG11 VAL 57 1HG1 VAL 57 12.348 -20.260 4.004 403 HG12 VAL 57 2HG1 VAL 57 12.997 -20.693 5.587 404 HG13 VAL 57 3HG1 VAL 57 11.447 -21.349 5.058 405 HG21 VAL 57 3HG2 VAL 57 11.377 -18.204 7.489 406 HG22 VAL 57 1HG2 VAL 57 12.128 -19.797 7.586 407 HG23 VAL 57 2HG2 VAL 57 12.980 -18.467 6.802 408 H ARG 58 H ARG 58 11.689 -16.367 6.509 409 HA ARG 58 HA ARG 58 10.393 -14.828 7.579 410 HB2 ARG 58 2HB ARG 58 10.645 -13.958 5.136 411 HB3 ARG 58 3HB ARG 58 8.945 -14.382 4.990 412 HG2 ARG 58 2HG ARG 58 9.205 -12.913 7.376 413 HG3 ARG 58 3HG ARG 58 10.130 -12.057 6.140 414 HD2 ARG 58 2HD ARG 58 8.252 -11.825 4.745 415 HD3 ARG 58 3HD ARG 58 7.337 -13.038 5.639 416 HE ARG 58 HE ARG 58 7.565 -10.251 6.253 417 HH11 ARG 58 1HH1 ARG 58 7.040 -13.417 7.602 418 HH12 ARG 58 2HH1 ARG 58 6.174 -12.828 8.982 419 HH21 ARG 58 2HH2 ARG 58 5.826 -10.579 9.245 420 HH22 ARG 58 1HH2 ARG 58 6.427 -9.463 8.066 421 H PHE 59 H PHE 59 9.405 -17.578 7.487 422 HA PHE 59 HA PHE 59 6.623 -17.002 8.179 423 HB2 PHE 59 2HB PHE 59 7.523 -19.144 6.252 424 HB3 PHE 59 3HB PHE 59 5.955 -19.179 7.052 425 HD1 PHE 59 HD1 PHE 59 5.057 -16.445 6.965 426 HD2 PHE 59 HD2 PHE 59 7.175 -18.681 4.027 427 HE1 PHE 59 HE1 PHE 59 4.125 -15.004 5.201 428 HE2 PHE 59 HE2 PHE 59 6.247 -17.244 2.259 429 HZ PHE 59 HZ PHE 59 4.720 -15.402 2.845 430 H ALA 60 H ALA 60 5.762 -18.326 9.777 431 HA ALA 60 HA ALA 60 7.682 -19.543 11.521 432 HB1 ALA 60 1HB ALA 60 5.636 -20.085 12.894 433 HB2 ALA 60 2HB ALA 60 5.906 -18.374 12.561 434 HB3 ALA 60 3HB ALA 60 4.689 -19.268 11.650 435 H GLY 61 H GLY 61 8.540 -21.442 10.908 436 HA2 GLY 61 2HA GLY 61 7.821 -23.873 11.200 437 HA3 GLY 61 3HA GLY 61 6.712 -23.519 9.883 438 H TYR 62 H TYR 62 9.362 -21.729 9.235 439 HA TYR 62 HA TYR 62 11.056 -21.884 7.726 440 HB2 TYR 62 2HB TYR 62 11.317 -24.814 8.315 441 HB3 TYR 62 3HB TYR 62 12.578 -23.635 7.974 442 HD1 TYR 62 HD1 TYR 62 10.632 -25.264 10.534 443 HD2 TYR 62 HD2 TYR 62 13.179 -21.949 9.739 444 HE1 TYR 62 HE1 TYR 62 11.018 -24.990 12.947 445 HE2 TYR 62 HE2 TYR 62 13.572 -21.666 12.151 446 HH TYR 62 HH TYR 62 11.897 -22.534 14.401 447 H THR 63 H THR 63 8.431 -22.209 6.756 448 HA THR 63 HA THR 63 8.863 -24.087 4.523 449 HB THR 63 HB THR 63 6.987 -24.878 5.777 450 HG1 THR 63 HG1 THR 63 5.408 -24.759 4.171 451 HG21 THR 63 3HG2 THR 63 5.771 -23.501 7.034 452 HG22 THR 63 1HG2 THR 63 5.082 -22.792 5.574 453 HG23 THR 63 2HG2 THR 63 6.544 -22.105 6.283 454 H VAL 64 H VAL 64 8.278 -23.420 2.440 455 HA VAL 64 HA VAL 64 7.427 -20.652 2.069 456 HB VAL 64 HB VAL 64 9.874 -21.694 0.647 457 HG11 VAL 64 1HG1 VAL 64 8.787 -20.001 -0.613 458 HG12 VAL 64 2HG1 VAL 64 8.544 -18.999 0.819 459 HG13 VAL 64 3HG1 VAL 64 10.168 -19.241 0.176 460 HG21 VAL 64 3HG2 VAL 64 11.136 -20.109 2.116 461 HG22 VAL 64 1HG2 VAL 64 9.682 -19.960 3.103 462 HG23 VAL 64 2HG2 VAL 64 10.488 -21.521 2.950 463 H THR 65 H THR 65 6.666 -20.193 -0.068 464 HA THR 65 HA THR 65 5.628 -22.581 -1.398 465 HB THR 65 HB THR 65 4.674 -20.177 -2.617 466 HG1 THR 65 HG1 THR 65 4.308 -20.243 0.208 467 HG21 THR 65 3HG2 THR 65 3.252 -22.069 -0.744 468 HG22 THR 65 1HG2 THR 65 3.538 -22.394 -2.453 469 HG23 THR 65 2HG2 THR 65 2.522 -21.035 -1.972 470 H GLU 66 H GLU 66 6.719 -19.399 -2.589 471 HA GLU 66 HA GLU 66 8.837 -20.323 -4.153 472 HB2 GLU 66 2HB GLU 66 7.735 -20.098 -6.424 473 HB3 GLU 66 3HB GLU 66 7.336 -21.548 -5.514 474 HG2 GLU 66 2HG GLU 66 5.182 -20.847 -5.079 475 HG3 GLU 66 3HG GLU 66 5.573 -19.148 -5.335 476 H LEU 67 H LEU 67 9.130 -18.678 -6.149 477 HA LEU 67 HA LEU 67 9.621 -16.183 -5.045 478 HB2 LEU 67 2HB LEU 67 9.898 -15.398 -7.372 479 HB3 LEU 67 3HB LEU 67 10.760 -16.895 -7.025 480 HG LEU 67 HG LEU 67 8.573 -17.969 -8.066 481 HD11 LEU 67 1HD1 LEU 67 7.161 -16.458 -8.881 482 HD12 LEU 67 2HD1 LEU 67 8.367 -16.126 -10.124 483 HD13 LEU 67 3HD1 LEU 67 8.320 -15.147 -8.658 484 HD21 LEU 67 3HD2 LEU 67 9.838 -18.427 -9.914 485 HD22 LEU 67 1HD2 LEU 67 11.096 -17.847 -8.822 486 HD23 LEU 67 2HD2 LEU 67 10.434 -16.772 -10.055 487 H ALA 68 H ALA 68 6.719 -17.451 -6.462 488 HA ALA 68 HA ALA 68 5.417 -15.002 -7.020 489 HB1 ALA 68 1HB ALA 68 3.549 -16.256 -7.504 490 HB2 ALA 68 2HB ALA 68 4.833 -17.445 -7.729 491 HB3 ALA 68 3HB ALA 68 3.885 -17.441 -6.242 492 H ALA 69 H ALA 69 5.525 -17.073 -4.158 493 HA ALA 69 HA ALA 69 3.583 -15.647 -2.667 494 HB1 ALA 69 1HB ALA 69 3.855 -17.316 -1.225 495 HB2 ALA 69 2HB ALA 69 5.065 -17.979 -2.325 496 HB3 ALA 69 3HB ALA 69 5.560 -16.925 -1.000 497 H PHE 70 H PHE 70 7.054 -15.309 -3.069 498 HA PHE 70 HA PHE 70 7.316 -13.362 -0.963 499 HB2 PHE 70 2HB PHE 70 9.163 -14.903 -1.632 500 HB3 PHE 70 3HB PHE 70 9.276 -14.043 -3.164 501 HD1 PHE 70 HD1 PHE 70 9.346 -13.390 0.505 502 HD2 PHE 70 HD2 PHE 70 10.786 -12.320 -3.354 503 HE1 PHE 70 HE1 PHE 70 10.890 -11.774 1.534 504 HE2 PHE 70 HE2 PHE 70 12.333 -10.703 -2.332 505 HZ PHE 70 HZ PHE 70 12.387 -10.429 0.114 506 H ASN 71 H ASN 71 6.839 -13.347 -4.424 507 HA ASN 71 HA ASN 71 7.548 -10.699 -4.987 508 HB2 ASN 71 2HB ASN 71 7.158 -12.287 -6.772 509 HB3 ASN 71 3HB ASN 71 5.475 -12.478 -6.287 510 HD21 ASN 71 2HD2 ASN 71 6.626 -9.455 -8.687 511 HD22 ASN 71 1HD2 ASN 71 7.738 -10.609 -8.044 512 H THR 72 H THR 72 4.443 -12.091 -3.987 513 HA THR 72 HA THR 72 2.994 -9.656 -4.088 514 HB THR 72 HB THR 72 1.924 -11.466 -2.110 515 HG1 THR 72 HG1 THR 72 1.980 -13.346 -3.182 516 HG21 THR 72 3HG2 THR 72 0.169 -11.659 -4.020 517 HG22 THR 72 1HG2 THR 72 1.118 -10.386 -4.785 518 HG23 THR 72 2HG2 THR 72 0.388 -10.111 -3.204 519 H VAL 73 H VAL 73 4.865 -11.261 -1.582 520 HA VAL 73 HA VAL 73 4.024 -9.596 0.563 521 HB VAL 73 HB VAL 73 6.530 -11.257 0.267 522 HG11 VAL 73 1HG1 VAL 73 7.228 -10.129 2.067 523 HG12 VAL 73 2HG1 VAL 73 5.637 -9.420 2.351 524 HG13 VAL 73 3HG1 VAL 73 6.003 -11.039 2.950 525 HG21 VAL 73 3HG2 VAL 73 4.133 -11.938 1.933 526 HG22 VAL 73 1HG2 VAL 73 4.196 -12.350 0.219 527 HG23 VAL 73 2HG2 VAL 73 5.405 -12.999 1.328 528 H VAL 74 H VAL 74 6.754 -9.504 -1.682 529 HA VAL 74 HA VAL 74 8.210 -7.432 -0.510 530 HB VAL 74 HB VAL 74 7.938 -8.149 -3.431 531 HG11 VAL 74 1HG1 VAL 74 8.939 -6.165 -3.760 532 HG12 VAL 74 2HG1 VAL 74 9.428 -6.017 -2.071 533 HG13 VAL 74 3HG1 VAL 74 10.383 -6.996 -3.184 534 HG21 VAL 74 3HG2 VAL 74 9.229 -9.427 -1.241 535 HG22 VAL 74 1HG2 VAL 74 9.220 -9.894 -2.942 536 HG23 VAL 74 2HG2 VAL 74 10.467 -8.805 -2.333 537 H ALA 75 H ALA 75 5.444 -7.347 -2.688 538 HA ALA 75 HA ALA 75 5.494 -4.611 -3.311 539 HB1 ALA 75 1HB ALA 75 3.300 -4.882 -4.126 540 HB2 ALA 75 2HB ALA 75 4.100 -6.431 -4.395 541 HB3 ALA 75 3HB ALA 75 2.982 -6.239 -3.045 542 H ARG 76 H ARG 76 3.910 -6.369 -0.669 543 HA ARG 76 HA ARG 76 2.777 -3.974 0.454 544 HB2 ARG 76 2HB ARG 76 3.049 -6.590 1.910 545 HB3 ARG 76 3HB ARG 76 1.802 -5.362 2.079 546 HG2 ARG 76 2HG ARG 76 2.167 -7.335 -0.155 547 HG3 ARG 76 3HG ARG 76 0.809 -7.184 0.961 548 HD2 ARG 76 2HD ARG 76 0.634 -4.779 -0.064 549 HD3 ARG 76 3HD ARG 76 1.530 -5.505 -1.398 550 HE ARG 76 HE ARG 76 -0.565 -7.215 -0.888 551 HH11 ARG 76 1HH1 ARG 76 -0.195 -3.872 -1.788 552 HH12 ARG 76 2HH1 ARG 76 -1.687 -3.808 -2.664 553 HH21 ARG 76 2HH2 ARG 76 -3.017 -5.668 -2.807 554 HH22 ARG 76 1HH2 ARG 76 -2.532 -7.143 -2.040 555 H HIS 77 H HIS 77 5.714 -5.769 0.787 556 HA HIS 77 HA HIS 77 6.439 -4.685 3.347 557 HB2 HIS 77 2HB HIS 77 7.354 -6.821 2.768 558 HB3 HIS 77 3HB HIS 77 7.996 -6.201 1.249 559 HD1 HIS 77 HD1 HIS 77 8.450 -4.383 4.507 560 HD2 HIS 77 HD2 HIS 77 10.644 -6.728 1.871 561 HE1 HIS 77 HE1 HIS 77 10.840 -4.192 5.267 562 H VAL 78 H VAL 78 7.146 -3.948 -0.026 563 HA VAL 78 HA VAL 78 9.210 -2.124 0.278 564 HB VAL 78 HB VAL 78 6.981 -2.255 -1.741 565 HG11 VAL 78 1HG1 VAL 78 8.944 -0.115 -1.283 566 HG12 VAL 78 2HG1 VAL 78 8.840 -0.698 -2.945 567 HG13 VAL 78 3HG1 VAL 78 7.400 -0.079 -2.135 568 HG21 VAL 78 3HG2 VAL 78 8.322 -3.644 -2.854 569 HG22 VAL 78 1HG2 VAL 78 9.701 -2.558 -2.682 570 HG23 VAL 78 2HG2 VAL 78 9.322 -3.712 -1.403 571 H ARG 79 H ARG 79 9.201 -0.538 1.749 572 HA ARG 79 HA ARG 79 7.272 1.597 1.476 573 HB2 ARG 79 2HB ARG 79 7.029 -0.374 3.575 574 HB3 ARG 79 3HB ARG 79 7.331 1.219 4.256 575 HG2 ARG 79 2HG ARG 79 5.440 1.890 2.513 576 HG3 ARG 79 3HG ARG 79 4.987 0.203 2.766 577 HD2 ARG 79 2HD ARG 79 4.890 0.583 5.174 578 HD3 ARG 79 3HD ARG 79 5.374 2.262 4.936 579 HE ARG 79 HE ARG 79 3.095 1.841 3.405 580 HH11 ARG 79 1HH1 ARG 79 4.008 1.809 6.765 581 HH12 ARG 79 2HH1 ARG 79 2.440 2.282 7.330 582 HH21 ARG 79 2HH2 ARG 79 0.745 2.653 5.835 583 HH22 ARG 79 1HH2 ARG 79 1.027 2.464 4.137 584 HA PRO 80 HA PRO 80 10.713 4.076 2.605 585 HB2 PRO 80 2HB PRO 80 9.491 6.187 3.797 586 HB3 PRO 80 3HB PRO 80 9.433 5.902 2.053 587 HG2 PRO 80 2HG PRO 80 7.389 5.266 4.146 588 HG3 PRO 80 3HG PRO 80 7.158 5.961 2.531 589 HD2 PRO 80 2HD PRO 80 6.707 3.346 3.070 590 HD3 PRO 80 3HD PRO 80 7.292 3.908 1.491 591 H SER 81 H SER 81 12.010 3.243 4.146 592 HA SER 81 HA SER 81 12.923 2.818 6.186 593 HB2 SER 81 2HB SER 81 10.978 4.832 7.317 594 HB3 SER 81 3HB SER 81 12.572 4.399 7.935 595 HG SER 81 HG SER 81 12.392 6.418 6.679 596 H ALA 82 H ALA 82 10.859 1.123 5.333 597 HA ALA 82 HA ALA 82 9.227 0.594 7.697 598 HB1 ALA 82 1HB ALA 82 7.812 0.273 5.964 599 HB2 ALA 82 2HB ALA 82 9.104 -0.165 4.845 600 HB3 ALA 82 3HB ALA 82 8.501 -1.351 6.003 601 H SER 83 H SER 83 10.022 -0.665 9.237 602 HA SER 83 HA SER 83 12.011 -2.708 8.522 603 HB2 SER 83 2HB SER 83 11.480 -1.995 11.367 604 HB3 SER 83 3HB SER 83 12.999 -2.417 10.578 605 HG SER 83 HG SER 83 12.530 -0.257 9.439 606 H ILE 84 H ILE 84 11.386 -4.753 8.477 607 HA ILE 84 HA ILE 84 9.173 -5.598 10.225 608 HB ILE 84 HB ILE 84 8.282 -7.031 8.507 609 HG12 ILE 84 2HG1 ILE 84 9.388 -6.431 6.107 610 HG13 ILE 84 3HG1 ILE 84 10.809 -6.322 7.140 611 HG21 ILE 84 1HG2 ILE 84 7.119 -5.410 7.453 612 HG22 ILE 84 2HG2 ILE 84 8.002 -4.356 8.557 613 HG23 ILE 84 3HG2 ILE 84 8.573 -4.576 6.903 614 HD11 ILE 84 3HD1 ILE 84 9.092 -8.705 7.466 615 HD12 ILE 84 1HD1 ILE 84 10.038 -8.582 5.984 616 HD13 ILE 84 2HD1 ILE 84 10.846 -8.544 7.552 617 HA PRO 85 HA PRO 85 11.900 -8.790 11.544 618 HB2 PRO 85 2HB PRO 85 10.073 -10.589 12.436 619 HB3 PRO 85 3HB PRO 85 10.453 -9.096 13.302 620 HG2 PRO 85 2HG PRO 85 8.157 -9.695 11.478 621 HG3 PRO 85 3HG PRO 85 8.159 -8.832 13.027 622 HD2 PRO 85 2HD PRO 85 8.100 -7.548 10.644 623 HD3 PRO 85 3HD PRO 85 8.901 -6.869 12.076 624 H VAL 86 H VAL 86 12.799 -10.677 10.811 625 HA VAL 86 HA VAL 86 11.344 -12.254 8.819 626 HB VAL 86 HB VAL 86 12.904 -10.441 7.779 627 HG11 VAL 86 1HG1 VAL 86 15.036 -12.488 7.974 628 HG12 VAL 86 2HG1 VAL 86 15.156 -10.734 7.822 629 HG13 VAL 86 3HG1 VAL 86 14.774 -11.461 9.383 630 HG21 VAL 86 3HG2 VAL 86 12.348 -11.675 6.016 631 HG22 VAL 86 1HG2 VAL 86 13.747 -12.699 6.339 632 HG23 VAL 86 2HG2 VAL 86 12.175 -13.112 7.024 633 H VAL 87 H VAL 87 12.061 -14.393 8.600 634 HA VAL 87 HA VAL 87 13.855 -15.291 10.759 635 HB VAL 87 HB VAL 87 11.600 -16.789 9.416 636 HG11 VAL 87 1HG1 VAL 87 12.685 -18.636 10.023 637 HG12 VAL 87 2HG1 VAL 87 13.899 -17.714 10.911 638 HG13 VAL 87 3HG1 VAL 87 12.385 -18.166 11.696 639 HG21 VAL 87 3HG2 VAL 87 11.745 -16.136 12.329 640 HG22 VAL 87 1HG2 VAL 87 11.175 -14.923 11.183 641 HG23 VAL 87 2HG2 VAL 87 10.335 -16.467 11.322 642 H PHE 88 H PHE 88 15.709 -16.219 10.197 643 HA PHE 88 HA PHE 88 16.013 -17.157 7.422 644 HB2 PHE 88 2HB PHE 88 18.051 -15.989 9.323 645 HB3 PHE 88 3HB PHE 88 18.468 -16.733 7.783 646 HD1 PHE 88 HD1 PHE 88 16.300 -15.731 6.060 647 HD2 PHE 88 HD2 PHE 88 18.597 -13.753 9.047 648 HE1 PHE 88 HE1 PHE 88 15.925 -13.582 4.920 649 HE2 PHE 88 HE2 PHE 88 18.226 -11.601 7.913 650 HZ PHE 88 HZ PHE 88 16.887 -11.513 5.848 651 H SER 89 H SER 89 17.449 -18.981 7.077 652 HA SER 89 HA SER 89 17.817 -20.712 9.417 653 HB2 SER 89 2HB SER 89 16.135 -21.246 7.026 654 HB3 SER 89 3HB SER 89 17.120 -22.583 7.619 655 HG SER 89 HG SER 89 15.622 -22.833 9.058 656 H ARG 90 H ARG 90 19.516 -22.186 9.266 657 HA ARG 90 HA ARG 90 21.193 -22.024 6.861 658 HB2 ARG 90 2HB ARG 90 21.854 -21.124 9.575 659 HB3 ARG 90 3HB ARG 90 23.049 -22.207 8.874 660 HG2 ARG 90 2HG ARG 90 22.518 -20.441 6.828 661 HG3 ARG 90 3HG ARG 90 22.473 -19.429 8.273 662 HD2 ARG 90 2HD ARG 90 24.711 -19.360 7.706 663 HD3 ARG 90 3HD ARG 90 24.672 -20.667 8.889 664 HE ARG 90 HE ARG 90 24.342 -21.604 6.208 665 HH11 ARG 90 1HH1 ARG 90 26.685 -20.604 8.581 666 HH12 ARG 90 2HH1 ARG 90 27.976 -21.527 7.886 667 HH21 ARG 90 2HH2 ARG 90 27.605 -22.788 6.010 668 HH22 ARG 90 1HH2 ARG 90 26.034 -22.823 5.283 669 H ASP 91 H ASP 91 20.443 -24.108 6.322 670 HA ASP 91 HA ASP 91 20.564 -26.378 6.223 671 HB2 ASP 91 2HB ASP 91 22.768 -26.397 8.254 672 HB3 ASP 91 3HB ASP 91 22.570 -27.393 6.814 673 H GLY 92 H GLY 92 18.741 -25.238 8.046 674 HA2 GLY 92 2HA GLY 92 17.206 -26.487 9.390 675 HA3 GLY 92 3HA GLY 92 18.555 -27.451 9.972 676 H VAL 93 H VAL 93 19.868 -24.557 10.095 677 HA VAL 93 HA VAL 93 19.558 -24.290 12.910 678 HB VAL 93 HB VAL 93 20.840 -22.466 10.874 679 HG11 VAL 93 1HG1 VAL 93 20.812 -22.283 13.883 680 HG12 VAL 93 2HG1 VAL 93 21.911 -21.379 12.840 681 HG13 VAL 93 3HG1 VAL 93 20.171 -21.107 12.736 682 HG21 VAL 93 3HG2 VAL 93 21.762 -24.821 11.446 683 HG22 VAL 93 1HG2 VAL 93 22.866 -23.445 11.429 684 HG23 VAL 93 2HG2 VAL 93 22.261 -24.072 12.962 685 H VAL 94 H VAL 94 18.470 -22.766 14.109 686 HA VAL 94 HA VAL 94 16.432 -21.220 12.647 687 HB VAL 94 HB VAL 94 16.318 -22.121 15.527 688 HG11 VAL 94 1HG1 VAL 94 14.944 -20.239 15.313 689 HG12 VAL 94 2HG1 VAL 94 14.393 -20.713 13.705 690 HG13 VAL 94 3HG1 VAL 94 13.845 -21.605 15.124 691 HG21 VAL 94 3HG2 VAL 94 16.260 -24.066 14.097 692 HG22 VAL 94 1HG2 VAL 94 14.643 -23.760 14.733 693 HG23 VAL 94 2HG2 VAL 94 15.036 -23.317 13.071 694 H MET 95 H MET 95 16.800 -19.111 12.571 695 HA MET 95 HA MET 95 17.814 -17.749 14.952 696 HB2 MET 95 2HB MET 95 18.947 -17.130 12.229 697 HB3 MET 95 3HB MET 95 19.516 -16.565 13.794 698 HG2 MET 95 2HG MET 95 19.817 -19.180 14.178 699 HG3 MET 95 3HG MET 95 19.969 -19.144 12.423 700 HE1 MET 95 3HE MET 95 21.708 -16.468 11.684 701 HE2 MET 95 1HE MET 95 23.179 -17.441 11.656 702 HE3 MET 95 2HE MET 95 21.652 -18.137 11.116 703 H SER 96 H SER 96 17.574 -15.355 14.770 704 HA SER 96 HA SER 96 15.503 -14.513 12.881 705 HB2 SER 96 2HB SER 96 14.181 -13.476 14.680 706 HB3 SER 96 3HB SER 96 14.300 -15.222 14.902 707 HG SER 96 HG SER 96 14.828 -13.493 16.696 708 H ALA 97 H ALA 97 15.877 -12.546 12.076 709 HA ALA 97 HA ALA 97 17.472 -10.630 13.606 710 HB1 ALA 97 1HB ALA 97 18.838 -10.134 11.573 711 HB2 ALA 97 2HB ALA 97 19.144 -11.715 12.292 712 HB3 ALA 97 3HB ALA 97 18.162 -11.585 10.834 713 H THR 98 H THR 98 16.971 -8.510 13.222 714 HA THR 98 HA THR 98 14.508 -8.020 11.789 715 HB THR 98 HB THR 98 16.235 -5.975 13.187 716 HG1 THR 98 HG1 THR 98 14.174 -7.644 14.238 717 HG21 THR 98 3HG2 THR 98 13.645 -5.943 11.856 718 HG22 THR 98 1HG2 THR 98 14.680 -4.602 12.343 719 HG23 THR 98 2HG2 THR 98 13.571 -5.327 13.506 720 H ILE 99 H ILE 99 14.319 -7.192 9.808 721 HA ILE 99 HA ILE 99 16.750 -6.166 8.502 722 HB ILE 99 HB ILE 99 15.471 -6.663 6.357 723 HG12 ILE 99 2HG1 ILE 99 13.829 -8.392 8.217 724 HG13 ILE 99 3HG1 ILE 99 13.254 -6.889 7.502 725 HG21 ILE 99 1HG2 ILE 99 17.227 -8.098 6.704 726 HG22 ILE 99 2HG2 ILE 99 16.587 -8.683 8.239 727 HG23 ILE 99 3HG2 ILE 99 15.875 -9.229 6.721 728 HD11 ILE 99 3HD1 ILE 99 13.668 -7.909 5.257 729 HD12 ILE 99 1HD1 ILE 99 13.984 -9.434 6.084 730 HD13 ILE 99 2HD1 ILE 99 12.396 -8.676 6.207 731 H VAL 100 H VAL 100 16.813 -4.098 7.921 732 HA VAL 100 HA VAL 100 14.287 -2.580 7.896 733 HB VAL 100 HB VAL 100 15.847 -0.571 8.228 734 HG11 VAL 100 1HG1 VAL 100 14.946 -2.584 10.172 735 HG12 VAL 100 2HG1 VAL 100 16.173 -1.462 10.764 736 HG13 VAL 100 3HG1 VAL 100 14.652 -0.846 10.115 737 HG21 VAL 100 3HG2 VAL 100 17.968 -1.083 9.373 738 HG22 VAL 100 1HG2 VAL 100 17.712 -2.797 9.044 739 HG23 VAL 100 2HG2 VAL 100 17.946 -1.668 7.709 740 H VAL 101 H VAL 101 13.622 -2.221 5.885 741 HA VAL 101 HA VAL 101 15.619 -1.775 3.776 742 HB VAL 101 HB VAL 101 12.677 -2.400 3.489 743 HG11 VAL 101 1HG1 VAL 101 13.348 -2.886 1.120 744 HG12 VAL 101 2HG1 VAL 101 13.417 -1.183 1.581 745 HG13 VAL 101 3HG1 VAL 101 14.901 -2.131 1.477 746 HG21 VAL 101 3HG2 VAL 101 13.623 -4.361 4.336 747 HG22 VAL 101 1HG2 VAL 101 13.658 -4.597 2.588 748 HG23 VAL 101 2HG2 VAL 101 15.127 -4.131 3.445 749 H GLY 102 H GLY 102 15.915 0.202 2.982 750 HA2 GLY 102 2HA GLY 102 13.929 2.273 3.655 751 HA3 GLY 102 3HA GLY 102 15.632 2.570 3.337 752 H GLU 103 H GLU 103 12.531 2.599 2.044 753 HA GLU 103 HA GLU 103 13.432 2.380 -0.723 754 HB2 GLU 103 2HB GLU 103 10.888 2.111 0.677 755 HB3 GLU 103 3HB GLU 103 10.755 3.103 -0.769 756 HG2 GLU 103 2HG GLU 103 10.423 1.124 -1.768 757 HG3 GLU 103 3HG GLU 103 12.184 1.055 -1.752 758 H LEU 104 H LEU 104 12.193 4.753 1.558 759 HA LEU 104 HA LEU 104 13.225 6.888 -0.114 760 HB2 LEU 104 2HB LEU 104 10.352 6.361 0.299 761 HB3 LEU 104 3HB LEU 104 10.866 8.034 0.506 762 HG LEU 104 HG LEU 104 11.948 6.954 -1.932 763 HD11 LEU 104 1HD1 LEU 104 8.985 7.092 -2.084 764 HD12 LEU 104 2HD1 LEU 104 9.721 5.606 -1.484 765 HD13 LEU 104 3HD1 LEU 104 10.133 6.208 -3.090 766 HD21 LEU 104 3HD2 LEU 104 11.659 9.339 -1.339 767 HD22 LEU 104 1HD2 LEU 104 9.912 9.125 -1.448 768 HD23 LEU 104 2HD2 LEU 104 10.917 8.915 -2.882 769 H GLU 105 H GLU 105 13.863 8.660 1.039 770 HA GLU 105 HA GLU 105 14.596 9.812 2.863 771 HB2 GLU 105 2HB GLU 105 11.731 9.341 3.246 772 HB3 GLU 105 3HB GLU 105 12.593 9.657 4.745 773 HG2 GLU 105 2HG GLU 105 13.461 11.737 3.816 774 HG3 GLU 105 3HG GLU 105 12.610 11.420 2.305 Start of MODEL 11 1 HA PRO 1 HA PRO 1 1.588 0.350 -1.105 2 HB2 PRO 1 2HB PRO 1 4.052 -0.791 -1.117 3 HB3 PRO 1 3HB PRO 1 3.707 0.741 -0.307 4 HG2 PRO 1 2HG PRO 1 3.919 -2.010 0.855 5 HG3 PRO 1 3HG PRO 1 4.560 -0.479 1.480 6 HD2 PRO 1 2HD PRO 1 2.287 -1.603 2.430 7 HD3 PRO 1 3HD PRO 1 2.529 0.155 2.366 8 H LEU 2 H LEU 2 2.524 -0.844 -3.046 9 HA LEU 2 HA LEU 2 2.034 -3.709 -3.063 10 HB2 LEU 2 2HB LEU 2 -0.073 -2.183 -3.650 11 HB3 LEU 2 3HB LEU 2 0.695 -2.202 -5.236 12 HG LEU 2 HG LEU 2 0.687 -4.792 -4.891 13 HD11 LEU 2 1HD1 LEU 2 -1.784 -4.231 -3.328 14 HD12 LEU 2 2HD1 LEU 2 -0.238 -4.313 -2.484 15 HD13 LEU 2 3HD1 LEU 2 -0.810 -5.698 -3.414 16 HD21 LEU 2 3HD2 LEU 2 -0.540 -4.137 -6.691 17 HD22 LEU 2 1HD2 LEU 2 -1.462 -2.947 -5.773 18 HD23 LEU 2 2HD2 LEU 2 -1.856 -4.661 -5.639 19 H THR 3 H THR 3 2.891 -4.776 -4.911 20 HA THR 3 HA THR 3 4.648 -3.122 -6.596 21 HB THR 3 HB THR 3 5.946 -4.260 -4.778 22 HG1 THR 3 HG1 THR 3 7.569 -4.602 -6.167 23 HG21 THR 3 3HG2 THR 3 4.375 -6.472 -5.532 24 HG22 THR 3 1HG2 THR 3 5.657 -6.422 -4.323 25 HG23 THR 3 2HG2 THR 3 6.033 -6.858 -5.990 26 H ARG 4 H ARG 4 5.451 -4.368 -8.535 27 HA ARG 4 HA ARG 4 3.186 -5.792 -9.705 28 HB2 ARG 4 2HB ARG 4 5.421 -4.163 -10.735 29 HB3 ARG 4 3HB ARG 4 4.976 -5.539 -11.736 30 HG2 ARG 4 2HG ARG 4 2.606 -4.701 -11.646 31 HG3 ARG 4 3HG ARG 4 3.241 -3.234 -10.897 32 HD2 ARG 4 2HD ARG 4 4.463 -2.654 -12.816 33 HD3 ARG 4 3HD ARG 4 4.310 -4.270 -13.503 34 HE ARG 4 HE ARG 4 1.771 -3.033 -13.166 35 HH11 ARG 4 1HH1 ARG 4 4.590 -3.095 -15.208 36 HH12 ARG 4 2HH1 ARG 4 3.738 -2.569 -16.622 37 HH21 ARG 4 2HH2 ARG 4 1.490 -2.140 -16.515 38 HH22 ARG 4 1HH2 ARG 4 0.638 -2.341 -15.021 39 HA PRO 5 HA PRO 5 5.033 -9.770 -9.734 40 HB2 PRO 5 2HB PRO 5 4.323 -10.729 -12.172 41 HB3 PRO 5 3HB PRO 5 3.170 -10.524 -10.848 42 HG2 PRO 5 2HG PRO 5 3.694 -8.743 -13.197 43 HG3 PRO 5 3HG PRO 5 2.145 -9.227 -12.483 44 HD2 PRO 5 2HD PRO 5 3.290 -6.824 -11.988 45 HD3 PRO 5 3HD PRO 5 2.299 -7.675 -10.786 46 H TYR 6 H TYR 6 7.201 -8.636 -9.799 47 HA TYR 6 HA TYR 6 8.589 -9.312 -12.308 48 HB2 TYR 6 2HB TYR 6 8.314 -6.789 -11.557 49 HB3 TYR 6 3HB TYR 6 9.672 -7.186 -10.510 50 HD1 TYR 6 HD1 TYR 6 8.658 -7.634 -14.085 51 HD2 TYR 6 HD2 TYR 6 11.782 -6.765 -11.330 52 HE1 TYR 6 HE1 TYR 6 10.205 -7.270 -15.962 53 HE2 TYR 6 HE2 TYR 6 13.337 -6.398 -13.200 54 HH TYR 6 HH TYR 6 13.632 -6.572 -15.410 55 H LEU 7 H LEU 7 10.170 -10.753 -12.113 56 HA LEU 7 HA LEU 7 11.242 -11.290 -9.422 57 HB2 LEU 7 2HB LEU 7 11.758 -13.577 -10.374 58 HB3 LEU 7 3HB LEU 7 10.061 -13.203 -10.079 59 HG LEU 7 HG LEU 7 10.905 -12.598 -12.804 60 HD11 LEU 7 1HD1 LEU 7 11.413 -14.709 -13.589 61 HD12 LEU 7 2HD1 LEU 7 10.760 -15.513 -12.162 62 HD13 LEU 7 3HD1 LEU 7 12.299 -14.657 -12.065 63 HD21 LEU 7 3HD2 LEU 7 8.878 -14.060 -13.233 64 HD22 LEU 7 1HD2 LEU 7 8.602 -12.590 -12.298 65 HD23 LEU 7 2HD2 LEU 7 8.695 -14.151 -11.481 66 H GLY 8 H GLY 8 13.318 -10.833 -9.126 67 HA2 GLY 8 2HA GLY 8 15.100 -10.856 -11.482 68 HA3 GLY 8 3HA GLY 8 15.166 -9.573 -10.283 69 H PHE 9 H PHE 9 14.650 -12.931 -9.447 70 HA PHE 9 HA PHE 9 17.437 -13.271 -8.676 71 HB2 PHE 9 2HB PHE 9 16.966 -13.759 -6.369 72 HB3 PHE 9 3HB PHE 9 16.277 -12.182 -6.739 73 HD1 PHE 9 HD1 PHE 9 15.683 -15.262 -5.208 74 HD2 PHE 9 HD2 PHE 9 13.754 -12.260 -7.528 75 HE1 PHE 9 HE1 PHE 9 13.498 -16.031 -4.379 76 HE2 PHE 9 HE2 PHE 9 11.566 -13.024 -6.702 77 HZ PHE 9 HZ PHE 9 11.436 -14.910 -5.125 78 H ARG 10 H ARG 10 17.686 -15.529 -7.602 79 HA ARG 10 HA ARG 10 16.027 -17.423 -9.132 80 HB2 ARG 10 2HB ARG 10 18.947 -17.371 -8.489 81 HB3 ARG 10 3HB ARG 10 18.149 -18.922 -8.710 82 HG2 ARG 10 2HG ARG 10 17.273 -17.627 -10.900 83 HG3 ARG 10 3HG ARG 10 18.840 -16.848 -10.677 84 HD2 ARG 10 2HD ARG 10 20.006 -18.852 -10.917 85 HD3 ARG 10 3HD ARG 10 18.579 -19.830 -10.580 86 HE ARG 10 HE ARG 10 18.049 -18.419 -12.903 87 HH11 ARG 10 1HH1 ARG 10 20.329 -20.808 -11.803 88 HH12 ARG 10 2HH1 ARG 10 20.539 -21.519 -13.369 89 HH21 ARG 10 2HH2 ARG 10 19.394 -20.686 -15.170 90 HH22 ARG 10 1HH2 ARG 10 18.316 -19.346 -14.970 91 H VAL 11 H VAL 11 15.122 -19.144 -8.108 92 HA VAL 11 HA VAL 11 15.750 -19.555 -5.268 93 HB VAL 11 HB VAL 11 13.699 -18.149 -5.474 94 HG11 VAL 11 1HG1 VAL 11 11.705 -18.970 -6.421 95 HG12 VAL 11 2HG1 VAL 11 12.961 -19.308 -7.613 96 HG13 VAL 11 3HG1 VAL 11 12.355 -20.601 -6.577 97 HG21 VAL 11 3HG2 VAL 11 14.089 -19.600 -3.531 98 HG22 VAL 11 1HG2 VAL 11 12.372 -19.443 -3.900 99 HG23 VAL 11 2HG2 VAL 11 13.239 -20.912 -4.349 100 H ALA 12 H ALA 12 15.850 -21.641 -4.649 101 HA ALA 12 HA ALA 12 14.903 -23.682 -6.553 102 HB1 ALA 12 1HB ALA 12 17.469 -23.249 -6.315 103 HB2 ALA 12 2HB ALA 12 17.289 -24.195 -4.837 104 HB3 ALA 12 3HB ALA 12 16.849 -24.898 -6.393 105 H VAL 13 H VAL 13 13.430 -24.993 -5.713 106 HA VAL 13 HA VAL 13 12.907 -24.995 -2.874 107 HB VAL 13 HB VAL 13 11.012 -24.995 -4.376 108 HG11 VAL 13 1HG1 VAL 13 10.928 -26.186 -6.250 109 HG12 VAL 13 2HG1 VAL 13 12.551 -26.776 -5.887 110 HG13 VAL 13 3HG1 VAL 13 11.139 -27.695 -5.362 111 HG21 VAL 13 3HG2 VAL 13 9.736 -26.398 -3.131 112 HG22 VAL 13 1HG2 VAL 13 10.833 -27.763 -3.346 113 HG23 VAL 13 2HG2 VAL 13 11.213 -26.502 -2.172 114 H GLY 14 H GLY 14 13.346 -26.574 -1.429 115 HA2 GLY 14 2HA GLY 14 13.987 -29.256 -2.183 116 HA3 GLY 14 3HA GLY 14 15.429 -28.341 -1.767 117 H ARG 15 H ARG 15 15.718 -29.863 -0.029 118 HA ARG 15 HA ARG 15 14.056 -29.186 2.305 119 HB2 ARG 15 2HB ARG 15 15.204 -31.908 1.661 120 HB3 ARG 15 3HB ARG 15 14.297 -31.491 3.108 121 HG2 ARG 15 2HG ARG 15 12.857 -30.827 0.679 122 HG3 ARG 15 3HG ARG 15 13.272 -32.539 0.775 123 HD2 ARG 15 2HD ARG 15 12.263 -31.412 3.280 124 HD3 ARG 15 3HD ARG 15 11.102 -31.365 1.954 125 HE ARG 15 HE ARG 15 11.948 -33.664 3.396 126 HH11 ARG 15 1HH1 ARG 15 10.956 -32.569 0.243 127 HH12 ARG 15 2HH1 ARG 15 10.355 -34.118 -0.249 128 HH21 ARG 15 2HH2 ARG 15 10.470 -35.902 1.184 129 HH22 ARG 15 1HH2 ARG 15 11.160 -35.708 2.759 130 H ASP 16 H ASP 16 15.116 -28.851 4.216 131 HA ASP 16 HA ASP 16 18.034 -28.666 4.031 132 HB2 ASP 16 2HB ASP 16 15.963 -27.319 5.732 133 HB3 ASP 16 3HB ASP 16 17.639 -27.377 6.272 134 H SER 17 H SER 17 18.987 -28.856 6.453 135 HA SER 17 HA SER 17 18.977 -31.602 7.034 136 HB2 SER 17 2HB SER 17 20.499 -29.384 7.790 137 HB3 SER 17 3HB SER 17 19.820 -29.994 9.299 138 HG SER 17 HG SER 17 20.851 -31.878 9.024 139 H SER 18 H SER 18 17.013 -28.988 8.183 140 HA SER 18 HA SER 18 16.032 -30.388 10.499 141 HB2 SER 18 2HB SER 18 15.981 -28.060 10.764 142 HB3 SER 18 3HB SER 18 15.333 -27.795 9.146 143 HG SER 18 HG SER 18 13.689 -27.512 10.639 144 H GLY 19 H GLY 19 14.254 -29.090 7.690 145 HA2 GLY 19 2HA GLY 19 13.021 -30.689 6.268 146 HA3 GLY 19 3HA GLY 19 12.614 -31.549 7.746 147 H CYS 20 H CYS 20 12.524 -28.081 6.967 148 HA CYS 20 HA CYS 20 9.694 -28.083 7.771 149 HB2 CYS 20 2HB CYS 20 11.933 -26.274 8.291 150 HB3 CYS 20 3HB CYS 20 10.494 -25.438 7.721 151 HG CYS 20 HG CYS 20 9.467 -25.299 10.060 152 H THR 21 H THR 21 11.243 -28.425 5.059 153 HA THR 21 HA THR 21 10.939 -27.877 2.866 154 HB THR 21 HB THR 21 8.149 -27.082 3.705 155 HG1 THR 21 HG1 THR 21 7.640 -29.281 3.503 156 HG21 THR 21 3HG2 THR 21 7.631 -27.088 1.525 157 HG22 THR 21 1HG2 THR 21 8.528 -28.577 1.230 158 HG23 THR 21 2HG2 THR 21 9.368 -27.026 1.233 159 H THR 22 H THR 22 12.390 -26.097 2.908 160 HA THR 22 HA THR 22 11.031 -23.512 2.576 161 HB THR 22 HB THR 22 11.965 -23.200 4.703 162 HG1 THR 22 HG1 THR 22 14.179 -22.310 3.211 163 HG21 THR 22 3HG2 THR 22 14.515 -23.741 4.983 164 HG22 THR 22 1HG2 THR 22 14.215 -24.866 3.659 165 HG23 THR 22 2HG2 THR 22 13.311 -25.016 5.166 166 H LEU 23 H LEU 23 12.214 -21.974 1.268 167 HA LEU 23 HA LEU 23 13.868 -23.327 -0.742 168 HB2 LEU 23 2HB LEU 23 12.047 -20.969 -0.781 169 HB3 LEU 23 3HB LEU 23 13.368 -21.039 -1.945 170 HG LEU 23 HG LEU 23 12.486 -23.043 -2.921 171 HD11 LEU 23 1HD1 LEU 23 11.604 -24.393 -1.311 172 HD12 LEU 23 2HD1 LEU 23 10.116 -23.719 -1.973 173 HD13 LEU 23 3HD1 LEU 23 10.792 -23.066 -0.481 174 HD21 LEU 23 3HD2 LEU 23 9.904 -21.931 -2.965 175 HD22 LEU 23 1HD2 LEU 23 11.203 -21.702 -4.136 176 HD23 LEU 23 2HD2 LEU 23 11.027 -20.582 -2.784 177 H SER 24 H SER 24 15.728 -22.240 -1.613 178 HA SER 24 HA SER 24 16.970 -20.374 0.302 179 HB2 SER 24 2HB SER 24 18.043 -22.586 0.354 180 HB3 SER 24 3HB SER 24 18.331 -22.491 -1.383 181 HG SER 24 HG SER 24 19.941 -21.153 -1.054 182 H ILE 25 H ILE 25 18.020 -18.598 -0.485 183 HA ILE 25 HA ILE 25 17.533 -17.978 -3.300 184 HB ILE 25 HB ILE 25 18.580 -16.073 -1.217 185 HG12 ILE 25 2HG1 ILE 25 16.503 -17.002 -0.353 186 HG13 ILE 25 3HG1 ILE 25 16.232 -15.349 -0.896 187 HG21 ILE 25 1HG2 ILE 25 16.986 -15.562 -3.722 188 HG22 ILE 25 2HG2 ILE 25 17.755 -14.366 -2.680 189 HG23 ILE 25 3HG2 ILE 25 18.745 -15.474 -3.630 190 HD11 ILE 25 3HD1 ILE 25 14.932 -17.764 -1.705 191 HD12 ILE 25 1HD1 ILE 25 14.533 -16.091 -2.095 192 HD13 ILE 25 2HD1 ILE 25 15.678 -16.982 -3.099 193 H GLN 26 H GLN 26 19.109 -17.748 -4.773 194 HA GLN 26 HA GLN 26 21.851 -18.287 -3.911 195 HB2 GLN 26 2HB GLN 26 20.485 -18.399 -6.595 196 HB3 GLN 26 3HB GLN 26 22.229 -18.539 -6.419 197 HG2 GLN 26 2HG GLN 26 22.105 -20.656 -5.743 198 HG3 GLN 26 3HG GLN 26 20.754 -20.327 -4.659 199 HE21 GLN 26 2HE2 GLN 26 18.284 -21.382 -6.877 200 HE22 GLN 26 1HE2 GLN 26 18.660 -20.567 -5.401 201 H GLU 27 H GLU 27 19.860 -15.772 -5.196 202 HA GLU 27 HA GLU 27 22.241 -14.060 -5.493 203 HB2 GLU 27 2HB GLU 27 20.378 -14.653 -7.441 204 HB3 GLU 27 3HB GLU 27 19.817 -13.106 -6.823 205 HG2 GLU 27 2HG GLU 27 21.335 -12.074 -8.046 206 HG3 GLU 27 3HG GLU 27 22.612 -12.906 -7.160 207 H VAL 28 H VAL 28 21.058 -11.608 -5.623 208 HA VAL 28 HA VAL 28 19.720 -11.371 -3.006 209 HB VAL 28 HB VAL 28 20.759 -9.047 -2.951 210 HG11 VAL 28 1HG1 VAL 28 21.599 -11.416 -1.944 211 HG12 VAL 28 2HG1 VAL 28 23.028 -10.913 -2.850 212 HG13 VAL 28 3HG1 VAL 28 22.361 -9.864 -1.599 213 HG21 VAL 28 3HG2 VAL 28 21.551 -9.707 -5.517 214 HG22 VAL 28 1HG2 VAL 28 22.136 -8.347 -4.560 215 HG23 VAL 28 2HG2 VAL 28 23.027 -9.869 -4.567 216 H THR 29 H THR 29 17.793 -10.414 -2.989 217 HA THR 29 HA THR 29 16.996 -8.844 -5.354 218 HB THR 29 HB THR 29 15.728 -10.899 -5.306 219 HG1 THR 29 HG1 THR 29 14.675 -8.674 -5.577 220 HG21 THR 29 3HG2 THR 29 16.020 -11.392 -2.900 221 HG22 THR 29 1HG2 THR 29 14.344 -11.549 -3.424 222 HG23 THR 29 2HG2 THR 29 14.856 -10.123 -2.521 223 H GLN 30 H GLN 30 17.893 -8.492 -2.265 224 HA GLN 30 HA GLN 30 15.817 -6.654 -1.412 225 HB2 GLN 30 2HB GLN 30 17.281 -6.367 0.596 226 HB3 GLN 30 3HB GLN 30 16.774 -8.026 0.305 227 HG2 GLN 30 2HG GLN 30 19.355 -7.193 -0.868 228 HG3 GLN 30 3HG GLN 30 19.282 -7.350 0.886 229 HE21 GLN 30 2HE2 GLN 30 20.350 -10.607 -0.257 230 HE22 GLN 30 1HE2 GLN 30 20.964 -9.001 -0.091 231 H THR 31 H THR 31 18.098 -6.371 -3.632 232 HA THR 31 HA THR 31 18.868 -3.632 -2.866 233 HB THR 31 HB THR 31 20.544 -4.035 -4.867 234 HG1 THR 31 HG1 THR 31 21.206 -6.272 -4.840 235 HG21 THR 31 3HG2 THR 31 21.372 -5.540 -2.459 236 HG22 THR 31 1HG2 THR 31 20.816 -3.887 -2.197 237 HG23 THR 31 2HG2 THR 31 22.167 -4.201 -3.287 238 H TYR 32 H TYR 32 16.411 -4.814 -4.312 239 HA TYR 32 HA TYR 32 16.535 -3.004 -6.635 240 HB2 TYR 32 2HB TYR 32 16.072 -5.768 -6.650 241 HB3 TYR 32 3HB TYR 32 14.490 -5.036 -6.889 242 HD1 TYR 32 HD1 TYR 32 13.846 -4.428 -9.030 243 HD2 TYR 32 HD2 TYR 32 17.993 -4.815 -8.161 244 HE1 TYR 32 HE1 TYR 32 14.372 -4.054 -11.403 245 HE2 TYR 32 HE2 TYR 32 18.531 -4.441 -10.531 246 HH TYR 32 HH TYR 32 16.092 -3.484 -12.841 247 H THR 33 H THR 33 14.719 -1.756 -7.083 248 HA THR 33 HA THR 33 12.380 -1.934 -5.384 249 HB THR 33 HB THR 33 13.957 0.641 -5.383 250 HG1 THR 33 HG1 THR 33 14.837 0.028 -3.501 251 HG21 THR 33 3HG2 THR 33 12.286 0.584 -3.194 252 HG22 THR 33 1HG2 THR 33 11.317 -0.182 -4.452 253 HG23 THR 33 2HG2 THR 33 11.973 1.435 -4.706 254 H GLY 34 H GLY 34 10.597 -0.749 -6.167 255 HA2 GLY 34 2HA GLY 34 10.889 0.907 -8.521 256 HA3 GLY 34 3HA GLY 34 10.132 -0.649 -8.825 257 H SER 35 H SER 35 8.742 -0.822 -6.323 258 HA SER 35 HA SER 35 6.656 1.185 -6.838 259 HB2 SER 35 2HB SER 35 6.192 -1.300 -5.223 260 HB3 SER 35 3HB SER 35 5.048 -0.372 -6.192 261 HG SER 35 HG SER 35 5.732 -1.350 -7.976 262 H ASN 36 H ASN 36 5.756 2.370 -5.176 263 HA ASN 36 HA ASN 36 5.687 3.505 -3.208 264 HB2 ASN 36 2HB ASN 36 5.320 1.024 -2.459 265 HB3 ASN 36 3HB ASN 36 6.942 1.179 -1.791 266 HD21 ASN 36 2HD2 ASN 36 3.925 3.474 -0.241 267 HD22 ASN 36 1HD2 ASN 36 3.895 2.995 -1.901 268 H GLY 37 H GLY 37 8.091 3.587 -4.888 269 HA2 GLY 37 2HA GLY 37 9.713 5.231 -3.343 270 HA3 GLY 37 3HA GLY 37 10.416 3.623 -3.263 271 H GLY 38 H GLY 38 10.617 2.540 -5.504 272 HA2 GLY 38 2HA GLY 38 11.390 2.587 -7.682 273 HA3 GLY 38 3HA GLY 38 10.971 4.292 -7.750 274 H ALA 39 H ALA 39 13.418 1.999 -6.653 275 HA ALA 39 HA ALA 39 15.578 3.525 -7.555 276 HB1 ALA 39 1HB ALA 39 14.689 4.109 -4.791 277 HB2 ALA 39 2HB ALA 39 16.424 3.951 -5.065 278 HB3 ALA 39 3HB ALA 39 15.494 5.146 -5.969 279 H ASP 40 H ASP 40 16.228 1.491 -8.259 280 HA ASP 40 HA ASP 40 16.691 -0.624 -6.331 281 HB2 ASP 40 2HB ASP 40 17.402 -1.948 -8.270 282 HB3 ASP 40 3HB ASP 40 15.842 -1.184 -8.566 283 H LEU 41 H LEU 41 18.462 -0.656 -5.129 284 HA LEU 41 HA LEU 41 21.065 -0.402 -6.278 285 HB2 LEU 41 2HB LEU 41 19.971 1.988 -5.613 286 HB3 LEU 41 3HB LEU 41 20.770 1.556 -4.102 287 HG LEU 41 HG LEU 41 22.847 1.167 -5.631 288 HD11 LEU 41 1HD1 LEU 41 22.071 1.389 -7.791 289 HD12 LEU 41 2HD1 LEU 41 22.720 2.997 -7.472 290 HD13 LEU 41 3HD1 LEU 41 20.982 2.714 -7.378 291 HD21 LEU 41 3HD2 LEU 41 23.476 3.523 -5.347 292 HD22 LEU 41 1HD2 LEU 41 22.715 2.864 -3.899 293 HD23 LEU 41 2HD2 LEU 41 21.798 3.919 -4.975 294 H MET 42 H MET 42 22.551 0.114 -4.003 295 HA MET 42 HA MET 42 21.782 -2.139 -2.269 296 HB2 MET 42 2HB MET 42 24.586 -1.096 -2.626 297 HB3 MET 42 3HB MET 42 24.078 -2.633 -1.939 298 HG2 MET 42 2HG MET 42 24.576 -3.474 -3.938 299 HG3 MET 42 3HG MET 42 23.039 -2.781 -4.449 300 HE1 MET 42 3HE MET 42 26.873 -2.757 -4.835 301 HE2 MET 42 1HE MET 42 27.231 -1.093 -5.297 302 HE3 MET 42 2HE MET 42 26.668 -1.453 -3.665 303 H GLY 43 H GLY 43 21.246 -1.641 -0.251 304 HA2 GLY 43 2HA GLY 43 22.700 0.311 1.272 305 HA3 GLY 43 3HA GLY 43 21.089 0.863 0.839 306 HA PRO 44 HA PRO 44 19.258 -1.343 4.150 307 HB2 PRO 44 2HB PRO 44 17.118 -2.594 3.043 308 HB3 PRO 44 3HB PRO 44 17.189 -0.845 3.284 309 HG2 PRO 44 2HG PRO 44 17.700 -2.436 0.801 310 HG3 PRO 44 3HG PRO 44 16.797 -0.922 0.994 311 HD2 PRO 44 2HD PRO 44 19.340 -0.994 0.067 312 HD3 PRO 44 3HD PRO 44 18.711 0.362 1.025 313 H ALA 45 H ALA 45 20.515 -3.092 1.515 314 HA ALA 45 HA ALA 45 19.946 -5.726 2.533 315 HB1 ALA 45 1HB ALA 45 21.331 -6.524 0.710 316 HB2 ALA 45 2HB ALA 45 20.198 -5.305 0.125 317 HB3 ALA 45 3HB ALA 45 21.890 -4.883 0.387 318 H PHE 46 H PHE 46 22.824 -3.648 2.316 319 HA PHE 46 HA PHE 46 24.502 -5.486 3.717 320 HB2 PHE 46 2HB PHE 46 24.784 -2.618 2.863 321 HB3 PHE 46 3HB PHE 46 25.991 -3.373 3.899 322 HD1 PHE 46 HD1 PHE 46 24.551 -3.245 0.554 323 HD2 PHE 46 HD2 PHE 46 27.411 -5.156 3.061 324 HE1 PHE 46 HE1 PHE 46 25.651 -4.195 -1.431 325 HE2 PHE 46 HE2 PHE 46 28.517 -6.108 1.080 326 HZ PHE 46 HZ PHE 46 27.638 -5.627 -1.170 327 H ALA 47 H ALA 47 22.287 -3.011 4.646 328 HA ALA 47 HA ALA 47 23.367 -2.520 7.247 329 HB1 ALA 47 1HB ALA 47 20.977 -1.583 7.609 330 HB2 ALA 47 2HB ALA 47 22.062 -0.769 6.481 331 HB3 ALA 47 3HB ALA 47 20.799 -1.840 5.873 332 H ALA 48 H ALA 48 21.179 -4.852 5.878 333 HA ALA 48 HA ALA 48 20.428 -5.818 8.542 334 HB1 ALA 48 1HB ALA 48 18.581 -6.805 7.608 335 HB2 ALA 48 2HB ALA 48 18.794 -5.426 6.530 336 HB3 ALA 48 3HB ALA 48 19.354 -7.024 6.038 337 H GLY 49 H GLY 49 22.432 -6.562 5.834 338 HA2 GLY 49 2HA GLY 49 24.234 -8.091 5.955 339 HA3 GLY 49 3HA GLY 49 23.390 -8.946 7.237 340 H LEU 50 H LEU 50 21.456 -8.124 4.551 341 HA LEU 50 HA LEU 50 20.924 -10.839 3.935 342 HB2 LEU 50 2HB LEU 50 20.280 -8.588 2.075 343 HB3 LEU 50 3HB LEU 50 19.359 -10.053 2.409 344 HG LEU 50 HG LEU 50 19.602 -7.608 4.155 345 HD11 LEU 50 1HD1 LEU 50 17.829 -6.957 2.987 346 HD12 LEU 50 2HD1 LEU 50 16.943 -8.288 3.731 347 HD13 LEU 50 3HD1 LEU 50 17.717 -8.512 2.162 348 HD21 LEU 50 3HD2 LEU 50 19.654 -9.652 5.515 349 HD22 LEU 50 1HD2 LEU 50 18.172 -10.201 4.730 350 HD23 LEU 50 2HD2 LEU 50 18.153 -8.750 5.733 351 H ARG 51 H ARG 51 22.287 -12.141 2.911 352 HA ARG 51 HA ARG 51 23.547 -11.209 0.444 353 HB2 ARG 51 2HB ARG 51 24.955 -11.695 2.908 354 HB3 ARG 51 3HB ARG 51 25.468 -12.854 1.689 355 HG2 ARG 51 2HG ARG 51 25.456 -10.475 0.312 356 HG3 ARG 51 3HG ARG 51 26.028 -10.013 1.917 357 HD2 ARG 51 2HD ARG 51 27.759 -11.718 1.809 358 HD3 ARG 51 3HD ARG 51 27.165 -12.243 0.234 359 HE ARG 51 HE ARG 51 27.814 -9.486 0.191 360 HH11 ARG 51 1HH1 ARG 51 29.260 -12.653 0.205 361 HH12 ARG 51 2HH1 ARG 51 30.695 -12.145 -0.622 362 HH21 ARG 51 2HH2 ARG 51 30.944 -9.955 -1.249 363 HH22 ARG 51 1HH2 ARG 51 29.699 -8.805 -0.899 364 H VAL 52 H VAL 52 24.271 -12.949 -0.941 365 HA VAL 52 HA VAL 52 22.432 -15.020 -1.204 366 HB VAL 52 HB VAL 52 23.914 -15.984 -2.866 367 HG11 VAL 52 1HG1 VAL 52 24.240 -13.012 -3.120 368 HG12 VAL 52 2HG1 VAL 52 23.933 -14.205 -4.383 369 HG13 VAL 52 3HG1 VAL 52 22.658 -13.781 -3.240 370 HG21 VAL 52 3HG2 VAL 52 26.160 -14.775 -3.216 371 HG22 VAL 52 1HG2 VAL 52 25.969 -14.247 -1.545 372 HG23 VAL 52 2HG2 VAL 52 26.047 -15.968 -1.922 373 H GLY 53 H GLY 53 22.265 -17.035 -0.409 374 HA2 GLY 53 2HA GLY 53 23.572 -19.065 0.257 375 HA3 GLY 53 3HA GLY 53 24.470 -17.986 1.314 376 H ASP 54 H ASP 54 22.127 -16.466 2.122 377 HA ASP 54 HA ASP 54 21.182 -18.296 4.167 378 HB2 ASP 54 2HB ASP 54 21.068 -15.328 3.763 379 HB3 ASP 54 3HB ASP 54 19.972 -16.094 4.910 380 H GLN 55 H GLN 55 18.942 -18.578 4.674 381 HA GLN 55 HA GLN 55 17.251 -18.498 2.277 382 HB2 GLN 55 2HB GLN 55 16.809 -20.078 4.814 383 HB3 GLN 55 3HB GLN 55 15.946 -20.255 3.292 384 HG2 GLN 55 2HG GLN 55 18.009 -21.013 2.216 385 HG3 GLN 55 3HG GLN 55 18.858 -20.857 3.754 386 HE21 GLN 55 2HE2 GLN 55 16.333 -23.982 3.068 387 HE22 GLN 55 1HE2 GLN 55 16.304 -22.574 2.068 388 H LEU 56 H LEU 56 15.139 -17.706 2.349 389 HA LEU 56 HA LEU 56 14.431 -16.153 4.747 390 HB2 LEU 56 2HB LEU 56 13.303 -14.688 2.776 391 HB3 LEU 56 3HB LEU 56 14.866 -14.339 3.511 392 HG LEU 56 HG LEU 56 14.766 -16.101 1.107 393 HD11 LEU 56 1HD1 LEU 56 13.708 -13.454 1.152 394 HD12 LEU 56 2HD1 LEU 56 13.904 -14.548 -0.216 395 HD13 LEU 56 3HD1 LEU 56 15.214 -13.457 0.235 396 HD21 LEU 56 3HD2 LEU 56 16.718 -14.460 2.581 397 HD22 LEU 56 1HD2 LEU 56 16.862 -14.430 0.823 398 HD23 LEU 56 2HD2 LEU 56 16.939 -15.966 1.688 399 H VAL 57 H VAL 57 12.488 -16.633 5.522 400 HA VAL 57 HA VAL 57 10.547 -17.934 3.725 401 HB VAL 57 HB VAL 57 9.593 -19.006 5.737 402 HG11 VAL 57 1HG1 VAL 57 12.222 -20.030 6.133 403 HG12 VAL 57 2HG1 VAL 57 10.891 -20.726 5.206 404 HG13 VAL 57 3HG1 VAL 57 12.024 -19.620 4.429 405 HG21 VAL 57 3HG2 VAL 57 10.053 -17.989 7.681 406 HG22 VAL 57 1HG2 VAL 57 11.552 -18.917 7.643 407 HG23 VAL 57 2HG2 VAL 57 11.529 -17.254 7.055 408 H ARG 58 H ARG 58 10.997 -15.584 6.306 409 HA ARG 58 HA ARG 58 9.665 -13.933 7.139 410 HB2 ARG 58 2HB ARG 58 8.360 -13.861 4.428 411 HB3 ARG 58 3HB ARG 58 8.647 -12.527 5.537 412 HG2 ARG 58 2HG ARG 58 11.009 -12.605 5.104 413 HG3 ARG 58 3HG ARG 58 10.816 -14.055 4.117 414 HD2 ARG 58 2HD ARG 58 9.054 -12.245 2.991 415 HD3 ARG 58 3HD ARG 58 10.454 -11.260 3.416 416 HE ARG 58 HE ARG 58 11.565 -12.228 1.683 417 HH11 ARG 58 1HH1 ARG 58 8.986 -14.355 2.657 418 HH12 ARG 58 2HH1 ARG 58 9.278 -15.501 1.391 419 HH21 ARG 58 2HH2 ARG 58 10.969 -15.145 -0.113 420 HH22 ARG 58 1HH2 ARG 58 11.959 -13.730 0.011 421 H PHE 59 H PHE 59 8.674 -16.710 7.288 422 HA PHE 59 HA PHE 59 5.901 -16.057 7.921 423 HB2 PHE 59 2HB PHE 59 5.752 -17.023 5.694 424 HB3 PHE 59 3HB PHE 59 6.715 -18.407 6.200 425 HD1 PHE 59 HD1 PHE 59 3.459 -16.727 6.567 426 HD2 PHE 59 HD2 PHE 59 5.738 -20.236 7.347 427 HE1 PHE 59 HE1 PHE 59 1.403 -17.915 7.209 428 HE2 PHE 59 HE2 PHE 59 3.685 -21.431 7.989 429 HZ PHE 59 HZ PHE 59 1.514 -20.271 7.920 430 H ALA 60 H ALA 60 4.991 -17.338 9.552 431 HA ALA 60 HA ALA 60 6.863 -18.401 11.423 432 HB1 ALA 60 1HB ALA 60 4.441 -19.185 12.382 433 HB2 ALA 60 2HB ALA 60 5.171 -17.603 12.660 434 HB3 ALA 60 3HB ALA 60 3.992 -17.816 11.365 435 H GLY 61 H GLY 61 7.862 -20.269 10.936 436 HA2 GLY 61 2HA GLY 61 7.131 -22.733 11.306 437 HA3 GLY 61 3HA GLY 61 6.276 -22.464 9.795 438 H TYR 62 H TYR 62 8.861 -20.603 9.404 439 HA TYR 62 HA TYR 62 10.796 -20.762 8.221 440 HB2 TYR 62 2HB TYR 62 11.095 -23.584 9.223 441 HB3 TYR 62 3HB TYR 62 12.356 -22.416 8.842 442 HD1 TYR 62 HD1 TYR 62 11.376 -24.131 11.462 443 HD2 TYR 62 HD2 TYR 62 11.489 -20.038 10.305 444 HE1 TYR 62 HE1 TYR 62 11.470 -23.471 13.829 445 HE2 TYR 62 HE2 TYR 62 11.584 -19.366 12.669 446 HH TYR 62 HH TYR 62 11.238 -20.115 14.811 447 H THR 63 H THR 63 8.410 -21.374 6.873 448 HA THR 63 HA THR 63 9.371 -23.351 4.909 449 HB THR 63 HB THR 63 7.492 -24.381 5.927 450 HG1 THR 63 HG1 THR 63 6.287 -24.674 4.136 451 HG21 THR 63 3HG2 THR 63 5.314 -22.663 5.505 452 HG22 THR 63 1HG2 THR 63 6.573 -21.671 6.239 453 HG23 THR 63 2HG2 THR 63 6.021 -23.137 7.049 454 H VAL 64 H VAL 64 8.704 -22.977 2.702 455 HA VAL 64 HA VAL 64 7.821 -20.244 2.106 456 HB VAL 64 HB VAL 64 10.152 -21.505 0.668 457 HG11 VAL 64 1HG1 VAL 64 10.500 -19.108 -0.033 458 HG12 VAL 64 2HG1 VAL 64 9.064 -19.894 -0.692 459 HG13 VAL 64 3HG1 VAL 64 8.913 -18.762 0.653 460 HG21 VAL 64 3HG2 VAL 64 11.152 -21.149 2.701 461 HG22 VAL 64 1HG2 VAL 64 11.372 -19.564 1.959 462 HG23 VAL 64 2HG2 VAL 64 10.072 -19.820 3.123 463 H THR 65 H THR 65 6.969 -19.966 -0.030 464 HA THR 65 HA THR 65 5.845 -22.454 -1.098 465 HB THR 65 HB THR 65 4.718 -20.203 -2.409 466 HG1 THR 65 HG1 THR 65 5.001 -19.913 0.406 467 HG21 THR 65 3HG2 THR 65 2.663 -20.990 -1.410 468 HG22 THR 65 1HG2 THR 65 3.560 -21.902 -0.197 469 HG23 THR 65 2HG2 THR 65 3.637 -22.379 -1.893 470 H GLU 66 H GLU 66 6.841 -19.330 -2.512 471 HA GLU 66 HA GLU 66 8.823 -20.344 -4.195 472 HB2 GLU 66 2HB GLU 66 7.554 -20.187 -6.383 473 HB3 GLU 66 3HB GLU 66 7.203 -21.594 -5.389 474 HG2 GLU 66 2HG GLU 66 5.173 -20.493 -4.567 475 HG3 GLU 66 3HG GLU 66 5.518 -19.110 -5.604 476 H LEU 67 H LEU 67 9.124 -18.781 -6.183 477 HA LEU 67 HA LEU 67 9.620 -16.239 -5.197 478 HB2 LEU 67 2HB LEU 67 9.801 -15.575 -7.618 479 HB3 LEU 67 3HB LEU 67 10.798 -16.938 -7.111 480 HG LEU 67 HG LEU 67 8.784 -18.345 -8.048 481 HD11 LEU 67 1HD1 LEU 67 7.172 -17.097 -8.940 482 HD12 LEU 67 2HD1 LEU 67 8.301 -16.752 -10.250 483 HD13 LEU 67 3HD1 LEU 67 8.164 -15.639 -8.889 484 HD21 LEU 67 3HD2 LEU 67 11.225 -18.090 -8.845 485 HD22 LEU 67 1HD2 LEU 67 10.546 -17.029 -10.080 486 HD23 LEU 67 2HD2 LEU 67 10.023 -18.711 -9.977 487 H ALA 68 H ALA 68 6.714 -17.565 -6.545 488 HA ALA 68 HA ALA 68 5.412 -15.165 -7.255 489 HB1 ALA 68 1HB ALA 68 4.692 -17.417 -7.983 490 HB2 ALA 68 2HB ALA 68 4.138 -17.740 -6.340 491 HB3 ALA 68 3HB ALA 68 3.381 -16.462 -7.290 492 H ALA 69 H ALA 69 5.446 -17.048 -4.251 493 HA ALA 69 HA ALA 69 3.585 -15.427 -2.862 494 HB1 ALA 69 1HB ALA 69 5.505 -16.695 -1.115 495 HB2 ALA 69 2HB ALA 69 3.778 -17.001 -1.303 496 HB3 ALA 69 3HB ALA 69 4.936 -17.804 -2.363 497 H PHE 70 H PHE 70 7.070 -15.292 -3.270 498 HA PHE 70 HA PHE 70 7.668 -13.451 -1.242 499 HB2 PHE 70 2HB PHE 70 9.465 -14.628 -2.288 500 HB3 PHE 70 3HB PHE 70 9.013 -14.031 -3.881 501 HD1 PHE 70 HD1 PHE 70 9.562 -12.342 -0.601 502 HD2 PHE 70 HD2 PHE 70 10.670 -12.672 -4.697 503 HE1 PHE 70 HE1 PHE 70 11.116 -10.454 -0.329 504 HE2 PHE 70 HE2 PHE 70 12.227 -10.786 -4.432 505 HZ PHE 70 HZ PHE 70 12.452 -9.674 -2.246 506 H ASN 71 H ASN 71 6.094 -13.055 -4.269 507 HA ASN 71 HA ASN 71 6.649 -10.280 -4.635 508 HB2 ASN 71 2HB ASN 71 5.581 -12.237 -6.215 509 HB3 ASN 71 3HB ASN 71 4.143 -11.317 -5.784 510 HD21 ASN 71 2HD2 ASN 71 6.646 -9.968 -8.569 511 HD22 ASN 71 1HD2 ASN 71 6.725 -11.547 -7.871 512 H THR 72 H THR 72 4.179 -12.115 -2.963 513 HA THR 72 HA THR 72 2.429 -9.900 -2.511 514 HB THR 72 HB THR 72 2.180 -12.009 -0.532 515 HG1 THR 72 HG1 THR 72 1.889 -13.722 -1.922 516 HG21 THR 72 3HG2 THR 72 -0.077 -12.172 -1.521 517 HG22 THR 72 1HG2 THR 72 0.424 -11.072 -2.805 518 HG23 THR 72 2HG2 THR 72 0.366 -10.510 -1.134 519 H VAL 73 H VAL 73 4.915 -11.544 -0.595 520 HA VAL 73 HA VAL 73 4.521 -9.977 1.748 521 HB VAL 73 HB VAL 73 6.695 -10.889 2.486 522 HG11 VAL 73 1HG1 VAL 73 5.548 -12.670 3.148 523 HG12 VAL 73 2HG1 VAL 73 4.320 -12.299 1.936 524 HG13 VAL 73 3HG1 VAL 73 5.656 -13.379 1.537 525 HG21 VAL 73 3HG2 VAL 73 6.781 -11.917 -0.337 526 HG22 VAL 73 1HG2 VAL 73 7.992 -10.968 0.526 527 HG23 VAL 73 2HG2 VAL 73 7.718 -12.654 0.963 528 H VAL 74 H VAL 74 6.795 -9.806 -0.964 529 HA VAL 74 HA VAL 74 8.337 -7.662 0.027 530 HB VAL 74 HB VAL 74 8.985 -9.185 -1.867 531 HG11 VAL 74 1HG1 VAL 74 7.196 -7.371 -3.481 532 HG12 VAL 74 2HG1 VAL 74 8.229 -8.657 -4.107 533 HG13 VAL 74 3HG1 VAL 74 6.847 -9.053 -3.085 534 HG21 VAL 74 3HG2 VAL 74 10.543 -7.682 -2.431 535 HG22 VAL 74 1HG2 VAL 74 9.347 -6.554 -3.069 536 HG23 VAL 74 2HG2 VAL 74 9.698 -6.584 -1.341 537 H ALA 75 H ALA 75 5.360 -7.795 -1.830 538 HA ALA 75 HA ALA 75 5.246 -5.115 -2.654 539 HB1 ALA 75 1HB ALA 75 2.932 -5.489 -3.095 540 HB2 ALA 75 2HB ALA 75 3.796 -6.978 -3.481 541 HB3 ALA 75 3HB ALA 75 2.880 -6.853 -1.979 542 H ARG 76 H ARG 76 4.054 -6.700 0.286 543 HA ARG 76 HA ARG 76 3.030 -4.222 1.359 544 HB2 ARG 76 2HB ARG 76 3.148 -7.061 2.302 545 HB3 ARG 76 3HB ARG 76 2.824 -5.779 3.461 546 HG2 ARG 76 2HG ARG 76 0.748 -6.712 2.693 547 HG3 ARG 76 3HG ARG 76 0.906 -5.062 2.086 548 HD2 ARG 76 2HD ARG 76 1.612 -5.903 -0.080 549 HD3 ARG 76 3HD ARG 76 1.549 -7.559 0.521 550 HE ARG 76 HE ARG 76 -0.960 -6.314 0.863 551 HH11 ARG 76 1HH1 ARG 76 1.119 -7.616 -1.608 552 HH12 ARG 76 2HH1 ARG 76 -0.185 -8.029 -2.671 553 HH21 ARG 76 2HH2 ARG 76 -2.349 -7.594 -2.056 554 HH22 ARG 76 1HH2 ARG 76 -2.686 -6.853 -0.528 555 H HIS 77 H HIS 77 5.987 -5.971 1.416 556 HA HIS 77 HA HIS 77 6.986 -4.841 3.862 557 HB2 HIS 77 2HB HIS 77 7.713 -7.049 2.807 558 HB3 HIS 77 3HB HIS 77 8.641 -6.081 1.666 559 HD1 HIS 77 HD1 HIS 77 10.211 -7.953 3.383 560 HD2 HIS 77 HD2 HIS 77 9.290 -4.082 4.579 561 HE1 HIS 77 HE1 HIS 77 11.931 -7.358 5.119 562 H VAL 78 H VAL 78 7.656 -4.321 0.404 563 HA VAL 78 HA VAL 78 9.572 -2.373 0.533 564 HB VAL 78 HB VAL 78 8.573 -1.441 -1.585 565 HG11 VAL 78 1HG1 VAL 78 10.002 -2.963 -2.363 566 HG12 VAL 78 2HG1 VAL 78 9.607 -4.099 -1.072 567 HG13 VAL 78 3HG1 VAL 78 8.619 -4.044 -2.532 568 HG21 VAL 78 3HG2 VAL 78 6.745 -3.631 -2.003 569 HG22 VAL 78 1HG2 VAL 78 6.257 -2.659 -0.615 570 HG23 VAL 78 2HG2 VAL 78 6.480 -1.897 -2.190 571 H ARG 79 H ARG 79 9.541 -0.740 1.961 572 HA ARG 79 HA ARG 79 7.556 1.334 1.632 573 HB2 ARG 79 2HB ARG 79 7.446 -0.537 3.853 574 HB3 ARG 79 3HB ARG 79 7.636 1.121 4.408 575 HG2 ARG 79 2HG ARG 79 5.684 1.288 2.452 576 HG3 ARG 79 3HG ARG 79 5.318 -0.211 3.308 577 HD2 ARG 79 2HD ARG 79 4.906 0.861 5.292 578 HD3 ARG 79 3HD ARG 79 5.969 2.214 4.904 579 HE ARG 79 HE ARG 79 3.908 2.414 3.119 580 HH11 ARG 79 1HH1 ARG 79 4.178 2.297 6.588 581 HH12 ARG 79 2HH1 ARG 79 2.769 3.268 6.860 582 HH21 ARG 79 2HH2 ARG 79 1.560 4.061 5.083 583 HH22 ARG 79 1HH2 ARG 79 2.052 3.693 3.465 584 HA PRO 80 HA PRO 80 10.901 3.983 2.646 585 HB2 PRO 80 2HB PRO 80 9.660 6.019 3.944 586 HB3 PRO 80 3HB PRO 80 9.508 5.755 2.203 587 HG2 PRO 80 2HG PRO 80 7.628 4.997 4.406 588 HG3 PRO 80 3HG PRO 80 7.266 5.701 2.819 589 HD2 PRO 80 2HD PRO 80 6.969 3.061 3.343 590 HD3 PRO 80 3HD PRO 80 7.430 3.671 1.740 591 H SER 81 H SER 81 12.237 2.973 4.094 592 HA SER 81 HA SER 81 13.270 2.515 6.068 593 HB2 SER 81 2HB SER 81 12.571 5.123 6.235 594 HB3 SER 81 3HB SER 81 11.699 4.482 7.627 595 HG SER 81 HG SER 81 13.713 4.999 8.350 596 H ALA 82 H ALA 82 11.040 0.953 5.423 597 HA ALA 82 HA ALA 82 9.418 0.644 7.799 598 HB1 ALA 82 1HB ALA 82 9.401 -0.407 5.058 599 HB2 ALA 82 2HB ALA 82 8.848 -1.539 6.293 600 HB3 ALA 82 3HB ALA 82 8.061 0.030 6.119 601 H SER 83 H SER 83 10.509 -0.130 9.517 602 HA SER 83 HA SER 83 12.455 -2.266 9.189 603 HB2 SER 83 2HB SER 83 11.548 -0.933 11.749 604 HB3 SER 83 3HB SER 83 13.001 -1.904 11.511 605 HG SER 83 HG SER 83 13.355 0.401 11.464 606 H ILE 84 H ILE 84 11.603 -4.232 8.916 607 HA ILE 84 HA ILE 84 9.579 -5.126 10.859 608 HB ILE 84 HB ILE 84 9.683 -5.913 7.945 609 HG12 ILE 84 2HG1 ILE 84 7.219 -4.700 8.849 610 HG13 ILE 84 3HG1 ILE 84 8.581 -3.623 9.137 611 HG21 ILE 84 1HG2 ILE 84 7.672 -6.642 10.069 612 HG22 ILE 84 2HG2 ILE 84 7.662 -7.162 8.385 613 HG23 ILE 84 3HG2 ILE 84 8.942 -7.708 9.468 614 HD11 ILE 84 3HD1 ILE 84 9.204 -3.755 6.799 615 HD12 ILE 84 1HD1 ILE 84 7.883 -4.884 6.496 616 HD13 ILE 84 2HD1 ILE 84 7.531 -3.222 6.972 617 HA PRO 85 HA PRO 85 12.560 -8.279 11.718 618 HB2 PRO 85 2HB PRO 85 10.951 -9.883 13.204 619 HB3 PRO 85 3HB PRO 85 11.623 -8.366 13.813 620 HG2 PRO 85 2HG PRO 85 8.895 -8.922 12.713 621 HG3 PRO 85 3HG PRO 85 9.355 -7.961 14.130 622 HD2 PRO 85 2HD PRO 85 8.724 -6.836 11.749 623 HD3 PRO 85 3HD PRO 85 9.912 -6.121 12.858 624 H VAL 86 H VAL 86 13.207 -9.818 10.361 625 HA VAL 86 HA VAL 86 11.168 -11.485 9.038 626 HB VAL 86 HB VAL 86 13.942 -10.786 8.064 627 HG11 VAL 86 1HG1 VAL 86 13.679 -12.787 7.037 628 HG12 VAL 86 2HG1 VAL 86 11.921 -12.754 7.178 629 HG13 VAL 86 3HG1 VAL 86 12.723 -11.818 5.917 630 HG21 VAL 86 3HG2 VAL 86 12.712 -9.579 6.275 631 HG22 VAL 86 1HG2 VAL 86 11.214 -9.878 7.157 632 HG23 VAL 86 2HG2 VAL 86 12.479 -8.885 7.879 633 H VAL 87 H VAL 87 11.458 -13.699 8.920 634 HA VAL 87 HA VAL 87 13.325 -14.798 10.886 635 HB VAL 87 HB VAL 87 10.985 -16.088 9.477 636 HG11 VAL 87 1HG1 VAL 87 12.295 -17.914 9.926 637 HG12 VAL 87 2HG1 VAL 87 13.068 -17.155 11.319 638 HG13 VAL 87 3HG1 VAL 87 11.420 -17.770 11.450 639 HG21 VAL 87 3HG2 VAL 87 10.595 -16.037 12.246 640 HG22 VAL 87 1HG2 VAL 87 11.194 -14.434 11.821 641 HG23 VAL 87 2HG2 VAL 87 9.755 -15.076 11.029 642 H PHE 88 H PHE 88 15.156 -15.722 10.268 643 HA PHE 88 HA PHE 88 15.366 -16.712 7.501 644 HB2 PHE 88 2HB PHE 88 17.191 -15.102 9.181 645 HB3 PHE 88 3HB PHE 88 17.953 -16.375 8.232 646 HD1 PHE 88 HD1 PHE 88 19.055 -15.309 6.505 647 HD2 PHE 88 HD2 PHE 88 15.054 -14.187 7.426 648 HE1 PHE 88 HE1 PHE 88 19.009 -13.856 4.520 649 HE2 PHE 88 HE2 PHE 88 15.001 -12.733 5.442 650 HZ PHE 88 HZ PHE 88 16.980 -12.567 3.985 651 H SER 89 H SER 89 16.678 -18.586 7.141 652 HA SER 89 HA SER 89 17.151 -20.240 9.525 653 HB2 SER 89 2HB SER 89 15.269 -20.739 7.346 654 HB3 SER 89 3HB SER 89 16.401 -22.070 7.585 655 HG SER 89 HG SER 89 15.492 -22.513 9.438 656 H ARG 90 H ARG 90 18.832 -21.739 9.362 657 HA ARG 90 HA ARG 90 20.540 -21.454 6.978 658 HB2 ARG 90 2HB ARG 90 21.138 -21.010 9.801 659 HB3 ARG 90 3HB ARG 90 22.255 -22.133 9.039 660 HG2 ARG 90 2HG ARG 90 22.155 -20.163 7.181 661 HG3 ARG 90 3HG ARG 90 21.938 -19.244 8.672 662 HD2 ARG 90 2HD ARG 90 23.967 -21.006 9.293 663 HD3 ARG 90 3HD ARG 90 24.305 -20.571 7.618 664 HE ARG 90 HE ARG 90 23.752 -18.236 9.073 665 HH11 ARG 90 1HH1 ARG 90 26.186 -20.711 8.807 666 HH12 ARG 90 2HH1 ARG 90 27.480 -19.675 9.311 667 HH21 ARG 90 2HH2 ARG 90 27.058 -17.487 9.842 668 HH22 ARG 90 1HH2 ARG 90 25.447 -16.863 9.738 669 H ASP 91 H ASP 91 19.523 -23.363 6.146 670 HA ASP 91 HA ASP 91 19.435 -25.591 5.695 671 HB2 ASP 91 2HB ASP 91 21.808 -25.865 7.544 672 HB3 ASP 91 3HB ASP 91 21.344 -26.942 6.230 673 H GLY 92 H GLY 92 17.810 -24.612 7.788 674 HA2 GLY 92 2HA GLY 92 16.235 -25.917 9.021 675 HA3 GLY 92 3HA GLY 92 17.503 -27.093 9.333 676 H VAL 93 H VAL 93 18.549 -23.896 9.718 677 HA VAL 93 HA VAL 93 18.572 -24.243 12.620 678 HB VAL 93 HB VAL 93 20.038 -22.314 10.820 679 HG11 VAL 93 1HG1 VAL 93 21.283 -21.832 13.040 680 HG12 VAL 93 2HG1 VAL 93 19.741 -21.031 12.729 681 HG13 VAL 93 3HG1 VAL 93 19.810 -22.430 13.802 682 HG21 VAL 93 3HG2 VAL 93 21.881 -23.634 11.063 683 HG22 VAL 93 1HG2 VAL 93 21.389 -24.219 12.653 684 HG23 VAL 93 2HG2 VAL 93 20.634 -24.873 11.199 685 H VAL 94 H VAL 94 17.684 -22.793 14.053 686 HA VAL 94 HA VAL 94 15.691 -20.968 12.912 687 HB VAL 94 HB VAL 94 15.951 -22.044 15.723 688 HG11 VAL 94 1HG1 VAL 94 13.659 -21.077 15.999 689 HG12 VAL 94 2HG1 VAL 94 14.947 -19.882 15.837 690 HG13 VAL 94 3HG1 VAL 94 13.895 -20.237 14.467 691 HG21 VAL 94 3HG2 VAL 94 15.185 -23.855 14.534 692 HG22 VAL 94 1HG2 VAL 94 13.663 -23.062 14.941 693 HG23 VAL 94 2HG2 VAL 94 14.362 -22.858 13.335 694 H MET 95 H MET 95 16.323 -18.926 12.710 695 HA MET 95 HA MET 95 17.638 -17.626 14.971 696 HB2 MET 95 2HB MET 95 19.520 -18.190 13.613 697 HB3 MET 95 3HB MET 95 18.704 -17.658 12.149 698 HG2 MET 95 2HG MET 95 19.143 -15.470 12.528 699 HG3 MET 95 3HG MET 95 19.083 -15.646 14.280 700 HE1 MET 95 3HE MET 95 20.748 -15.541 11.167 701 HE2 MET 95 1HE MET 95 22.125 -14.631 11.787 702 HE3 MET 95 2HE MET 95 22.327 -16.315 11.305 703 H SER 96 H SER 96 17.278 -15.394 15.103 704 HA SER 96 HA SER 96 15.246 -14.361 13.234 705 HB2 SER 96 2HB SER 96 14.103 -13.304 15.002 706 HB3 SER 96 3HB SER 96 14.522 -14.889 15.653 707 HG SER 96 HG SER 96 15.318 -13.695 17.209 708 H ALA 97 H ALA 97 15.688 -12.498 12.238 709 HA ALA 97 HA ALA 97 17.677 -10.680 13.380 710 HB1 ALA 97 1HB ALA 97 19.230 -11.455 11.970 711 HB2 ALA 97 2HB ALA 97 18.042 -12.298 10.976 712 HB3 ALA 97 3HB ALA 97 18.337 -10.577 10.728 713 H THR 98 H THR 98 17.292 -8.553 12.979 714 HA THR 98 HA THR 98 14.729 -7.896 11.795 715 HB THR 98 HB THR 98 16.629 -5.817 12.812 716 HG1 THR 98 HG1 THR 98 14.944 -7.294 14.552 717 HG21 THR 98 3HG2 THR 98 13.844 -5.769 13.664 718 HG22 THR 98 1HG2 THR 98 14.019 -5.781 11.910 719 HG23 THR 98 2HG2 THR 98 14.801 -4.522 12.866 720 H ILE 99 H ILE 99 14.451 -7.228 9.775 721 HA ILE 99 HA ILE 99 16.795 -6.226 8.296 722 HB ILE 99 HB ILE 99 14.363 -7.629 7.183 723 HG12 ILE 99 2HG1 ILE 99 17.220 -8.578 7.494 724 HG13 ILE 99 3HG1 ILE 99 15.840 -9.146 8.427 725 HG21 ILE 99 1HG2 ILE 99 15.553 -7.601 5.060 726 HG22 ILE 99 2HG2 ILE 99 15.304 -5.961 5.657 727 HG23 ILE 99 3HG2 ILE 99 16.888 -6.723 5.806 728 HD11 ILE 99 3HD1 ILE 99 16.180 -9.460 5.454 729 HD12 ILE 99 1HD1 ILE 99 16.480 -10.709 6.662 730 HD13 ILE 99 2HD1 ILE 99 14.848 -10.082 6.427 731 H VAL 100 H VAL 100 16.721 -4.192 7.611 732 HA VAL 100 HA VAL 100 14.124 -2.807 7.620 733 HB VAL 100 HB VAL 100 15.646 -1.772 9.150 734 HG11 VAL 100 1HG1 VAL 100 17.732 -0.778 7.539 735 HG12 VAL 100 2HG1 VAL 100 17.840 -1.946 8.857 736 HG13 VAL 100 3HG1 VAL 100 17.605 -2.503 7.200 737 HG21 VAL 100 3HG2 VAL 100 15.625 -0.110 6.633 738 HG22 VAL 100 1HG2 VAL 100 14.248 -0.300 7.719 739 HG23 VAL 100 2HG2 VAL 100 15.724 0.475 8.294 740 H VAL 101 H VAL 101 13.264 -2.642 5.659 741 HA VAL 101 HA VAL 101 15.037 -2.346 3.337 742 HB VAL 101 HB VAL 101 12.107 -3.076 3.438 743 HG11 VAL 101 1HG1 VAL 101 13.962 -2.440 1.218 744 HG12 VAL 101 2HG1 VAL 101 12.855 -3.794 0.983 745 HG13 VAL 101 3HG1 VAL 101 12.222 -2.189 1.350 746 HG21 VAL 101 3HG2 VAL 101 14.618 -4.661 3.354 747 HG22 VAL 101 1HG2 VAL 101 13.087 -5.007 4.157 748 HG23 VAL 101 2HG2 VAL 101 13.243 -5.241 2.416 749 H GLY 102 H GLY 102 15.374 -0.325 2.692 750 HA2 GLY 102 2HA GLY 102 13.202 1.641 3.051 751 HA3 GLY 102 3HA GLY 102 14.913 2.041 3.000 752 H GLU 103 H GLU 103 12.068 1.912 1.242 753 HA GLU 103 HA GLU 103 13.249 1.503 -1.357 754 HB2 GLU 103 2HB GLU 103 10.505 2.562 -0.661 755 HB3 GLU 103 3HB GLU 103 11.028 1.962 -2.228 756 HG2 GLU 103 2HG GLU 103 10.488 0.434 0.285 757 HG3 GLU 103 3HG GLU 103 9.805 0.207 -1.324 758 H LEU 104 H LEU 104 12.745 4.144 0.770 759 HA LEU 104 HA LEU 104 13.464 6.023 -1.383 760 HB2 LEU 104 2HB LEU 104 11.697 6.409 1.017 761 HB3 LEU 104 3HB LEU 104 12.376 7.762 0.115 762 HG LEU 104 HG LEU 104 10.143 7.459 -0.632 763 HD11 LEU 104 1HD1 LEU 104 10.543 7.531 -2.854 764 HD12 LEU 104 2HD1 LEU 104 11.473 6.034 -2.849 765 HD13 LEU 104 3HD1 LEU 104 12.223 7.538 -2.318 766 HD21 LEU 104 3HD2 LEU 104 10.676 4.624 -1.433 767 HD22 LEU 104 1HD2 LEU 104 9.135 5.445 -1.186 768 HD23 LEU 104 2HD2 LEU 104 10.135 5.011 0.201 769 H GLU 105 H GLU 105 15.660 5.184 -0.673 770 HA GLU 105 HA GLU 105 17.655 5.494 0.381 771 HB2 GLU 105 2HB GLU 105 16.846 7.903 -0.373 772 HB3 GLU 105 3HB GLU 105 16.773 8.170 1.362 773 HG2 GLU 105 2HG GLU 105 19.199 7.263 -0.169 774 HG3 GLU 105 3HG GLU 105 18.897 8.900 0.411 Start of MODEL 12 1 HA PRO 1 HA PRO 1 3.156 0.801 -1.890 2 HB2 PRO 1 2HB PRO 1 5.162 -0.897 -1.210 3 HB3 PRO 1 3HB PRO 1 4.833 0.601 -0.332 4 HG2 PRO 1 2HG PRO 1 4.045 -2.205 0.348 5 HG3 PRO 1 3HG PRO 1 4.676 -0.932 1.409 6 HD2 PRO 1 2HD PRO 1 2.042 -1.547 1.279 7 HD3 PRO 1 3HD PRO 1 2.623 0.099 1.602 8 H LEU 2 H LEU 2 4.835 -0.776 -3.215 9 HA LEU 2 HA LEU 2 3.626 -3.265 -4.011 10 HB2 LEU 2 2HB LEU 2 2.908 -0.867 -5.357 11 HB3 LEU 2 3HB LEU 2 3.909 -1.827 -6.445 12 HG LEU 2 HG LEU 2 2.137 -3.691 -5.521 13 HD11 LEU 2 1HD1 LEU 2 0.912 -1.019 -5.283 14 HD12 LEU 2 2HD1 LEU 2 0.520 -2.529 -4.461 15 HD13 LEU 2 3HD1 LEU 2 -0.049 -2.248 -6.106 16 HD21 LEU 2 3HD2 LEU 2 1.314 -2.097 -7.879 17 HD22 LEU 2 1HD2 LEU 2 1.522 -3.840 -7.701 18 HD23 LEU 2 2HD2 LEU 2 2.932 -2.799 -7.900 19 H THR 3 H THR 3 4.870 -4.259 -5.868 20 HA THR 3 HA THR 3 7.666 -3.337 -5.887 21 HB THR 3 HB THR 3 7.470 -5.251 -4.350 22 HG1 THR 3 HG1 THR 3 9.159 -6.412 -5.287 23 HG21 THR 3 3HG2 THR 3 5.625 -6.213 -6.171 24 HG22 THR 3 1HG2 THR 3 6.296 -7.102 -4.804 25 HG23 THR 3 2HG2 THR 3 7.022 -7.263 -6.403 26 H ARG 4 H ARG 4 8.943 -4.420 -7.672 27 HA ARG 4 HA ARG 4 7.933 -3.792 -10.149 28 HB2 ARG 4 2HB ARG 4 10.238 -5.259 -9.130 29 HB3 ARG 4 3HB ARG 4 9.703 -5.854 -10.696 30 HG2 ARG 4 2HG ARG 4 9.738 -3.412 -11.439 31 HG3 ARG 4 3HG ARG 4 10.661 -3.111 -9.966 32 HD2 ARG 4 2HD ARG 4 12.523 -3.962 -10.851 33 HD3 ARG 4 3HD ARG 4 11.675 -5.391 -11.442 34 HE ARG 4 HE ARG 4 10.980 -3.316 -13.130 35 HH11 ARG 4 1HH1 ARG 4 13.888 -4.974 -12.174 36 HH12 ARG 4 2HH1 ARG 4 14.690 -4.714 -13.688 37 HH21 ARG 4 2HH2 ARG 4 13.629 -3.570 -15.367 38 HH22 ARG 4 1HH2 ARG 4 12.025 -2.966 -15.127 39 HA PRO 5 HA PRO 5 5.192 -6.971 -11.428 40 HB2 PRO 5 2HB PRO 5 5.757 -7.161 -14.077 41 HB3 PRO 5 3HB PRO 5 4.897 -5.786 -13.374 42 HG2 PRO 5 2HG PRO 5 7.786 -6.035 -14.118 43 HG3 PRO 5 3HG PRO 5 6.675 -4.680 -14.386 44 HD2 PRO 5 2HD PRO 5 8.478 -4.708 -12.366 45 HD3 PRO 5 3HD PRO 5 6.901 -3.903 -12.228 46 H TYR 6 H TYR 6 8.419 -7.400 -12.894 47 HA TYR 6 HA TYR 6 8.098 -10.304 -12.632 48 HB2 TYR 6 2HB TYR 6 9.171 -8.669 -14.668 49 HB3 TYR 6 3HB TYR 6 10.530 -9.540 -13.965 50 HD1 TYR 6 HD1 TYR 6 10.531 -12.028 -13.965 51 HD2 TYR 6 HD2 TYR 6 7.554 -9.783 -16.015 52 HE1 TYR 6 HE1 TYR 6 9.929 -14.026 -15.266 53 HE2 TYR 6 HE2 TYR 6 6.944 -11.776 -17.322 54 HH TYR 6 HH TYR 6 7.706 -14.809 -16.515 55 H LEU 7 H LEU 7 9.783 -11.585 -11.735 56 HA LEU 7 HA LEU 7 11.191 -10.225 -9.574 57 HB2 LEU 7 2HB LEU 7 11.692 -12.590 -8.848 58 HB3 LEU 7 3HB LEU 7 9.998 -12.103 -8.827 59 HG LEU 7 HG LEU 7 10.722 -13.371 -11.332 60 HD11 LEU 7 1HD1 LEU 7 10.856 -15.668 -10.266 61 HD12 LEU 7 2HD1 LEU 7 11.262 -14.836 -8.766 62 HD13 LEU 7 3HD1 LEU 7 12.307 -14.669 -10.176 63 HD21 LEU 7 3HD2 LEU 7 8.443 -13.094 -10.753 64 HD22 LEU 7 1HD2 LEU 7 8.682 -13.835 -9.170 65 HD23 LEU 7 2HD2 LEU 7 8.781 -14.821 -10.629 66 H GLY 8 H GLY 8 13.395 -10.221 -9.309 67 HA2 GLY 8 2HA GLY 8 14.944 -11.135 -11.651 68 HA3 GLY 8 3HA GLY 8 15.374 -9.752 -10.656 69 H PHE 9 H PHE 9 14.389 -13.025 -9.698 70 HA PHE 9 HA PHE 9 17.069 -13.717 -8.886 71 HB2 PHE 9 2HB PHE 9 16.689 -13.879 -6.540 72 HB3 PHE 9 3HB PHE 9 16.152 -12.273 -7.020 73 HD1 PHE 9 HD1 PHE 9 15.356 -14.998 -5.060 74 HD2 PHE 9 HD2 PHE 9 13.562 -12.253 -7.773 75 HE1 PHE 9 HE1 PHE 9 13.158 -15.437 -4.045 76 HE2 PHE 9 HE2 PHE 9 11.361 -12.686 -6.762 77 HZ PHE 9 HZ PHE 9 11.157 -14.279 -4.895 78 H ARG 10 H ARG 10 17.204 -15.922 -8.038 79 HA ARG 10 HA ARG 10 14.965 -17.577 -9.003 80 HB2 ARG 10 2HB ARG 10 17.930 -18.156 -8.940 81 HB3 ARG 10 3HB ARG 10 16.706 -19.359 -9.325 82 HG2 ARG 10 2HG ARG 10 15.989 -17.989 -11.237 83 HG3 ARG 10 3HG ARG 10 17.270 -16.834 -10.865 84 HD2 ARG 10 2HD ARG 10 18.963 -18.418 -11.351 85 HD3 ARG 10 3HD ARG 10 17.804 -19.747 -11.389 86 HE ARG 10 HE ARG 10 16.936 -18.132 -13.370 87 HH11 ARG 10 1HH1 ARG 10 20.048 -19.491 -12.603 88 HH12 ARG 10 2HH1 ARG 10 20.567 -19.567 -14.254 89 HH21 ARG 10 2HH2 ARG 10 19.179 -18.847 -15.928 90 HH22 ARG 10 1HH2 ARG 10 17.608 -18.227 -15.547 91 H VAL 11 H VAL 11 14.359 -19.403 -7.807 92 HA VAL 11 HA VAL 11 15.522 -19.660 -5.122 93 HB VAL 11 HB VAL 11 13.201 -20.009 -4.220 94 HG11 VAL 11 1HG1 VAL 11 14.003 -17.318 -5.306 95 HG12 VAL 11 2HG1 VAL 11 12.667 -17.550 -4.178 96 HG13 VAL 11 3HG1 VAL 11 14.310 -17.974 -3.698 97 HG21 VAL 11 3HG2 VAL 11 11.963 -20.435 -6.212 98 HG22 VAL 11 1HG2 VAL 11 11.368 -18.917 -5.541 99 HG23 VAL 11 2HG2 VAL 11 12.463 -18.901 -6.923 100 H ALA 12 H ALA 12 15.874 -21.706 -4.517 101 HA ALA 12 HA ALA 12 14.715 -23.844 -6.179 102 HB1 ALA 12 1HB ALA 12 17.402 -23.399 -5.080 103 HB2 ALA 12 2HB ALA 12 16.796 -25.049 -4.933 104 HB3 ALA 12 3HB ALA 12 16.893 -24.283 -6.518 105 H VAL 13 H VAL 13 13.254 -25.098 -5.239 106 HA VAL 13 HA VAL 13 12.822 -24.971 -2.386 107 HB VAL 13 HB VAL 13 10.874 -24.999 -3.814 108 HG11 VAL 13 1HG1 VAL 13 10.878 -27.709 -4.727 109 HG12 VAL 13 2HG1 VAL 13 10.760 -26.219 -5.666 110 HG13 VAL 13 3HG1 VAL 13 12.342 -26.901 -5.287 111 HG21 VAL 13 3HG2 VAL 13 11.085 -27.647 -2.384 112 HG22 VAL 13 1HG2 VAL 13 10.759 -26.102 -1.597 113 HG23 VAL 13 2HG2 VAL 13 9.608 -26.759 -2.761 114 H GLY 14 H GLY 14 13.633 -26.328 -0.930 115 HA2 GLY 14 2HA GLY 14 14.142 -29.106 -1.624 116 HA3 GLY 14 3HA GLY 14 15.561 -28.158 -1.203 117 H ARG 15 H ARG 15 15.863 -29.641 0.562 118 HA ARG 15 HA ARG 15 14.213 -28.912 2.883 119 HB2 ARG 15 2HB ARG 15 15.174 -31.697 2.200 120 HB3 ARG 15 3HB ARG 15 14.380 -31.240 3.701 121 HG2 ARG 15 2HG ARG 15 12.766 -30.389 1.512 122 HG3 ARG 15 3HG ARG 15 13.202 -32.084 1.286 123 HD2 ARG 15 2HD ARG 15 12.322 -32.665 3.434 124 HD3 ARG 15 3HD ARG 15 12.082 -30.969 3.851 125 HE ARG 15 HE ARG 15 10.588 -31.384 1.583 126 HH11 ARG 15 1HH1 ARG 15 10.716 -32.733 4.790 127 HH12 ARG 15 2HH1 ARG 15 9.028 -33.121 4.835 128 HH21 ARG 15 2HH2 ARG 15 7.692 -32.642 3.037 129 HH22 ARG 15 1HH2 ARG 15 8.365 -31.890 1.630 130 H ASP 16 H ASP 16 15.365 -28.239 4.572 131 HA ASP 16 HA ASP 16 18.257 -28.326 4.432 132 HB2 ASP 16 2HB ASP 16 18.077 -26.940 6.549 133 HB3 ASP 16 3HB ASP 16 17.358 -26.230 5.106 134 H SER 17 H SER 17 19.300 -28.587 6.775 135 HA SER 17 HA SER 17 19.267 -31.297 7.372 136 HB2 SER 17 2HB SER 17 20.233 -28.889 8.894 137 HB3 SER 17 3HB SER 17 20.351 -30.504 9.592 138 HG SER 17 HG SER 17 22.148 -29.537 8.170 139 H SER 18 H SER 18 17.225 -28.740 8.515 140 HA SER 18 HA SER 18 16.224 -30.144 10.804 141 HB2 SER 18 2HB SER 18 16.004 -27.832 11.019 142 HB3 SER 18 3HB SER 18 15.457 -27.629 9.355 143 HG SER 18 HG SER 18 14.020 -28.221 11.630 144 H GLY 19 H GLY 19 15.099 -29.593 7.492 145 HA2 GLY 19 2HA GLY 19 13.803 -31.086 6.230 146 HA3 GLY 19 3HA GLY 19 13.420 -31.964 7.704 147 H CYS 20 H CYS 20 13.034 -28.516 6.960 148 HA CYS 20 HA CYS 20 10.153 -28.835 7.483 149 HB2 CYS 20 2HB CYS 20 12.134 -26.844 8.369 150 HB3 CYS 20 3HB CYS 20 10.611 -26.163 7.810 151 HG CYS 20 HG CYS 20 10.615 -28.672 10.112 152 H THR 21 H THR 21 12.026 -28.759 4.961 153 HA THR 21 HA THR 21 11.850 -28.104 2.788 154 HB THR 21 HB THR 21 9.011 -27.285 3.382 155 HG1 THR 21 HG1 THR 21 8.937 -29.302 4.140 156 HG21 THR 21 3HG2 THR 21 10.064 -28.671 0.935 157 HG22 THR 21 1HG2 THR 21 10.162 -26.919 1.107 158 HG23 THR 21 2HG2 THR 21 8.591 -27.720 1.121 159 H THR 22 H THR 22 13.213 -26.368 2.694 160 HA THR 22 HA THR 22 11.951 -23.716 2.949 161 HB THR 22 HB THR 22 13.886 -22.767 3.884 162 HG1 THR 22 HG1 THR 22 15.367 -25.162 3.621 163 HG21 THR 22 3HG2 THR 22 14.068 -25.423 5.236 164 HG22 THR 22 1HG2 THR 22 12.549 -24.530 5.301 165 HG23 THR 22 2HG2 THR 22 14.025 -23.805 5.937 166 H LEU 23 H LEU 23 13.270 -22.009 1.737 167 HA LEU 23 HA LEU 23 14.285 -23.132 -0.789 168 HB2 LEU 23 2HB LEU 23 12.288 -20.969 -0.303 169 HB3 LEU 23 3HB LEU 23 13.324 -20.881 -1.726 170 HG LEU 23 HG LEU 23 12.444 -23.017 -2.511 171 HD11 LEU 23 1HD1 LEU 23 11.151 -23.003 0.159 172 HD12 LEU 23 2HD1 LEU 23 11.841 -24.340 -0.761 173 HD13 LEU 23 3HD1 LEU 23 10.255 -23.700 -1.190 174 HD21 LEU 23 3HD2 LEU 23 10.338 -22.240 -3.222 175 HD22 LEU 23 1HD2 LEU 23 11.316 -20.792 -2.985 176 HD23 LEU 23 2HD2 LEU 23 10.121 -21.256 -1.774 177 H SER 24 H SER 24 16.275 -22.505 -1.285 178 HA SER 24 HA SER 24 17.506 -20.350 0.242 179 HB2 SER 24 2HB SER 24 18.575 -22.653 -0.160 180 HB3 SER 24 3HB SER 24 18.889 -22.085 -1.800 181 HG SER 24 HG SER 24 19.791 -20.159 -0.478 182 H ILE 25 H ILE 25 18.445 -18.531 -0.657 183 HA ILE 25 HA ILE 25 17.414 -17.801 -3.294 184 HB ILE 25 HB ILE 25 17.096 -16.312 -1.261 185 HG12 ILE 25 2HG1 ILE 25 18.494 -15.130 -3.671 186 HG13 ILE 25 3HG1 ILE 25 16.784 -15.538 -3.582 187 HG21 ILE 25 1HG2 ILE 25 19.900 -15.391 -1.760 188 HG22 ILE 25 2HG2 ILE 25 18.853 -15.081 -0.376 189 HG23 ILE 25 3HG2 ILE 25 19.567 -16.678 -0.601 190 HD11 ILE 25 3HD1 ILE 25 18.248 -13.399 -2.066 191 HD12 ILE 25 1HD1 ILE 25 16.974 -13.202 -3.269 192 HD13 ILE 25 2HD1 ILE 25 16.599 -13.901 -1.694 193 H GLN 26 H GLN 26 18.676 -17.426 -5.027 194 HA GLN 26 HA GLN 26 21.575 -17.789 -4.676 195 HB2 GLN 26 2HB GLN 26 19.733 -18.408 -6.976 196 HB3 GLN 26 3HB GLN 26 21.478 -18.319 -7.183 197 HG2 GLN 26 2HG GLN 26 21.843 -20.273 -6.125 198 HG3 GLN 26 3HG GLN 26 20.524 -20.027 -4.982 199 HE21 GLN 26 2HE2 GLN 26 18.075 -21.573 -6.987 200 HE22 GLN 26 1HE2 GLN 26 18.352 -20.404 -5.745 201 H GLU 27 H GLU 27 19.177 -15.543 -5.506 202 HA GLU 27 HA GLU 27 21.223 -13.740 -6.620 203 HB2 GLU 27 2HB GLU 27 18.957 -14.670 -7.950 204 HB3 GLU 27 3HB GLU 27 18.515 -13.054 -7.417 205 HG2 GLU 27 2HG GLU 27 19.956 -12.044 -8.819 206 HG3 GLU 27 3HG GLU 27 21.171 -13.312 -8.660 207 H VAL 28 H VAL 28 19.742 -11.423 -6.693 208 HA VAL 28 HA VAL 28 19.043 -10.992 -3.861 209 HB VAL 28 HB VAL 28 20.249 -8.858 -5.604 210 HG11 VAL 28 1HG1 VAL 28 19.991 -9.227 -2.623 211 HG12 VAL 28 2HG1 VAL 28 20.872 -7.909 -3.397 212 HG13 VAL 28 3HG1 VAL 28 19.130 -8.062 -3.629 213 HG21 VAL 28 3HG2 VAL 28 22.398 -9.397 -4.351 214 HG22 VAL 28 1HG2 VAL 28 21.652 -10.948 -3.962 215 HG23 VAL 28 2HG2 VAL 28 21.934 -10.502 -5.645 216 H THR 29 H THR 29 17.012 -10.379 -3.574 217 HA THR 29 HA THR 29 15.632 -8.992 -5.779 218 HB THR 29 HB THR 29 14.556 -11.087 -5.475 219 HG1 THR 29 HG1 THR 29 13.024 -9.243 -3.937 220 HG21 THR 29 3HG2 THR 29 14.382 -10.484 -2.521 221 HG22 THR 29 1HG2 THR 29 15.532 -11.600 -3.257 222 HG23 THR 29 2HG2 THR 29 13.802 -11.937 -3.335 223 H GLN 30 H GLN 30 16.803 -8.678 -2.639 224 HA GLN 30 HA GLN 30 14.825 -6.732 -1.782 225 HB2 GLN 30 2HB GLN 30 17.388 -7.649 -0.468 226 HB3 GLN 30 3HB GLN 30 16.200 -6.578 0.263 227 HG2 GLN 30 2HG GLN 30 15.201 -8.363 1.095 228 HG3 GLN 30 3HG GLN 30 14.759 -8.820 -0.550 229 HE21 GLN 30 2HE2 GLN 30 16.604 -11.577 1.174 230 HE22 GLN 30 1HE2 GLN 30 15.236 -10.609 1.591 231 H THR 31 H THR 31 17.061 -6.534 -4.015 232 HA THR 31 HA THR 31 18.053 -3.885 -3.191 233 HB THR 31 HB THR 31 19.675 -4.306 -5.195 234 HG1 THR 31 HG1 THR 31 19.946 -6.394 -5.763 235 HG21 THR 31 3HG2 THR 31 20.278 -6.080 -2.878 236 HG22 THR 31 1HG2 THR 31 20.035 -4.360 -2.578 237 HG23 THR 31 2HG2 THR 31 21.301 -4.892 -3.684 238 H TYR 32 H TYR 32 15.471 -4.810 -4.579 239 HA TYR 32 HA TYR 32 15.679 -2.975 -6.876 240 HB2 TYR 32 2HB TYR 32 13.891 -5.402 -6.612 241 HB3 TYR 32 3HB TYR 32 13.917 -4.293 -7.979 242 HD1 TYR 32 HD1 TYR 32 14.641 -7.440 -7.440 243 HD2 TYR 32 HD2 TYR 32 16.790 -3.898 -8.409 244 HE1 TYR 32 HE1 TYR 32 16.393 -8.801 -8.502 245 HE2 TYR 32 HE2 TYR 32 18.547 -5.248 -9.475 246 HH TYR 32 HH TYR 32 18.243 -8.764 -9.762 247 H THR 33 H THR 33 13.951 -1.574 -7.256 248 HA THR 33 HA THR 33 11.634 -1.561 -5.555 249 HB THR 33 HB THR 33 13.416 0.853 -5.312 250 HG1 THR 33 HG1 THR 33 14.629 -0.629 -4.268 251 HG21 THR 33 3HG2 THR 33 11.904 0.677 -3.055 252 HG22 THR 33 1HG2 THR 33 10.816 -0.017 -4.256 253 HG23 THR 33 2HG2 THR 33 11.461 1.608 -4.484 254 H GLY 34 H GLY 34 10.133 0.189 -6.098 255 HA2 GLY 34 2HA GLY 34 10.603 1.971 -8.246 256 HA3 GLY 34 3HA GLY 34 9.808 0.523 -8.844 257 H SER 35 H SER 35 8.313 0.118 -6.353 258 HA SER 35 HA SER 35 6.267 2.176 -6.812 259 HB2 SER 35 2HB SER 35 5.379 -0.072 -5.212 260 HB3 SER 35 3HB SER 35 4.748 0.524 -6.747 261 HG SER 35 HG SER 35 5.775 -1.016 -7.735 262 H ASN 36 H ASN 36 5.720 3.565 -5.255 263 HA ASN 36 HA ASN 36 5.808 4.723 -3.295 264 HB2 ASN 36 2HB ASN 36 5.413 1.881 -2.433 265 HB3 ASN 36 3HB ASN 36 5.655 3.127 -1.213 266 HD21 ASN 36 2HD2 ASN 36 2.384 4.181 -1.306 267 HD22 ASN 36 1HD2 ASN 36 3.904 4.086 -0.490 268 H GLY 37 H GLY 37 8.350 3.895 -4.532 269 HA2 GLY 37 2HA GLY 37 10.068 4.626 -2.337 270 HA3 GLY 37 3HA GLY 37 10.320 2.979 -2.896 271 H GLY 38 H GLY 38 10.255 3.015 -5.520 272 HA2 GLY 38 2HA GLY 38 11.596 3.446 -7.337 273 HA3 GLY 38 3HA GLY 38 11.267 5.132 -6.967 274 H ALA 39 H ALA 39 13.466 2.448 -6.375 275 HA ALA 39 HA ALA 39 15.776 4.010 -6.533 276 HB1 ALA 39 1HB ALA 39 14.667 3.668 -3.781 277 HB2 ALA 39 2HB ALA 39 16.413 3.714 -4.026 278 HB3 ALA 39 3HB ALA 39 15.417 5.082 -4.523 279 H ASP 40 H ASP 40 15.463 1.802 -7.783 280 HA ASP 40 HA ASP 40 16.068 -0.599 -6.397 281 HB2 ASP 40 2HB ASP 40 16.476 -1.544 -8.633 282 HB3 ASP 40 3HB ASP 40 14.977 -0.620 -8.586 283 H LEU 41 H LEU 41 17.907 -0.928 -5.340 284 HA LEU 41 HA LEU 41 20.410 -0.953 -6.640 285 HB2 LEU 41 2HB LEU 41 19.734 1.577 -5.940 286 HB3 LEU 41 3HB LEU 41 20.579 1.046 -4.488 287 HG LEU 41 HG LEU 41 22.395 0.308 -6.290 288 HD11 LEU 41 1HD1 LEU 41 22.513 2.178 -7.989 289 HD12 LEU 41 2HD1 LEU 41 20.825 2.510 -7.602 290 HD13 LEU 41 3HD1 LEU 41 21.285 0.944 -8.270 291 HD21 LEU 41 3HD2 LEU 41 22.733 3.124 -5.938 292 HD22 LEU 41 1HD2 LEU 41 23.554 1.794 -5.121 293 HD23 LEU 41 2HD2 LEU 41 22.043 2.430 -4.470 294 H MET 42 H MET 42 22.134 -0.635 -4.496 295 HA MET 42 HA MET 42 21.193 -2.745 -2.668 296 HB2 MET 42 2HB MET 42 24.083 -2.113 -3.217 297 HB3 MET 42 3HB MET 42 23.398 -3.575 -2.523 298 HG2 MET 42 2HG MET 42 22.200 -3.555 -4.947 299 HG3 MET 42 3HG MET 42 23.743 -2.794 -5.327 300 HE1 MET 42 3HE MET 42 22.648 -6.818 -5.491 301 HE2 MET 42 1HE MET 42 22.225 -5.262 -6.207 302 HE3 MET 42 2HE MET 42 23.663 -6.123 -6.756 303 H GLY 43 H GLY 43 20.784 -2.073 -0.673 304 HA2 GLY 43 2HA GLY 43 22.643 -0.424 0.764 305 HA3 GLY 43 3HA GLY 43 21.159 0.429 0.367 306 HA PRO 44 HA PRO 44 19.037 -1.324 3.774 307 HB2 PRO 44 2HB PRO 44 16.661 -2.150 2.755 308 HB3 PRO 44 3HB PRO 44 17.078 -0.445 2.956 309 HG2 PRO 44 2HG PRO 44 17.190 -2.145 0.495 310 HG3 PRO 44 3HG PRO 44 16.606 -0.481 0.679 311 HD2 PRO 44 2HD PRO 44 19.056 -1.064 -0.316 312 HD3 PRO 44 3HD PRO 44 18.734 0.404 0.629 313 H ALA 45 H ALA 45 19.374 -3.377 0.967 314 HA ALA 45 HA ALA 45 18.590 -5.794 2.307 315 HB1 ALA 45 1HB ALA 45 19.955 -5.296 -0.332 316 HB2 ALA 45 2HB ALA 45 19.504 -6.897 0.257 317 HB3 ALA 45 3HB ALA 45 18.258 -5.688 -0.053 318 H PHE 46 H PHE 46 21.682 -4.379 1.269 319 HA PHE 46 HA PHE 46 23.271 -6.484 2.333 320 HB2 PHE 46 2HB PHE 46 23.962 -4.861 0.518 321 HB3 PHE 46 3HB PHE 46 24.170 -3.653 1.782 322 HD1 PHE 46 HD1 PHE 46 25.128 -7.233 1.309 323 HD2 PHE 46 HD2 PHE 46 26.350 -3.294 2.362 324 HE1 PHE 46 HE1 PHE 46 27.413 -8.053 1.710 325 HE2 PHE 46 HE2 PHE 46 28.637 -4.108 2.764 326 HZ PHE 46 HZ PHE 46 29.171 -6.489 2.437 327 H ALA 47 H ALA 47 21.880 -3.597 3.653 328 HA ALA 47 HA ALA 47 23.581 -3.418 5.943 329 HB1 ALA 47 1HB ALA 47 20.813 -2.272 5.624 330 HB2 ALA 47 2HB ALA 47 22.078 -1.735 6.731 331 HB3 ALA 47 3HB ALA 47 22.275 -1.514 4.993 332 H ALA 48 H ALA 48 20.527 -4.995 5.217 333 HA ALA 48 HA ALA 48 20.028 -5.752 7.950 334 HB1 ALA 48 1HB ALA 48 18.150 -7.027 7.028 335 HB2 ALA 48 2HB ALA 48 18.165 -5.366 6.435 336 HB3 ALA 48 3HB ALA 48 18.720 -6.678 5.395 337 H GLY 49 H GLY 49 21.772 -7.044 5.270 338 HA2 GLY 49 2HA GLY 49 23.428 -8.746 5.665 339 HA3 GLY 49 3HA GLY 49 22.359 -9.446 6.871 340 H LEU 50 H LEU 50 20.797 -8.435 4.018 341 HA LEU 50 HA LEU 50 20.208 -11.179 3.325 342 HB2 LEU 50 2HB LEU 50 19.316 -8.868 1.672 343 HB3 LEU 50 3HB LEU 50 18.470 -10.365 2.059 344 HG LEU 50 HG LEU 50 18.900 -8.066 3.965 345 HD11 LEU 50 1HD1 LEU 50 16.258 -8.895 2.847 346 HD12 LEU 50 2HD1 LEU 50 17.305 -7.813 1.929 347 HD13 LEU 50 3HD1 LEU 50 16.752 -7.349 3.538 348 HD21 LEU 50 3HD2 LEU 50 17.636 -9.238 5.528 349 HD22 LEU 50 1HD2 LEU 50 18.690 -10.476 4.845 350 HD23 LEU 50 2HD2 LEU 50 17.009 -10.363 4.323 351 H ARG 51 H ARG 51 21.606 -12.289 2.132 352 HA ARG 51 HA ARG 51 22.606 -11.091 -0.338 353 HB2 ARG 51 2HB ARG 51 24.229 -11.396 1.934 354 HB3 ARG 51 3HB ARG 51 24.678 -12.709 0.855 355 HG2 ARG 51 2HG ARG 51 24.634 -10.665 -0.893 356 HG3 ARG 51 3HG ARG 51 25.085 -9.809 0.583 357 HD2 ARG 51 2HD ARG 51 27.102 -10.835 0.723 358 HD3 ARG 51 3HD ARG 51 26.500 -12.346 0.042 359 HE ARG 51 HE ARG 51 26.632 -10.205 -1.866 360 HH11 ARG 51 1HH1 ARG 51 28.421 -12.750 -0.304 361 HH12 ARG 51 2HH1 ARG 51 29.578 -12.901 -1.584 362 HH21 ARG 51 2HH2 ARG 51 29.423 -11.559 -3.435 363 HH22 ARG 51 1HH2 ARG 51 28.149 -10.394 -3.558 364 H VAL 52 H VAL 52 23.509 -12.721 -1.828 365 HA VAL 52 HA VAL 52 21.784 -14.863 -2.223 366 HB VAL 52 HB VAL 52 23.510 -15.737 -3.812 367 HG11 VAL 52 1HG1 VAL 52 23.207 -14.011 -5.398 368 HG12 VAL 52 2HG1 VAL 52 21.794 -13.953 -4.342 369 HG13 VAL 52 3HG1 VAL 52 23.093 -12.777 -4.145 370 HG21 VAL 52 3HG2 VAL 52 25.221 -14.123 -2.217 371 HG22 VAL 52 1HG2 VAL 52 25.644 -15.178 -3.566 372 HG23 VAL 52 2HG2 VAL 52 25.239 -13.487 -3.861 373 H GLY 53 H GLY 53 21.546 -16.692 -1.129 374 HA2 GLY 53 2HA GLY 53 22.719 -18.826 -0.595 375 HA3 GLY 53 3HA GLY 53 23.923 -17.831 0.210 376 H ASP 54 H ASP 54 21.433 -16.135 1.039 377 HA ASP 54 HA ASP 54 21.027 -17.600 3.531 378 HB2 ASP 54 2HB ASP 54 20.031 -14.825 2.890 379 HB3 ASP 54 3HB ASP 54 20.293 -15.546 4.476 380 H GLN 55 H GLN 55 19.031 -18.207 4.319 381 HA GLN 55 HA GLN 55 16.945 -18.482 2.298 382 HB2 GLN 55 2HB GLN 55 17.328 -19.755 5.008 383 HB3 GLN 55 3HB GLN 55 15.908 -20.018 4.006 384 HG2 GLN 55 2HG GLN 55 17.093 -21.205 2.409 385 HG3 GLN 55 3HG GLN 55 18.642 -20.538 2.922 386 HE21 GLN 55 2HE2 GLN 55 17.939 -24.110 4.093 387 HE22 GLN 55 1HE2 GLN 55 17.565 -23.330 2.598 388 H LEU 56 H LEU 56 14.898 -17.665 2.489 389 HA LEU 56 HA LEU 56 14.311 -16.011 4.846 390 HB2 LEU 56 2HB LEU 56 13.136 -14.478 3.096 391 HB3 LEU 56 3HB LEU 56 14.863 -14.318 3.409 392 HG LEU 56 HG LEU 56 13.987 -16.076 1.170 393 HD11 LEU 56 1HD1 LEU 56 13.768 -13.093 1.234 394 HD12 LEU 56 2HD1 LEU 56 12.651 -14.283 0.566 395 HD13 LEU 56 3HD1 LEU 56 14.168 -13.935 -0.264 396 HD21 LEU 56 3HD2 LEU 56 16.060 -14.933 0.190 397 HD22 LEU 56 1HD2 LEU 56 16.298 -16.073 1.516 398 HD23 LEU 56 2HD2 LEU 56 16.343 -14.337 1.826 399 H VAL 57 H VAL 57 12.516 -16.728 5.763 400 HA VAL 57 HA VAL 57 10.387 -17.816 4.037 401 HB VAL 57 HB VAL 57 11.371 -19.595 5.373 402 HG11 VAL 57 1HG1 VAL 57 10.445 -18.538 7.955 403 HG12 VAL 57 2HG1 VAL 57 11.902 -19.449 7.555 404 HG13 VAL 57 3HG1 VAL 57 11.839 -17.711 7.261 405 HG21 VAL 57 3HG2 VAL 57 9.337 -20.475 5.520 406 HG22 VAL 57 1HG2 VAL 57 8.994 -19.508 6.954 407 HG23 VAL 57 2HG2 VAL 57 8.646 -18.862 5.350 408 H ARG 58 H ARG 58 11.161 -15.944 6.917 409 HA ARG 58 HA ARG 58 9.944 -14.495 8.188 410 HB2 ARG 58 2HB ARG 58 9.800 -13.682 5.591 411 HB3 ARG 58 3HB ARG 58 8.094 -13.802 6.001 412 HG2 ARG 58 2HG ARG 58 9.794 -12.408 7.963 413 HG3 ARG 58 3HG ARG 58 9.578 -11.605 6.406 414 HD2 ARG 58 2HD ARG 58 7.377 -12.565 8.232 415 HD3 ARG 58 3HD ARG 58 7.885 -10.891 8.014 416 HE ARG 58 HE ARG 58 7.250 -11.712 5.502 417 HH11 ARG 58 1HH1 ARG 58 5.575 -11.704 8.555 418 HH12 ARG 58 2HH1 ARG 58 4.005 -11.534 7.841 419 HH21 ARG 58 2HH2 ARG 58 3.786 -11.413 5.564 420 HH22 ARG 58 1HH2 ARG 58 5.188 -11.489 4.551 421 H PHE 59 H PHE 59 8.997 -17.257 8.036 422 HA PHE 59 HA PHE 59 6.282 -16.780 9.012 423 HB2 PHE 59 2HB PHE 59 7.033 -18.801 6.898 424 HB3 PHE 59 3HB PHE 59 5.543 -18.899 7.830 425 HD1 PHE 59 HD1 PHE 59 6.493 -18.223 4.741 426 HD2 PHE 59 HD2 PHE 59 4.603 -16.184 7.964 427 HE1 PHE 59 HE1 PHE 59 5.398 -16.712 3.138 428 HE2 PHE 59 HE2 PHE 59 3.504 -14.671 6.366 429 HZ PHE 59 HZ PHE 59 3.900 -14.933 3.950 430 H ALA 60 H ALA 60 5.576 -18.244 10.578 431 HA ALA 60 HA ALA 60 7.664 -19.478 12.099 432 HB1 ALA 60 1HB ALA 60 4.707 -19.183 12.440 433 HB2 ALA 60 2HB ALA 60 5.625 -20.267 13.486 434 HB3 ALA 60 3HB ALA 60 6.018 -18.549 13.436 435 H GLY 61 H GLY 61 8.553 -21.294 11.302 436 HA2 GLY 61 2HA GLY 61 7.926 -23.772 11.499 437 HA3 GLY 61 3HA GLY 61 6.753 -23.378 10.251 438 H TYR 62 H TYR 62 9.228 -21.438 9.524 439 HA TYR 62 HA TYR 62 10.828 -21.435 7.908 440 HB2 TYR 62 2HB TYR 62 11.380 -24.327 8.510 441 HB3 TYR 62 3HB TYR 62 12.511 -23.061 8.043 442 HD1 TYR 62 HD1 TYR 62 12.007 -25.122 10.589 443 HD2 TYR 62 HD2 TYR 62 12.002 -20.921 9.912 444 HE1 TYR 62 HE1 TYR 62 12.554 -24.745 12.957 445 HE2 TYR 62 HE2 TYR 62 12.551 -20.533 12.278 446 HH TYR 62 HH TYR 62 12.321 -22.942 14.636 447 H THR 63 H THR 63 8.199 -22.004 7.081 448 HA THR 63 HA THR 63 8.639 -23.909 4.876 449 HB THR 63 HB THR 63 6.810 -24.704 6.165 450 HG1 THR 63 HG1 THR 63 5.161 -24.595 4.631 451 HG21 THR 63 3HG2 THR 63 4.841 -22.723 6.111 452 HG22 THR 63 1HG2 THR 63 6.316 -21.892 6.604 453 HG23 THR 63 2HG2 THR 63 5.742 -23.287 7.518 454 H VAL 64 H VAL 64 8.699 -23.131 2.871 455 HA VAL 64 HA VAL 64 7.578 -20.449 2.375 456 HB VAL 64 HB VAL 64 9.993 -21.581 0.966 457 HG11 VAL 64 1HG1 VAL 64 10.315 -19.122 0.443 458 HG12 VAL 64 2HG1 VAL 64 8.963 -19.922 -0.360 459 HG13 VAL 64 3HG1 VAL 64 8.671 -18.881 1.034 460 HG21 VAL 64 3HG2 VAL 64 9.867 -19.732 3.345 461 HG22 VAL 64 1HG2 VAL 64 10.606 -21.332 3.272 462 HG23 VAL 64 2HG2 VAL 64 11.309 -19.994 2.364 463 H THR 65 H THR 65 6.798 -20.049 0.235 464 HA THR 65 HA THR 65 5.689 -22.454 -0.996 465 HB THR 65 HB THR 65 4.761 -20.154 -2.354 466 HG1 THR 65 HG1 THR 65 4.569 -19.854 0.474 467 HG21 THR 65 3HG2 THR 65 3.487 -22.202 -1.940 468 HG22 THR 65 1HG2 THR 65 2.610 -20.786 -1.361 469 HG23 THR 65 2HG2 THR 65 3.446 -21.835 -0.215 470 H GLU 66 H GLU 66 6.868 -19.365 -2.336 471 HA GLU 66 HA GLU 66 8.949 -20.424 -3.865 472 HB2 GLU 66 2HB GLU 66 7.831 -20.252 -6.140 473 HB3 GLU 66 3HB GLU 66 7.416 -21.659 -5.171 474 HG2 GLU 66 2HG GLU 66 5.350 -20.495 -4.455 475 HG3 GLU 66 3HG GLU 66 5.754 -19.181 -5.558 476 H LEU 67 H LEU 67 9.444 -18.884 -5.817 477 HA LEU 67 HA LEU 67 9.873 -16.334 -4.812 478 HB2 LEU 67 2HB LEU 67 10.308 -15.704 -7.207 479 HB3 LEU 67 3HB LEU 67 11.227 -17.076 -6.592 480 HG LEU 67 HG LEU 67 9.290 -18.460 -7.712 481 HD11 LEU 67 1HD1 LEU 67 8.667 -15.803 -8.516 482 HD12 LEU 67 2HD1 LEU 67 7.842 -17.307 -8.925 483 HD13 LEU 67 3HD1 LEU 67 9.163 -16.723 -9.937 484 HD21 LEU 67 3HD2 LEU 67 11.789 -17.302 -8.778 485 HD22 LEU 67 1HD2 LEU 67 10.698 -18.034 -9.954 486 HD23 LEU 67 2HD2 LEU 67 11.301 -18.988 -8.599 487 H ALA 68 H ALA 68 7.100 -17.653 -6.419 488 HA ALA 68 HA ALA 68 5.906 -15.230 -7.264 489 HB1 ALA 68 1HB ALA 68 4.187 -17.520 -6.483 490 HB2 ALA 68 2HB ALA 68 4.136 -16.502 -7.923 491 HB3 ALA 68 3HB ALA 68 5.353 -17.770 -7.782 492 H ALA 69 H ALA 69 5.590 -17.158 -4.305 493 HA ALA 69 HA ALA 69 3.600 -15.524 -3.114 494 HB1 ALA 69 1HB ALA 69 3.605 -17.057 -1.485 495 HB2 ALA 69 2HB ALA 69 4.691 -17.962 -2.540 496 HB3 ALA 69 3HB ALA 69 5.350 -16.947 -1.257 497 H PHE 70 H PHE 70 7.111 -15.478 -3.098 498 HA PHE 70 HA PHE 70 7.408 -13.603 -0.988 499 HB2 PHE 70 2HB PHE 70 9.255 -15.043 -1.670 500 HB3 PHE 70 3HB PHE 70 9.273 -14.299 -3.266 501 HD1 PHE 70 HD1 PHE 70 10.451 -12.304 -3.666 502 HD2 PHE 70 HD2 PHE 70 9.881 -13.672 0.324 503 HE1 PHE 70 HE1 PHE 70 12.055 -10.620 -2.863 504 HE2 PHE 70 HE2 PHE 70 11.483 -11.989 1.134 505 HZ PHE 70 HZ PHE 70 12.571 -10.460 -0.460 506 H ASN 71 H ASN 71 6.922 -13.318 -4.444 507 HA ASN 71 HA ASN 71 7.640 -10.638 -4.793 508 HB2 ASN 71 2HB ASN 71 6.323 -12.682 -6.320 509 HB3 ASN 71 3HB ASN 71 5.439 -11.168 -6.492 510 HD21 ASN 71 2HD2 ASN 71 7.630 -10.036 -8.885 511 HD22 ASN 71 1HD2 ASN 71 6.021 -10.177 -8.273 512 H THR 72 H THR 72 4.625 -12.106 -3.711 513 HA THR 72 HA THR 72 3.142 -9.664 -3.688 514 HB THR 72 HB THR 72 1.993 -11.490 -1.844 515 HG1 THR 72 HG1 THR 72 2.520 -12.830 -4.272 516 HG21 THR 72 3HG2 THR 72 1.399 -10.592 -4.644 517 HG22 THR 72 1HG2 THR 72 0.560 -10.187 -3.147 518 HG23 THR 72 2HG2 THR 72 0.388 -11.797 -3.846 519 H VAL 73 H VAL 73 5.044 -11.451 -1.333 520 HA VAL 73 HA VAL 73 4.235 -9.929 0.934 521 HB VAL 73 HB VAL 73 6.683 -11.641 0.487 522 HG11 VAL 73 1HG1 VAL 73 7.195 -10.064 2.219 523 HG12 VAL 73 2HG1 VAL 73 5.639 -10.348 3.003 524 HG13 VAL 73 3HG1 VAL 73 6.858 -11.623 2.972 525 HG21 VAL 73 3HG2 VAL 73 5.470 -13.270 1.874 526 HG22 VAL 73 1HG2 VAL 73 4.085 -12.178 1.923 527 HG23 VAL 73 2HG2 VAL 73 4.598 -12.884 0.391 528 H VAL 74 H VAL 74 7.137 -9.857 -1.126 529 HA VAL 74 HA VAL 74 8.470 -7.772 0.162 530 HB VAL 74 HB VAL 74 9.521 -9.191 -1.552 531 HG11 VAL 74 1HG1 VAL 74 7.623 -9.282 -3.109 532 HG12 VAL 74 2HG1 VAL 74 7.898 -7.590 -3.528 533 HG13 VAL 74 3HG1 VAL 74 9.117 -8.805 -3.914 534 HG21 VAL 74 3HG2 VAL 74 11.038 -7.606 -2.106 535 HG22 VAL 74 1HG2 VAL 74 9.815 -6.502 -2.735 536 HG23 VAL 74 2HG2 VAL 74 10.084 -6.623 -0.996 537 H ALA 75 H ALA 75 5.930 -7.714 -2.269 538 HA ALA 75 HA ALA 75 6.073 -5.000 -2.966 539 HB1 ALA 75 1HB ALA 75 3.363 -6.053 -2.943 540 HB2 ALA 75 2HB ALA 75 4.350 -5.495 -4.294 541 HB3 ALA 75 3HB ALA 75 4.515 -7.149 -3.705 542 H ARG 76 H ARG 76 4.224 -6.655 -0.430 543 HA ARG 76 HA ARG 76 3.086 -4.182 0.531 544 HB2 ARG 76 2HB ARG 76 3.043 -6.898 1.853 545 HB3 ARG 76 3HB ARG 76 1.980 -5.537 2.189 546 HG2 ARG 76 2HG ARG 76 2.047 -7.281 -0.252 547 HG3 ARG 76 3HG ARG 76 0.726 -7.048 0.895 548 HD2 ARG 76 2HD ARG 76 0.987 -4.531 0.107 549 HD3 ARG 76 3HD ARG 76 1.651 -5.308 -1.329 550 HE ARG 76 HE ARG 76 -0.766 -6.561 -0.673 551 HH11 ARG 76 1HH1 ARG 76 0.415 -3.498 -1.832 552 HH12 ARG 76 2HH1 ARG 76 -1.031 -3.125 -2.711 553 HH21 ARG 76 2HH2 ARG 76 -2.788 -4.595 -2.706 554 HH22 ARG 76 1HH2 ARG 76 -2.674 -6.082 -1.826 555 H HIS 77 H HIS 77 5.901 -6.063 1.122 556 HA HIS 77 HA HIS 77 6.398 -5.089 3.777 557 HB2 HIS 77 2HB HIS 77 7.763 -6.853 1.841 558 HB3 HIS 77 3HB HIS 77 8.825 -5.969 2.933 559 HD1 HIS 77 HD1 HIS 77 9.512 -7.987 4.318 560 HD2 HIS 77 HD2 HIS 77 5.399 -7.423 4.167 561 HE1 HIS 77 HE1 HIS 77 8.556 -9.549 6.041 562 H VAL 78 H VAL 78 7.870 -4.466 0.592 563 HA VAL 78 HA VAL 78 9.719 -2.558 1.284 564 HB VAL 78 HB VAL 78 9.366 -1.586 -1.004 565 HG11 VAL 78 1HG1 VAL 78 9.729 -3.985 -2.109 566 HG12 VAL 78 2HG1 VAL 78 10.964 -3.196 -1.125 567 HG13 VAL 78 3HG1 VAL 78 9.927 -4.434 -0.415 568 HG21 VAL 78 3HG2 VAL 78 7.454 -1.901 -2.089 569 HG22 VAL 78 1HG2 VAL 78 7.691 -3.648 -2.038 570 HG23 VAL 78 2HG2 VAL 78 6.845 -2.834 -0.722 571 H ARG 79 H ARG 79 9.468 -0.794 2.479 572 HA ARG 79 HA ARG 79 7.447 1.156 1.761 573 HB2 ARG 79 2HB ARG 79 7.190 -0.570 4.088 574 HB3 ARG 79 3HB ARG 79 7.215 1.131 4.533 575 HG2 ARG 79 2HG ARG 79 5.497 1.031 2.365 576 HG3 ARG 79 3HG ARG 79 5.124 -0.427 3.286 577 HD2 ARG 79 2HD ARG 79 5.331 1.427 5.266 578 HD3 ARG 79 3HD ARG 79 4.676 2.397 3.948 579 HE ARG 79 HE ARG 79 3.175 0.066 4.071 580 HH11 ARG 79 1HH1 ARG 79 3.854 2.822 6.085 581 HH12 ARG 79 2HH1 ARG 79 2.321 2.776 6.891 582 HH21 ARG 79 2HH2 ARG 79 0.785 1.166 6.344 583 HH22 ARG 79 1HH2 ARG 79 1.153 -0.006 5.124 584 HA PRO 80 HA PRO 80 10.512 4.058 2.956 585 HB2 PRO 80 2HB PRO 80 9.030 6.088 3.983 586 HB3 PRO 80 3HB PRO 80 9.082 5.715 2.256 587 HG2 PRO 80 2HG PRO 80 7.016 4.974 4.293 588 HG3 PRO 80 3HG PRO 80 6.792 5.562 2.635 589 HD2 PRO 80 2HD PRO 80 6.582 2.944 3.292 590 HD3 PRO 80 3HD PRO 80 7.181 3.487 1.712 591 H SER 81 H SER 81 11.796 3.385 4.593 592 HA SER 81 HA SER 81 12.645 3.135 6.689 593 HB2 SER 81 2HB SER 81 11.619 5.620 6.663 594 HB3 SER 81 3HB SER 81 10.620 4.918 7.935 595 HG SER 81 HG SER 81 13.344 5.459 7.901 596 H ALA 82 H ALA 82 10.738 1.255 5.865 597 HA ALA 82 HA ALA 82 9.141 0.729 8.270 598 HB1 ALA 82 1HB ALA 82 8.205 -1.136 6.733 599 HB2 ALA 82 2HB ALA 82 7.730 0.539 6.446 600 HB3 ALA 82 3HB ALA 82 8.966 -0.213 5.437 601 H SER 83 H SER 83 10.216 -0.391 9.763 602 HA SER 83 HA SER 83 12.093 -2.479 8.908 603 HB2 SER 83 2HB SER 83 11.802 -1.599 11.759 604 HB3 SER 83 3HB SER 83 13.229 -2.203 10.917 605 HG SER 83 HG SER 83 12.882 0.219 11.412 606 H ILE 84 H ILE 84 11.541 -4.545 9.051 607 HA ILE 84 HA ILE 84 9.536 -5.358 11.037 608 HB ILE 84 HB ILE 84 9.527 -6.261 8.154 609 HG12 ILE 84 2HG1 ILE 84 7.123 -5.170 8.453 610 HG13 ILE 84 3HG1 ILE 84 7.966 -4.220 9.671 611 HG21 ILE 84 1HG2 ILE 84 7.618 -6.922 10.392 612 HG22 ILE 84 2HG2 ILE 84 7.536 -7.505 8.730 613 HG23 ILE 84 3HG2 ILE 84 8.869 -8.000 9.773 614 HD11 ILE 84 3HD1 ILE 84 9.485 -4.322 7.234 615 HD12 ILE 84 1HD1 ILE 84 7.847 -3.740 6.935 616 HD13 ILE 84 2HD1 ILE 84 8.870 -2.928 8.121 617 HA PRO 85 HA PRO 85 12.589 -8.444 11.891 618 HB2 PRO 85 2HB PRO 85 11.065 -9.998 13.513 619 HB3 PRO 85 3HB PRO 85 11.747 -8.451 14.028 620 HG2 PRO 85 2HG PRO 85 8.979 -9.078 13.076 621 HG3 PRO 85 3HG PRO 85 9.491 -8.054 14.430 622 HD2 PRO 85 2HD PRO 85 8.743 -7.036 12.035 623 HD3 PRO 85 3HD PRO 85 9.971 -6.264 13.060 624 H VAL 86 H VAL 86 13.180 -9.982 10.507 625 HA VAL 86 HA VAL 86 11.118 -11.825 9.482 626 HB VAL 86 HB VAL 86 13.627 -10.894 8.078 627 HG11 VAL 86 1HG1 VAL 86 11.637 -13.027 7.486 628 HG12 VAL 86 2HG1 VAL 86 12.327 -12.115 6.143 629 HG13 VAL 86 3HG1 VAL 86 13.382 -13.011 7.236 630 HG21 VAL 86 3HG2 VAL 86 10.823 -9.999 8.039 631 HG22 VAL 86 1HG2 VAL 86 12.302 -9.124 7.641 632 HG23 VAL 86 2HG2 VAL 86 11.575 -10.212 6.458 633 H VAL 87 H VAL 87 11.599 -14.004 9.370 634 HA VAL 87 HA VAL 87 13.834 -14.858 11.049 635 HB VAL 87 HB VAL 87 11.713 -15.789 11.684 636 HG11 VAL 87 1HG1 VAL 87 11.299 -15.931 8.850 637 HG12 VAL 87 2HG1 VAL 87 11.009 -17.511 9.581 638 HG13 VAL 87 3HG1 VAL 87 10.129 -16.095 10.159 639 HG21 VAL 87 3HG2 VAL 87 13.865 -17.225 11.572 640 HG22 VAL 87 1HG2 VAL 87 12.320 -18.021 11.865 641 HG23 VAL 87 2HG2 VAL 87 13.041 -18.062 10.257 642 H PHE 88 H PHE 88 15.614 -15.752 10.243 643 HA PHE 88 HA PHE 88 15.555 -16.701 7.453 644 HB2 PHE 88 2HB PHE 88 17.506 -15.025 8.939 645 HB3 PHE 88 3HB PHE 88 18.170 -16.201 7.809 646 HD1 PHE 88 HD1 PHE 88 18.887 -15.063 5.943 647 HD2 PHE 88 HD2 PHE 88 15.117 -14.070 7.651 648 HE1 PHE 88 HE1 PHE 88 18.454 -13.515 4.079 649 HE2 PHE 88 HE2 PHE 88 14.678 -12.522 5.791 650 HZ PHE 88 HZ PHE 88 16.346 -12.243 4.001 651 H SER 89 H SER 89 17.087 -18.422 6.930 652 HA SER 89 HA SER 89 17.810 -20.097 9.235 653 HB2 SER 89 2HB SER 89 15.980 -20.738 7.006 654 HB3 SER 89 3HB SER 89 17.169 -21.984 7.383 655 HG SER 89 HG SER 89 14.960 -21.714 8.592 656 H ARG 90 H ARG 90 19.613 -21.428 8.957 657 HA ARG 90 HA ARG 90 21.178 -20.942 6.509 658 HB2 ARG 90 2HB ARG 90 21.863 -20.440 9.307 659 HB3 ARG 90 3HB ARG 90 23.060 -21.422 8.472 660 HG2 ARG 90 2HG ARG 90 22.069 -18.940 7.161 661 HG3 ARG 90 3HG ARG 90 23.227 -18.811 8.487 662 HD2 ARG 90 2HD ARG 90 24.502 -20.658 7.120 663 HD3 ARG 90 3HD ARG 90 23.557 -20.013 5.779 664 HE ARG 90 HE ARG 90 24.834 -17.931 7.226 665 HH11 ARG 90 1HH1 ARG 90 25.427 -20.455 4.903 666 HH12 ARG 90 2HH1 ARG 90 26.778 -19.648 4.176 667 HH21 ARG 90 2HH2 ARG 90 27.450 -17.603 4.960 668 HH22 ARG 90 1HH2 ARG 90 26.610 -16.858 6.278 669 H ASP 91 H ASP 91 20.353 -22.948 5.711 670 HA ASP 91 HA ASP 91 20.491 -25.173 5.256 671 HB2 ASP 91 2HB ASP 91 22.878 -25.428 7.052 672 HB3 ASP 91 3HB ASP 91 22.557 -26.212 5.507 673 H GLY 92 H GLY 92 18.833 -24.374 7.396 674 HA2 GLY 92 2HA GLY 92 17.447 -25.846 8.669 675 HA3 GLY 92 3HA GLY 92 18.850 -26.866 8.954 676 H VAL 93 H VAL 93 19.680 -23.644 9.312 677 HA VAL 93 HA VAL 93 19.771 -23.942 12.205 678 HB VAL 93 HB VAL 93 20.943 -21.861 10.360 679 HG11 VAL 93 1HG1 VAL 93 22.146 -21.071 12.412 680 HG12 VAL 93 2HG1 VAL 93 20.416 -20.726 12.389 681 HG13 VAL 93 3HG1 VAL 93 21.037 -22.058 13.364 682 HG21 VAL 93 3HG2 VAL 93 22.646 -23.496 12.117 683 HG22 VAL 93 1HG2 VAL 93 21.821 -24.373 10.829 684 HG23 VAL 93 2HG2 VAL 93 22.878 -23.017 10.436 685 H VAL 94 H VAL 94 18.789 -22.578 13.669 686 HA VAL 94 HA VAL 94 16.606 -20.937 12.578 687 HB VAL 94 HB VAL 94 16.902 -22.126 15.340 688 HG11 VAL 94 1HG1 VAL 94 14.536 -21.411 15.611 689 HG12 VAL 94 2HG1 VAL 94 15.671 -20.067 15.468 690 HG13 VAL 94 3HG1 VAL 94 14.671 -20.530 14.090 691 HG21 VAL 94 3HG2 VAL 94 15.158 -22.905 13.007 692 HG22 VAL 94 1HG2 VAL 94 16.468 -23.849 13.717 693 HG23 VAL 94 2HG2 VAL 94 14.995 -23.550 14.640 694 H MET 95 H MET 95 17.058 -18.840 12.507 695 HA MET 95 HA MET 95 18.187 -17.557 14.873 696 HB2 MET 95 2HB MET 95 19.993 -18.122 13.103 697 HB3 MET 95 3HB MET 95 19.269 -16.820 12.168 698 HG2 MET 95 2HG MET 95 21.120 -15.927 13.356 699 HG3 MET 95 3HG MET 95 19.649 -15.306 14.102 700 HE1 MET 95 3HE MET 95 22.474 -15.173 15.940 701 HE2 MET 95 1HE MET 95 23.068 -16.803 16.260 702 HE3 MET 95 2HE MET 95 22.906 -16.234 14.598 703 H SER 96 H SER 96 17.873 -15.224 14.887 704 HA SER 96 HA SER 96 15.718 -14.338 13.086 705 HB2 SER 96 2HB SER 96 14.528 -13.337 14.877 706 HB3 SER 96 3HB SER 96 14.971 -14.942 15.456 707 HG SER 96 HG SER 96 15.378 -13.184 16.955 708 H ALA 97 H ALA 97 16.042 -12.433 12.123 709 HA ALA 97 HA ALA 97 17.909 -10.513 13.303 710 HB1 ALA 97 1HB ALA 97 18.535 -10.351 10.626 711 HB2 ALA 97 2HB ALA 97 19.516 -11.114 11.878 712 HB3 ALA 97 3HB ALA 97 18.410 -12.087 10.909 713 H THR 98 H THR 98 17.401 -8.404 12.923 714 HA THR 98 HA THR 98 14.795 -7.884 11.779 715 HB THR 98 HB THR 98 16.740 -5.885 12.943 716 HG1 THR 98 HG1 THR 98 16.312 -6.945 14.734 717 HG21 THR 98 3HG2 THR 98 15.192 -4.360 12.459 718 HG22 THR 98 1HG2 THR 98 13.984 -5.272 13.363 719 HG23 THR 98 2HG2 THR 98 14.237 -5.601 11.649 720 H ILE 99 H ILE 99 14.388 -7.064 9.824 721 HA ILE 99 HA ILE 99 16.680 -6.171 8.205 722 HB ILE 99 HB ILE 99 14.023 -7.185 7.193 723 HG12 ILE 99 2HG1 ILE 99 16.674 -8.624 7.436 724 HG13 ILE 99 3HG1 ILE 99 15.223 -8.966 8.372 725 HG21 ILE 99 1HG2 ILE 99 16.431 -7.247 5.503 726 HG22 ILE 99 2HG2 ILE 99 14.768 -6.826 5.098 727 HG23 ILE 99 3HG2 ILE 99 15.810 -5.642 5.886 728 HD11 ILE 99 3HD1 ILE 99 15.594 -10.567 6.549 729 HD12 ILE 99 1HD1 ILE 99 14.070 -9.694 6.387 730 HD13 ILE 99 2HD1 ILE 99 15.453 -9.249 5.387 731 H VAL 100 H VAL 100 16.761 -4.111 7.602 732 HA VAL 100 HA VAL 100 14.341 -2.467 7.917 733 HB VAL 100 HB VAL 100 15.972 -0.532 7.896 734 HG11 VAL 100 1HG1 VAL 100 16.474 -2.447 10.158 735 HG12 VAL 100 2HG1 VAL 100 16.394 -0.685 10.209 736 HG13 VAL 100 3HG1 VAL 100 14.928 -1.628 9.937 737 HG21 VAL 100 3HG2 VAL 100 18.206 -2.124 8.810 738 HG22 VAL 100 1HG2 VAL 100 17.777 -2.508 7.144 739 HG23 VAL 100 2HG2 VAL 100 18.157 -0.846 7.596 740 H VAL 101 H VAL 101 13.311 -2.126 6.064 741 HA VAL 101 HA VAL 101 14.859 -1.924 3.577 742 HB VAL 101 HB VAL 101 12.553 -2.093 2.497 743 HG11 VAL 101 1HG1 VAL 101 12.939 -4.288 2.217 744 HG12 VAL 101 2HG1 VAL 101 14.374 -3.984 3.200 745 HG13 VAL 101 3HG1 VAL 101 12.908 -4.617 3.949 746 HG21 VAL 101 3HG2 VAL 101 11.797 -3.047 5.258 747 HG22 VAL 101 1HG2 VAL 101 11.279 -1.525 4.533 748 HG23 VAL 101 2HG2 VAL 101 10.771 -3.057 3.823 749 H GLY 102 H GLY 102 15.138 -0.016 2.623 750 HA2 GLY 102 2HA GLY 102 13.440 2.230 3.514 751 HA3 GLY 102 3HA GLY 102 15.111 2.394 2.995 752 H GLU 103 H GLU 103 11.893 2.622 2.063 753 HA GLU 103 HA GLU 103 12.442 2.257 -0.778 754 HB2 GLU 103 2HB GLU 103 9.983 2.542 0.883 755 HB3 GLU 103 3HB GLU 103 9.902 3.029 -0.804 756 HG2 GLU 103 2HG GLU 103 9.221 0.646 -0.218 757 HG3 GLU 103 3HG GLU 103 10.321 0.876 -1.577 758 H LEU 104 H LEU 104 11.698 4.787 1.542 759 HA LEU 104 HA LEU 104 12.473 6.777 -0.467 760 HB2 LEU 104 2HB LEU 104 10.153 7.169 1.410 761 HB3 LEU 104 3HB LEU 104 10.683 8.247 0.120 762 HG LEU 104 HG LEU 104 9.791 5.493 -0.593 763 HD11 LEU 104 1HD1 LEU 104 8.092 7.618 0.566 764 HD12 LEU 104 2HD1 LEU 104 7.884 5.867 0.568 765 HD13 LEU 104 3HD1 LEU 104 7.482 6.801 -0.873 766 HD21 LEU 104 3HD2 LEU 104 9.190 8.070 -1.997 767 HD22 LEU 104 1HD2 LEU 104 9.310 6.440 -2.659 768 HD23 LEU 104 2HD2 LEU 104 10.768 7.297 -2.157 769 H GLU 105 H GLU 105 14.479 6.528 0.809 770 HA GLU 105 HA GLU 105 14.366 8.004 3.354 771 HB2 GLU 105 2HB GLU 105 16.488 6.938 3.925 772 HB3 GLU 105 3HB GLU 105 15.263 5.732 3.555 773 HG2 GLU 105 2HG GLU 105 16.250 5.692 1.208 774 HG3 GLU 105 3HG GLU 105 17.610 6.577 1.894 Start of MODEL 13 1 HA PRO 1 HA PRO 1 3.010 1.007 -2.116 2 HB2 PRO 1 2HB PRO 1 5.045 -0.651 -1.422 3 HB3 PRO 1 3HB PRO 1 4.743 0.891 -0.612 4 HG2 PRO 1 2HG PRO 1 3.989 -1.878 0.242 5 HG3 PRO 1 3HG PRO 1 4.655 -0.550 1.211 6 HD2 PRO 1 2HD PRO 1 2.020 -1.174 1.210 7 HD3 PRO 1 3HD PRO 1 2.607 0.487 1.425 8 H LEU 2 H LEU 2 4.637 -0.626 -3.427 9 HA LEU 2 HA LEU 2 3.358 -3.140 -4.062 10 HB2 LEU 2 2HB LEU 2 2.913 -0.740 -5.631 11 HB3 LEU 2 3HB LEU 2 3.625 -2.035 -6.590 12 HG LEU 2 HG LEU 2 1.481 -3.132 -5.076 13 HD11 LEU 2 1HD1 LEU 2 0.888 -0.575 -5.167 14 HD12 LEU 2 2HD1 LEU 2 -0.341 -1.805 -5.466 15 HD13 LEU 2 3HD1 LEU 2 0.417 -0.969 -6.821 16 HD21 LEU 2 3HD2 LEU 2 1.499 -2.512 -8.017 17 HD22 LEU 2 1HD2 LEU 2 0.725 -3.858 -7.181 18 HD23 LEU 2 2HD2 LEU 2 2.483 -3.798 -7.315 19 H THR 3 H THR 3 4.567 -4.279 -5.854 20 HA THR 3 HA THR 3 7.405 -3.488 -5.866 21 HB THR 3 HB THR 3 7.097 -5.372 -4.324 22 HG1 THR 3 HG1 THR 3 8.989 -5.219 -5.733 23 HG21 THR 3 3HG2 THR 3 5.219 -6.244 -6.191 24 HG22 THR 3 1HG2 THR 3 5.753 -7.103 -4.747 25 HG23 THR 3 2HG2 THR 3 6.537 -7.410 -6.297 26 H ARG 4 H ARG 4 8.653 -4.635 -7.624 27 HA ARG 4 HA ARG 4 7.698 -3.982 -10.121 28 HB2 ARG 4 2HB ARG 4 9.843 -5.824 -9.157 29 HB3 ARG 4 3HB ARG 4 9.419 -5.845 -10.864 30 HG2 ARG 4 2HG ARG 4 9.675 -3.167 -10.353 31 HG3 ARG 4 3HG ARG 4 10.925 -3.881 -9.332 32 HD2 ARG 4 2HD ARG 4 12.096 -4.720 -11.118 33 HD3 ARG 4 3HD ARG 4 10.664 -4.827 -12.142 34 HE ARG 4 HE ARG 4 11.000 -2.160 -11.804 35 HH11 ARG 4 1HH1 ARG 4 13.091 -4.737 -12.855 36 HH12 ARG 4 2HH1 ARG 4 14.034 -3.723 -13.897 37 HH21 ARG 4 2HH2 ARG 4 13.545 -1.492 -14.076 38 HH22 ARG 4 1HH2 ARG 4 12.233 -0.814 -13.172 39 HA PRO 5 HA PRO 5 4.904 -7.094 -11.444 40 HB2 PRO 5 2HB PRO 5 5.554 -7.375 -14.064 41 HB3 PRO 5 3HB PRO 5 4.724 -5.950 -13.428 42 HG2 PRO 5 2HG PRO 5 7.626 -6.327 -14.059 43 HG3 PRO 5 3HG PRO 5 6.578 -4.938 -14.401 44 HD2 PRO 5 2HD PRO 5 8.306 -4.982 -12.316 45 HD3 PRO 5 3HD PRO 5 6.757 -4.115 -12.255 46 H TYR 6 H TYR 6 8.164 -7.682 -12.774 47 HA TYR 6 HA TYR 6 7.726 -10.564 -12.418 48 HB2 TYR 6 2HB TYR 6 9.273 -8.930 -14.328 49 HB3 TYR 6 3HB TYR 6 10.076 -10.395 -13.775 50 HD1 TYR 6 HD1 TYR 6 6.487 -9.686 -14.528 51 HD2 TYR 6 HD2 TYR 6 9.960 -11.949 -15.487 52 HE1 TYR 6 HE1 TYR 6 5.176 -11.006 -16.136 53 HE2 TYR 6 HE2 TYR 6 8.659 -13.275 -17.099 54 HH TYR 6 HH TYR 6 5.621 -13.644 -17.147 55 H LEU 7 H LEU 7 9.358 -11.863 -11.454 56 HA LEU 7 HA LEU 7 10.721 -10.514 -9.280 57 HB2 LEU 7 2HB LEU 7 11.306 -12.869 -8.608 58 HB3 LEU 7 3HB LEU 7 9.589 -12.474 -8.639 59 HG LEU 7 HG LEU 7 10.450 -13.613 -11.155 60 HD11 LEU 7 1HD1 LEU 7 10.910 -15.244 -8.663 61 HD12 LEU 7 2HD1 LEU 7 12.121 -14.766 -9.852 62 HD13 LEU 7 3HD1 LEU 7 10.842 -15.893 -10.301 63 HD21 LEU 7 3HD2 LEU 7 8.588 -15.171 -10.620 64 HD22 LEU 7 1HD2 LEU 7 8.140 -13.467 -10.528 65 HD23 LEU 7 2HD2 LEU 7 8.435 -14.382 -9.049 66 H GLY 8 H GLY 8 12.916 -10.421 -8.957 67 HA2 GLY 8 2HA GLY 8 14.563 -11.186 -11.286 68 HA3 GLY 8 3HA GLY 8 14.901 -9.814 -10.241 69 H PHE 9 H PHE 9 14.053 -13.158 -9.404 70 HA PHE 9 HA PHE 9 16.738 -13.766 -8.563 71 HB2 PHE 9 2HB PHE 9 16.294 -14.032 -6.211 72 HB3 PHE 9 3HB PHE 9 15.841 -12.395 -6.672 73 HD1 PHE 9 HD1 PHE 9 13.312 -12.114 -7.361 74 HD2 PHE 9 HD2 PHE 9 14.838 -15.250 -4.921 75 HE1 PHE 9 HE1 PHE 9 11.067 -12.467 -6.417 76 HE2 PHE 9 HE2 PHE 9 12.596 -15.609 -3.974 77 HZ PHE 9 HZ PHE 9 10.707 -14.217 -4.723 78 H ARG 10 H ARG 10 16.955 -15.978 -7.790 79 HA ARG 10 HA ARG 10 14.758 -17.687 -8.756 80 HB2 ARG 10 2HB ARG 10 17.737 -18.201 -8.733 81 HB3 ARG 10 3HB ARG 10 16.527 -19.394 -9.184 82 HG2 ARG 10 2HG ARG 10 15.830 -18.022 -11.056 83 HG3 ARG 10 3HG ARG 10 16.976 -16.766 -10.583 84 HD2 ARG 10 2HD ARG 10 18.795 -17.970 -11.286 85 HD3 ARG 10 3HD ARG 10 17.998 -19.523 -11.035 86 HE ARG 10 HE ARG 10 16.650 -18.263 -13.098 87 HH11 ARG 10 1HH1 ARG 10 19.865 -19.438 -12.467 88 HH12 ARG 10 2HH1 ARG 10 20.204 -19.790 -14.130 89 HH21 ARG 10 2HH2 ARG 10 18.621 -19.381 -15.734 90 HH22 ARG 10 1HH2 ARG 10 17.083 -18.722 -15.290 91 H VAL 11 H VAL 11 14.161 -19.486 -7.560 92 HA VAL 11 HA VAL 11 15.430 -19.832 -4.933 93 HB VAL 11 HB VAL 11 13.273 -20.028 -3.830 94 HG11 VAL 11 1HG1 VAL 11 12.652 -17.715 -3.802 95 HG12 VAL 11 2HG1 VAL 11 14.400 -17.811 -4.024 96 HG13 VAL 11 3HG1 VAL 11 13.353 -17.456 -5.399 97 HG21 VAL 11 3HG2 VAL 11 11.690 -20.784 -5.293 98 HG22 VAL 11 1HG2 VAL 11 11.296 -19.065 -5.303 99 HG23 VAL 11 2HG2 VAL 11 12.256 -19.757 -6.610 100 H ALA 12 H ALA 12 15.706 -21.902 -4.333 101 HA ALA 12 HA ALA 12 14.387 -23.981 -5.955 102 HB1 ALA 12 1HB ALA 12 17.213 -23.753 -5.003 103 HB2 ALA 12 2HB ALA 12 16.501 -25.338 -5.309 104 HB3 ALA 12 3HB ALA 12 16.600 -24.150 -6.609 105 H VAL 13 H VAL 13 13.064 -25.247 -4.842 106 HA VAL 13 HA VAL 13 13.044 -25.189 -1.957 107 HB VAL 13 HB VAL 13 10.916 -25.188 -3.104 108 HG11 VAL 13 1HG1 VAL 13 10.729 -27.860 -4.052 109 HG12 VAL 13 2HG1 VAL 13 10.586 -26.355 -4.962 110 HG13 VAL 13 3HG1 VAL 13 12.163 -27.120 -4.763 111 HG21 VAL 13 3HG2 VAL 13 9.829 -26.632 -1.693 112 HG22 VAL 13 1HG2 VAL 13 10.987 -27.935 -1.958 113 HG23 VAL 13 2HG2 VAL 13 11.413 -26.575 -0.920 114 H GLY 14 H GLY 14 13.730 -26.738 -0.580 115 HA2 GLY 14 2HA GLY 14 14.401 -29.391 -1.588 116 HA3 GLY 14 3HA GLY 14 15.736 -28.435 -0.961 117 H ARG 15 H ARG 15 16.096 -29.993 0.672 118 HA ARG 15 HA ARG 15 14.209 -29.756 2.912 119 HB2 ARG 15 2HB ARG 15 15.660 -32.321 2.286 120 HB3 ARG 15 3HB ARG 15 14.348 -32.068 3.428 121 HG2 ARG 15 2HG ARG 15 14.108 -31.864 0.434 122 HG3 ARG 15 3HG ARG 15 13.620 -33.250 1.410 123 HD2 ARG 15 2HD ARG 15 12.460 -30.874 2.495 124 HD3 ARG 15 3HD ARG 15 12.117 -30.950 0.768 125 HE ARG 15 HE ARG 15 11.041 -32.637 2.816 126 HH11 ARG 15 1HH1 ARG 15 11.875 -32.452 -0.559 127 HH12 ARG 15 2HH1 ARG 15 10.741 -33.670 -1.040 128 HH21 ARG 15 2HH2 ARG 15 9.415 -34.687 0.527 129 HH22 ARG 15 1HH2 ARG 15 9.544 -34.242 2.195 130 H ASP 16 H ASP 16 15.134 -29.217 4.787 131 HA ASP 16 HA ASP 16 18.061 -29.119 4.891 132 HB2 ASP 16 2HB ASP 16 17.659 -27.619 6.876 133 HB3 ASP 16 3HB ASP 16 17.048 -27.000 5.344 134 H SER 17 H SER 17 18.685 -29.163 7.464 135 HA SER 17 HA SER 17 18.488 -31.910 8.152 136 HB2 SER 17 2HB SER 17 20.369 -30.202 8.699 137 HB3 SER 17 3HB SER 17 19.367 -29.784 10.089 138 HG SER 17 HG SER 17 20.067 -31.518 11.024 139 H SER 18 H SER 18 16.677 -29.082 9.015 140 HA SER 18 HA SER 18 15.446 -30.266 11.337 141 HB2 SER 18 2HB SER 18 15.849 -27.734 10.804 142 HB3 SER 18 3HB SER 18 14.331 -27.869 9.916 143 HG SER 18 HG SER 18 13.286 -28.402 11.787 144 H GLY 19 H GLY 19 14.447 -29.500 8.014 145 HA2 GLY 19 2HA GLY 19 13.026 -30.893 6.727 146 HA3 GLY 19 3HA GLY 19 12.421 -31.607 8.214 147 H CYS 20 H CYS 20 12.690 -28.191 7.295 148 HA CYS 20 HA CYS 20 9.776 -27.973 7.662 149 HB2 CYS 20 2HB CYS 20 11.981 -25.981 8.200 150 HB3 CYS 20 3HB CYS 20 10.278 -25.539 8.167 151 HG CYS 20 HG CYS 20 9.647 -26.382 10.533 152 H THR 21 H THR 21 11.756 -28.361 5.254 153 HA THR 21 HA THR 21 11.813 -27.799 3.048 154 HB THR 21 HB THR 21 9.114 -26.518 3.486 155 HG1 THR 21 HG1 THR 21 9.598 -29.243 2.830 156 HG21 THR 21 3HG2 THR 21 9.387 -28.013 1.067 157 HG22 THR 21 1HG2 THR 21 10.741 -26.893 1.203 158 HG23 THR 21 2HG2 THR 21 9.086 -26.288 1.271 159 H THR 22 H THR 22 13.467 -26.327 2.993 160 HA THR 22 HA THR 22 12.725 -23.487 3.251 161 HB THR 22 HB THR 22 14.936 -22.957 3.884 162 HG1 THR 22 HG1 THR 22 16.253 -24.111 2.585 163 HG21 THR 22 3HG2 THR 22 15.034 -25.466 5.361 164 HG22 THR 22 1HG2 THR 22 13.432 -24.730 5.374 165 HG23 THR 22 2HG2 THR 22 14.827 -23.816 5.949 166 H LEU 23 H LEU 23 14.013 -22.001 1.837 167 HA LEU 23 HA LEU 23 14.683 -23.232 -0.747 168 HB2 LEU 23 2HB LEU 23 12.760 -21.030 -0.164 169 HB3 LEU 23 3HB LEU 23 13.669 -20.995 -1.674 170 HG LEU 23 HG LEU 23 12.731 -23.234 -2.221 171 HD11 LEU 23 1HD1 LEU 23 11.738 -22.982 0.492 172 HD12 LEU 23 2HD1 LEU 23 11.866 -24.406 -0.539 173 HD13 LEU 23 3HD1 LEU 23 10.455 -23.356 -0.659 174 HD21 LEU 23 3HD2 LEU 23 11.746 -21.157 -3.091 175 HD22 LEU 23 1HD2 LEU 23 10.680 -21.087 -1.688 176 HD23 LEU 23 2HD2 LEU 23 10.533 -22.413 -2.841 177 H SER 24 H SER 24 16.661 -22.705 -1.371 178 HA SER 24 HA SER 24 18.051 -20.511 -0.072 179 HB2 SER 24 2HB SER 24 18.853 -23.003 -0.948 180 HB3 SER 24 3HB SER 24 19.503 -21.927 -2.185 181 HG SER 24 HG SER 24 19.956 -21.830 0.611 182 H ILE 25 H ILE 25 18.622 -18.623 -0.994 183 HA ILE 25 HA ILE 25 17.561 -18.073 -3.664 184 HB ILE 25 HB ILE 25 18.764 -15.984 -1.884 185 HG12 ILE 25 2HG1 ILE 25 17.234 -17.196 -0.432 186 HG13 ILE 25 3HG1 ILE 25 16.527 -15.645 -0.871 187 HG21 ILE 25 1HG2 ILE 25 17.264 -14.512 -3.027 188 HG22 ILE 25 2HG2 ILE 25 18.095 -15.492 -4.234 189 HG23 ILE 25 3HG2 ILE 25 16.431 -15.868 -3.786 190 HD11 ILE 25 3HD1 ILE 25 15.849 -18.285 -2.144 191 HD12 ILE 25 1HD1 ILE 25 14.895 -17.466 -0.908 192 HD13 ILE 25 2HD1 ILE 25 15.101 -16.728 -2.496 193 H GLN 26 H GLN 26 18.807 -17.646 -5.389 194 HA GLN 26 HA GLN 26 21.689 -17.930 -5.080 195 HB2 GLN 26 2HB GLN 26 19.787 -18.081 -7.387 196 HB3 GLN 26 3HB GLN 26 21.496 -17.795 -7.692 197 HG2 GLN 26 2HG GLN 26 21.613 -20.025 -7.761 198 HG3 GLN 26 3HG GLN 26 21.638 -19.896 -6.003 199 HE21 GLN 26 2HE2 GLN 26 18.616 -21.728 -7.893 200 HE22 GLN 26 1HE2 GLN 26 20.013 -21.114 -8.702 201 H GLU 27 H GLU 27 19.308 -15.514 -5.813 202 HA GLU 27 HA GLU 27 21.470 -13.541 -6.128 203 HB2 GLU 27 2HB GLU 27 19.615 -14.242 -8.090 204 HB3 GLU 27 3HB GLU 27 18.998 -12.738 -7.421 205 HG2 GLU 27 2HG GLU 27 20.524 -11.551 -8.493 206 HG3 GLU 27 3HG GLU 27 21.831 -12.554 -7.866 207 H VAL 28 H VAL 28 19.991 -11.245 -6.144 208 HA VAL 28 HA VAL 28 18.586 -11.314 -3.552 209 HB VAL 28 HB VAL 28 19.419 -8.899 -3.324 210 HG11 VAL 28 1HG1 VAL 28 20.926 -11.412 -2.918 211 HG12 VAL 28 2HG1 VAL 28 21.819 -9.904 -2.716 212 HG13 VAL 28 3HG1 VAL 28 20.379 -10.214 -1.746 213 HG21 VAL 28 3HG2 VAL 28 21.833 -9.533 -4.832 214 HG22 VAL 28 1HG2 VAL 28 20.403 -9.346 -5.848 215 HG23 VAL 28 2HG2 VAL 28 20.895 -8.040 -4.770 216 H THR 29 H THR 29 16.658 -10.308 -3.428 217 HA THR 29 HA THR 29 15.758 -8.811 -5.803 218 HB THR 29 HB THR 29 14.518 -10.850 -5.739 219 HG1 THR 29 HG1 THR 29 12.941 -9.503 -6.206 220 HG21 THR 29 3HG2 THR 29 14.029 -10.219 -2.829 221 HG22 THR 29 1HG2 THR 29 14.927 -11.585 -3.489 222 HG23 THR 29 2HG2 THR 29 13.182 -11.481 -3.723 223 H GLN 30 H GLN 30 16.605 -8.487 -2.642 224 HA GLN 30 HA GLN 30 14.555 -6.549 -1.928 225 HB2 GLN 30 2HB GLN 30 16.909 -7.718 -0.459 226 HB3 GLN 30 3HB GLN 30 15.995 -6.360 0.184 227 HG2 GLN 30 2HG GLN 30 13.992 -8.077 -0.381 228 HG3 GLN 30 3HG GLN 30 15.290 -9.205 0.006 229 HE21 GLN 30 2HE2 GLN 30 15.210 -8.624 3.420 230 HE22 GLN 30 1HE2 GLN 30 15.932 -9.443 2.082 231 H THR 31 H THR 31 16.888 -6.323 -4.010 232 HA THR 31 HA THR 31 17.903 -3.723 -3.066 233 HB THR 31 HB THR 31 19.540 -4.188 -5.112 234 HG1 THR 31 HG1 THR 31 19.346 -6.169 -5.809 235 HG21 THR 31 3HG2 THR 31 20.102 -3.859 -2.684 236 HG22 THR 31 1HG2 THR 31 21.180 -4.952 -3.551 237 HG23 THR 31 2HG2 THR 31 19.940 -5.603 -2.479 238 H TYR 32 H TYR 32 15.366 -4.575 -4.605 239 HA TYR 32 HA TYR 32 15.690 -2.635 -6.800 240 HB2 TYR 32 2HB TYR 32 14.131 -5.214 -6.728 241 HB3 TYR 32 3HB TYR 32 13.800 -3.954 -7.912 242 HD1 TYR 32 HD1 TYR 32 15.911 -3.119 -9.256 243 HD2 TYR 32 HD2 TYR 32 15.647 -6.873 -7.271 244 HE1 TYR 32 HE1 TYR 32 17.695 -4.002 -10.701 245 HE2 TYR 32 HE2 TYR 32 17.431 -7.766 -8.709 246 HH TYR 32 HH TYR 32 19.431 -5.853 -10.560 247 H THR 33 H THR 33 13.784 -1.410 -7.353 248 HA THR 33 HA THR 33 11.503 -1.433 -5.606 249 HB THR 33 HB THR 33 12.521 1.262 -5.462 250 HG1 THR 33 HG1 THR 33 14.095 -0.580 -4.000 251 HG21 THR 33 3HG2 THR 33 11.918 1.075 -3.179 252 HG22 THR 33 1HG2 THR 33 12.067 -0.681 -3.205 253 HG23 THR 33 2HG2 THR 33 10.744 0.105 -4.066 254 H GLY 34 H GLY 34 9.898 0.213 -6.210 255 HA2 GLY 34 2HA GLY 34 10.259 1.819 -8.537 256 HA3 GLY 34 3HA GLY 34 9.416 0.327 -8.927 257 H SER 35 H SER 35 8.046 0.154 -6.375 258 HA SER 35 HA SER 35 6.032 2.239 -6.857 259 HB2 SER 35 2HB SER 35 5.863 -0.593 -6.403 260 HB3 SER 35 3HB SER 35 4.990 0.255 -5.127 261 HG SER 35 HG SER 35 3.693 1.194 -6.631 262 H ASN 36 H ASN 36 5.764 3.795 -5.407 263 HA ASN 36 HA ASN 36 5.868 5.007 -3.486 264 HB2 ASN 36 2HB ASN 36 4.767 2.641 -2.752 265 HB3 ASN 36 3HB ASN 36 6.190 2.660 -1.715 266 HD21 ASN 36 2HD2 ASN 36 3.017 4.602 -0.538 267 HD22 ASN 36 1HD2 ASN 36 3.077 3.268 -1.635 268 H GLY 37 H GLY 37 8.282 4.521 -4.853 269 HA2 GLY 37 2HA GLY 37 10.172 5.435 -3.029 270 HA3 GLY 37 3HA GLY 37 10.372 3.692 -3.127 271 H GLY 38 H GLY 38 10.615 2.797 -5.372 272 HA2 GLY 38 2HA GLY 38 11.616 2.787 -7.448 273 HA3 GLY 38 3HA GLY 38 11.470 4.538 -7.470 274 H ALA 39 H ALA 39 13.080 2.977 -4.825 275 HA ALA 39 HA ALA 39 15.594 4.206 -5.684 276 HB1 ALA 39 1HB ALA 39 14.658 4.682 -3.415 277 HB2 ALA 39 2HB ALA 39 14.959 2.994 -3.001 278 HB3 ALA 39 3HB ALA 39 16.307 4.054 -3.413 279 H ASP 40 H ASP 40 15.251 2.160 -7.272 280 HA ASP 40 HA ASP 40 16.083 -0.366 -6.278 281 HB2 ASP 40 2HB ASP 40 16.355 -0.979 -8.642 282 HB3 ASP 40 3HB ASP 40 14.825 -0.150 -8.369 283 H LEU 41 H LEU 41 18.014 -0.725 -5.415 284 HA LEU 41 HA LEU 41 20.404 -0.553 -6.827 285 HB2 LEU 41 2HB LEU 41 19.637 1.952 -5.961 286 HB3 LEU 41 3HB LEU 41 20.777 1.425 -4.724 287 HG LEU 41 HG LEU 41 22.125 0.839 -7.032 288 HD11 LEU 41 1HD1 LEU 41 21.956 3.058 -8.286 289 HD12 LEU 41 2HD1 LEU 41 20.392 3.244 -7.493 290 HD13 LEU 41 3HD1 LEU 41 20.683 1.868 -8.557 291 HD21 LEU 41 3HD2 LEU 41 22.147 3.114 -5.105 292 HD22 LEU 41 1HD2 LEU 41 23.203 3.171 -6.516 293 HD23 LEU 41 2HD2 LEU 41 23.343 1.843 -5.364 294 H MET 42 H MET 42 22.267 -0.151 -4.817 295 HA MET 42 HA MET 42 21.549 -2.279 -2.912 296 HB2 MET 42 2HB MET 42 24.257 -1.538 -4.032 297 HB3 MET 42 3HB MET 42 23.982 -2.765 -2.803 298 HG2 MET 42 2HG MET 42 23.267 -4.282 -4.289 299 HG3 MET 42 3HG MET 42 22.391 -3.087 -5.243 300 HE1 MET 42 3HE MET 42 25.120 -5.499 -5.134 301 HE2 MET 42 1HE MET 42 24.095 -5.564 -6.568 302 HE3 MET 42 2HE MET 42 25.822 -5.249 -6.733 303 H GLY 43 H GLY 43 21.308 -1.631 -0.882 304 HA2 GLY 43 2HA GLY 43 23.202 0.127 0.371 305 HA3 GLY 43 3HA GLY 43 21.639 0.890 0.119 306 HA PRO 44 HA PRO 44 19.947 -0.975 3.703 307 HB2 PRO 44 2HB PRO 44 17.558 -1.988 2.904 308 HB3 PRO 44 3HB PRO 44 17.864 -0.254 3.055 309 HG2 PRO 44 2HG PRO 44 17.886 -1.976 0.606 310 HG3 PRO 44 3HG PRO 44 17.198 -0.356 0.829 311 HD2 PRO 44 2HD PRO 44 19.588 -0.771 -0.375 312 HD3 PRO 44 3HD PRO 44 19.241 0.682 0.584 313 H ALA 45 H ALA 45 20.742 -2.936 1.061 314 HA ALA 45 HA ALA 45 19.868 -5.464 1.969 315 HB1 ALA 45 1HB ALA 45 21.717 -6.310 0.440 316 HB2 ALA 45 2HB ALA 45 20.461 -5.317 -0.300 317 HB3 ALA 45 3HB ALA 45 22.036 -4.615 0.071 318 H PHE 46 H PHE 46 22.979 -3.775 2.305 319 HA PHE 46 HA PHE 46 24.183 -5.842 3.852 320 HB2 PHE 46 2HB PHE 46 25.291 -3.923 2.471 321 HB3 PHE 46 3HB PHE 46 25.095 -2.985 3.948 322 HD1 PHE 46 HD1 PHE 46 27.090 -2.775 5.051 323 HD2 PHE 46 HD2 PHE 46 26.118 -6.506 3.247 324 HE1 PHE 46 HE1 PHE 46 29.168 -3.744 5.943 325 HE2 PHE 46 HE2 PHE 46 28.194 -7.481 4.136 326 HZ PHE 46 HZ PHE 46 29.722 -6.100 5.487 327 H ALA 47 H ALA 47 21.987 -3.334 4.570 328 HA ALA 47 HA ALA 47 22.690 -2.953 7.315 329 HB1 ALA 47 1HB ALA 47 19.968 -2.292 6.909 330 HB2 ALA 47 2HB ALA 47 21.352 -1.206 7.042 331 HB3 ALA 47 3HB ALA 47 20.856 -1.813 5.462 332 H ALA 48 H ALA 48 20.424 -5.016 5.576 333 HA ALA 48 HA ALA 48 19.431 -6.139 8.084 334 HB1 ALA 48 1HB ALA 48 18.593 -6.654 5.233 335 HB2 ALA 48 2HB ALA 48 17.829 -7.347 6.664 336 HB3 ALA 48 3HB ALA 48 17.776 -5.605 6.392 337 H GLY 49 H GLY 49 21.647 -6.836 5.533 338 HA2 GLY 49 2HA GLY 49 23.331 -8.477 5.673 339 HA3 GLY 49 3HA GLY 49 22.370 -9.329 6.872 340 H LEU 50 H LEU 50 20.505 -8.379 4.234 341 HA LEU 50 HA LEU 50 20.016 -11.056 3.434 342 HB2 LEU 50 2HB LEU 50 18.713 -9.970 1.582 343 HB3 LEU 50 3HB LEU 50 18.240 -9.520 3.219 344 HG LEU 50 HG LEU 50 20.032 -7.549 2.550 345 HD11 LEU 50 1HD1 LEU 50 18.748 -6.893 0.280 346 HD12 LEU 50 2HD1 LEU 50 18.822 -8.646 0.097 347 HD13 LEU 50 3HD1 LEU 50 20.306 -7.719 0.320 348 HD21 LEU 50 3HD2 LEU 50 17.197 -7.087 1.847 349 HD22 LEU 50 1HD2 LEU 50 18.267 -6.180 2.917 350 HD23 LEU 50 2HD2 LEU 50 17.525 -7.679 3.476 351 H ARG 51 H ARG 51 21.416 -12.251 2.331 352 HA ARG 51 HA ARG 51 22.619 -11.136 -0.088 353 HB2 ARG 51 2HB ARG 51 24.095 -12.149 2.293 354 HB3 ARG 51 3HB ARG 51 24.735 -12.541 0.703 355 HG2 ARG 51 2HG ARG 51 24.015 -9.730 1.013 356 HG3 ARG 51 3HG ARG 51 25.278 -10.273 2.119 357 HD2 ARG 51 2HD ARG 51 25.704 -11.293 -0.551 358 HD3 ARG 51 3HD ARG 51 25.580 -9.534 -0.550 359 HE ARG 51 HE ARG 51 27.291 -10.291 1.525 360 HH11 ARG 51 1HH1 ARG 51 27.175 -10.323 -1.954 361 HH12 ARG 51 2HH1 ARG 51 28.893 -10.208 -2.142 362 HH21 ARG 51 2HH2 ARG 51 30.246 -10.104 -0.296 363 HH22 ARG 51 1HH2 ARG 51 29.555 -10.139 1.290 364 H VAL 52 H VAL 52 23.447 -12.796 -1.548 365 HA VAL 52 HA VAL 52 21.657 -14.878 -1.970 366 HB VAL 52 HB VAL 52 23.218 -15.748 -3.617 367 HG11 VAL 52 1HG1 VAL 52 23.367 -13.839 -5.032 368 HG12 VAL 52 2HG1 VAL 52 21.916 -13.644 -4.046 369 HG13 VAL 52 3HG1 VAL 52 23.378 -12.740 -3.652 370 HG21 VAL 52 3HG2 VAL 52 25.457 -14.644 -3.865 371 HG22 VAL 52 1HG2 VAL 52 25.200 -13.916 -2.279 372 HG23 VAL 52 2HG2 VAL 52 25.291 -15.670 -2.440 373 H GLY 53 H GLY 53 21.488 -16.929 -1.275 374 HA2 GLY 53 2HA GLY 53 22.734 -18.987 -0.651 375 HA3 GLY 53 3HA GLY 53 23.675 -17.963 0.424 376 H ASP 54 H ASP 54 21.791 -16.460 1.672 377 HA ASP 54 HA ASP 54 20.768 -18.258 3.600 378 HB2 ASP 54 2HB ASP 54 20.461 -15.311 3.115 379 HB3 ASP 54 3HB ASP 54 19.500 -16.113 4.354 380 H GLN 55 H GLN 55 18.664 -18.880 4.068 381 HA GLN 55 HA GLN 55 16.843 -18.799 1.778 382 HB2 GLN 55 2HB GLN 55 16.711 -20.500 4.274 383 HB3 GLN 55 3HB GLN 55 15.688 -20.660 2.852 384 HG2 GLN 55 2HG GLN 55 17.261 -21.749 1.671 385 HG3 GLN 55 3HG GLN 55 18.584 -20.812 2.363 386 HE21 GLN 55 2HE2 GLN 55 18.604 -24.407 3.491 387 HE22 GLN 55 1HE2 GLN 55 18.414 -23.668 1.941 388 H LEU 56 H LEU 56 15.447 -17.165 1.795 389 HA LEU 56 HA LEU 56 14.591 -15.924 4.252 390 HB2 LEU 56 2HB LEU 56 13.371 -14.391 2.826 391 HB3 LEU 56 3HB LEU 56 15.030 -14.585 2.262 392 HG LEU 56 HG LEU 56 13.721 -16.426 0.738 393 HD11 LEU 56 1HD1 LEU 56 11.607 -15.270 1.832 394 HD12 LEU 56 2HD1 LEU 56 11.616 -15.795 0.149 395 HD13 LEU 56 3HD1 LEU 56 11.890 -14.099 0.544 396 HD21 LEU 56 3HD2 LEU 56 14.274 -15.064 -1.035 397 HD22 LEU 56 1HD2 LEU 56 15.332 -14.437 0.229 398 HD23 LEU 56 2HD2 LEU 56 13.841 -13.585 -0.175 399 H VAL 57 H VAL 57 12.954 -16.622 5.441 400 HA VAL 57 HA VAL 57 10.850 -18.227 4.152 401 HB VAL 57 HB VAL 57 11.552 -18.133 7.088 402 HG11 VAL 57 1HG1 VAL 57 9.225 -18.954 5.882 403 HG12 VAL 57 2HG1 VAL 57 10.134 -20.458 6.048 404 HG13 VAL 57 3HG1 VAL 57 9.799 -19.467 7.468 405 HG21 VAL 57 3HG2 VAL 57 12.645 -19.707 4.851 406 HG22 VAL 57 1HG2 VAL 57 13.366 -19.285 6.404 407 HG23 VAL 57 2HG2 VAL 57 12.224 -20.625 6.297 408 H ARG 58 H ARG 58 11.231 -15.978 6.899 409 HA ARG 58 HA ARG 58 9.869 -14.364 7.744 410 HB2 ARG 58 2HB ARG 58 10.173 -13.546 5.353 411 HB3 ARG 58 3HB ARG 58 8.593 -14.241 5.014 412 HG2 ARG 58 2HG ARG 58 7.489 -12.598 6.087 413 HG3 ARG 58 3HG ARG 58 8.724 -12.438 7.338 414 HD2 ARG 58 2HD ARG 58 9.944 -10.932 6.134 415 HD3 ARG 58 3HD ARG 58 9.433 -11.594 4.582 416 HE ARG 58 HE ARG 58 7.161 -10.506 5.519 417 HH11 ARG 58 1HH1 ARG 58 10.404 -9.274 5.222 418 HH12 ARG 58 2HH1 ARG 58 9.900 -7.632 4.997 419 HH21 ARG 58 2HH2 ARG 58 7.670 -7.106 4.998 420 HH22 ARG 58 1HH2 ARG 58 6.484 -8.348 5.223 421 H PHE 59 H PHE 59 9.028 -17.166 7.821 422 HA PHE 59 HA PHE 59 6.186 -16.696 8.352 423 HB2 PHE 59 2HB PHE 59 7.345 -18.891 6.652 424 HB3 PHE 59 3HB PHE 59 5.803 -19.096 7.478 425 HD1 PHE 59 HD1 PHE 59 7.197 -18.307 4.451 426 HD2 PHE 59 HD2 PHE 59 4.233 -16.887 7.155 427 HE1 PHE 59 HE1 PHE 59 6.059 -17.161 2.595 428 HE2 PHE 59 HE2 PHE 59 3.089 -15.739 5.304 429 HZ PHE 59 HZ PHE 59 4.001 -15.876 3.020 430 H ALA 60 H ALA 60 5.314 -17.927 10.029 431 HA ALA 60 HA ALA 60 7.186 -18.753 12.024 432 HB1 ALA 60 1HB ALA 60 5.397 -17.921 13.114 433 HB2 ALA 60 2HB ALA 60 4.267 -18.395 11.844 434 HB3 ALA 60 3HB ALA 60 4.826 -19.588 13.017 435 H GLY 61 H GLY 61 8.269 -20.610 11.802 436 HA2 GLY 61 2HA GLY 61 7.826 -23.052 12.268 437 HA3 GLY 61 3HA GLY 61 6.773 -22.978 10.864 438 H TYR 62 H TYR 62 9.337 -20.975 10.282 439 HA TYR 62 HA TYR 62 11.151 -21.089 8.915 440 HB2 TYR 62 2HB TYR 62 11.500 -23.957 9.764 441 HB3 TYR 62 3HB TYR 62 12.738 -22.792 9.310 442 HD1 TYR 62 HD1 TYR 62 11.975 -24.596 11.944 443 HD2 TYR 62 HD2 TYR 62 12.060 -20.463 10.938 444 HE1 TYR 62 HE1 TYR 62 12.303 -24.032 14.316 445 HE2 TYR 62 HE2 TYR 62 12.390 -19.887 13.307 446 HH TYR 62 HH TYR 62 12.741 -20.669 15.360 447 H THR 63 H THR 63 8.629 -21.650 7.778 448 HA THR 63 HA THR 63 9.441 -23.432 5.580 449 HB THR 63 HB THR 63 7.806 -24.679 6.817 450 HG1 THR 63 HG1 THR 63 6.382 -23.498 4.659 451 HG21 THR 63 3HG2 THR 63 6.262 -23.658 8.054 452 HG22 THR 63 1HG2 THR 63 5.450 -23.123 6.584 453 HG23 THR 63 2HG2 THR 63 6.684 -22.107 7.329 454 H VAL 64 H VAL 64 9.287 -22.556 3.612 455 HA VAL 64 HA VAL 64 7.698 -20.090 3.313 456 HB VAL 64 HB VAL 64 10.246 -19.867 3.205 457 HG11 VAL 64 1HG1 VAL 64 10.134 -20.673 0.369 458 HG12 VAL 64 2HG1 VAL 64 11.452 -20.797 1.535 459 HG13 VAL 64 3HG1 VAL 64 10.145 -21.982 1.549 460 HG21 VAL 64 3HG2 VAL 64 8.691 -18.145 2.423 461 HG22 VAL 64 1HG2 VAL 64 10.125 -18.230 1.400 462 HG23 VAL 64 2HG2 VAL 64 8.605 -18.936 0.849 463 H THR 65 H THR 65 6.769 -19.702 1.226 464 HA THR 65 HA THR 65 5.778 -22.124 0.008 465 HB THR 65 HB THR 65 4.891 -19.969 -1.535 466 HG1 THR 65 HG1 THR 65 4.691 -19.258 1.209 467 HG21 THR 65 3HG2 THR 65 2.804 -20.611 -0.807 468 HG22 THR 65 1HG2 THR 65 3.343 -20.876 0.850 469 HG23 THR 65 2HG2 THR 65 3.743 -22.048 -0.405 470 H GLU 66 H GLU 66 6.944 -19.156 -1.575 471 HA GLU 66 HA GLU 66 9.101 -20.292 -2.938 472 HB2 GLU 66 2HB GLU 66 8.048 -20.400 -5.242 473 HB3 GLU 66 3HB GLU 66 7.626 -21.703 -4.139 474 HG2 GLU 66 2HG GLU 66 5.486 -20.732 -3.704 475 HG3 GLU 66 3HG GLU 66 5.908 -19.280 -4.609 476 H LEU 67 H LEU 67 9.355 -18.956 -5.199 477 HA LEU 67 HA LEU 67 9.747 -16.284 -4.393 478 HB2 LEU 67 2HB LEU 67 10.284 -15.887 -6.790 479 HB3 LEU 67 3HB LEU 67 11.174 -17.216 -6.050 480 HG LEU 67 HG LEU 67 9.293 -18.685 -7.126 481 HD11 LEU 67 1HD1 LEU 67 9.184 -17.036 -9.442 482 HD12 LEU 67 2HD1 LEU 67 8.582 -16.115 -8.064 483 HD13 LEU 67 3HD1 LEU 67 7.856 -17.670 -8.469 484 HD21 LEU 67 3HD2 LEU 67 11.880 -18.147 -7.736 485 HD22 LEU 67 1HD2 LEU 67 11.074 -17.679 -9.234 486 HD23 LEU 67 2HD2 LEU 67 10.872 -19.312 -8.597 487 H ALA 68 H ALA 68 7.116 -17.899 -5.996 488 HA ALA 68 HA ALA 68 5.840 -15.620 -7.084 489 HB1 ALA 68 1HB ALA 68 4.249 -17.055 -7.790 490 HB2 ALA 68 2HB ALA 68 5.447 -18.268 -7.337 491 HB3 ALA 68 3HB ALA 68 4.135 -17.868 -6.229 492 H ALA 69 H ALA 69 5.468 -17.333 -4.001 493 HA ALA 69 HA ALA 69 3.341 -15.716 -3.042 494 HB1 ALA 69 1HB ALA 69 5.289 -17.243 -1.333 495 HB2 ALA 69 2HB ALA 69 3.612 -16.830 -0.974 496 HB3 ALA 69 3HB ALA 69 3.979 -18.019 -2.223 497 H PHE 70 H PHE 70 6.840 -15.501 -2.849 498 HA PHE 70 HA PHE 70 6.920 -13.448 -0.883 499 HB2 PHE 70 2HB PHE 70 8.831 -14.970 -1.455 500 HB3 PHE 70 3HB PHE 70 9.017 -14.084 -2.966 501 HD1 PHE 70 HD1 PHE 70 11.038 -12.976 -2.799 502 HD2 PHE 70 HD2 PHE 70 8.312 -12.838 0.467 503 HE1 PHE 70 HE1 PHE 70 12.486 -11.343 -1.663 504 HE2 PHE 70 HE2 PHE 70 9.756 -11.205 1.608 505 HZ PHE 70 HZ PHE 70 11.846 -10.455 0.543 506 H ASN 71 H ASN 71 6.439 -13.493 -4.311 507 HA ASN 71 HA ASN 71 7.211 -10.890 -4.981 508 HB2 ASN 71 2HB ASN 71 5.708 -13.038 -6.204 509 HB3 ASN 71 3HB ASN 71 4.967 -11.480 -6.561 510 HD21 ASN 71 2HD2 ASN 71 8.090 -10.281 -8.069 511 HD22 ASN 71 1HD2 ASN 71 7.053 -9.807 -6.771 512 H THR 72 H THR 72 4.113 -12.140 -3.800 513 HA THR 72 HA THR 72 2.772 -9.628 -3.917 514 HB THR 72 HB THR 72 1.564 -11.302 -1.946 515 HG1 THR 72 HG1 THR 72 2.642 -13.074 -2.737 516 HG21 THR 72 3HG2 THR 72 0.046 -10.105 -3.156 517 HG22 THR 72 1HG2 THR 72 -0.016 -11.611 -4.072 518 HG23 THR 72 2HG2 THR 72 0.956 -10.261 -4.659 519 H VAL 73 H VAL 73 4.591 -11.344 -1.449 520 HA VAL 73 HA VAL 73 3.865 -9.655 0.720 521 HB VAL 73 HB VAL 73 6.269 -11.451 0.369 522 HG11 VAL 73 1HG1 VAL 73 5.255 -9.935 2.761 523 HG12 VAL 73 2HG1 VAL 73 6.341 -11.320 2.892 524 HG13 VAL 73 3HG1 VAL 73 6.858 -9.871 2.029 525 HG21 VAL 73 3HG2 VAL 73 4.319 -12.782 0.338 526 HG22 VAL 73 1HG2 VAL 73 4.941 -12.884 1.985 527 HG23 VAL 73 2HG2 VAL 73 3.564 -11.843 1.626 528 H VAL 74 H VAL 74 6.584 -9.696 -1.545 529 HA VAL 74 HA VAL 74 8.136 -7.690 -0.377 530 HB VAL 74 HB VAL 74 7.841 -8.452 -3.283 531 HG11 VAL 74 1HG1 VAL 74 9.593 -6.447 -1.937 532 HG12 VAL 74 2HG1 VAL 74 10.207 -7.344 -3.327 533 HG13 VAL 74 3HG1 VAL 74 8.758 -6.350 -3.487 534 HG21 VAL 74 3HG2 VAL 74 10.360 -9.095 -2.081 535 HG22 VAL 74 1HG2 VAL 74 9.048 -9.747 -1.098 536 HG23 VAL 74 2HG2 VAL 74 9.166 -10.172 -2.806 537 H ALA 75 H ALA 75 5.384 -7.491 -2.565 538 HA ALA 75 HA ALA 75 5.568 -4.763 -3.205 539 HB1 ALA 75 1HB ALA 75 2.848 -5.842 -2.963 540 HB2 ALA 75 2HB ALA 75 3.658 -5.095 -4.341 541 HB3 ALA 75 3HB ALA 75 3.941 -6.795 -3.967 542 H ARG 76 H ARG 76 3.887 -6.432 -0.566 543 HA ARG 76 HA ARG 76 2.891 -3.962 0.543 544 HB2 ARG 76 2HB ARG 76 2.924 -6.630 1.937 545 HB3 ARG 76 3HB ARG 76 1.808 -5.291 2.168 546 HG2 ARG 76 2HG ARG 76 1.970 -7.143 -0.196 547 HG3 ARG 76 3HG ARG 76 0.670 -7.024 0.992 548 HD2 ARG 76 2HD ARG 76 0.682 -4.497 0.146 549 HD3 ARG 76 3HD ARG 76 1.323 -5.266 -1.305 550 HE ARG 76 HE ARG 76 -0.963 -6.657 -0.421 551 HH11 ARG 76 1HH1 ARG 76 -0.023 -3.657 -1.916 552 HH12 ARG 76 2HH1 ARG 76 -1.523 -3.456 -2.759 553 HH21 ARG 76 2HH2 ARG 76 -3.183 -5.019 -2.537 554 HH22 ARG 76 1HH2 ARG 76 -2.942 -6.404 -1.526 555 H HIS 77 H HIS 77 5.720 -5.882 0.830 556 HA HIS 77 HA HIS 77 6.463 -4.977 3.455 557 HB2 HIS 77 2HB HIS 77 7.307 -7.107 2.772 558 HB3 HIS 77 3HB HIS 77 7.969 -6.438 1.284 559 HD1 HIS 77 HD1 HIS 77 8.516 -4.699 4.552 560 HD2 HIS 77 HD2 HIS 77 10.575 -7.195 1.946 561 HE1 HIS 77 HE1 HIS 77 10.906 -4.661 5.333 562 H VAL 78 H VAL 78 7.631 -4.304 0.158 563 HA VAL 78 HA VAL 78 9.595 -2.471 0.675 564 HB VAL 78 HB VAL 78 8.955 -1.377 -1.506 565 HG11 VAL 78 1HG1 VAL 78 9.105 -3.806 -2.691 566 HG12 VAL 78 2HG1 VAL 78 10.486 -2.953 -1.998 567 HG13 VAL 78 3HG1 VAL 78 9.657 -4.198 -1.062 568 HG21 VAL 78 3HG2 VAL 78 6.474 -2.527 -0.954 569 HG22 VAL 78 1HG2 VAL 78 6.960 -1.701 -2.434 570 HG23 VAL 78 2HG2 VAL 78 7.120 -3.453 -2.309 571 H ARG 79 H ARG 79 9.435 -0.910 2.171 572 HA ARG 79 HA ARG 79 7.488 1.209 1.722 573 HB2 ARG 79 2HB ARG 79 7.354 -0.675 3.933 574 HB3 ARG 79 3HB ARG 79 7.500 0.985 4.495 575 HG2 ARG 79 2HG ARG 79 5.381 1.413 4.008 576 HG3 ARG 79 3HG ARG 79 5.569 0.791 2.367 577 HD2 ARG 79 2HD ARG 79 5.004 -1.386 3.004 578 HD3 ARG 79 3HD ARG 79 5.298 -1.058 4.712 579 HE ARG 79 HE ARG 79 2.863 -0.669 3.299 580 HH11 ARG 79 1HH1 ARG 79 4.830 0.645 5.854 581 HH12 ARG 79 2HH1 ARG 79 3.493 1.358 6.693 582 HH21 ARG 79 2HH2 ARG 79 1.368 1.140 5.864 583 HH22 ARG 79 1HH2 ARG 79 1.094 0.265 4.395 584 HA PRO 80 HA PRO 80 10.774 3.892 2.840 585 HB2 PRO 80 2HB PRO 80 9.483 5.893 4.144 586 HB3 PRO 80 3HB PRO 80 9.364 5.652 2.397 587 HG2 PRO 80 2HG PRO 80 7.456 4.837 4.555 588 HG3 PRO 80 3HG PRO 80 7.113 5.559 2.973 589 HD2 PRO 80 2HD PRO 80 6.843 2.908 3.454 590 HD3 PRO 80 3HD PRO 80 7.323 3.547 1.869 591 H SER 81 H SER 81 12.119 2.927 4.296 592 HA SER 81 HA SER 81 13.128 2.462 6.281 593 HB2 SER 81 2HB SER 81 11.332 4.520 7.560 594 HB3 SER 81 3HB SER 81 12.975 4.068 8.015 595 HG SER 81 HG SER 81 13.626 4.946 5.946 596 H ALA 82 H ALA 82 10.978 0.829 5.559 597 HA ALA 82 HA ALA 82 9.361 0.399 7.932 598 HB1 ALA 82 1HB ALA 82 9.348 -0.589 5.145 599 HB2 ALA 82 2HB ALA 82 8.711 -1.678 6.379 600 HB3 ALA 82 3HB ALA 82 8.013 -0.071 6.175 601 H SER 83 H SER 83 10.080 -0.762 9.581 602 HA SER 83 HA SER 83 12.059 -2.882 9.057 603 HB2 SER 83 2HB SER 83 12.224 -2.410 11.756 604 HB3 SER 83 3HB SER 83 13.284 -1.696 10.540 605 HG SER 83 HG SER 83 12.387 -0.088 11.861 606 H ILE 84 H ILE 84 11.461 -4.908 9.436 607 HA ILE 84 HA ILE 84 9.432 -5.479 11.457 608 HB ILE 84 HB ILE 84 8.014 -6.731 10.064 609 HG12 ILE 84 2HG1 ILE 84 9.733 -7.897 8.770 610 HG13 ILE 84 3HG1 ILE 84 8.505 -7.225 7.702 611 HG21 ILE 84 1HG2 ILE 84 8.840 -4.247 8.569 612 HG22 ILE 84 2HG2 ILE 84 7.352 -5.147 8.279 613 HG23 ILE 84 3HG2 ILE 84 7.620 -4.366 9.837 614 HD11 ILE 84 3HD1 ILE 84 11.325 -6.329 8.127 615 HD12 ILE 84 1HD1 ILE 84 10.502 -6.754 6.626 616 HD13 ILE 84 2HD1 ILE 84 10.113 -5.243 7.448 617 HA PRO 85 HA PRO 85 11.987 -8.935 12.361 618 HB2 PRO 85 2HB PRO 85 10.154 -10.672 13.359 619 HB3 PRO 85 3HB PRO 85 10.696 -9.237 14.237 620 HG2 PRO 85 2HG PRO 85 8.209 -9.641 12.621 621 HG3 PRO 85 3HG PRO 85 8.405 -8.844 14.193 622 HD2 PRO 85 2HD PRO 85 8.193 -7.462 11.874 623 HD3 PRO 85 3HD PRO 85 9.162 -6.884 13.245 624 H VAL 86 H VAL 86 12.768 -10.722 11.366 625 HA VAL 86 HA VAL 86 11.029 -12.238 9.564 626 HB VAL 86 HB VAL 86 13.737 -11.241 8.679 627 HG11 VAL 86 1HG1 VAL 86 13.200 -13.279 7.593 628 HG12 VAL 86 2HG1 VAL 86 11.534 -12.769 7.311 629 HG13 VAL 86 3HG1 VAL 86 12.856 -11.990 6.441 630 HG21 VAL 86 3HG2 VAL 86 10.990 -10.129 8.237 631 HG22 VAL 86 1HG2 VAL 86 12.477 -9.288 8.677 632 HG23 VAL 86 2HG2 VAL 86 12.262 -9.898 7.036 633 H VAL 87 H VAL 87 11.700 -14.363 9.169 634 HA VAL 87 HA VAL 87 13.760 -15.336 11.031 635 HB VAL 87 HB VAL 87 11.656 -16.317 11.562 636 HG11 VAL 87 1HG1 VAL 87 11.433 -16.870 8.613 637 HG12 VAL 87 2HG1 VAL 87 10.407 -17.651 9.818 638 HG13 VAL 87 3HG1 VAL 87 10.364 -15.898 9.624 639 HG21 VAL 87 3HG2 VAL 87 12.749 -18.557 9.961 640 HG22 VAL 87 1HG2 VAL 87 13.838 -17.783 11.114 641 HG23 VAL 87 2HG2 VAL 87 12.320 -18.488 11.670 642 H PHE 88 H PHE 88 15.517 -16.355 10.284 643 HA PHE 88 HA PHE 88 15.568 -17.118 7.439 644 HB2 PHE 88 2HB PHE 88 17.434 -15.444 9.016 645 HB3 PHE 88 3HB PHE 88 18.177 -16.607 7.922 646 HD1 PHE 88 HD1 PHE 88 16.778 -13.383 8.220 647 HD2 PHE 88 HD2 PHE 88 17.292 -16.600 5.481 648 HE1 PHE 88 HE1 PHE 88 16.412 -11.837 6.341 649 HE2 PHE 88 HE2 PHE 88 16.928 -15.060 3.598 650 HZ PHE 88 HZ PHE 88 16.488 -12.675 4.026 651 H SER 89 H SER 89 16.805 -18.940 6.881 652 HA SER 89 HA SER 89 17.726 -20.595 9.132 653 HB2 SER 89 2HB SER 89 15.650 -21.198 7.124 654 HB3 SER 89 3HB SER 89 16.834 -22.480 7.376 655 HG SER 89 HG SER 89 15.529 -21.198 9.531 656 H ARG 90 H ARG 90 19.451 -21.984 8.703 657 HA ARG 90 HA ARG 90 20.721 -21.709 6.066 658 HB2 ARG 90 2HB ARG 90 21.684 -20.259 8.028 659 HB3 ARG 90 3HB ARG 90 22.400 -21.780 8.543 660 HG2 ARG 90 2HG ARG 90 24.101 -21.210 7.221 661 HG3 ARG 90 3HG ARG 90 23.052 -21.715 5.894 662 HD2 ARG 90 2HD ARG 90 22.202 -19.377 5.766 663 HD3 ARG 90 3HD ARG 90 23.405 -18.923 6.972 664 HE ARG 90 HE ARG 90 23.849 -19.360 4.188 665 HH11 ARG 90 1HH1 ARG 90 25.318 -19.596 7.336 666 HH12 ARG 90 2HH1 ARG 90 26.936 -19.437 6.737 667 HH21 ARG 90 2HH2 ARG 90 27.308 -19.182 4.491 668 HH22 ARG 90 1HH2 ARG 90 25.975 -19.150 3.387 669 H ASP 91 H ASP 91 20.024 -23.789 5.515 670 HA ASP 91 HA ASP 91 20.199 -26.047 5.303 671 HB2 ASP 91 2HB ASP 91 22.634 -26.062 7.051 672 HB3 ASP 91 3HB ASP 91 22.293 -27.011 5.606 673 H GLY 92 H GLY 92 18.578 -25.050 7.385 674 HA2 GLY 92 2HA GLY 92 17.257 -26.402 8.848 675 HA3 GLY 92 3HA GLY 92 18.691 -27.351 9.210 676 H VAL 93 H VAL 93 20.025 -24.509 9.352 677 HA VAL 93 HA VAL 93 20.039 -24.360 12.176 678 HB VAL 93 HB VAL 93 20.997 -22.390 10.099 679 HG11 VAL 93 1HG1 VAL 93 22.360 -21.501 12.066 680 HG12 VAL 93 2HG1 VAL 93 20.650 -21.069 12.007 681 HG13 VAL 93 3HG1 VAL 93 21.202 -22.344 13.094 682 HG21 VAL 93 3HG2 VAL 93 22.015 -24.801 10.554 683 HG22 VAL 93 1HG2 VAL 93 23.033 -23.407 10.195 684 HG23 VAL 93 2HG2 VAL 93 22.817 -23.935 11.864 685 H VAL 94 H VAL 94 19.075 -22.941 13.588 686 HA VAL 94 HA VAL 94 16.843 -21.364 12.485 687 HB VAL 94 HB VAL 94 17.110 -22.588 15.235 688 HG11 VAL 94 1HG1 VAL 94 14.828 -21.042 14.008 689 HG12 VAL 94 2HG1 VAL 94 14.813 -21.829 15.587 690 HG13 VAL 94 3HG1 VAL 94 15.897 -20.470 15.288 691 HG21 VAL 94 3HG2 VAL 94 15.730 -23.424 12.733 692 HG22 VAL 94 1HG2 VAL 94 16.565 -24.398 13.943 693 HG23 VAL 94 2HG2 VAL 94 14.953 -23.766 14.279 694 H MET 95 H MET 95 17.285 -19.264 12.443 695 HA MET 95 HA MET 95 18.395 -18.005 14.832 696 HB2 MET 95 2HB MET 95 20.249 -18.514 13.157 697 HB3 MET 95 3HB MET 95 19.488 -17.329 12.105 698 HG2 MET 95 2HG MET 95 21.278 -16.273 13.272 699 HG3 MET 95 3HG MET 95 19.755 -15.639 13.892 700 HE1 MET 95 3HE MET 95 22.898 -17.337 14.299 701 HE2 MET 95 1HE MET 95 23.118 -16.134 15.570 702 HE3 MET 95 2HE MET 95 23.046 -17.848 15.981 703 H SER 96 H SER 96 18.006 -15.712 14.937 704 HA SER 96 HA SER 96 15.808 -14.843 13.175 705 HB2 SER 96 2HB SER 96 14.747 -13.764 15.003 706 HB3 SER 96 3HB SER 96 15.225 -15.348 15.613 707 HG SER 96 HG SER 96 17.101 -14.304 16.496 708 H ALA 97 H ALA 97 16.066 -12.977 12.120 709 HA ALA 97 HA ALA 97 18.019 -11.024 13.089 710 HB1 ALA 97 1HB ALA 97 19.517 -11.704 11.581 711 HB2 ALA 97 2HB ALA 97 18.332 -12.684 10.717 712 HB3 ALA 97 3HB ALA 97 18.464 -10.958 10.379 713 H THR 98 H THR 98 17.491 -8.928 12.667 714 HA THR 98 HA THR 98 14.812 -8.437 11.693 715 HB THR 98 HB THR 98 16.555 -6.133 12.334 716 HG1 THR 98 HG1 THR 98 15.848 -8.125 14.241 717 HG21 THR 98 3HG2 THR 98 14.396 -5.428 12.177 718 HG22 THR 98 1HG2 THR 98 14.390 -5.874 13.883 719 HG23 THR 98 2HG2 THR 98 13.736 -6.984 12.679 720 H ILE 99 H ILE 99 14.249 -7.557 9.786 721 HA ILE 99 HA ILE 99 16.429 -6.771 7.964 722 HB ILE 99 HB ILE 99 13.716 -7.742 7.089 723 HG12 ILE 99 2HG1 ILE 99 14.735 -9.537 8.379 724 HG13 ILE 99 3HG1 ILE 99 14.793 -9.934 6.665 725 HG21 ILE 99 1HG2 ILE 99 15.972 -8.228 5.342 726 HG22 ILE 99 2HG2 ILE 99 14.449 -7.403 5.015 727 HG23 ILE 99 3HG2 ILE 99 15.796 -6.516 5.728 728 HD11 ILE 99 3HD1 ILE 99 17.084 -8.803 8.252 729 HD12 ILE 99 1HD1 ILE 99 16.861 -10.506 7.852 730 HD13 ILE 99 2HD1 ILE 99 17.124 -9.325 6.568 731 H VAL 100 H VAL 100 16.504 -4.673 7.551 732 HA VAL 100 HA VAL 100 13.987 -3.136 7.580 733 HB VAL 100 HB VAL 100 16.735 -2.038 8.179 734 HG11 VAL 100 1HG1 VAL 100 13.955 -0.903 8.290 735 HG12 VAL 100 2HG1 VAL 100 15.302 -0.183 9.174 736 HG13 VAL 100 3HG1 VAL 100 15.359 -0.292 7.415 737 HG21 VAL 100 3HG2 VAL 100 14.862 -3.490 9.872 738 HG22 VAL 100 1HG2 VAL 100 16.550 -3.065 10.154 739 HG23 VAL 100 2HG2 VAL 100 15.276 -1.899 10.510 740 H VAL 101 H VAL 101 13.400 -2.692 5.561 741 HA VAL 101 HA VAL 101 15.475 -2.163 3.549 742 HB VAL 101 HB VAL 101 12.543 -2.645 3.034 743 HG11 VAL 101 1HG1 VAL 101 13.672 -3.424 0.802 744 HG12 VAL 101 2HG1 VAL 101 13.372 -1.711 1.104 745 HG13 VAL 101 3HG1 VAL 101 14.986 -2.380 1.345 746 HG21 VAL 101 3HG2 VAL 101 13.458 -4.588 4.176 747 HG22 VAL 101 1HG2 VAL 101 13.161 -4.955 2.476 748 HG23 VAL 101 2HG2 VAL 101 14.804 -4.644 3.037 749 H GLY 102 H GLY 102 15.243 -0.382 2.099 750 HA2 GLY 102 2HA GLY 102 13.496 1.773 3.111 751 HA3 GLY 102 3HA GLY 102 15.180 2.072 2.705 752 H GLU 103 H GLU 103 12.026 2.127 1.577 753 HA GLU 103 HA GLU 103 12.566 1.656 -1.201 754 HB2 GLU 103 2HB GLU 103 10.214 2.576 0.392 755 HB3 GLU 103 3HB GLU 103 10.228 2.886 -1.339 756 HG2 GLU 103 2HG GLU 103 9.143 0.718 -0.387 757 HG3 GLU 103 3HG GLU 103 10.076 0.672 -1.882 758 H LEU 104 H LEU 104 12.282 4.476 0.888 759 HA LEU 104 HA LEU 104 13.932 6.092 -0.687 760 HB2 LEU 104 2HB LEU 104 12.478 7.551 -1.801 761 HB3 LEU 104 3HB LEU 104 11.885 5.933 -2.168 762 HG LEU 104 HG LEU 104 10.687 7.772 -0.098 763 HD11 LEU 104 1HD1 LEU 104 10.197 7.428 -3.001 764 HD12 LEU 104 2HD1 LEU 104 10.034 8.858 -1.983 765 HD13 LEU 104 3HD1 LEU 104 8.793 7.606 -1.949 766 HD21 LEU 104 3HD2 LEU 104 8.760 6.086 -0.481 767 HD22 LEU 104 1HD2 LEU 104 10.109 5.628 0.559 768 HD23 LEU 104 2HD2 LEU 104 10.031 5.029 -1.098 769 H GLU 105 H GLU 105 13.661 8.501 -0.038 770 HA GLU 105 HA GLU 105 13.180 8.541 2.857 771 HB2 GLU 105 2HB GLU 105 14.685 10.396 2.977 772 HB3 GLU 105 3HB GLU 105 15.443 9.164 1.978 773 HG2 GLU 105 2HG GLU 105 14.519 10.444 -0.017 774 HG3 GLU 105 3HG GLU 105 14.195 11.751 1.121 Start of MODEL 14 1 HA PRO 1 HA PRO 1 1.188 0.547 -1.196 2 HB2 PRO 1 2HB PRO 1 3.709 -0.449 -1.047 3 HB3 PRO 1 3HB PRO 1 3.243 1.096 -0.327 4 HG2 PRO 1 2HG PRO 1 3.554 -1.582 0.974 5 HG3 PRO 1 3HG PRO 1 4.080 0.010 1.551 6 HD2 PRO 1 2HD PRO 1 1.832 -1.199 2.456 7 HD3 PRO 1 3HD PRO 1 1.978 0.565 2.318 8 H LEU 2 H LEU 2 2.581 -0.785 -2.908 9 HA LEU 2 HA LEU 2 2.307 -3.617 -2.867 10 HB2 LEU 2 2HB LEU 2 0.008 -2.195 -3.603 11 HB3 LEU 2 3HB LEU 2 0.703 -2.791 -5.109 12 HG LEU 2 HG LEU 2 0.160 -4.598 -2.767 13 HD11 LEU 2 1HD1 LEU 2 -1.721 -4.618 -5.026 14 HD12 LEU 2 2HD1 LEU 2 -1.829 -3.217 -3.961 15 HD13 LEU 2 3HD1 LEU 2 -2.009 -4.842 -3.300 16 HD21 LEU 2 3HD2 LEU 2 -0.050 -6.189 -4.820 17 HD22 LEU 2 1HD2 LEU 2 1.544 -5.731 -4.221 18 HD23 LEU 2 2HD2 LEU 2 0.877 -4.936 -5.647 19 H THR 3 H THR 3 3.184 -4.625 -4.751 20 HA THR 3 HA THR 3 4.579 -2.792 -6.585 21 HB THR 3 HB THR 3 6.110 -3.735 -4.811 22 HG1 THR 3 HG1 THR 3 7.478 -3.339 -6.366 23 HG21 THR 3 3HG2 THR 3 6.336 -6.293 -6.223 24 HG22 THR 3 1HG2 THR 3 4.834 -6.101 -5.320 25 HG23 THR 3 2HG2 THR 3 6.385 -5.944 -4.495 26 H ARG 4 H ARG 4 5.415 -3.964 -8.554 27 HA ARG 4 HA ARG 4 3.261 -5.565 -9.638 28 HB2 ARG 4 2HB ARG 4 4.577 -5.376 -11.766 29 HB3 ARG 4 3HB ARG 4 4.101 -3.837 -11.060 30 HG2 ARG 4 2HG ARG 4 6.231 -3.226 -10.608 31 HG3 ARG 4 3HG ARG 4 6.756 -4.881 -10.294 32 HD2 ARG 4 2HD ARG 4 7.544 -5.077 -12.363 33 HD3 ARG 4 3HD ARG 4 5.988 -4.602 -13.043 34 HE ARG 4 HE ARG 4 7.339 -2.313 -12.129 35 HH11 ARG 4 1HH1 ARG 4 7.510 -4.715 -14.643 36 HH12 ARG 4 2HH1 ARG 4 8.284 -3.660 -15.778 37 HH21 ARG 4 2HH2 ARG 4 8.766 -1.499 -15.192 38 HH22 ARG 4 1HH2 ARG 4 8.358 -0.914 -13.615 39 HA PRO 5 HA PRO 5 5.113 -9.527 -9.274 40 HB2 PRO 5 2HB PRO 5 4.267 -10.726 -11.559 41 HB3 PRO 5 3HB PRO 5 3.191 -10.382 -10.199 42 HG2 PRO 5 2HG PRO 5 3.578 -8.852 -12.743 43 HG3 PRO 5 3HG PRO 5 2.072 -9.254 -11.897 44 HD2 PRO 5 2HD PRO 5 3.240 -6.818 -11.714 45 HD3 PRO 5 3HD PRO 5 2.320 -7.539 -10.378 46 H TYR 6 H TYR 6 7.283 -8.481 -9.549 47 HA TYR 6 HA TYR 6 8.515 -9.354 -12.080 48 HB2 TYR 6 2HB TYR 6 8.359 -6.822 -11.671 49 HB3 TYR 6 3HB TYR 6 9.570 -7.072 -10.419 50 HD1 TYR 6 HD1 TYR 6 9.029 -6.447 -13.865 51 HD2 TYR 6 HD2 TYR 6 11.749 -8.281 -11.156 52 HE1 TYR 6 HE1 TYR 6 10.802 -6.313 -15.564 53 HE2 TYR 6 HE2 TYR 6 13.530 -8.151 -12.847 54 HH TYR 6 HH TYR 6 14.125 -7.214 -14.827 55 H LEU 7 H LEU 7 10.209 -10.694 -11.921 56 HA LEU 7 HA LEU 7 11.305 -11.196 -9.233 57 HB2 LEU 7 2HB LEU 7 11.895 -13.465 -10.204 58 HB3 LEU 7 3HB LEU 7 10.193 -13.148 -9.873 59 HG LEU 7 HG LEU 7 11.131 -12.602 -12.627 60 HD11 LEU 7 1HD1 LEU 7 10.573 -15.183 -12.949 61 HD12 LEU 7 2HD1 LEU 7 11.285 -15.263 -11.338 62 HD13 LEU 7 3HD1 LEU 7 12.214 -14.594 -12.679 63 HD21 LEU 7 3HD2 LEU 7 8.734 -14.179 -11.779 64 HD22 LEU 7 1HD2 LEU 7 8.959 -13.160 -13.201 65 HD23 LEU 7 2HD2 LEU 7 8.755 -12.423 -11.611 66 H GLY 8 H GLY 8 13.466 -11.104 -8.927 67 HA2 GLY 8 2HA GLY 8 15.156 -10.734 -11.322 68 HA3 GLY 8 3HA GLY 8 15.320 -9.700 -9.910 69 H PHE 9 H PHE 9 14.596 -12.995 -9.301 70 HA PHE 9 HA PHE 9 17.382 -13.779 -9.058 71 HB2 PHE 9 2HB PHE 9 17.308 -14.252 -6.709 72 HB3 PHE 9 3HB PHE 9 16.789 -12.584 -6.926 73 HD1 PHE 9 HD1 PHE 9 14.154 -12.332 -7.246 74 HD2 PHE 9 HD2 PHE 9 16.102 -15.559 -5.268 75 HE1 PHE 9 HE1 PHE 9 12.086 -12.813 -6.003 76 HE2 PHE 9 HE2 PHE 9 14.037 -16.046 -4.023 77 HZ PHE 9 HZ PHE 9 12.025 -14.673 -4.390 78 H ARG 10 H ARG 10 17.482 -16.085 -8.093 79 HA ARG 10 HA ARG 10 15.260 -17.638 -9.246 80 HB2 ARG 10 2HB ARG 10 16.993 -19.459 -9.515 81 HB3 ARG 10 3HB ARG 10 17.207 -18.049 -10.543 82 HG2 ARG 10 2HG ARG 10 18.636 -17.640 -8.110 83 HG3 ARG 10 3HG ARG 10 19.060 -19.219 -8.777 84 HD2 ARG 10 2HD ARG 10 20.497 -17.332 -9.567 85 HD3 ARG 10 3HD ARG 10 19.714 -18.249 -10.854 86 HE ARG 10 HE ARG 10 18.260 -15.908 -10.011 87 HH11 ARG 10 1HH1 ARG 10 20.699 -17.175 -12.148 88 HH12 ARG 10 2HH1 ARG 10 20.522 -15.906 -13.314 89 HH21 ARG 10 2HH2 ARG 10 18.998 -14.232 -12.966 90 HH22 ARG 10 1HH2 ARG 10 18.018 -14.232 -11.538 91 H VAL 11 H VAL 11 14.738 -19.664 -8.220 92 HA VAL 11 HA VAL 11 15.609 -19.893 -5.423 93 HB VAL 11 HB VAL 11 13.229 -20.512 -4.832 94 HG11 VAL 11 1HG1 VAL 11 12.591 -17.883 -5.231 95 HG12 VAL 11 2HG1 VAL 11 13.563 -18.504 -3.895 96 HG13 VAL 11 3HG1 VAL 11 14.351 -17.859 -5.336 97 HG21 VAL 11 3HG2 VAL 11 12.838 -20.367 -7.559 98 HG22 VAL 11 1HG2 VAL 11 11.575 -20.441 -6.330 99 HG23 VAL 11 2HG2 VAL 11 12.102 -18.881 -6.960 100 H ALA 12 H ALA 12 15.821 -21.951 -4.662 101 HA ALA 12 HA ALA 12 15.117 -24.133 -6.515 102 HB1 ALA 12 1HB ALA 12 17.481 -23.891 -6.610 103 HB2 ALA 12 2HB ALA 12 17.605 -23.807 -4.852 104 HB3 ALA 12 3HB ALA 12 17.142 -25.319 -5.632 105 H VAL 13 H VAL 13 13.719 -25.533 -5.690 106 HA VAL 13 HA VAL 13 13.052 -25.479 -2.887 107 HB VAL 13 HB VAL 13 11.337 -25.763 -4.676 108 HG11 VAL 13 1HG1 VAL 13 11.166 -27.645 -5.991 109 HG12 VAL 13 2HG1 VAL 13 12.918 -27.449 -5.900 110 HG13 VAL 13 3HG1 VAL 13 12.108 -28.639 -4.880 111 HG21 VAL 13 3HG2 VAL 13 10.815 -26.364 -2.390 112 HG22 VAL 13 1HG2 VAL 13 10.061 -27.514 -3.494 113 HG23 VAL 13 2HG2 VAL 13 11.525 -27.962 -2.618 114 H GLY 14 H GLY 14 13.592 -26.919 -1.341 115 HA2 GLY 14 2HA GLY 14 14.564 -29.551 -1.952 116 HA3 GLY 14 3HA GLY 14 15.847 -28.463 -1.443 117 H ARG 15 H ARG 15 16.138 -29.929 0.354 118 HA ARG 15 HA ARG 15 14.237 -29.357 2.527 119 HB2 ARG 15 2HB ARG 15 15.693 -31.983 2.271 120 HB3 ARG 15 3HB ARG 15 14.356 -31.582 3.340 121 HG2 ARG 15 2HG ARG 15 14.167 -31.741 0.339 122 HG3 ARG 15 3HG ARG 15 13.700 -33.026 1.455 123 HD2 ARG 15 2HD ARG 15 11.787 -31.992 2.044 124 HD3 ARG 15 3HD ARG 15 12.528 -30.393 2.026 125 HE ARG 15 HE ARG 15 11.794 -30.119 -0.123 126 HH11 ARG 15 1HH1 ARG 15 11.630 -33.494 0.713 127 HH12 ARG 15 2HH1 ARG 15 10.793 -33.946 -0.735 128 HH21 ARG 15 2HH2 ARG 15 10.262 -32.357 -2.297 129 HH22 ARG 15 1HH2 ARG 15 10.693 -30.701 -2.034 130 H ASP 16 H ASP 16 15.116 -29.049 4.563 131 HA ASP 16 HA ASP 16 18.000 -28.528 4.579 132 HB2 ASP 16 2HB ASP 16 16.239 -27.729 6.850 133 HB3 ASP 16 3HB ASP 16 17.631 -26.897 6.161 134 H SER 17 H SER 17 18.732 -28.676 7.122 135 HA SER 17 HA SER 17 18.955 -31.472 7.583 136 HB2 SER 17 2HB SER 17 20.647 -29.628 8.173 137 HB3 SER 17 3HB SER 17 19.652 -29.342 9.601 138 HG SER 17 HG SER 17 21.528 -31.140 9.324 139 H SER 18 H SER 18 16.826 -28.997 8.744 140 HA SER 18 HA SER 18 15.870 -30.574 10.978 141 HB2 SER 18 2HB SER 18 15.806 -28.291 11.472 142 HB3 SER 18 3HB SER 18 15.213 -27.861 9.868 143 HG SER 18 HG SER 18 13.823 -28.526 12.112 144 H GLY 19 H GLY 19 14.554 -29.378 7.893 145 HA2 GLY 19 2HA GLY 19 13.229 -30.777 6.472 146 HA3 GLY 19 3HA GLY 19 12.724 -31.681 7.892 147 H CYS 20 H CYS 20 12.647 -28.273 6.831 148 HA CYS 20 HA CYS 20 9.842 -28.179 7.725 149 HB2 CYS 20 2HB CYS 20 11.964 -26.036 7.639 150 HB3 CYS 20 3HB CYS 20 10.256 -25.667 7.842 151 HG CYS 20 HG CYS 20 12.292 -26.071 10.185 152 H THR 21 H THR 21 11.768 -28.270 5.026 153 HA THR 21 HA THR 21 11.370 -27.968 2.804 154 HB THR 21 HB THR 21 8.517 -27.227 3.373 155 HG1 THR 21 HG1 THR 21 8.227 -29.094 4.307 156 HG21 THR 21 3HG2 THR 21 10.068 -27.952 1.080 157 HG22 THR 21 1HG2 THR 21 8.375 -27.464 1.163 158 HG23 THR 21 2HG2 THR 21 8.813 -29.164 1.338 159 H THR 22 H THR 22 12.656 -26.128 2.632 160 HA THR 22 HA THR 22 11.157 -23.652 2.201 161 HB THR 22 HB THR 22 11.920 -23.046 4.289 162 HG1 THR 22 HG1 THR 22 12.905 -21.750 2.475 163 HG21 THR 22 3HG2 THR 22 13.137 -24.793 5.141 164 HG22 THR 22 1HG2 THR 22 14.432 -23.624 4.882 165 HG23 THR 22 2HG2 THR 22 14.164 -24.918 3.713 166 H LEU 23 H LEU 23 12.143 -22.193 0.748 167 HA LEU 23 HA LEU 23 14.036 -23.482 -1.063 168 HB2 LEU 23 2HB LEU 23 12.314 -21.027 -1.332 169 HB3 LEU 23 3HB LEU 23 13.467 -21.549 -2.558 170 HG LEU 23 HG LEU 23 12.129 -23.752 -2.570 171 HD11 LEU 23 1HD1 LEU 23 9.669 -23.218 -2.053 172 HD12 LEU 23 2HD1 LEU 23 10.313 -21.927 -1.039 173 HD13 LEU 23 3HD1 LEU 23 10.743 -23.605 -0.708 174 HD21 LEU 23 3HD2 LEU 23 11.477 -21.132 -3.773 175 HD22 LEU 23 1HD2 LEU 23 10.259 -22.398 -3.922 176 HD23 LEU 23 2HD2 LEU 23 11.889 -22.666 -4.541 177 H SER 24 H SER 24 15.806 -22.215 -1.987 178 HA SER 24 HA SER 24 16.905 -20.291 -0.042 179 HB2 SER 24 2HB SER 24 17.986 -22.696 -0.475 180 HB3 SER 24 3HB SER 24 18.747 -21.827 -1.808 181 HG SER 24 HG SER 24 19.898 -20.694 -0.430 182 H ILE 25 H ILE 25 18.081 -18.527 -0.842 183 HA ILE 25 HA ILE 25 17.336 -17.762 -3.559 184 HB ILE 25 HB ILE 25 18.670 -16.067 -1.449 185 HG12 ILE 25 2HG1 ILE 25 16.104 -15.159 -1.616 186 HG13 ILE 25 3HG1 ILE 25 15.864 -16.890 -1.828 187 HG21 ILE 25 1HG2 ILE 25 16.990 -14.852 -3.532 188 HG22 ILE 25 2HG2 ILE 25 18.537 -14.328 -2.869 189 HG23 ILE 25 3HG2 ILE 25 18.488 -15.586 -4.104 190 HD11 ILE 25 3HD1 ILE 25 16.873 -17.362 0.271 191 HD12 ILE 25 1HD1 ILE 25 17.406 -15.691 0.455 192 HD13 ILE 25 2HD1 ILE 25 15.687 -16.081 0.519 193 H GLN 26 H GLN 26 18.733 -17.603 -5.203 194 HA GLN 26 HA GLN 26 21.568 -18.133 -4.634 195 HB2 GLN 26 2HB GLN 26 19.724 -18.952 -6.772 196 HB3 GLN 26 3HB GLN 26 21.309 -18.443 -7.338 197 HG2 GLN 26 2HG GLN 26 22.399 -20.158 -6.248 198 HG3 GLN 26 3HG GLN 26 21.089 -20.393 -5.092 199 HE21 GLN 26 2HE2 GLN 26 19.058 -22.084 -7.627 200 HE22 GLN 26 1HE2 GLN 26 18.911 -20.711 -6.590 201 H GLU 27 H GLU 27 19.371 -15.800 -5.872 202 HA GLU 27 HA GLU 27 21.625 -14.171 -6.848 203 HB2 GLU 27 2HB GLU 27 19.252 -14.877 -8.157 204 HB3 GLU 27 3HB GLU 27 19.027 -13.201 -7.677 205 HG2 GLU 27 2HG GLU 27 19.950 -13.155 -9.840 206 HG3 GLU 27 3HG GLU 27 21.252 -12.710 -8.738 207 H VAL 28 H VAL 28 20.458 -11.712 -6.938 208 HA VAL 28 HA VAL 28 19.829 -11.178 -4.107 209 HB VAL 28 HB VAL 28 21.100 -9.177 -5.960 210 HG11 VAL 28 1HG1 VAL 28 21.418 -9.325 -2.990 211 HG12 VAL 28 2HG1 VAL 28 21.529 -7.926 -4.061 212 HG13 VAL 28 3HG1 VAL 28 19.956 -8.633 -3.692 213 HG21 VAL 28 3HG2 VAL 28 22.572 -11.107 -5.924 214 HG22 VAL 28 1HG2 VAL 28 23.273 -9.791 -4.981 215 HG23 VAL 28 2HG2 VAL 28 22.506 -11.151 -4.162 216 H THR 29 H THR 29 17.849 -10.447 -3.760 217 HA THR 29 HA THR 29 16.513 -8.917 -5.899 218 HB THR 29 HB THR 29 15.395 -11.035 -5.712 219 HG1 THR 29 HG1 THR 29 14.058 -9.130 -5.855 220 HG21 THR 29 3HG2 THR 29 14.574 -11.963 -3.681 221 HG22 THR 29 1HG2 THR 29 14.942 -10.493 -2.782 222 HG23 THR 29 2HG2 THR 29 16.251 -11.509 -3.383 223 H GLN 30 H GLN 30 17.717 -8.840 -2.776 224 HA GLN 30 HA GLN 30 15.784 -7.005 -1.670 225 HB2 GLN 30 2HB GLN 30 18.528 -7.747 -0.641 226 HB3 GLN 30 3HB GLN 30 17.269 -6.913 0.260 227 HG2 GLN 30 2HG GLN 30 16.538 -9.531 -0.883 228 HG3 GLN 30 3HG GLN 30 17.718 -9.545 0.428 229 HE21 GLN 30 2HE2 GLN 30 14.948 -9.731 2.537 230 HE22 GLN 30 1HE2 GLN 30 16.292 -10.557 1.832 231 H THR 31 H THR 31 18.020 -6.650 -3.999 232 HA THR 31 HA THR 31 18.737 -3.911 -3.186 233 HB THR 31 HB THR 31 20.403 -4.234 -5.209 234 HG1 THR 31 HG1 THR 31 20.919 -6.312 -5.622 235 HG21 THR 31 3HG2 THR 31 21.314 -5.777 -2.864 236 HG22 THR 31 1HG2 THR 31 20.682 -4.167 -2.524 237 HG23 THR 31 2HG2 THR 31 22.032 -4.366 -3.642 238 H TYR 32 H TYR 32 16.275 -5.072 -4.596 239 HA TYR 32 HA TYR 32 16.356 -3.264 -6.922 240 HB2 TYR 32 2HB TYR 32 15.386 -6.042 -6.653 241 HB3 TYR 32 3HB TYR 32 14.329 -4.956 -7.549 242 HD1 TYR 32 HD1 TYR 32 17.908 -6.006 -7.372 243 HD2 TYR 32 HD2 TYR 32 14.702 -4.641 -9.814 244 HE1 TYR 32 HE1 TYR 32 19.313 -6.298 -9.370 245 HE2 TYR 32 HE2 TYR 32 16.097 -4.930 -11.818 246 HH TYR 32 HH TYR 32 18.958 -6.673 -11.831 247 H THR 33 H THR 33 14.539 -2.001 -7.333 248 HA THR 33 HA THR 33 12.258 -2.135 -5.547 249 HB THR 33 HB THR 33 13.834 0.436 -5.678 250 HG1 THR 33 HG1 THR 33 14.663 -0.093 -3.685 251 HG21 THR 33 3HG2 THR 33 12.397 0.970 -3.687 252 HG22 THR 33 1HG2 THR 33 11.481 -0.495 -4.035 253 HG23 THR 33 2HG2 THR 33 11.521 0.820 -5.210 254 H GLY 34 H GLY 34 10.488 -0.783 -6.223 255 HA2 GLY 34 2HA GLY 34 10.706 0.705 -8.687 256 HA3 GLY 34 3HA GLY 34 9.848 -0.819 -8.858 257 H SER 35 H SER 35 8.646 -0.758 -6.237 258 HA SER 35 HA SER 35 6.614 1.303 -6.753 259 HB2 SER 35 2HB SER 35 6.495 -1.494 -5.920 260 HB3 SER 35 3HB SER 35 5.538 -0.436 -4.882 261 HG SER 35 HG SER 35 4.820 0.425 -7.091 262 H ASN 36 H ASN 36 5.746 2.514 -5.025 263 HA ASN 36 HA ASN 36 5.943 3.862 -3.200 264 HB2 ASN 36 2HB ASN 36 5.749 1.265 -2.317 265 HB3 ASN 36 3HB ASN 36 7.184 1.840 -1.474 266 HD21 ASN 36 2HD2 ASN 36 3.712 3.907 -0.812 267 HD22 ASN 36 1HD2 ASN 36 4.121 3.371 -2.402 268 H GLY 37 H GLY 37 8.211 3.748 -5.012 269 HA2 GLY 37 2HA GLY 37 10.031 5.350 -3.662 270 HA3 GLY 37 3HA GLY 37 10.649 3.708 -3.556 271 H GLY 38 H GLY 38 10.694 2.520 -5.725 272 HA2 GLY 38 2HA GLY 38 11.308 2.422 -7.953 273 HA3 GLY 38 3HA GLY 38 10.945 4.137 -8.088 274 H ALA 39 H ALA 39 13.374 1.834 -6.942 275 HA ALA 39 HA ALA 39 15.529 3.187 -8.105 276 HB1 ALA 39 1HB ALA 39 14.691 4.286 -5.584 277 HB2 ALA 39 2HB ALA 39 16.326 3.636 -5.462 278 HB3 ALA 39 3HB ALA 39 15.948 4.845 -6.689 279 H ASP 40 H ASP 40 16.104 1.096 -8.666 280 HA ASP 40 HA ASP 40 16.542 -0.906 -6.629 281 HB2 ASP 40 2HB ASP 40 17.218 -2.350 -8.490 282 HB3 ASP 40 3HB ASP 40 15.686 -1.554 -8.840 283 H LEU 41 H LEU 41 18.312 -0.943 -5.426 284 HA LEU 41 HA LEU 41 20.922 -0.803 -6.575 285 HB2 LEU 41 2HB LEU 41 19.896 1.641 -6.034 286 HB3 LEU 41 3HB LEU 41 20.658 1.260 -4.491 287 HG LEU 41 HG LEU 41 22.665 0.670 -6.222 288 HD11 LEU 41 1HD1 LEU 41 22.712 2.758 -7.709 289 HD12 LEU 41 2HD1 LEU 41 20.967 2.807 -7.460 290 HD13 LEU 41 3HD1 LEU 41 21.710 1.399 -8.218 291 HD21 LEU 41 3HD2 LEU 41 23.142 1.944 -4.335 292 HD22 LEU 41 1HD2 LEU 41 21.939 3.169 -4.737 293 HD23 LEU 41 2HD2 LEU 41 23.435 3.066 -5.664 294 H MET 42 H MET 42 22.453 -0.284 -4.368 295 HA MET 42 HA MET 42 21.582 -2.381 -2.491 296 HB2 MET 42 2HB MET 42 23.595 -2.909 -3.878 297 HB3 MET 42 3HB MET 42 24.417 -1.549 -3.125 298 HG2 MET 42 2HG MET 42 23.984 -2.674 -0.910 299 HG3 MET 42 3HG MET 42 23.478 -4.089 -1.830 300 HE1 MET 42 3HE MET 42 24.816 -5.107 -3.642 301 HE2 MET 42 1HE MET 42 25.928 -3.938 -4.356 302 HE3 MET 42 2HE MET 42 26.558 -5.371 -3.544 303 H GLY 43 H GLY 43 21.187 -1.766 -0.471 304 HA2 GLY 43 2HA GLY 43 22.791 0.201 0.871 305 HA3 GLY 43 3HA GLY 43 21.186 0.799 0.478 306 HA PRO 44 HA PRO 44 19.440 -1.113 4.009 307 HB2 PRO 44 2HB PRO 44 17.158 -2.262 3.089 308 HB3 PRO 44 3HB PRO 44 17.359 -0.512 3.242 309 HG2 PRO 44 2HG PRO 44 17.610 -2.241 0.812 310 HG3 PRO 44 3HG PRO 44 16.823 -0.662 0.984 311 HD2 PRO 44 2HD PRO 44 19.294 -0.949 -0.084 312 HD3 PRO 44 3HD PRO 44 18.816 0.488 0.844 313 H ALA 45 H ALA 45 19.600 -3.251 1.193 314 HA ALA 45 HA ALA 45 19.255 -5.685 2.572 315 HB1 ALA 45 1HB ALA 45 20.180 -6.739 0.571 316 HB2 ALA 45 2HB ALA 45 18.993 -5.502 0.155 317 HB3 ALA 45 3HB ALA 45 20.715 -5.163 -0.015 318 H PHE 46 H PHE 46 22.153 -3.844 1.702 319 HA PHE 46 HA PHE 46 24.022 -5.748 2.637 320 HB2 PHE 46 2HB PHE 46 24.357 -3.650 1.117 321 HB3 PHE 46 3HB PHE 46 24.591 -2.802 2.643 322 HD1 PHE 46 HD1 PHE 46 26.780 -2.464 3.198 323 HD2 PHE 46 HD2 PHE 46 25.710 -6.042 1.156 324 HE1 PHE 46 HE1 PHE 46 29.131 -3.188 3.240 325 HE2 PHE 46 HE2 PHE 46 28.059 -6.772 1.196 326 HZ PHE 46 HZ PHE 46 29.773 -5.344 2.239 327 H ALA 47 H ALA 47 22.096 -3.348 4.223 328 HA ALA 47 HA ALA 47 23.655 -3.181 6.613 329 HB1 ALA 47 1HB ALA 47 22.360 -1.385 6.796 330 HB2 ALA 47 2HB ALA 47 21.242 -1.991 5.574 331 HB3 ALA 47 3HB ALA 47 21.044 -2.463 7.262 332 H ALA 48 H ALA 48 20.881 -5.091 5.567 333 HA ALA 48 HA ALA 48 20.579 -6.346 8.155 334 HB1 ALA 48 1HB ALA 48 19.145 -7.776 6.183 335 HB2 ALA 48 2HB ALA 48 18.518 -6.666 7.403 336 HB3 ALA 48 3HB ALA 48 18.984 -6.059 5.814 337 H GLY 49 H GLY 49 22.305 -6.924 5.226 338 HA2 GLY 49 2HA GLY 49 24.085 -8.462 5.048 339 HA3 GLY 49 3HA GLY 49 23.398 -9.376 6.383 340 H LEU 50 H LEU 50 21.153 -8.444 3.994 341 HA LEU 50 HA LEU 50 20.552 -11.133 3.322 342 HB2 LEU 50 2HB LEU 50 19.695 -8.707 1.770 343 HB3 LEU 50 3HB LEU 50 18.866 -10.256 1.912 344 HG LEU 50 HG LEU 50 19.250 -8.617 4.370 345 HD11 LEU 50 1HD1 LEU 50 17.993 -6.912 3.719 346 HD12 LEU 50 2HD1 LEU 50 16.737 -8.005 3.139 347 HD13 LEU 50 3HD1 LEU 50 18.059 -7.536 2.071 348 HD21 LEU 50 3HD2 LEU 50 17.610 -10.847 3.432 349 HD22 LEU 50 1HD2 LEU 50 16.708 -9.617 4.318 350 HD23 LEU 50 2HD2 LEU 50 18.097 -10.403 5.068 351 H ARG 51 H ARG 51 21.831 -12.363 2.113 352 HA ARG 51 HA ARG 51 22.724 -11.341 -0.474 353 HB2 ARG 51 2HB ARG 51 24.470 -11.931 1.783 354 HB3 ARG 51 3HB ARG 51 24.884 -12.872 0.356 355 HG2 ARG 51 2HG ARG 51 24.494 -10.321 -0.632 356 HG3 ARG 51 3HG ARG 51 25.304 -10.063 0.915 357 HD2 ARG 51 2HD ARG 51 26.855 -12.003 0.051 358 HD3 ARG 51 3HD ARG 51 26.262 -11.481 -1.525 359 HE ARG 51 HE ARG 51 28.088 -10.074 0.199 360 HH11 ARG 51 1HH1 ARG 51 25.796 -9.791 -2.406 361 HH12 ARG 51 2HH1 ARG 51 26.478 -8.322 -3.021 362 HH21 ARG 51 2HH2 ARG 51 28.298 -7.384 -1.994 363 HH22 ARG 51 1HH2 ARG 51 28.995 -8.139 -0.601 364 H VAL 52 H VAL 52 23.914 -13.290 -1.646 365 HA VAL 52 HA VAL 52 21.951 -15.302 -1.989 366 HB VAL 52 HB VAL 52 23.500 -16.337 -3.555 367 HG11 VAL 52 1HG1 VAL 52 23.314 -13.338 -3.667 368 HG12 VAL 52 2HG1 VAL 52 23.969 -14.302 -4.992 369 HG13 VAL 52 3HG1 VAL 52 22.297 -14.529 -4.477 370 HG21 VAL 52 3HG2 VAL 52 25.654 -16.312 -2.918 371 HG22 VAL 52 1HG2 VAL 52 25.709 -14.758 -3.750 372 HG23 VAL 52 2HG2 VAL 52 25.469 -14.815 -2.003 373 H GLY 53 H GLY 53 21.739 -17.283 -1.127 374 HA2 GLY 53 2HA GLY 53 23.035 -19.295 -0.353 375 HA3 GLY 53 3HA GLY 53 23.866 -18.178 0.719 376 H ASP 54 H ASP 54 21.997 -16.710 1.875 377 HA ASP 54 HA ASP 54 20.803 -18.477 3.731 378 HB2 ASP 54 2HB ASP 54 20.352 -15.525 3.253 379 HB3 ASP 54 3HB ASP 54 19.718 -16.418 4.633 380 H GLN 55 H GLN 55 18.551 -18.754 4.205 381 HA GLN 55 HA GLN 55 16.895 -18.696 1.778 382 HB2 GLN 55 2HB GLN 55 16.550 -20.372 4.270 383 HB3 GLN 55 3HB GLN 55 15.587 -20.484 2.803 384 HG2 GLN 55 2HG GLN 55 17.373 -21.380 1.570 385 HG3 GLN 55 3HG GLN 55 18.552 -20.932 2.802 386 HE21 GLN 55 2HE2 GLN 55 16.126 -24.170 3.449 387 HE22 GLN 55 1HE2 GLN 55 15.574 -22.841 2.494 388 H LEU 56 H LEU 56 15.087 -17.511 1.701 389 HA LEU 56 HA LEU 56 14.404 -15.904 4.034 390 HB2 LEU 56 2HB LEU 56 13.173 -14.516 2.552 391 HB3 LEU 56 3HB LEU 56 14.716 -14.882 1.784 392 HG LEU 56 HG LEU 56 13.219 -16.797 0.663 393 HD11 LEU 56 1HD1 LEU 56 11.200 -14.703 0.433 394 HD12 LEU 56 2HD1 LEU 56 11.291 -15.428 2.038 395 HD13 LEU 56 3HD1 LEU 56 11.014 -16.447 0.625 396 HD21 LEU 56 3HD2 LEU 56 14.000 -15.663 -1.076 397 HD22 LEU 56 1HD2 LEU 56 14.235 -14.230 -0.075 398 HD23 LEU 56 2HD2 LEU 56 12.689 -14.499 -0.880 399 H VAL 57 H VAL 57 12.716 -16.309 5.301 400 HA VAL 57 HA VAL 57 10.627 -18.138 4.306 401 HB VAL 57 HB VAL 57 11.669 -17.888 7.132 402 HG11 VAL 57 1HG1 VAL 57 10.051 -20.162 6.858 403 HG12 VAL 57 2HG1 VAL 57 9.706 -18.701 7.785 404 HG13 VAL 57 3HG1 VAL 57 9.157 -18.837 6.114 405 HG21 VAL 57 3HG2 VAL 57 12.788 -19.271 5.064 406 HG22 VAL 57 1HG2 VAL 57 12.960 -19.687 6.770 407 HG23 VAL 57 2HG2 VAL 57 11.736 -20.489 5.785 408 H ARG 58 H ARG 58 11.200 -15.702 6.853 409 HA ARG 58 HA ARG 58 9.833 -14.132 7.781 410 HB2 ARG 58 2HB ARG 58 10.143 -13.392 5.314 411 HB3 ARG 58 3HB ARG 58 8.473 -13.904 5.113 412 HG2 ARG 58 2HG ARG 58 8.340 -12.335 7.352 413 HG3 ARG 58 3HG ARG 58 9.562 -11.517 6.377 414 HD2 ARG 58 2HD ARG 58 7.818 -10.556 5.352 415 HD3 ARG 58 3HD ARG 58 7.659 -12.099 4.514 416 HE ARG 58 HE ARG 58 5.715 -12.458 5.654 417 HH11 ARG 58 1HH1 ARG 58 7.562 -10.030 7.332 418 HH12 ARG 58 2HH1 ARG 58 6.311 -9.684 8.478 419 HH21 ARG 58 2HH2 ARG 58 4.319 -10.811 8.379 420 HH22 ARG 58 1HH2 ARG 58 4.059 -12.010 7.157 421 H PHE 59 H PHE 59 8.915 -16.924 7.796 422 HA PHE 59 HA PHE 59 6.115 -16.381 8.425 423 HB2 PHE 59 2HB PHE 59 7.076 -18.545 6.555 424 HB3 PHE 59 3HB PHE 59 5.509 -18.612 7.354 425 HD1 PHE 59 HD1 PHE 59 4.436 -15.989 7.198 426 HD2 PHE 59 HD2 PHE 59 6.808 -18.059 4.333 427 HE1 PHE 59 HE1 PHE 59 3.463 -14.615 5.404 428 HE2 PHE 59 HE2 PHE 59 5.840 -16.687 2.535 429 HZ PHE 59 HZ PHE 59 4.165 -14.962 3.069 430 H ALA 60 H ALA 60 5.242 -17.707 10.027 431 HA ALA 60 HA ALA 60 7.143 -18.798 11.862 432 HB1 ALA 60 1HB ALA 60 4.143 -18.641 11.852 433 HB2 ALA 60 2HB ALA 60 5.042 -19.452 13.135 434 HB3 ALA 60 3HB ALA 60 5.289 -17.732 12.838 435 H GLY 61 H GLY 61 8.131 -20.657 11.323 436 HA2 GLY 61 2HA GLY 61 7.438 -23.125 11.648 437 HA3 GLY 61 3HA GLY 61 6.507 -22.831 10.187 438 H TYR 62 H TYR 62 9.069 -20.947 9.720 439 HA TYR 62 HA TYR 62 10.940 -21.070 8.434 440 HB2 TYR 62 2HB TYR 62 11.328 -23.912 9.332 441 HB3 TYR 62 3HB TYR 62 12.546 -22.693 8.972 442 HD1 TYR 62 HD1 TYR 62 11.639 -20.408 10.566 443 HD2 TYR 62 HD2 TYR 62 11.706 -24.551 11.534 444 HE1 TYR 62 HE1 TYR 62 11.783 -19.841 12.955 445 HE2 TYR 62 HE2 TYR 62 11.849 -23.995 13.926 446 HH TYR 62 HH TYR 62 11.025 -21.395 15.263 447 H THR 63 H THR 63 8.484 -21.690 7.205 448 HA THR 63 HA THR 63 9.324 -23.681 5.199 449 HB THR 63 HB THR 63 7.397 -24.580 6.248 450 HG1 THR 63 HG1 THR 63 7.166 -24.790 4.053 451 HG21 THR 63 3HG2 THR 63 6.050 -23.225 7.399 452 HG22 THR 63 1HG2 THR 63 5.322 -22.742 5.868 453 HG23 THR 63 2HG2 THR 63 6.657 -21.808 6.544 454 H VAL 64 H VAL 64 8.653 -23.276 2.999 455 HA VAL 64 HA VAL 64 7.840 -20.543 2.369 456 HB VAL 64 HB VAL 64 10.277 -21.746 1.061 457 HG11 VAL 64 1HG1 VAL 64 8.984 -19.028 0.987 458 HG12 VAL 64 2HG1 VAL 64 10.611 -19.344 0.381 459 HG13 VAL 64 3HG1 VAL 64 9.224 -20.153 -0.350 460 HG21 VAL 64 3HG2 VAL 64 10.093 -19.823 3.372 461 HG22 VAL 64 1HG2 VAL 64 10.912 -21.385 3.323 462 HG23 VAL 64 2HG2 VAL 64 11.545 -20.028 2.392 463 H THR 65 H THR 65 7.100 -20.272 0.193 464 HA THR 65 HA THR 65 6.130 -22.789 -0.966 465 HB THR 65 HB THR 65 5.161 -19.956 -1.397 466 HG1 THR 65 HG1 THR 65 3.930 -22.157 -0.064 467 HG21 THR 65 3HG2 THR 65 4.797 -22.321 -2.970 468 HG22 THR 65 1HG2 THR 65 4.148 -20.703 -3.235 469 HG23 THR 65 2HG2 THR 65 3.258 -21.859 -2.244 470 H GLU 66 H GLU 66 6.792 -19.601 -2.402 471 HA GLU 66 HA GLU 66 8.934 -20.544 -4.030 472 HB2 GLU 66 2HB GLU 66 7.815 -20.360 -6.206 473 HB3 GLU 66 3HB GLU 66 7.107 -21.635 -5.224 474 HG2 GLU 66 2HG GLU 66 5.123 -20.567 -5.012 475 HG3 GLU 66 3HG GLU 66 5.854 -18.964 -5.052 476 H LEU 67 H LEU 67 8.945 -18.805 -6.086 477 HA LEU 67 HA LEU 67 9.811 -16.421 -4.984 478 HB2 LEU 67 2HB LEU 67 9.447 -15.499 -7.336 479 HB3 LEU 67 3HB LEU 67 10.536 -16.872 -7.148 480 HG LEU 67 HG LEU 67 7.937 -17.884 -7.692 481 HD11 LEU 67 1HD1 LEU 67 7.107 -16.726 -9.437 482 HD12 LEU 67 2HD1 LEU 67 8.701 -16.253 -10.024 483 HD13 LEU 67 3HD1 LEU 67 7.962 -15.383 -8.679 484 HD21 LEU 67 3HD2 LEU 67 9.298 -18.400 -9.920 485 HD22 LEU 67 1HD2 LEU 67 9.605 -19.250 -8.405 486 HD23 LEU 67 2HD2 LEU 67 10.647 -17.912 -8.892 487 H ALA 68 H ALA 68 6.596 -17.390 -5.923 488 HA ALA 68 HA ALA 68 5.387 -14.846 -6.007 489 HB1 ALA 68 1HB ALA 68 3.266 -16.082 -5.674 490 HB2 ALA 68 2HB ALA 68 4.274 -16.756 -6.955 491 HB3 ALA 68 3HB ALA 68 4.204 -17.546 -5.380 492 H ALA 69 H ALA 69 5.800 -17.181 -3.371 493 HA ALA 69 HA ALA 69 4.324 -15.819 -1.419 494 HB1 ALA 69 1HB ALA 69 6.515 -17.845 -1.331 495 HB2 ALA 69 2HB ALA 69 5.972 -17.076 0.161 496 HB3 ALA 69 3HB ALA 69 4.830 -17.987 -0.827 497 H PHE 70 H PHE 70 7.617 -15.407 -2.547 498 HA PHE 70 HA PHE 70 8.322 -13.587 -0.422 499 HB2 PHE 70 2HB PHE 70 10.133 -14.863 -1.249 500 HB3 PHE 70 3HB PHE 70 9.718 -14.515 -2.924 501 HD1 PHE 70 HD1 PHE 70 10.904 -12.897 -4.049 502 HD2 PHE 70 HD2 PHE 70 10.751 -12.772 0.203 503 HE1 PHE 70 HE1 PHE 70 12.488 -11.014 -4.051 504 HE2 PHE 70 HE2 PHE 70 12.335 -10.889 0.208 505 HZ PHE 70 HZ PHE 70 13.205 -10.007 -1.920 506 H ASN 71 H ASN 71 7.085 -13.399 -3.670 507 HA ASN 71 HA ASN 71 7.657 -10.625 -4.060 508 HB2 ASN 71 2HB ASN 71 7.294 -12.278 -5.913 509 HB3 ASN 71 3HB ASN 71 5.586 -12.310 -5.481 510 HD21 ASN 71 2HD2 ASN 71 6.704 -9.709 -8.125 511 HD22 ASN 71 1HD2 ASN 71 7.401 -11.252 -7.781 512 H THR 72 H THR 72 4.953 -12.470 -2.799 513 HA THR 72 HA THR 72 3.121 -10.279 -2.726 514 HB THR 72 HB THR 72 2.259 -12.544 -2.775 515 HG1 THR 72 HG1 THR 72 0.794 -12.332 -1.021 516 HG21 THR 72 3HG2 THR 72 3.498 -12.899 -0.044 517 HG22 THR 72 1HG2 THR 72 4.114 -13.613 -1.533 518 HG23 THR 72 2HG2 THR 72 2.528 -14.083 -0.920 519 H VAL 73 H VAL 73 5.326 -11.765 -0.400 520 HA VAL 73 HA VAL 73 4.472 -10.200 1.823 521 HB VAL 73 HB VAL 73 6.545 -10.986 2.917 522 HG11 VAL 73 1HG1 VAL 73 5.868 -13.557 1.989 523 HG12 VAL 73 2HG1 VAL 73 5.274 -12.733 3.432 524 HG13 VAL 73 3HG1 VAL 73 4.398 -12.585 1.908 525 HG21 VAL 73 3HG2 VAL 73 7.119 -12.109 0.183 526 HG22 VAL 73 1HG2 VAL 73 8.111 -11.005 1.136 527 HG23 VAL 73 2HG2 VAL 73 7.916 -12.681 1.648 528 H VAL 74 H VAL 74 7.114 -9.927 -0.517 529 HA VAL 74 HA VAL 74 8.349 -7.675 0.682 530 HB VAL 74 HB VAL 74 9.467 -9.181 -0.961 531 HG11 VAL 74 1HG1 VAL 74 7.568 -9.346 -2.533 532 HG12 VAL 74 2HG1 VAL 74 7.849 -7.670 -3.009 533 HG13 VAL 74 3HG1 VAL 74 9.077 -8.896 -3.327 534 HG21 VAL 74 3HG2 VAL 74 10.949 -7.546 -1.257 535 HG22 VAL 74 1HG2 VAL 74 9.861 -6.675 -2.338 536 HG23 VAL 74 2HG2 VAL 74 9.753 -6.433 -0.595 537 H ALA 75 H ALA 75 5.821 -8.054 -1.735 538 HA ALA 75 HA ALA 75 5.696 -5.437 -2.692 539 HB1 ALA 75 1HB ALA 75 4.499 -7.281 -3.737 540 HB2 ALA 75 2HB ALA 75 3.437 -7.403 -2.334 541 HB3 ALA 75 3HB ALA 75 3.396 -5.960 -3.347 542 H ARG 76 H ARG 76 4.116 -6.920 0.114 543 HA ARG 76 HA ARG 76 2.752 -4.493 0.837 544 HB2 ARG 76 2HB ARG 76 3.003 -7.234 1.991 545 HB3 ARG 76 3HB ARG 76 2.476 -5.929 3.046 546 HG2 ARG 76 2HG ARG 76 0.602 -7.167 2.057 547 HG3 ARG 76 3HG ARG 76 0.602 -5.462 1.602 548 HD2 ARG 76 2HD ARG 76 1.649 -6.052 -0.542 549 HD3 ARG 76 3HD ARG 76 1.603 -7.754 -0.084 550 HE ARG 76 HE ARG 76 -0.981 -6.577 0.047 551 HH11 ARG 76 1HH1 ARG 76 1.392 -7.826 -2.173 552 HH12 ARG 76 2HH1 ARG 76 0.227 -8.257 -3.380 553 HH21 ARG 76 2HH2 ARG 76 -2.001 -7.866 -3.017 554 HH22 ARG 76 1HH2 ARG 76 -2.525 -7.140 -1.535 555 H HIS 77 H HIS 77 5.794 -5.992 1.563 556 HA HIS 77 HA HIS 77 6.316 -4.451 3.930 557 HB2 HIS 77 2HB HIS 77 7.354 -6.643 3.633 558 HB3 HIS 77 3HB HIS 77 8.173 -6.078 2.181 559 HD1 HIS 77 HD1 HIS 77 7.966 -4.572 5.675 560 HD2 HIS 77 HD2 HIS 77 10.769 -5.792 2.861 561 HE1 HIS 77 HE1 HIS 77 10.206 -4.002 6.666 562 H VAL 78 H VAL 78 6.815 -4.067 0.516 563 HA VAL 78 HA VAL 78 8.886 -2.241 0.409 564 HB VAL 78 HB VAL 78 6.409 -2.473 -1.290 565 HG11 VAL 78 1HG1 VAL 78 6.829 -0.373 -1.957 566 HG12 VAL 78 2HG1 VAL 78 8.444 -0.365 -1.248 567 HG13 VAL 78 3HG1 VAL 78 8.179 -1.094 -2.832 568 HG21 VAL 78 3HG2 VAL 78 7.548 -4.026 -2.405 569 HG22 VAL 78 1HG2 VAL 78 8.943 -2.959 -2.573 570 HG23 VAL 78 2HG2 VAL 78 8.768 -3.962 -1.133 571 H ARG 79 H ARG 79 9.017 -0.623 1.869 572 HA ARG 79 HA ARG 79 7.149 1.568 1.610 573 HB2 ARG 79 2HB ARG 79 7.027 -0.275 3.849 574 HB3 ARG 79 3HB ARG 79 7.357 1.367 4.383 575 HG2 ARG 79 2HG ARG 79 5.324 1.652 2.521 576 HG3 ARG 79 3HG ARG 79 4.900 0.195 3.422 577 HD2 ARG 79 2HD ARG 79 5.657 1.838 5.436 578 HD3 ARG 79 3HD ARG 79 4.996 3.005 4.291 579 HE ARG 79 HE ARG 79 3.539 1.028 5.798 580 HH11 ARG 79 1HH1 ARG 79 3.534 3.106 3.005 581 HH12 ARG 79 2HH1 ARG 79 1.807 3.144 2.874 582 HH21 ARG 79 2HH2 ARG 79 0.517 1.986 4.371 583 HH22 ARG 79 1HH2 ARG 79 1.264 1.070 5.636 584 HA PRO 80 HA PRO 80 10.706 4.005 2.417 585 HB2 PRO 80 2HB PRO 80 9.653 6.147 3.711 586 HB3 PRO 80 3HB PRO 80 9.414 5.855 1.984 587 HG2 PRO 80 2HG PRO 80 7.578 5.271 4.275 588 HG3 PRO 80 3HG PRO 80 7.200 5.963 2.687 589 HD2 PRO 80 2HD PRO 80 6.753 3.360 3.286 590 HD3 PRO 80 3HD PRO 80 7.188 3.903 1.653 591 H SER 81 H SER 81 12.091 3.058 3.830 592 HA SER 81 HA SER 81 13.183 2.598 5.772 593 HB2 SER 81 2HB SER 81 12.899 5.120 5.990 594 HB3 SER 81 3HB SER 81 11.529 4.781 7.047 595 HG SER 81 HG SER 81 12.859 3.968 8.544 596 H ALA 82 H ALA 82 10.916 1.053 5.195 597 HA ALA 82 HA ALA 82 9.444 0.729 7.681 598 HB1 ALA 82 1HB ALA 82 9.150 -0.221 4.905 599 HB2 ALA 82 2HB ALA 82 8.584 -1.317 6.165 600 HB3 ALA 82 3HB ALA 82 7.929 0.317 6.059 601 H SER 83 H SER 83 10.646 -0.191 9.246 602 HA SER 83 HA SER 83 12.403 -2.429 8.611 603 HB2 SER 83 2HB SER 83 12.554 -2.096 11.335 604 HB3 SER 83 3HB SER 83 13.610 -1.313 10.161 605 HG SER 83 HG SER 83 12.182 -0.073 11.852 606 H ILE 84 H ILE 84 11.737 -4.457 8.750 607 HA ILE 84 HA ILE 84 9.708 -5.164 10.749 608 HB ILE 84 HB ILE 84 9.651 -6.106 7.880 609 HG12 ILE 84 2HG1 ILE 84 8.893 -3.769 8.159 610 HG13 ILE 84 3HG1 ILE 84 7.576 -4.838 7.690 611 HG21 ILE 84 1HG2 ILE 84 7.729 -6.665 10.134 612 HG22 ILE 84 2HG2 ILE 84 7.619 -7.269 8.481 613 HG23 ILE 84 3HG2 ILE 84 8.937 -7.797 9.527 614 HD11 ILE 84 3HD1 ILE 84 7.749 -4.674 10.547 615 HD12 ILE 84 1HD1 ILE 84 7.651 -3.062 9.838 616 HD13 ILE 84 2HD1 ILE 84 6.410 -4.263 9.476 617 HA PRO 85 HA PRO 85 12.646 -8.350 11.635 618 HB2 PRO 85 2HB PRO 85 11.071 -9.826 13.282 619 HB3 PRO 85 3HB PRO 85 11.811 -8.298 13.775 620 HG2 PRO 85 2HG PRO 85 9.019 -8.834 12.839 621 HG3 PRO 85 3HG PRO 85 9.573 -7.812 14.178 622 HD2 PRO 85 2HD PRO 85 8.855 -6.798 11.772 623 HD3 PRO 85 3HD PRO 85 10.115 -6.060 12.782 624 H VAL 86 H VAL 86 13.163 -9.889 10.220 625 HA VAL 86 HA VAL 86 11.028 -11.648 9.201 626 HB VAL 86 HB VAL 86 13.670 -11.083 7.855 627 HG11 VAL 86 1HG1 VAL 86 11.919 -11.883 5.932 628 HG12 VAL 86 2HG1 VAL 86 13.060 -12.946 6.760 629 HG13 VAL 86 3HG1 VAL 86 11.388 -12.842 7.313 630 HG21 VAL 86 3HG2 VAL 86 12.388 -9.026 7.956 631 HG22 VAL 86 1HG2 VAL 86 12.390 -9.657 6.309 632 HG23 VAL 86 2HG2 VAL 86 10.964 -9.855 7.328 633 H VAL 87 H VAL 87 11.434 -13.868 9.018 634 HA VAL 87 HA VAL 87 13.500 -14.845 10.850 635 HB VAL 87 HB VAL 87 11.104 -16.259 9.671 636 HG11 VAL 87 1HG1 VAL 87 12.567 -18.003 10.019 637 HG12 VAL 87 2HG1 VAL 87 13.366 -17.204 11.374 638 HG13 VAL 87 3HG1 VAL 87 11.763 -17.908 11.586 639 HG21 VAL 87 3HG2 VAL 87 11.243 -15.984 12.560 640 HG22 VAL 87 1HG2 VAL 87 11.213 -14.426 11.734 641 HG23 VAL 87 2HG2 VAL 87 9.928 -15.599 11.450 642 H PHE 88 H PHE 88 15.257 -15.874 10.153 643 HA PHE 88 HA PHE 88 15.302 -16.818 7.362 644 HB2 PHE 88 2HB PHE 88 17.215 -15.183 8.912 645 HB3 PHE 88 3HB PHE 88 17.930 -16.450 7.920 646 HD1 PHE 88 HD1 PHE 88 14.951 -14.314 7.291 647 HD2 PHE 88 HD2 PHE 88 18.908 -15.366 6.127 648 HE1 PHE 88 HE1 PHE 88 14.749 -12.869 5.310 649 HE2 PHE 88 HE2 PHE 88 18.712 -13.922 4.145 650 HZ PHE 88 HZ PHE 88 16.631 -12.670 3.735 651 H SER 89 H SER 89 16.562 -18.692 6.907 652 HA SER 89 HA SER 89 17.268 -20.327 9.244 653 HB2 SER 89 2HB SER 89 15.185 -20.854 7.254 654 HB3 SER 89 3HB SER 89 16.328 -22.185 7.432 655 HG SER 89 HG SER 89 14.925 -22.593 9.009 656 H ARG 90 H ARG 90 18.930 -21.818 8.928 657 HA ARG 90 HA ARG 90 20.308 -21.701 6.333 658 HB2 ARG 90 2HB ARG 90 21.264 -20.760 8.913 659 HB3 ARG 90 3HB ARG 90 22.335 -21.969 8.219 660 HG2 ARG 90 2HG ARG 90 22.313 -20.597 6.102 661 HG3 ARG 90 3HG ARG 90 21.509 -19.335 7.038 662 HD2 ARG 90 2HD ARG 90 24.151 -20.572 7.793 663 HD3 ARG 90 3HD ARG 90 23.992 -19.085 6.858 664 HE ARG 90 HE ARG 90 22.542 -18.975 9.313 665 HH11 ARG 90 1HH1 ARG 90 25.710 -18.659 7.906 666 HH12 ARG 90 2HH1 ARG 90 26.302 -17.609 9.151 667 HH21 ARG 90 2HH2 ARG 90 24.935 -17.004 10.887 668 HH22 ARG 90 1HH2 ARG 90 23.309 -17.593 10.958 669 H ASP 91 H ASP 91 19.543 -23.756 5.807 670 HA ASP 91 HA ASP 91 19.601 -26.026 5.673 671 HB2 ASP 91 2HB ASP 91 22.047 -25.788 7.437 672 HB3 ASP 91 3HB ASP 91 21.608 -27.173 6.442 673 H GLY 92 H GLY 92 17.946 -24.877 7.649 674 HA2 GLY 92 2HA GLY 92 16.490 -26.107 9.090 675 HA3 GLY 92 3HA GLY 92 17.850 -27.125 9.541 676 H VAL 93 H VAL 93 19.317 -24.336 9.652 677 HA VAL 93 HA VAL 93 19.244 -24.112 12.470 678 HB VAL 93 HB VAL 93 20.363 -22.260 10.367 679 HG11 VAL 93 1HG1 VAL 93 20.039 -20.808 12.151 680 HG12 VAL 93 2HG1 VAL 93 20.362 -22.057 13.355 681 HG13 VAL 93 3HG1 VAL 93 21.686 -21.384 12.404 682 HG21 VAL 93 3HG2 VAL 93 22.339 -23.361 10.583 683 HG22 VAL 93 1HG2 VAL 93 22.055 -23.765 12.276 684 HG23 VAL 93 2HG2 VAL 93 21.259 -24.690 11.003 685 H VAL 94 H VAL 94 18.278 -22.638 13.814 686 HA VAL 94 HA VAL 94 16.141 -21.013 12.601 687 HB VAL 94 HB VAL 94 16.325 -22.128 15.404 688 HG11 VAL 94 1HG1 VAL 94 14.050 -21.270 15.687 689 HG12 VAL 94 2HG1 VAL 94 15.195 -19.966 15.366 690 HG13 VAL 94 3HG1 VAL 94 14.126 -20.538 14.085 691 HG21 VAL 94 3HG2 VAL 94 14.382 -23.491 14.704 692 HG22 VAL 94 1HG2 VAL 94 14.577 -22.877 13.063 693 HG23 VAL 94 2HG2 VAL 94 15.845 -23.862 13.792 694 H MET 95 H MET 95 16.647 -18.931 12.478 695 HA MET 95 HA MET 95 17.778 -17.609 14.823 696 HB2 MET 95 2HB MET 95 19.582 -18.264 13.081 697 HB3 MET 95 3HB MET 95 18.895 -16.969 12.109 698 HG2 MET 95 2HG MET 95 20.760 -16.092 13.288 699 HG3 MET 95 3HG MET 95 19.300 -15.416 14.005 700 HE1 MET 95 3HE MET 95 22.437 -16.535 14.320 701 HE2 MET 95 1HE MET 95 22.645 -16.369 16.064 702 HE3 MET 95 2HE MET 95 22.527 -17.972 15.339 703 H SER 96 H SER 96 17.520 -15.269 14.771 704 HA SER 96 HA SER 96 15.453 -14.350 12.891 705 HB2 SER 96 2HB SER 96 14.288 -13.201 14.712 706 HB3 SER 96 3HB SER 96 14.388 -14.930 15.046 707 HG SER 96 HG SER 96 15.627 -14.539 16.711 708 H ALA 97 H ALA 97 15.857 -12.432 11.986 709 HA ALA 97 HA ALA 97 17.667 -10.556 13.316 710 HB1 ALA 97 1HB ALA 97 18.944 -12.051 11.710 711 HB2 ALA 97 2HB ALA 97 18.058 -11.242 10.416 712 HB3 ALA 97 3HB ALA 97 19.116 -10.311 11.477 713 H THR 98 H THR 98 17.200 -8.437 12.951 714 HA THR 98 HA THR 98 14.684 -7.867 11.640 715 HB THR 98 HB THR 98 16.490 -5.798 12.869 716 HG1 THR 98 HG1 THR 98 16.310 -7.030 14.613 717 HG21 THR 98 3HG2 THR 98 14.585 -4.905 11.721 718 HG22 THR 98 1HG2 THR 98 14.276 -4.786 13.452 719 HG23 THR 98 2HG2 THR 98 13.506 -6.059 12.504 720 H ILE 99 H ILE 99 14.479 -7.179 9.618 721 HA ILE 99 HA ILE 99 16.842 -6.032 8.282 722 HB ILE 99 HB ILE 99 14.564 -7.602 7.073 723 HG12 ILE 99 2HG1 ILE 99 16.755 -8.957 6.370 724 HG13 ILE 99 3HG1 ILE 99 17.368 -8.235 7.854 725 HG21 ILE 99 1HG2 ILE 99 16.831 -6.084 5.829 726 HG22 ILE 99 2HG2 ILE 99 16.062 -7.437 5.002 727 HG23 ILE 99 3HG2 ILE 99 15.111 -6.020 5.444 728 HD11 ILE 99 3HD1 ILE 99 16.465 -9.971 8.896 729 HD12 ILE 99 1HD1 ILE 99 14.903 -9.213 8.590 730 HD13 ILE 99 2HD1 ILE 99 15.524 -10.434 7.479 731 H VAL 100 H VAL 100 16.698 -3.995 7.619 732 HA VAL 100 HA VAL 100 14.033 -2.749 7.502 733 HB VAL 100 HB VAL 100 15.409 -1.677 9.149 734 HG11 VAL 100 1HG1 VAL 100 17.507 -0.520 7.650 735 HG12 VAL 100 2HG1 VAL 100 17.622 -1.678 8.976 736 HG13 VAL 100 3HG1 VAL 100 17.511 -2.250 7.310 737 HG21 VAL 100 3HG2 VAL 100 15.761 0.316 7.007 738 HG22 VAL 100 1HG2 VAL 100 14.139 -0.358 7.168 739 HG23 VAL 100 2HG2 VAL 100 14.903 0.438 8.544 740 H VAL 101 H VAL 101 13.279 -2.496 5.512 741 HA VAL 101 HA VAL 101 15.170 -2.131 3.296 742 HB VAL 101 HB VAL 101 12.241 -2.871 3.228 743 HG11 VAL 101 1HG1 VAL 101 14.222 -2.223 1.108 744 HG12 VAL 101 2HG1 VAL 101 13.050 -3.505 0.796 745 HG13 VAL 101 3HG1 VAL 101 12.495 -1.877 1.185 746 HG21 VAL 101 3HG2 VAL 101 13.345 -5.023 2.250 747 HG22 VAL 101 1HG2 VAL 101 14.770 -4.455 3.121 748 HG23 VAL 101 2HG2 VAL 101 13.275 -4.786 3.996 749 H GLY 102 H GLY 102 15.538 -0.093 2.729 750 HA2 GLY 102 2HA GLY 102 13.307 1.834 2.936 751 HA3 GLY 102 3HA GLY 102 14.997 2.267 3.148 752 H GLU 103 H GLU 103 12.432 2.161 0.995 753 HA GLU 103 HA GLU 103 13.938 1.861 -1.431 754 HB2 GLU 103 2HB GLU 103 11.146 2.939 -0.994 755 HB3 GLU 103 3HB GLU 103 11.847 2.515 -2.550 756 HG2 GLU 103 2HG GLU 103 10.821 0.559 -2.224 757 HG3 GLU 103 3HG GLU 103 12.202 0.205 -1.188 758 H LEU 104 H LEU 104 12.771 4.538 0.522 759 HA LEU 104 HA LEU 104 14.133 6.404 -1.307 760 HB2 LEU 104 2HB LEU 104 11.855 6.937 0.594 761 HB3 LEU 104 3HB LEU 104 12.653 8.147 -0.408 762 HG LEU 104 HG LEU 104 10.682 7.687 -1.552 763 HD11 LEU 104 1HD1 LEU 104 11.459 7.088 -3.589 764 HD12 LEU 104 2HD1 LEU 104 12.240 5.627 -2.986 765 HD13 LEU 104 3HD1 LEU 104 13.015 7.196 -2.764 766 HD21 LEU 104 3HD2 LEU 104 10.582 5.391 -0.096 767 HD22 LEU 104 1HD2 LEU 104 10.889 4.768 -1.718 768 HD23 LEU 104 2HD2 LEU 104 9.486 5.794 -1.419 769 H GLU 105 H GLU 105 15.794 5.169 0.364 770 HA GLU 105 HA GLU 105 17.319 5.433 2.037 771 HB2 GLU 105 2HB GLU 105 16.666 8.248 1.236 772 HB3 GLU 105 3HB GLU 105 17.767 7.950 2.574 773 HG2 GLU 105 2HG GLU 105 19.023 6.430 0.925 774 HG3 GLU 105 3HG GLU 105 18.096 7.268 -0.319 Start of MODEL 15 1 HA PRO 1 HA PRO 1 2.140 -0.057 -1.862 2 HB2 PRO 1 2HB PRO 1 4.534 -1.206 -1.295 3 HB3 PRO 1 3HB PRO 1 3.961 0.264 -0.498 4 HG2 PRO 1 2HG PRO 1 3.896 -2.567 0.474 5 HG3 PRO 1 3HG PRO 1 4.322 -1.090 1.358 6 HD2 PRO 1 2HD PRO 1 1.895 -2.271 1.578 7 HD3 PRO 1 3HD PRO 1 2.118 -0.515 1.710 8 H LEU 2 H LEU 2 3.965 -1.329 -3.283 9 HA LEU 2 HA LEU 2 3.240 -4.090 -3.753 10 HB2 LEU 2 2HB LEU 2 2.216 -1.886 -5.377 11 HB3 LEU 2 3HB LEU 2 3.032 -3.136 -6.314 12 HG LEU 2 HG LEU 2 0.993 -4.026 -4.352 13 HD11 LEU 2 1HD1 LEU 2 -0.638 -3.665 -6.405 14 HD12 LEU 2 2HD1 LEU 2 0.426 -2.288 -6.690 15 HD13 LEU 2 3HD1 LEU 2 -0.427 -2.439 -5.154 16 HD21 LEU 2 3HD2 LEU 2 2.246 -4.935 -6.855 17 HD22 LEU 2 1HD2 LEU 2 0.532 -5.313 -6.680 18 HD23 LEU 2 2HD2 LEU 2 1.684 -5.859 -5.461 19 H THR 3 H THR 3 4.527 -5.000 -5.622 20 HA THR 3 HA THR 3 7.134 -3.635 -5.814 21 HB THR 3 HB THR 3 7.261 -5.621 -4.351 22 HG1 THR 3 HG1 THR 3 9.179 -5.394 -5.294 23 HG21 THR 3 3HG2 THR 3 5.600 -6.771 -6.327 24 HG22 THR 3 1HG2 THR 3 6.203 -7.517 -4.848 25 HG23 THR 3 2HG2 THR 3 7.120 -7.664 -6.347 26 H ARG 4 H ARG 4 8.460 -4.459 -7.697 27 HA ARG 4 HA ARG 4 7.231 -3.904 -10.099 28 HB2 ARG 4 2HB ARG 4 9.776 -5.174 -9.291 29 HB3 ARG 4 3HB ARG 4 9.250 -5.501 -10.937 30 HG2 ARG 4 2HG ARG 4 9.655 -3.399 -11.626 31 HG3 ARG 4 3HG ARG 4 9.121 -2.683 -10.104 32 HD2 ARG 4 2HD ARG 4 11.208 -3.221 -9.051 33 HD3 ARG 4 3HD ARG 4 11.730 -4.149 -10.456 34 HE ARG 4 HE ARG 4 11.894 -1.317 -10.107 35 HH11 ARG 4 1HH1 ARG 4 11.549 -3.852 -12.469 36 HH12 ARG 4 2HH1 ARG 4 12.224 -2.917 -13.762 37 HH21 ARG 4 2HH2 ARG 4 12.927 -0.770 -13.381 38 HH22 ARG 4 1HH2 ARG 4 12.784 -0.076 -11.802 39 HA PRO 5 HA PRO 5 4.989 -7.448 -11.386 40 HB2 PRO 5 2HB PRO 5 5.445 -7.458 -14.062 41 HB3 PRO 5 3HB PRO 5 4.409 -6.266 -13.269 42 HG2 PRO 5 2HG PRO 5 7.259 -6.011 -14.147 43 HG3 PRO 5 3HG PRO 5 5.929 -4.850 -14.312 44 HD2 PRO 5 2HD PRO 5 7.810 -4.645 -12.375 45 HD3 PRO 5 3HD PRO 5 6.132 -4.117 -12.136 46 H TYR 6 H TYR 6 8.220 -7.269 -12.879 47 HA TYR 6 HA TYR 6 8.352 -10.154 -13.114 48 HB2 TYR 6 2HB TYR 6 9.805 -7.868 -14.199 49 HB3 TYR 6 3HB TYR 6 10.876 -9.172 -13.699 50 HD1 TYR 6 HD1 TYR 6 11.058 -11.159 -14.974 51 HD2 TYR 6 HD2 TYR 6 8.001 -8.341 -15.877 52 HE1 TYR 6 HE1 TYR 6 10.570 -12.366 -17.060 53 HE2 TYR 6 HE2 TYR 6 7.503 -9.541 -17.965 54 HH TYR 6 HH TYR 6 9.529 -11.758 -19.338 55 H LEU 7 H LEU 7 9.974 -11.452 -12.131 56 HA LEU 7 HA LEU 7 10.569 -10.631 -9.417 57 HB2 LEU 7 2HB LEU 7 10.691 -13.188 -10.946 58 HB3 LEU 7 3HB LEU 7 11.625 -13.033 -9.460 59 HG LEU 7 HG LEU 7 9.449 -14.150 -9.132 60 HD11 LEU 7 1HD1 LEU 7 8.667 -12.196 -7.424 61 HD12 LEU 7 2HD1 LEU 7 10.341 -11.733 -7.728 62 HD13 LEU 7 3HD1 LEU 7 9.970 -13.341 -7.106 63 HD21 LEU 7 3HD2 LEU 7 8.240 -12.849 -10.880 64 HD22 LEU 7 1HD2 LEU 7 8.237 -11.468 -9.782 65 HD23 LEU 7 2HD2 LEU 7 7.388 -12.949 -9.338 66 H GLY 8 H GLY 8 12.585 -10.333 -8.538 67 HA2 GLY 8 2HA GLY 8 14.793 -10.137 -10.490 68 HA3 GLY 8 3HA GLY 8 14.625 -9.108 -9.075 69 H PHE 9 H PHE 9 14.219 -12.616 -9.243 70 HA PHE 9 HA PHE 9 16.773 -13.302 -8.277 71 HB2 PHE 9 2HB PHE 9 16.340 -13.770 -5.960 72 HB3 PHE 9 3HB PHE 9 15.892 -12.095 -6.263 73 HD1 PHE 9 HD1 PHE 9 14.820 -15.254 -5.021 74 HD2 PHE 9 HD2 PHE 9 13.427 -11.584 -6.667 75 HE1 PHE 9 HE1 PHE 9 12.582 -15.693 -4.097 76 HE2 PHE 9 HE2 PHE 9 11.187 -12.017 -5.745 77 HZ PHE 9 HZ PHE 9 10.762 -14.073 -4.458 78 H ARG 10 H ARG 10 16.861 -15.595 -7.526 79 HA ARG 10 HA ARG 10 14.643 -17.158 -8.678 80 HB2 ARG 10 2HB ARG 10 16.346 -18.845 -9.340 81 HB3 ARG 10 3HB ARG 10 16.540 -17.301 -10.159 82 HG2 ARG 10 2HG ARG 10 18.156 -16.959 -8.007 83 HG3 ARG 10 3HG ARG 10 18.327 -18.691 -8.303 84 HD2 ARG 10 2HD ARG 10 20.011 -17.396 -9.519 85 HD3 ARG 10 3HD ARG 10 18.931 -18.251 -10.618 86 HE ARG 10 HE ARG 10 18.081 -15.569 -10.095 87 HH11 ARG 10 1HH1 ARG 10 20.222 -17.538 -12.009 88 HH12 ARG 10 2HH1 ARG 10 20.319 -16.397 -13.310 89 HH21 ARG 10 2HH2 ARG 10 19.170 -14.419 -13.190 90 HH22 ARG 10 1HH2 ARG 10 18.201 -14.060 -11.801 91 H VAL 11 H VAL 11 14.201 -19.194 -7.719 92 HA VAL 11 HA VAL 11 15.434 -19.665 -5.095 93 HB VAL 11 HB VAL 11 13.134 -20.312 -4.249 94 HG11 VAL 11 1HG1 VAL 11 13.721 -18.407 -3.201 95 HG12 VAL 11 2HG1 VAL 11 14.201 -17.608 -4.699 96 HG13 VAL 11 3HG1 VAL 11 12.498 -17.685 -4.246 97 HG21 VAL 11 3HG2 VAL 11 12.209 -20.276 -6.654 98 HG22 VAL 11 1HG2 VAL 11 11.200 -19.636 -5.356 99 HG23 VAL 11 2HG2 VAL 11 12.076 -18.533 -6.418 100 H ALA 12 H ALA 12 15.531 -21.807 -4.439 101 HA ALA 12 HA ALA 12 14.705 -23.793 -6.456 102 HB1 ALA 12 1HB ALA 12 17.108 -23.562 -6.488 103 HB2 ALA 12 2HB ALA 12 17.186 -23.805 -4.743 104 HB3 ALA 12 3HB ALA 12 16.675 -25.125 -5.795 105 H VAL 13 H VAL 13 13.317 -25.273 -5.756 106 HA VAL 13 HA VAL 13 12.590 -25.392 -2.971 107 HB VAL 13 HB VAL 13 10.857 -25.554 -4.685 108 HG11 VAL 13 1HG1 VAL 13 10.955 -26.904 -6.460 109 HG12 VAL 13 2HG1 VAL 13 12.641 -27.177 -6.016 110 HG13 VAL 13 3HG1 VAL 13 11.393 -28.301 -5.477 111 HG21 VAL 13 3HG2 VAL 13 11.207 -28.057 -3.040 112 HG22 VAL 13 1HG2 VAL 13 10.388 -26.573 -2.554 113 HG23 VAL 13 2HG2 VAL 13 9.705 -27.579 -3.832 114 H GLY 14 H GLY 14 13.326 -26.774 -1.492 115 HA2 GLY 14 2HA GLY 14 14.093 -29.458 -2.115 116 HA3 GLY 14 3HA GLY 14 15.493 -28.436 -1.822 117 H ARG 15 H ARG 15 16.014 -29.715 0.010 118 HA ARG 15 HA ARG 15 14.408 -29.015 2.369 119 HB2 ARG 15 2HB ARG 15 14.548 -31.575 1.310 120 HB3 ARG 15 3HB ARG 15 15.731 -31.600 2.611 121 HG2 ARG 15 2HG ARG 15 14.077 -31.937 4.039 122 HG3 ARG 15 3HG ARG 15 13.465 -30.327 3.657 123 HD2 ARG 15 2HD ARG 15 11.618 -31.506 3.085 124 HD3 ARG 15 3HD ARG 15 12.488 -31.661 1.559 125 HE ARG 15 HE ARG 15 12.677 -33.901 1.952 126 HH11 ARG 15 1HH1 ARG 15 11.954 -32.295 4.955 127 HH12 ARG 15 2HH1 ARG 15 11.765 -33.767 5.848 128 HH21 ARG 15 2HH2 ARG 15 12.037 -35.787 4.801 129 HH22 ARG 15 1HH2 ARG 15 12.430 -35.847 3.117 130 H ASP 16 H ASP 16 15.552 -28.589 4.232 131 HA ASP 16 HA ASP 16 18.435 -28.230 3.862 132 HB2 ASP 16 2HB ASP 16 18.152 -26.873 6.039 133 HB3 ASP 16 3HB ASP 16 17.481 -26.204 4.555 134 H SER 17 H SER 17 19.507 -28.272 6.265 135 HA SER 17 HA SER 17 19.847 -30.963 6.876 136 HB2 SER 17 2HB SER 17 21.362 -28.985 7.472 137 HB3 SER 17 3HB SER 17 20.314 -28.748 8.871 138 HG SER 17 HG SER 17 20.959 -30.657 9.697 139 H SER 18 H SER 18 17.461 -28.709 7.969 140 HA SER 18 HA SER 18 16.624 -30.396 10.184 141 HB2 SER 18 2HB SER 18 16.615 -27.810 10.164 142 HB3 SER 18 3HB SER 18 15.147 -27.963 9.198 143 HG SER 18 HG SER 18 14.772 -27.802 11.489 144 H GLY 19 H GLY 19 15.141 -29.092 7.211 145 HA2 GLY 19 2HA GLY 19 13.888 -30.427 5.690 146 HA3 GLY 19 3HA GLY 19 13.597 -31.579 6.985 147 H CYS 20 H CYS 20 12.983 -28.120 6.356 148 HA CYS 20 HA CYS 20 10.275 -28.520 7.444 149 HB2 CYS 20 2HB CYS 20 12.218 -26.270 7.645 150 HB3 CYS 20 3HB CYS 20 10.506 -25.868 7.580 151 HG CYS 20 HG CYS 20 9.795 -27.154 9.880 152 H THR 21 H THR 21 11.626 -28.586 4.609 153 HA THR 21 HA THR 21 11.025 -28.104 2.466 154 HB THR 21 HB THR 21 8.277 -27.447 3.512 155 HG1 THR 21 HG1 THR 21 7.872 -29.645 3.595 156 HG21 THR 21 3HG2 THR 21 8.108 -27.159 1.262 157 HG22 THR 21 1HG2 THR 21 7.893 -28.908 1.303 158 HG23 THR 21 2HG2 THR 21 9.471 -28.223 0.913 159 H THR 22 H THR 22 12.359 -26.225 2.410 160 HA THR 22 HA THR 22 10.808 -23.767 2.079 161 HB THR 22 HB THR 22 11.599 -23.279 4.210 162 HG1 THR 22 HG1 THR 22 13.167 -21.696 3.862 163 HG21 THR 22 3HG2 THR 22 12.992 -24.955 4.907 164 HG22 THR 22 1HG2 THR 22 14.187 -23.690 4.627 165 HG23 THR 22 2HG2 THR 22 13.932 -24.946 3.416 166 H LEU 23 H LEU 23 11.879 -22.157 0.775 167 HA LEU 23 HA LEU 23 13.729 -23.378 -1.142 168 HB2 LEU 23 2HB LEU 23 11.992 -20.924 -1.321 169 HB3 LEU 23 3HB LEU 23 13.111 -21.439 -2.581 170 HG LEU 23 HG LEU 23 11.742 -23.638 -2.563 171 HD11 LEU 23 1HD1 LEU 23 9.325 -23.148 -2.009 172 HD12 LEU 23 2HD1 LEU 23 9.910 -21.744 -1.118 173 HD13 LEU 23 3HD1 LEU 23 10.411 -23.365 -0.636 174 HD21 LEU 23 3HD2 LEU 23 9.884 -22.208 -3.893 175 HD22 LEU 23 1HD2 LEU 23 11.477 -22.595 -4.544 176 HD23 LEU 23 2HD2 LEU 23 11.187 -21.022 -3.800 177 H SER 24 H SER 24 15.711 -22.532 -1.603 178 HA SER 24 HA SER 24 16.712 -20.526 0.280 179 HB2 SER 24 2HB SER 24 17.899 -22.719 0.060 180 HB3 SER 24 3HB SER 24 18.289 -22.292 -1.606 181 HG SER 24 HG SER 24 19.916 -21.239 -0.825 182 H ILE 25 H ILE 25 17.860 -18.700 -0.391 183 HA ILE 25 HA ILE 25 17.077 -17.711 -3.011 184 HB ILE 25 HB ILE 25 16.903 -16.350 -0.862 185 HG12 ILE 25 2HG1 ILE 25 18.069 -14.310 -2.174 186 HG13 ILE 25 3HG1 ILE 25 18.009 -15.490 -3.479 187 HG21 ILE 25 1HG2 ILE 25 18.877 -15.198 -0.095 188 HG22 ILE 25 2HG2 ILE 25 19.154 -16.937 -0.026 189 HG23 ILE 25 3HG2 ILE 25 19.858 -15.984 -1.332 190 HD11 ILE 25 3HD1 ILE 25 15.611 -15.691 -3.215 191 HD12 ILE 25 1HD1 ILE 25 15.649 -14.569 -1.855 192 HD13 ILE 25 2HD1 ILE 25 16.068 -14.008 -3.474 193 H GLN 26 H GLN 26 18.414 -17.361 -4.693 194 HA GLN 26 HA GLN 26 21.235 -18.115 -4.336 195 HB2 GLN 26 2HB GLN 26 19.292 -18.440 -6.574 196 HB3 GLN 26 3HB GLN 26 20.992 -18.235 -6.977 197 HG2 GLN 26 2HG GLN 26 21.532 -20.292 -6.294 198 HG3 GLN 26 3HG GLN 26 20.487 -20.206 -4.878 199 HE21 GLN 26 2HE2 GLN 26 17.579 -21.214 -6.849 200 HE22 GLN 26 1HE2 GLN 26 18.036 -19.901 -5.824 201 H GLU 27 H GLU 27 19.097 -15.578 -5.300 202 HA GLU 27 HA GLU 27 21.430 -13.896 -5.932 203 HB2 GLU 27 2HB GLU 27 18.704 -13.620 -7.203 204 HB3 GLU 27 3HB GLU 27 20.160 -12.721 -7.609 205 HG2 GLU 27 2HG GLU 27 19.669 -15.655 -8.054 206 HG3 GLU 27 3HG GLU 27 19.751 -14.393 -9.282 207 H VAL 28 H VAL 28 20.201 -11.464 -6.125 208 HA VAL 28 HA VAL 28 19.257 -11.055 -3.370 209 HB VAL 28 HB VAL 28 20.208 -8.842 -5.158 210 HG11 VAL 28 1HG1 VAL 28 20.757 -7.763 -3.068 211 HG12 VAL 28 2HG1 VAL 28 19.085 -8.324 -3.018 212 HG13 VAL 28 3HG1 VAL 28 20.343 -9.223 -2.170 213 HG21 VAL 28 3HG2 VAL 28 22.478 -9.159 -4.227 214 HG22 VAL 28 1HG2 VAL 28 21.943 -10.682 -3.516 215 HG23 VAL 28 2HG2 VAL 28 21.972 -10.489 -5.268 216 H THR 29 H THR 29 17.329 -10.127 -2.950 217 HA THR 29 HA THR 29 15.715 -9.253 -5.258 218 HB THR 29 HB THR 29 14.838 -11.351 -4.403 219 HG1 THR 29 HG1 THR 29 13.211 -10.011 -5.059 220 HG21 THR 29 3HG2 THR 29 14.202 -11.722 -2.165 221 HG22 THR 29 1HG2 THR 29 14.339 -10.013 -1.755 222 HG23 THR 29 2HG2 THR 29 15.792 -10.965 -2.065 223 H GLN 30 H GLN 30 17.145 -8.331 -2.373 224 HA GLN 30 HA GLN 30 15.158 -6.309 -1.709 225 HB2 GLN 30 2HB GLN 30 17.602 -7.398 -0.400 226 HB3 GLN 30 3HB GLN 30 17.119 -5.755 0.003 227 HG2 GLN 30 2HG GLN 30 16.065 -6.990 1.630 228 HG3 GLN 30 3HG GLN 30 14.793 -6.800 0.424 229 HE21 GLN 30 2HE2 GLN 30 16.659 -10.444 0.574 230 HE22 GLN 30 1HE2 GLN 30 17.572 -8.985 0.723 231 H THR 31 H THR 31 17.096 -6.429 -4.144 232 HA THR 31 HA THR 31 18.201 -3.716 -3.825 233 HB THR 31 HB THR 31 19.514 -4.478 -5.979 234 HG1 THR 31 HG1 THR 31 18.972 -6.958 -4.677 235 HG21 THR 31 3HG2 THR 31 20.590 -5.847 -3.598 236 HG22 THR 31 1HG2 THR 31 20.182 -4.145 -3.382 237 HG23 THR 31 2HG2 THR 31 21.328 -4.626 -4.634 238 H TYR 32 H TYR 32 15.461 -4.795 -4.748 239 HA TYR 32 HA TYR 32 15.368 -3.256 -7.260 240 HB2 TYR 32 2HB TYR 32 13.894 -5.767 -6.481 241 HB3 TYR 32 3HB TYR 32 13.332 -4.722 -7.781 242 HD1 TYR 32 HD1 TYR 32 15.952 -7.058 -6.718 243 HD2 TYR 32 HD2 TYR 32 14.528 -4.595 -9.882 244 HE1 TYR 32 HE1 TYR 32 17.472 -8.197 -8.280 245 HE2 TYR 32 HE2 TYR 32 16.042 -5.729 -11.453 246 HH TYR 32 HH TYR 32 17.640 -7.247 -11.700 247 H THR 33 H THR 33 13.636 -1.867 -7.569 248 HA THR 33 HA THR 33 11.488 -1.676 -5.675 249 HB THR 33 HB THR 33 13.615 0.472 -5.685 250 HG1 THR 33 HG1 THR 33 13.814 -0.086 -3.519 251 HG21 THR 33 3HG2 THR 33 12.041 1.503 -3.940 252 HG22 THR 33 1HG2 THR 33 10.798 0.465 -4.636 253 HG23 THR 33 2HG2 THR 33 11.600 1.675 -5.638 254 H GLY 34 H GLY 34 9.804 -0.376 -6.397 255 HA2 GLY 34 2HA GLY 34 10.166 1.351 -8.690 256 HA3 GLY 34 3HA GLY 34 9.271 -0.122 -9.031 257 H SER 35 H SER 35 7.955 -0.277 -6.483 258 HA SER 35 HA SER 35 6.020 1.905 -6.860 259 HB2 SER 35 2HB SER 35 5.700 -0.901 -6.619 260 HB3 SER 35 3HB SER 35 5.011 -0.179 -5.165 261 HG SER 35 HG SER 35 3.835 1.237 -6.610 262 H ASN 36 H ASN 36 5.299 3.124 -5.145 263 HA ASN 36 HA ASN 36 5.391 4.204 -3.146 264 HB2 ASN 36 2HB ASN 36 5.108 1.538 -2.529 265 HB3 ASN 36 3HB ASN 36 6.527 1.992 -1.591 266 HD21 ASN 36 2HD2 ASN 36 4.726 4.403 0.372 267 HD22 ASN 36 1HD2 ASN 36 6.214 4.224 -0.487 268 H GLY 37 H GLY 37 7.731 4.136 -4.907 269 HA2 GLY 37 2HA GLY 37 9.542 5.585 -3.379 270 HA3 GLY 37 3HA GLY 37 10.107 3.921 -3.368 271 H GLY 38 H GLY 38 10.143 2.893 -5.641 272 HA2 GLY 38 2HA GLY 38 10.841 2.940 -7.844 273 HA3 GLY 38 3HA GLY 38 10.567 4.676 -7.852 274 H ALA 39 H ALA 39 12.855 2.134 -7.066 275 HA ALA 39 HA ALA 39 15.089 3.582 -7.920 276 HB1 ALA 39 1HB ALA 39 15.245 5.010 -6.172 277 HB2 ALA 39 2HB ALA 39 14.368 3.941 -5.076 278 HB3 ALA 39 3HB ALA 39 16.069 3.638 -5.431 279 H ASP 40 H ASP 40 15.149 1.421 -8.852 280 HA ASP 40 HA ASP 40 15.761 -0.809 -7.123 281 HB2 ASP 40 2HB ASP 40 15.986 -2.084 -9.216 282 HB3 ASP 40 3HB ASP 40 14.477 -1.177 -9.173 283 H LEU 41 H LEU 41 17.698 -0.982 -6.217 284 HA LEU 41 HA LEU 41 20.072 -1.121 -7.753 285 HB2 LEU 41 2HB LEU 41 19.397 1.452 -7.246 286 HB3 LEU 41 3HB LEU 41 20.378 1.085 -5.829 287 HG LEU 41 HG LEU 41 22.075 0.219 -7.657 288 HD11 LEU 41 1HD1 LEU 41 20.451 2.274 -9.148 289 HD12 LEU 41 2HD1 LEU 41 20.603 0.565 -9.555 290 HD13 LEU 41 3HD1 LEU 41 22.008 1.625 -9.662 291 HD21 LEU 41 3HD2 LEU 41 21.734 3.178 -7.245 292 HD22 LEU 41 1HD2 LEU 41 23.229 2.270 -7.468 293 HD23 LEU 41 2HD2 LEU 41 22.305 2.095 -5.975 294 H MET 42 H MET 42 21.989 -0.599 -5.848 295 HA MET 42 HA MET 42 21.261 -2.496 -3.715 296 HB2 MET 42 2HB MET 42 22.943 -3.412 -5.207 297 HB3 MET 42 3HB MET 42 23.943 -1.979 -5.009 298 HG2 MET 42 2HG MET 42 23.448 -2.980 -2.428 299 HG3 MET 42 3HG MET 42 23.866 -4.360 -3.440 300 HE1 MET 42 3HE MET 42 27.156 -4.607 -3.835 301 HE2 MET 42 1HE MET 42 25.640 -4.682 -4.734 302 HE3 MET 42 2HE MET 42 26.873 -3.502 -5.181 303 H GLY 43 H GLY 43 21.337 -1.803 -1.675 304 HA2 GLY 43 2HA GLY 43 23.254 -0.025 -0.633 305 HA3 GLY 43 3HA GLY 43 21.798 0.883 -1.013 306 HA PRO 44 HA PRO 44 19.855 -0.337 2.717 307 HB2 PRO 44 2HB PRO 44 17.354 -1.088 1.975 308 HB3 PRO 44 3HB PRO 44 17.898 0.594 1.954 309 HG2 PRO 44 2HG PRO 44 17.696 -1.361 -0.305 310 HG3 PRO 44 3HG PRO 44 17.240 0.353 -0.263 311 HD2 PRO 44 2HD PRO 44 19.556 -0.511 -1.367 312 HD3 PRO 44 3HD PRO 44 19.409 1.068 -0.569 313 H ALA 45 H ALA 45 19.932 -2.689 0.156 314 HA ALA 45 HA ALA 45 18.916 -4.915 1.555 315 HB1 ALA 45 1HB ALA 45 19.089 -4.987 -0.833 316 HB2 ALA 45 2HB ALA 45 20.837 -4.756 -0.761 317 HB3 ALA 45 3HB ALA 45 20.120 -6.253 -0.164 318 H PHE 46 H PHE 46 22.245 -3.762 1.074 319 HA PHE 46 HA PHE 46 23.386 -5.833 2.687 320 HB2 PHE 46 2HB PHE 46 24.358 -3.970 0.856 321 HB3 PHE 46 3HB PHE 46 25.057 -3.474 2.393 322 HD1 PHE 46 HD1 PHE 46 27.011 -4.462 3.104 323 HD2 PHE 46 HD2 PHE 46 24.547 -6.518 0.307 324 HE1 PHE 46 HE1 PHE 46 28.721 -6.219 2.893 325 HE2 PHE 46 HE2 PHE 46 26.252 -8.278 0.093 326 HZ PHE 46 HZ PHE 46 28.342 -8.130 1.388 327 H ALA 47 H ALA 47 21.721 -3.011 3.400 328 HA ALA 47 HA ALA 47 23.092 -2.073 5.679 329 HB1 ALA 47 1HB ALA 47 20.195 -1.759 5.788 330 HB2 ALA 47 2HB ALA 47 21.469 -0.539 5.751 331 HB3 ALA 47 3HB ALA 47 20.896 -1.262 4.248 332 H ALA 48 H ALA 48 20.665 -4.580 5.227 333 HA ALA 48 HA ALA 48 20.597 -5.102 8.105 334 HB1 ALA 48 1HB ALA 48 18.672 -6.407 7.726 335 HB2 ALA 48 2HB ALA 48 18.496 -4.990 6.690 336 HB3 ALA 48 3HB ALA 48 19.000 -6.531 5.998 337 H GLY 49 H GLY 49 21.964 -6.312 5.179 338 HA2 GLY 49 2HA GLY 49 23.873 -7.786 5.336 339 HA3 GLY 49 3HA GLY 49 23.090 -8.575 6.697 340 H LEU 50 H LEU 50 21.020 -7.811 4.095 341 HA LEU 50 HA LEU 50 20.390 -10.532 3.620 342 HB2 LEU 50 2HB LEU 50 19.720 -8.201 1.838 343 HB3 LEU 50 3HB LEU 50 18.862 -9.735 1.971 344 HG LEU 50 HG LEU 50 18.935 -8.358 4.512 345 HD11 LEU 50 1HD1 LEU 50 17.100 -6.719 3.341 346 HD12 LEU 50 2HD1 LEU 50 18.382 -6.752 2.130 347 HD13 LEU 50 3HD1 LEU 50 18.742 -6.252 3.783 348 HD21 LEU 50 3HD2 LEU 50 16.376 -8.647 3.146 349 HD22 LEU 50 1HD2 LEU 50 16.925 -9.317 4.682 350 HD23 LEU 50 2HD2 LEU 50 17.324 -10.134 3.171 351 H ARG 51 H ARG 51 21.682 -11.908 2.599 352 HA ARG 51 HA ARG 51 22.818 -11.126 0.023 353 HB2 ARG 51 2HB ARG 51 24.359 -11.441 2.408 354 HB3 ARG 51 3HB ARG 51 24.757 -12.756 1.311 355 HG2 ARG 51 2HG ARG 51 24.644 -10.084 0.089 356 HG3 ARG 51 3HG ARG 51 25.936 -10.337 1.265 357 HD2 ARG 51 2HD ARG 51 26.208 -12.594 -0.119 358 HD3 ARG 51 3HD ARG 51 25.497 -11.594 -1.385 359 HE ARG 51 HE ARG 51 27.502 -10.536 -1.574 360 HH11 ARG 51 1HH1 ARG 51 27.310 -11.969 1.593 361 HH12 ARG 51 2HH1 ARG 51 28.924 -11.523 2.036 362 HH21 ARG 51 2HH2 ARG 51 30.242 -10.369 0.559 363 HH22 ARG 51 1HH2 ARG 51 29.629 -9.942 -1.002 364 H VAL 52 H VAL 52 23.449 -12.952 -1.302 365 HA VAL 52 HA VAL 52 21.564 -14.990 -1.383 366 HB VAL 52 HB VAL 52 22.973 -16.090 -3.028 367 HG11 VAL 52 1HG1 VAL 52 23.201 -14.276 -4.621 368 HG12 VAL 52 2HG1 VAL 52 21.720 -14.074 -3.683 369 HG13 VAL 52 3HG1 VAL 52 23.138 -13.092 -3.316 370 HG21 VAL 52 3HG2 VAL 52 25.091 -14.509 -1.700 371 HG22 VAL 52 1HG2 VAL 52 25.154 -16.120 -2.416 372 HG23 VAL 52 2HG2 VAL 52 25.220 -14.692 -3.449 373 H GLY 53 H GLY 53 21.370 -16.949 -0.465 374 HA2 GLY 53 2HA GLY 53 22.683 -18.968 0.267 375 HA3 GLY 53 3HA GLY 53 23.590 -17.843 1.268 376 H ASP 54 H ASP 54 21.042 -16.333 1.810 377 HA ASP 54 HA ASP 54 20.157 -18.047 4.008 378 HB2 ASP 54 2HB ASP 54 19.945 -15.088 3.478 379 HB3 ASP 54 3HB ASP 54 19.017 -15.869 4.755 380 H GLN 55 H GLN 55 18.310 -19.123 3.887 381 HA GLN 55 HA GLN 55 16.527 -18.795 1.681 382 HB2 GLN 55 2HB GLN 55 15.918 -20.373 4.170 383 HB3 GLN 55 3HB GLN 55 15.363 -20.665 2.527 384 HG2 GLN 55 2HG GLN 55 17.664 -21.246 1.879 385 HG3 GLN 55 3HG GLN 55 18.170 -21.019 3.552 386 HE21 GLN 55 2HE2 GLN 55 15.935 -24.280 2.506 387 HE22 GLN 55 1HE2 GLN 55 15.913 -22.848 1.539 388 H LEU 56 H LEU 56 14.985 -17.322 1.513 389 HA LEU 56 HA LEU 56 14.118 -15.806 3.806 390 HB2 LEU 56 2HB LEU 56 13.584 -15.697 0.866 391 HB3 LEU 56 3HB LEU 56 12.570 -14.788 1.984 392 HG LEU 56 HG LEU 56 14.276 -13.355 1.043 393 HD11 LEU 56 1HD1 LEU 56 15.207 -13.857 3.837 394 HD12 LEU 56 2HD1 LEU 56 13.562 -13.297 3.537 395 HD13 LEU 56 3HD1 LEU 56 14.934 -12.328 3.002 396 HD21 LEU 56 3HD2 LEU 56 15.872 -15.543 0.991 397 HD22 LEU 56 1HD2 LEU 56 16.524 -14.686 2.388 398 HD23 LEU 56 2HD2 LEU 56 16.450 -13.885 0.819 399 H VAL 57 H VAL 57 12.690 -16.687 5.154 400 HA VAL 57 HA VAL 57 10.531 -18.352 4.061 401 HB VAL 57 HB VAL 57 11.491 -18.060 6.911 402 HG11 VAL 57 1HG1 VAL 57 9.028 -19.069 5.833 403 HG12 VAL 57 2HG1 VAL 57 9.929 -20.368 6.616 404 HG13 VAL 57 3HG1 VAL 57 9.528 -18.905 7.516 405 HG21 VAL 57 3HG2 VAL 57 12.870 -19.785 6.567 406 HG22 VAL 57 1HG2 VAL 57 11.655 -20.682 5.656 407 HG23 VAL 57 2HG2 VAL 57 12.646 -19.469 4.846 408 H ARG 58 H ARG 58 10.993 -15.877 6.591 409 HA ARG 58 HA ARG 58 9.580 -14.315 7.461 410 HB2 ARG 58 2HB ARG 58 9.912 -13.571 5.026 411 HB3 ARG 58 3HB ARG 58 8.298 -14.208 4.739 412 HG2 ARG 58 2HG ARG 58 8.264 -11.802 5.126 413 HG3 ARG 58 3HG ARG 58 7.377 -12.671 6.380 414 HD2 ARG 58 2HD ARG 58 10.202 -12.275 7.004 415 HD3 ARG 58 3HD ARG 58 9.308 -10.769 6.807 416 HE ARG 58 HE ARG 58 9.144 -12.556 8.997 417 HH11 ARG 58 1HH1 ARG 58 7.199 -10.462 7.009 418 HH12 ARG 58 2HH1 ARG 58 6.020 -10.168 8.244 419 HH21 ARG 58 2HH2 ARG 58 6.249 -11.144 10.304 420 HH22 ARG 58 1HH2 ARG 58 7.599 -12.177 10.631 421 H PHE 59 H PHE 59 8.733 -17.132 7.521 422 HA PHE 59 HA PHE 59 5.915 -16.647 8.117 423 HB2 PHE 59 2HB PHE 59 6.939 -18.820 6.290 424 HB3 PHE 59 3HB PHE 59 5.364 -18.901 7.072 425 HD1 PHE 59 HD1 PHE 59 4.286 -16.264 6.865 426 HD2 PHE 59 HD2 PHE 59 6.651 -18.411 4.052 427 HE1 PHE 59 HE1 PHE 59 3.310 -14.937 5.037 428 HE2 PHE 59 HE2 PHE 59 5.679 -17.087 2.220 429 HZ PHE 59 HZ PHE 59 4.007 -15.347 2.711 430 H ALA 60 H ALA 60 5.086 -17.911 9.769 431 HA ALA 60 HA ALA 60 7.004 -18.970 11.603 432 HB1 ALA 60 1HB ALA 60 4.011 -18.765 11.611 433 HB2 ALA 60 2HB ALA 60 4.882 -19.625 12.881 434 HB3 ALA 60 3HB ALA 60 5.185 -17.909 12.612 435 H GLY 61 H GLY 61 7.984 -20.843 11.109 436 HA2 GLY 61 2HA GLY 61 7.307 -23.302 11.483 437 HA3 GLY 61 3HA GLY 61 6.346 -23.041 10.035 438 H TYR 62 H TYR 62 8.936 -21.166 9.539 439 HA TYR 62 HA TYR 62 10.793 -21.311 8.236 440 HB2 TYR 62 2HB TYR 62 11.104 -24.171 9.120 441 HB3 TYR 62 3HB TYR 62 12.359 -23.009 8.706 442 HD1 TYR 62 HD1 TYR 62 11.453 -24.798 11.323 443 HD2 TYR 62 HD2 TYR 62 11.674 -20.676 10.295 444 HE1 TYR 62 HE1 TYR 62 11.697 -24.224 13.702 445 HE2 TYR 62 HE2 TYR 62 11.920 -20.090 12.671 446 HH TYR 62 HH TYR 62 11.224 -21.242 14.931 447 H THR 63 H THR 63 8.306 -21.863 7.030 448 HA THR 63 HA THR 63 9.101 -23.807 4.960 449 HB THR 63 HB THR 63 7.220 -24.767 6.036 450 HG1 THR 63 HG1 THR 63 5.628 -24.620 4.345 451 HG21 THR 63 3HG2 THR 63 5.111 -22.942 5.768 452 HG22 THR 63 1HG2 THR 63 6.452 -22.019 6.446 453 HG23 THR 63 2HG2 THR 63 5.880 -23.474 7.263 454 H VAL 64 H VAL 64 8.474 -23.331 2.794 455 HA VAL 64 HA VAL 64 7.535 -20.616 2.254 456 HB VAL 64 HB VAL 64 10.005 -21.667 0.885 457 HG11 VAL 64 1HG1 VAL 64 10.254 -19.216 0.346 458 HG12 VAL 64 2HG1 VAL 64 8.897 -20.035 -0.430 459 HG13 VAL 64 3HG1 VAL 64 8.619 -18.998 0.969 460 HG21 VAL 64 3HG2 VAL 64 10.811 -21.403 3.043 461 HG22 VAL 64 1HG2 VAL 64 11.118 -19.822 2.326 462 HG23 VAL 64 2HG2 VAL 64 9.732 -20.053 3.391 463 H THR 65 H THR 65 6.790 -20.303 0.081 464 HA THR 65 HA THR 65 5.880 -22.809 -1.138 465 HB THR 65 HB THR 65 4.897 -20.067 -1.894 466 HG1 THR 65 HG1 THR 65 4.692 -20.424 0.419 467 HG21 THR 65 3HG2 THR 65 2.859 -22.004 -1.884 468 HG22 THR 65 1HG2 THR 65 4.264 -22.773 -2.621 469 HG23 THR 65 2HG2 THR 65 3.635 -21.266 -3.285 470 H GLU 66 H GLU 66 6.812 -19.580 -2.349 471 HA GLU 66 HA GLU 66 8.909 -20.459 -3.980 472 HB2 GLU 66 2HB GLU 66 7.781 -20.214 -6.214 473 HB3 GLU 66 3HB GLU 66 7.324 -21.649 -5.307 474 HG2 GLU 66 2HG GLU 66 5.242 -20.652 -4.662 475 HG3 GLU 66 3HG GLU 66 5.710 -19.112 -5.382 476 H LEU 67 H LEU 67 9.066 -18.753 -5.984 477 HA LEU 67 HA LEU 67 9.666 -16.303 -4.845 478 HB2 LEU 67 2HB LEU 67 9.653 -15.438 -7.201 479 HB3 LEU 67 3HB LEU 67 10.656 -16.858 -6.912 480 HG LEU 67 HG LEU 67 8.533 -18.140 -7.783 481 HD11 LEU 67 1HD1 LEU 67 7.941 -15.344 -8.369 482 HD12 LEU 67 2HD1 LEU 67 6.878 -16.750 -8.347 483 HD13 LEU 67 3HD1 LEU 67 7.847 -16.399 -9.779 484 HD21 LEU 67 3HD2 LEU 67 9.498 -18.168 -9.976 485 HD22 LEU 67 1HD2 LEU 67 10.806 -18.063 -8.797 486 HD23 LEU 67 2HD2 LEU 67 10.309 -16.627 -9.692 487 H ALA 68 H ALA 68 6.657 -17.455 -6.198 488 HA ALA 68 HA ALA 68 5.341 -14.984 -6.484 489 HB1 ALA 68 1HB ALA 68 4.608 -17.206 -7.415 490 HB2 ALA 68 2HB ALA 68 4.008 -17.594 -5.802 491 HB3 ALA 68 3HB ALA 68 3.334 -16.227 -6.688 492 H ALA 69 H ALA 69 5.628 -17.207 -3.751 493 HA ALA 69 HA ALA 69 3.804 -15.888 -2.045 494 HB1 ALA 69 1HB ALA 69 4.255 -18.006 -1.307 495 HB2 ALA 69 2HB ALA 69 5.978 -17.887 -1.670 496 HB3 ALA 69 3HB ALA 69 5.317 -17.074 -0.251 497 H PHE 70 H PHE 70 7.223 -15.430 -2.702 498 HA PHE 70 HA PHE 70 7.624 -13.587 -0.535 499 HB2 PHE 70 2HB PHE 70 9.498 -14.910 -1.332 500 HB3 PHE 70 3HB PHE 70 9.326 -14.237 -2.950 501 HD1 PHE 70 HD1 PHE 70 10.604 -13.712 0.402 502 HD2 PHE 70 HD2 PHE 70 9.938 -11.900 -3.391 503 HE1 PHE 70 HE1 PHE 70 12.161 -11.902 0.997 504 HE2 PHE 70 HE2 PHE 70 11.494 -10.088 -2.803 505 HZ PHE 70 HZ PHE 70 12.609 -10.087 -0.607 506 H ASN 71 H ASN 71 6.859 -13.377 -3.949 507 HA ASN 71 HA ASN 71 7.377 -10.658 -4.362 508 HB2 ASN 71 2HB ASN 71 6.538 -12.681 -5.950 509 HB3 ASN 71 3HB ASN 71 5.025 -11.801 -5.751 510 HD21 ASN 71 2HD2 ASN 71 5.919 -9.754 -8.379 511 HD22 ASN 71 1HD2 ASN 71 4.773 -10.821 -7.649 512 H THR 72 H THR 72 4.609 -12.308 -2.971 513 HA THR 72 HA THR 72 2.905 -10.018 -2.919 514 HB THR 72 HB THR 72 2.104 -11.793 -0.871 515 HG1 THR 72 HG1 THR 72 2.583 -13.297 -3.210 516 HG21 THR 72 3HG2 THR 72 1.218 -11.190 -3.669 517 HG22 THR 72 1HG2 THR 72 0.436 -10.786 -2.142 518 HG23 THR 72 2HG2 THR 72 0.415 -12.449 -2.731 519 H VAL 73 H VAL 73 5.116 -11.526 -0.619 520 HA VAL 73 HA VAL 73 4.412 -9.869 1.586 521 HB VAL 73 HB VAL 73 6.901 -11.501 1.071 522 HG11 VAL 73 1HG1 VAL 73 6.739 -11.228 3.771 523 HG12 VAL 73 2HG1 VAL 73 7.775 -10.255 2.724 524 HG13 VAL 73 3HG1 VAL 73 6.200 -9.640 3.228 525 HG21 VAL 73 3HG2 VAL 73 5.187 -13.038 1.282 526 HG22 VAL 73 1HG2 VAL 73 5.739 -12.877 2.949 527 HG23 VAL 73 2HG2 VAL 73 4.284 -12.034 2.417 528 H VAL 74 H VAL 74 7.161 -9.839 -0.677 529 HA VAL 74 HA VAL 74 8.445 -7.576 0.346 530 HB VAL 74 HB VAL 74 9.534 -9.070 -1.246 531 HG11 VAL 74 1HG1 VAL 74 7.325 -9.239 -2.624 532 HG12 VAL 74 2HG1 VAL 74 7.998 -7.867 -3.507 533 HG13 VAL 74 3HG1 VAL 74 8.884 -9.391 -3.434 534 HG21 VAL 74 3HG2 VAL 74 9.471 -6.512 -2.749 535 HG22 VAL 74 1HG2 VAL 74 9.937 -6.451 -1.050 536 HG23 VAL 74 2HG2 VAL 74 10.846 -7.457 -2.178 537 H ALA 75 H ALA 75 5.872 -7.886 -2.049 538 HA ALA 75 HA ALA 75 5.817 -5.247 -2.967 539 HB1 ALA 75 1HB ALA 75 4.004 -7.548 -3.013 540 HB2 ALA 75 2HB ALA 75 3.201 -5.980 -3.108 541 HB3 ALA 75 3HB ALA 75 4.434 -6.413 -4.293 542 H ARG 76 H ARG 76 4.156 -6.758 -0.223 543 HA ARG 76 HA ARG 76 2.845 -4.311 0.533 544 HB2 ARG 76 2HB ARG 76 2.997 -7.082 1.643 545 HB3 ARG 76 3HB ARG 76 2.443 -5.779 2.686 546 HG2 ARG 76 2HG ARG 76 0.481 -6.639 1.804 547 HG3 ARG 76 3HG ARG 76 0.802 -5.235 0.784 548 HD2 ARG 76 2HD ARG 76 1.941 -6.810 -0.821 549 HD3 ARG 76 3HD ARG 76 1.299 -8.135 0.148 550 HE ARG 76 HE ARG 76 -0.885 -6.619 -0.438 551 HH11 ARG 76 1HH1 ARG 76 1.612 -8.143 -2.325 552 HH12 ARG 76 2HH1 ARG 76 0.593 -8.402 -3.702 553 HH21 ARG 76 2HH2 ARG 76 -1.595 -7.725 -3.656 554 HH22 ARG 76 1HH2 ARG 76 -2.236 -6.954 -2.245 555 H HIS 77 H HIS 77 5.823 -5.919 1.278 556 HA HIS 77 HA HIS 77 6.337 -4.480 3.708 557 HB2 HIS 77 2HB HIS 77 7.807 -6.427 2.011 558 HB3 HIS 77 3HB HIS 77 8.776 -5.368 3.032 559 HD1 HIS 77 HD1 HIS 77 9.328 -7.836 4.111 560 HD2 HIS 77 HD2 HIS 77 5.576 -6.212 4.855 561 HE1 HIS 77 HE1 HIS 77 8.438 -9.085 6.105 562 H VAL 78 H VAL 78 6.905 -3.972 0.321 563 HA VAL 78 HA VAL 78 9.020 -2.194 0.321 564 HB VAL 78 HB VAL 78 6.570 -2.322 -1.423 565 HG11 VAL 78 1HG1 VAL 78 8.633 -0.233 -1.275 566 HG12 VAL 78 2HG1 VAL 78 8.317 -0.867 -2.891 567 HG13 VAL 78 3HG1 VAL 78 7.002 -0.174 -1.941 568 HG21 VAL 78 3HG2 VAL 78 9.110 -2.744 -2.705 569 HG22 VAL 78 1HG2 VAL 78 8.942 -3.801 -1.304 570 HG23 VAL 78 2HG2 VAL 78 7.725 -3.829 -2.581 571 H ARG 79 H ARG 79 9.164 -0.647 1.856 572 HA ARG 79 HA ARG 79 7.337 1.592 1.667 573 HB2 ARG 79 2HB ARG 79 7.308 -0.297 3.917 574 HB3 ARG 79 3HB ARG 79 7.466 1.388 4.396 575 HG2 ARG 79 2HG ARG 79 5.462 1.567 2.591 576 HG3 ARG 79 3HG ARG 79 5.179 -0.046 3.247 577 HD2 ARG 79 2HD ARG 79 5.363 1.010 5.544 578 HD3 ARG 79 3HD ARG 79 5.289 2.570 4.727 579 HE ARG 79 HE ARG 79 3.126 1.092 3.826 580 HH11 ARG 79 1HH1 ARG 79 4.290 2.383 6.842 581 HH12 ARG 79 2HH1 ARG 79 2.707 2.580 7.519 582 HH21 ARG 79 2HH2 ARG 79 0.858 1.989 6.303 583 HH22 ARG 79 1HH2 ARG 79 1.037 1.346 4.705 584 HA PRO 80 HA PRO 80 10.935 3.944 2.539 585 HB2 PRO 80 2HB PRO 80 9.918 6.058 3.905 586 HB3 PRO 80 3HB PRO 80 9.671 5.827 2.170 587 HG2 PRO 80 2HG PRO 80 7.832 5.197 4.446 588 HG3 PRO 80 3HG PRO 80 7.461 5.946 2.882 589 HD2 PRO 80 2HD PRO 80 6.975 3.332 3.398 590 HD3 PRO 80 3HD PRO 80 7.415 3.921 1.782 591 H SER 81 H SER 81 12.310 2.932 3.917 592 HA SER 81 HA SER 81 13.398 2.391 5.840 593 HB2 SER 81 2HB SER 81 12.976 4.963 6.108 594 HB3 SER 81 3HB SER 81 11.825 4.457 7.344 595 HG SER 81 HG SER 81 14.424 3.398 7.366 596 H ALA 82 H ALA 82 11.102 0.904 5.219 597 HA ALA 82 HA ALA 82 9.614 0.530 7.685 598 HB1 ALA 82 1HB ALA 82 9.311 -0.277 4.887 599 HB2 ALA 82 2HB ALA 82 8.832 -1.509 6.055 600 HB3 ALA 82 3HB ALA 82 8.088 0.090 6.104 601 H SER 83 H SER 83 10.728 -0.463 9.258 602 HA SER 83 HA SER 83 12.376 -2.794 8.570 603 HB2 SER 83 2HB SER 83 12.387 -1.663 11.325 604 HB3 SER 83 3HB SER 83 13.717 -2.323 10.373 605 HG SER 83 HG SER 83 14.029 -0.140 10.462 606 H ILE 84 H ILE 84 11.415 -4.696 8.776 607 HA ILE 84 HA ILE 84 9.604 -5.117 11.059 608 HB ILE 84 HB ILE 84 8.499 -6.845 9.410 609 HG12 ILE 84 2HG1 ILE 84 8.407 -5.987 7.104 610 HG13 ILE 84 3HG1 ILE 84 9.559 -4.725 7.527 611 HG21 ILE 84 1HG2 ILE 84 7.007 -5.344 10.231 612 HG22 ILE 84 2HG2 ILE 84 8.016 -3.954 9.833 613 HG23 ILE 84 3HG2 ILE 84 7.080 -4.755 8.571 614 HD11 ILE 84 3HD1 ILE 84 10.392 -7.506 8.052 615 HD12 ILE 84 1HD1 ILE 84 10.262 -7.014 6.364 616 HD13 ILE 84 2HD1 ILE 84 11.322 -6.130 7.462 617 HA PRO 85 HA PRO 85 11.912 -8.727 12.008 618 HB2 PRO 85 2HB PRO 85 9.980 -10.421 12.883 619 HB3 PRO 85 3HB PRO 85 10.519 -9.018 13.813 620 HG2 PRO 85 2HG PRO 85 8.106 -9.319 12.068 621 HG3 PRO 85 3HG PRO 85 8.246 -8.553 13.661 622 HD2 PRO 85 2HD PRO 85 8.194 -7.129 11.358 623 HD3 PRO 85 3HD PRO 85 9.109 -6.603 12.786 624 H VAL 86 H VAL 86 12.681 -10.533 11.034 625 HA VAL 86 HA VAL 86 10.992 -11.957 9.114 626 HB VAL 86 HB VAL 86 13.742 -10.906 8.432 627 HG11 VAL 86 1HG1 VAL 86 12.649 -11.815 6.111 628 HG12 VAL 86 2HG1 VAL 86 13.782 -12.722 7.114 629 HG13 VAL 86 3HG1 VAL 86 12.047 -12.997 7.272 630 HG21 VAL 86 3HG2 VAL 86 12.217 -9.856 6.542 631 HG22 VAL 86 1HG2 VAL 86 10.987 -9.988 7.799 632 HG23 VAL 86 2HG2 VAL 86 12.451 -9.051 8.093 633 H VAL 87 H VAL 87 11.530 -14.107 8.808 634 HA VAL 87 HA VAL 87 13.540 -15.164 10.683 635 HB VAL 87 HB VAL 87 11.082 -16.495 9.538 636 HG11 VAL 87 1HG1 VAL 87 11.949 -18.145 11.506 637 HG12 VAL 87 2HG1 VAL 87 12.299 -18.370 9.791 638 HG13 VAL 87 3HG1 VAL 87 13.482 -17.584 10.838 639 HG21 VAL 87 3HG2 VAL 87 11.761 -15.269 12.173 640 HG22 VAL 87 1HG2 VAL 87 10.275 -15.161 11.230 641 HG23 VAL 87 2HG2 VAL 87 10.650 -16.638 12.117 642 H PHE 88 H PHE 88 15.337 -15.935 9.814 643 HA PHE 88 HA PHE 88 15.231 -17.003 7.069 644 HB2 PHE 88 2HB PHE 88 17.466 -16.192 6.691 645 HB3 PHE 88 3HB PHE 88 16.494 -14.855 7.297 646 HD1 PHE 88 HD1 PHE 88 16.646 -14.330 9.797 647 HD2 PHE 88 HD2 PHE 88 19.462 -16.760 7.727 648 HE1 PHE 88 HE1 PHE 88 18.290 -13.944 11.587 649 HE2 PHE 88 HE2 PHE 88 21.109 -16.379 9.514 650 HZ PHE 88 HZ PHE 88 20.524 -14.969 11.447 651 H SER 89 H SER 89 16.718 -18.726 6.575 652 HA SER 89 HA SER 89 17.546 -20.264 8.949 653 HB2 SER 89 2HB SER 89 16.882 -22.308 7.871 654 HB3 SER 89 3HB SER 89 15.518 -21.193 7.780 655 HG SER 89 HG SER 89 16.334 -22.431 5.793 656 H ARG 90 H ARG 90 19.438 -21.496 8.776 657 HA ARG 90 HA ARG 90 21.125 -20.855 6.446 658 HB2 ARG 90 2HB ARG 90 21.651 -19.805 8.788 659 HB3 ARG 90 3HB ARG 90 22.295 -21.401 9.148 660 HG2 ARG 90 2HG ARG 90 23.415 -20.794 6.702 661 HG3 ARG 90 3HG ARG 90 23.423 -19.253 7.563 662 HD2 ARG 90 2HD ARG 90 24.912 -19.973 9.111 663 HD3 ARG 90 3HD ARG 90 24.287 -21.622 9.101 664 HE ARG 90 HE ARG 90 25.598 -21.061 6.662 665 HH11 ARG 90 1HH1 ARG 90 26.241 -21.695 10.024 666 HH12 ARG 90 2HH1 ARG 90 27.808 -22.374 9.731 667 HH21 ARG 90 2HH2 ARG 90 28.614 -22.519 7.591 668 HH22 ARG 90 1HH2 ARG 90 27.659 -21.952 6.263 669 H ASP 91 H ASP 91 20.277 -22.870 5.558 670 HA ASP 91 HA ASP 91 20.505 -25.061 4.990 671 HB2 ASP 91 2HB ASP 91 22.915 -25.329 6.746 672 HB3 ASP 91 3HB ASP 91 22.614 -26.014 5.152 673 H GLY 92 H GLY 92 18.822 -24.455 7.155 674 HA2 GLY 92 2HA GLY 92 17.522 -26.065 8.357 675 HA3 GLY 92 3HA GLY 92 18.988 -26.998 8.623 676 H VAL 93 H VAL 93 19.425 -23.668 9.078 677 HA VAL 93 HA VAL 93 19.489 -24.072 11.981 678 HB VAL 93 HB VAL 93 20.719 -21.896 10.284 679 HG11 VAL 93 1HG1 VAL 93 21.953 -21.495 12.540 680 HG12 VAL 93 2HG1 VAL 93 20.345 -20.813 12.290 681 HG13 VAL 93 3HG1 VAL 93 20.541 -22.285 13.242 682 HG21 VAL 93 3HG2 VAL 93 22.363 -23.729 11.918 683 HG22 VAL 93 1HG2 VAL 93 21.597 -24.420 10.487 684 HG23 VAL 93 2HG2 VAL 93 22.677 -23.034 10.328 685 H VAL 94 H VAL 94 18.481 -22.662 13.413 686 HA VAL 94 HA VAL 94 16.347 -21.021 12.221 687 HB VAL 94 HB VAL 94 16.458 -22.281 14.965 688 HG11 VAL 94 1HG1 VAL 94 14.166 -21.513 15.220 689 HG12 VAL 94 2HG1 VAL 94 15.246 -20.146 14.938 690 HG13 VAL 94 3HG1 VAL 94 14.227 -20.751 13.631 691 HG21 VAL 94 3HG2 VAL 94 14.621 -22.962 12.679 692 HG22 VAL 94 1HG2 VAL 94 16.124 -23.825 13.004 693 HG23 VAL 94 2HG2 VAL 94 14.828 -23.830 14.200 694 H MET 95 H MET 95 16.823 -18.927 12.227 695 HA MET 95 HA MET 95 17.758 -17.695 14.696 696 HB2 MET 95 2HB MET 95 19.803 -18.185 13.394 697 HB3 MET 95 3HB MET 95 19.155 -17.252 12.051 698 HG2 MET 95 2HG MET 95 20.763 -15.946 13.287 699 HG3 MET 95 3HG MET 95 19.154 -15.247 13.446 700 HE1 MET 95 3HE MET 95 22.122 -16.297 16.422 701 HE2 MET 95 1HE MET 95 21.484 -17.886 16.000 702 HE3 MET 95 2HE MET 95 22.082 -16.813 14.735 703 H SER 96 H SER 96 17.165 -15.540 14.927 704 HA SER 96 HA SER 96 15.338 -14.525 12.849 705 HB2 SER 96 2HB SER 96 13.887 -13.719 14.475 706 HB3 SER 96 3HB SER 96 14.463 -15.208 15.226 707 HG SER 96 HG SER 96 16.002 -13.916 16.359 708 H ALA 97 H ALA 97 15.765 -12.596 11.980 709 HA ALA 97 HA ALA 97 17.486 -10.712 13.412 710 HB1 ALA 97 1HB ALA 97 18.940 -10.369 11.530 711 HB2 ALA 97 2HB ALA 97 18.937 -12.084 11.940 712 HB3 ALA 97 3HB ALA 97 18.013 -11.508 10.553 713 H THR 98 H THR 98 17.030 -8.589 13.028 714 HA THR 98 HA THR 98 14.554 -8.031 11.642 715 HB THR 98 HB THR 98 16.081 -5.729 12.639 716 HG1 THR 98 HG1 THR 98 15.877 -6.314 14.815 717 HG21 THR 98 3HG2 THR 98 13.762 -5.719 13.985 718 HG22 THR 98 1HG2 THR 98 13.309 -6.772 12.646 719 HG23 THR 98 2HG2 THR 98 13.907 -5.144 12.325 720 H ILE 99 H ILE 99 14.382 -7.314 9.625 721 HA ILE 99 HA ILE 99 16.786 -6.208 8.327 722 HB ILE 99 HB ILE 99 14.480 -7.560 6.929 723 HG12 ILE 99 2HG1 ILE 99 15.560 -9.212 8.329 724 HG13 ILE 99 3HG1 ILE 99 16.042 -9.485 6.658 725 HG21 ILE 99 1HG2 ILE 99 17.174 -7.366 5.732 726 HG22 ILE 99 2HG2 ILE 99 15.585 -7.229 4.982 727 HG23 ILE 99 3HG2 ILE 99 16.261 -5.864 5.870 728 HD11 ILE 99 3HD1 ILE 99 18.173 -8.424 7.072 729 HD12 ILE 99 1HD1 ILE 99 17.691 -8.052 8.726 730 HD13 ILE 99 2HD1 ILE 99 17.903 -9.730 8.226 731 H VAL 100 H VAL 100 16.689 -4.167 7.666 732 HA VAL 100 HA VAL 100 14.040 -2.894 7.448 733 HB VAL 100 HB VAL 100 15.280 -1.868 9.218 734 HG11 VAL 100 1HG1 VAL 100 17.512 -0.696 7.960 735 HG12 VAL 100 2HG1 VAL 100 17.499 -1.924 9.228 736 HG13 VAL 100 3HG1 VAL 100 17.524 -2.407 7.531 737 HG21 VAL 100 3HG2 VAL 100 15.512 -0.084 6.797 738 HG22 VAL 100 1HG2 VAL 100 14.015 -0.387 7.680 739 HG23 VAL 100 2HG2 VAL 100 15.362 0.423 8.480 740 H VAL 101 H VAL 101 13.447 -2.673 5.396 741 HA VAL 101 HA VAL 101 15.498 -2.165 3.356 742 HB VAL 101 HB VAL 101 12.622 -3.018 2.992 743 HG11 VAL 101 1HG1 VAL 101 13.690 -3.623 0.667 744 HG12 VAL 101 2HG1 VAL 101 13.096 -1.994 0.995 745 HG13 VAL 101 3HG1 VAL 101 14.822 -2.343 1.100 746 HG21 VAL 101 3HG2 VAL 101 15.202 -4.549 3.066 747 HG22 VAL 101 1HG2 VAL 101 13.700 -4.864 3.935 748 HG23 VAL 101 2HG2 VAL 101 13.793 -5.159 2.199 749 H GLY 102 H GLY 102 15.695 -0.210 2.482 750 HA2 GLY 102 2HA GLY 102 13.477 1.703 2.869 751 HA3 GLY 102 3HA GLY 102 15.174 2.157 2.841 752 H GLU 103 H GLU 103 12.356 1.928 1.043 753 HA GLU 103 HA GLU 103 13.538 1.523 -1.540 754 HB2 GLU 103 2HB GLU 103 10.821 2.191 -0.510 755 HB3 GLU 103 3HB GLU 103 11.180 2.553 -2.193 756 HG2 GLU 103 2HG GLU 103 10.229 0.436 -2.255 757 HG3 GLU 103 3HG GLU 103 11.962 0.130 -2.364 758 H LEU 104 H LEU 104 12.865 4.241 0.512 759 HA LEU 104 HA LEU 104 14.502 5.987 -0.976 760 HB2 LEU 104 2HB LEU 104 12.935 7.510 -1.901 761 HB3 LEU 104 3HB LEU 104 12.506 5.897 -2.469 762 HG LEU 104 HG LEU 104 11.115 7.259 -0.170 763 HD11 LEU 104 1HD1 LEU 104 10.699 8.676 -2.008 764 HD12 LEU 104 2HD1 LEU 104 9.288 7.626 -1.878 765 HD13 LEU 104 3HD1 LEU 104 10.507 7.314 -3.113 766 HD21 LEU 104 3HD2 LEU 104 10.798 4.716 -1.662 767 HD22 LEU 104 1HD2 LEU 104 9.332 5.561 -1.167 768 HD23 LEU 104 2HD2 LEU 104 10.519 5.075 0.043 769 H GLU 105 H GLU 105 14.002 5.097 1.749 770 HA GLU 105 HA GLU 105 13.931 5.911 3.873 771 HB2 GLU 105 2HB GLU 105 15.479 7.645 2.379 772 HB3 GLU 105 3HB GLU 105 14.347 8.720 3.188 773 HG2 GLU 105 2HG GLU 105 14.988 7.497 5.332 774 HG3 GLU 105 3HG GLU 105 16.339 6.844 4.407 Start of MODEL 16 1 HA PRO 1 HA PRO 1 1.223 0.657 -1.330 2 HB2 PRO 1 2HB PRO 1 3.686 -0.484 -1.265 3 HB3 PRO 1 3HB PRO 1 3.311 1.038 -0.449 4 HG2 PRO 1 2HG PRO 1 3.482 -1.727 0.685 5 HG3 PRO 1 3HG PRO 1 4.098 -0.204 1.352 6 HD2 PRO 1 2HD PRO 1 1.792 -1.340 2.203 7 HD3 PRO 1 3HD PRO 1 2.035 0.418 2.170 8 H LEU 2 H LEU 2 2.657 -0.713 -3.063 9 HA LEU 2 HA LEU 2 1.993 -3.502 -3.180 10 HB2 LEU 2 2HB LEU 2 0.491 -3.484 -4.992 11 HB3 LEU 2 3HB LEU 2 -0.132 -2.318 -3.826 12 HG LEU 2 HG LEU 2 1.414 -0.778 -5.526 13 HD11 LEU 2 1HD1 LEU 2 -0.241 -2.599 -7.249 14 HD12 LEU 2 2HD1 LEU 2 1.488 -2.839 -7.001 15 HD13 LEU 2 3HD1 LEU 2 0.903 -1.353 -7.748 16 HD21 LEU 2 3HD2 LEU 2 -0.773 0.032 -6.345 17 HD22 LEU 2 1HD2 LEU 2 -0.709 -0.118 -4.589 18 HD23 LEU 2 2HD2 LEU 2 -1.550 -1.336 -5.548 19 H THR 3 H THR 3 2.965 -4.580 -4.976 20 HA THR 3 HA THR 3 4.894 -2.949 -6.487 21 HB THR 3 HB THR 3 5.993 -4.169 -4.583 22 HG1 THR 3 HG1 THR 3 7.582 -3.959 -5.957 23 HG21 THR 3 3HG2 THR 3 5.888 -6.409 -4.325 24 HG22 THR 3 1HG2 THR 3 5.914 -6.713 -6.062 25 HG23 THR 3 2HG2 THR 3 4.405 -6.260 -5.268 26 H ARG 4 H ARG 4 5.817 -4.183 -8.379 27 HA ARG 4 HA ARG 4 3.616 -5.515 -9.759 28 HB2 ARG 4 2HB ARG 4 5.083 -5.207 -11.781 29 HB3 ARG 4 3HB ARG 4 4.573 -3.717 -10.997 30 HG2 ARG 4 2HG ARG 4 6.688 -3.276 -10.166 31 HG3 ARG 4 3HG ARG 4 7.203 -4.958 -10.312 32 HD2 ARG 4 2HD ARG 4 8.288 -3.648 -12.017 33 HD3 ARG 4 3HD ARG 4 7.116 -4.727 -12.773 34 HE ARG 4 HE ARG 4 5.744 -2.403 -12.400 35 HH11 ARG 4 1HH1 ARG 4 8.731 -3.260 -13.970 36 HH12 ARG 4 2HH1 ARG 4 8.621 -2.002 -15.156 37 HH21 ARG 4 2HH2 ARG 4 6.833 -0.569 -15.146 38 HH22 ARG 4 1HH2 ARG 4 5.588 -0.742 -13.956 39 HA PRO 5 HA PRO 5 5.338 -9.549 -9.611 40 HB2 PRO 5 2HB PRO 5 4.606 -10.535 -12.032 41 HB3 PRO 5 3HB PRO 5 3.457 -10.268 -10.716 42 HG2 PRO 5 2HG PRO 5 4.042 -8.552 -13.099 43 HG3 PRO 5 3HG PRO 5 2.476 -8.974 -12.381 44 HD2 PRO 5 2HD PRO 5 3.693 -6.597 -11.930 45 HD3 PRO 5 3HD PRO 5 2.672 -7.394 -10.715 46 H TYR 6 H TYR 6 7.551 -8.583 -9.659 47 HA TYR 6 HA TYR 6 8.913 -9.263 -12.182 48 HB2 TYR 6 2HB TYR 6 8.808 -6.771 -11.512 49 HB3 TYR 6 3HB TYR 6 9.964 -7.203 -10.256 50 HD1 TYR 6 HD1 TYR 6 9.628 -6.040 -13.542 51 HD2 TYR 6 HD2 TYR 6 12.062 -8.571 -11.139 52 HE1 TYR 6 HE1 TYR 6 11.464 -5.800 -15.160 53 HE2 TYR 6 HE2 TYR 6 13.906 -8.337 -12.750 54 HH TYR 6 HH TYR 6 13.464 -6.827 -15.841 55 H LEU 7 H LEU 7 10.475 -10.742 -12.041 56 HA LEU 7 HA LEU 7 11.437 -11.482 -9.357 57 HB2 LEU 7 2HB LEU 7 10.130 -13.251 -10.323 58 HB3 LEU 7 3HB LEU 7 11.052 -13.168 -11.823 59 HG LEU 7 HG LEU 7 13.067 -13.817 -10.303 60 HD11 LEU 7 1HD1 LEU 7 11.230 -15.404 -8.689 61 HD12 LEU 7 2HD1 LEU 7 11.151 -13.676 -8.349 62 HD13 LEU 7 3HD1 LEU 7 12.689 -14.530 -8.222 63 HD21 LEU 7 3HD2 LEU 7 12.718 -15.464 -11.790 64 HD22 LEU 7 1HD2 LEU 7 10.967 -15.416 -11.588 65 HD23 LEU 7 2HD2 LEU 7 11.964 -16.294 -10.428 66 H GLY 8 H GLY 8 13.515 -11.116 -8.964 67 HA2 GLY 8 2HA GLY 8 15.366 -11.001 -11.265 68 HA3 GLY 8 3HA GLY 8 15.454 -9.861 -9.930 69 H PHE 9 H PHE 9 14.665 -13.120 -9.165 70 HA PHE 9 HA PHE 9 17.434 -13.832 -8.606 71 HB2 PHE 9 2HB PHE 9 17.035 -14.305 -6.265 72 HB3 PHE 9 3HB PHE 9 16.623 -12.625 -6.590 73 HD1 PHE 9 HD1 PHE 9 14.097 -12.202 -7.178 74 HD2 PHE 9 HD2 PHE 9 15.562 -15.591 -5.061 75 HE1 PHE 9 HE1 PHE 9 11.862 -12.562 -6.214 76 HE2 PHE 9 HE2 PHE 9 13.329 -15.957 -4.094 77 HZ PHE 9 HZ PHE 9 11.475 -14.442 -4.671 78 H ARG 10 H ARG 10 17.469 -16.110 -7.554 79 HA ARG 10 HA ARG 10 15.463 -17.760 -8.945 80 HB2 ARG 10 2HB ARG 10 18.403 -18.146 -8.478 81 HB3 ARG 10 3HB ARG 10 17.358 -19.534 -8.748 82 HG2 ARG 10 2HG ARG 10 16.619 -18.459 -10.881 83 HG3 ARG 10 3HG ARG 10 17.867 -17.238 -10.620 84 HD2 ARG 10 2HD ARG 10 18.895 -19.935 -10.331 85 HD3 ARG 10 3HD ARG 10 18.171 -19.669 -11.917 86 HE ARG 10 HE ARG 10 19.732 -17.498 -11.620 87 HH11 ARG 10 1HH1 ARG 10 20.338 -20.903 -11.220 88 HH12 ARG 10 2HH1 ARG 10 22.009 -20.791 -11.666 89 HH21 ARG 10 2HH2 ARG 10 22.913 -18.762 -12.228 90 HH22 ARG 10 1HH2 ARG 10 21.929 -17.337 -12.210 91 H VAL 11 H VAL 11 14.816 -19.739 -7.930 92 HA VAL 11 HA VAL 11 15.337 -19.895 -5.043 93 HB VAL 11 HB VAL 11 12.895 -20.526 -4.751 94 HG11 VAL 11 1HG1 VAL 11 14.084 -17.881 -5.109 95 HG12 VAL 11 2HG1 VAL 11 12.324 -17.896 -5.235 96 HG13 VAL 11 3HG1 VAL 11 13.111 -18.518 -3.784 97 HG21 VAL 11 3HG2 VAL 11 12.114 -18.897 -7.053 98 HG22 VAL 11 1HG2 VAL 11 12.833 -20.450 -7.481 99 HG23 VAL 11 2HG2 VAL 11 11.416 -20.394 -6.432 100 H ALA 12 H ALA 12 15.746 -21.897 -4.336 101 HA ALA 12 HA ALA 12 15.174 -24.140 -6.160 102 HB1 ALA 12 1HB ALA 12 17.109 -25.266 -4.984 103 HB2 ALA 12 2HB ALA 12 17.520 -23.904 -6.028 104 HB3 ALA 12 3HB ALA 12 17.475 -23.692 -4.278 105 H VAL 13 H VAL 13 13.719 -25.550 -5.461 106 HA VAL 13 HA VAL 13 12.819 -25.482 -2.710 107 HB VAL 13 HB VAL 13 11.175 -25.652 -4.528 108 HG11 VAL 13 1HG1 VAL 13 11.719 -28.489 -5.059 109 HG12 VAL 13 2HG1 VAL 13 11.213 -27.202 -6.156 110 HG13 VAL 13 3HG1 VAL 13 12.912 -27.366 -5.710 111 HG21 VAL 13 3HG2 VAL 13 9.863 -27.527 -3.596 112 HG22 VAL 13 1HG2 VAL 13 11.295 -28.058 -2.713 113 HG23 VAL 13 2HG2 VAL 13 10.561 -26.497 -2.346 114 H GLY 14 H GLY 14 13.345 -26.886 -1.151 115 HA2 GLY 14 2HA GLY 14 14.121 -29.589 -1.685 116 HA3 GLY 14 3HA GLY 14 15.499 -28.586 -1.258 117 H ARG 15 H ARG 15 15.733 -30.005 0.586 118 HA ARG 15 HA ARG 15 13.993 -29.168 2.802 119 HB2 ARG 15 2HB ARG 15 14.885 -31.970 2.133 120 HB3 ARG 15 3HB ARG 15 14.312 -31.516 3.732 121 HG2 ARG 15 2HG ARG 15 12.437 -32.412 2.697 122 HG3 ARG 15 3HG ARG 15 12.215 -30.669 2.532 123 HD2 ARG 15 2HD ARG 15 12.395 -30.734 0.293 124 HD3 ARG 15 3HD ARG 15 13.700 -31.919 0.336 125 HE ARG 15 HE ARG 15 12.149 -33.533 -0.070 126 HH11 ARG 15 1HH1 ARG 15 10.534 -30.787 1.333 127 HH12 ARG 15 2HH1 ARG 15 8.951 -31.473 1.175 128 HH21 ARG 15 2HH2 ARG 15 8.688 -33.555 0.257 129 HH22 ARG 15 1HH2 ARG 15 10.070 -34.447 -0.283 130 H ASP 16 H ASP 16 14.999 -28.838 4.755 131 HA ASP 16 HA ASP 16 17.927 -28.776 4.657 132 HB2 ASP 16 2HB ASP 16 17.586 -27.368 6.790 133 HB3 ASP 16 3HB ASP 16 17.124 -26.653 5.247 134 H SER 17 H SER 17 18.748 -28.890 7.160 135 HA SER 17 HA SER 17 18.656 -31.621 7.809 136 HB2 SER 17 2HB SER 17 20.571 -30.283 8.436 137 HB3 SER 17 3HB SER 17 19.566 -29.243 9.446 138 HG SER 17 HG SER 17 20.319 -31.930 9.871 139 H SER 18 H SER 18 16.683 -28.941 8.777 140 HA SER 18 HA SER 18 15.527 -30.314 11.044 141 HB2 SER 18 2HB SER 18 15.261 -28.138 11.577 142 HB3 SER 18 3HB SER 18 15.423 -27.619 9.900 143 HG SER 18 HG SER 18 13.119 -28.426 11.300 144 H GLY 19 H GLY 19 14.424 -29.285 7.819 145 HA2 GLY 19 2HA GLY 19 13.029 -30.565 6.412 146 HA3 GLY 19 3HA GLY 19 12.561 -31.538 7.799 147 H CYS 20 H CYS 20 12.408 -28.084 6.913 148 HA CYS 20 HA CYS 20 9.604 -28.096 7.816 149 HB2 CYS 20 2HB CYS 20 11.807 -26.134 8.119 150 HB3 CYS 20 3HB CYS 20 10.209 -25.470 7.805 151 HG CYS 20 HG CYS 20 11.452 -26.389 10.636 152 H THR 21 H THR 21 11.132 -28.468 5.094 153 HA THR 21 HA THR 21 10.800 -27.964 2.894 154 HB THR 21 HB THR 21 8.007 -27.088 3.521 155 HG1 THR 21 HG1 THR 21 9.162 -29.585 4.075 156 HG21 THR 21 3HG2 THR 21 7.879 -27.351 1.309 157 HG22 THR 21 1HG2 THR 21 8.077 -29.084 1.565 158 HG23 THR 21 2HG2 THR 21 9.486 -28.073 1.247 159 H THR 22 H THR 22 12.182 -26.164 2.794 160 HA THR 22 HA THR 22 10.771 -23.634 2.380 161 HB THR 22 HB THR 22 11.552 -23.215 4.553 162 HG1 THR 22 HG1 THR 22 13.515 -21.838 4.092 163 HG21 THR 22 3HG2 THR 22 14.167 -23.616 4.901 164 HG22 THR 22 1HG2 THR 22 13.857 -24.889 3.721 165 HG23 THR 22 2HG2 THR 22 12.968 -24.863 5.244 166 H LEU 23 H LEU 23 11.982 -22.094 1.096 167 HA LEU 23 HA LEU 23 13.825 -23.450 -0.742 168 HB2 LEU 23 2HB LEU 23 12.100 -21.003 -1.046 169 HB3 LEU 23 3HB LEU 23 13.312 -21.480 -2.233 170 HG LEU 23 HG LEU 23 12.011 -23.710 -2.331 171 HD11 LEU 23 1HD1 LEU 23 9.996 -21.899 -1.017 172 HD12 LEU 23 2HD1 LEU 23 10.586 -23.457 -0.439 173 HD13 LEU 23 3HD1 LEU 23 9.575 -23.378 -1.882 174 HD21 LEU 23 3HD2 LEU 23 10.201 -22.391 -3.773 175 HD22 LEU 23 1HD2 LEU 23 11.875 -22.581 -4.295 176 HD23 LEU 23 2HD2 LEU 23 11.356 -21.080 -3.527 177 H SER 24 H SER 24 15.627 -22.193 -1.621 178 HA SER 24 HA SER 24 16.666 -20.235 0.321 179 HB2 SER 24 2HB SER 24 18.426 -22.089 -1.276 180 HB3 SER 24 3HB SER 24 18.837 -21.155 0.163 181 HG SER 24 HG SER 24 18.505 -23.354 0.662 182 H ILE 25 H ILE 25 17.461 -18.367 -0.468 183 HA ILE 25 HA ILE 25 17.077 -17.822 -3.282 184 HB ILE 25 HB ILE 25 18.039 -16.012 -1.063 185 HG12 ILE 25 2HG1 ILE 25 15.322 -16.329 -2.359 186 HG13 ILE 25 3HG1 ILE 25 15.747 -16.770 -0.708 187 HG21 ILE 25 1HG2 ILE 25 17.590 -14.180 -2.605 188 HG22 ILE 25 2HG2 ILE 25 18.798 -15.278 -3.270 189 HG23 ILE 25 3HG2 ILE 25 17.137 -15.333 -3.860 190 HD11 ILE 25 3HD1 ILE 25 16.143 -14.435 -0.173 191 HD12 ILE 25 1HD1 ILE 25 15.759 -13.980 -1.833 192 HD13 ILE 25 2HD1 ILE 25 14.512 -14.676 -0.797 193 H GLN 26 H GLN 26 18.615 -17.614 -4.799 194 HA GLN 26 HA GLN 26 21.406 -17.985 -3.949 195 HB2 GLN 26 2HB GLN 26 19.929 -18.755 -6.451 196 HB3 GLN 26 3HB GLN 26 21.684 -18.646 -6.431 197 HG2 GLN 26 2HG GLN 26 21.925 -20.528 -5.222 198 HG3 GLN 26 3HG GLN 26 20.475 -20.230 -4.265 199 HE21 GLN 26 2HE2 GLN 26 18.287 -21.832 -6.559 200 HE22 GLN 26 1HE2 GLN 26 18.396 -20.519 -5.442 201 H GLU 27 H GLU 27 19.278 -15.687 -5.102 202 HA GLU 27 HA GLU 27 21.494 -14.079 -6.192 203 HB2 GLU 27 2HB GLU 27 19.151 -14.851 -7.512 204 HB3 GLU 27 3HB GLU 27 18.883 -13.174 -7.060 205 HG2 GLU 27 2HG GLU 27 19.925 -12.738 -8.988 206 HG3 GLU 27 3HG GLU 27 21.389 -13.019 -8.046 207 H VAL 28 H VAL 28 20.253 -11.645 -6.349 208 HA VAL 28 HA VAL 28 19.583 -11.067 -3.535 209 HB VAL 28 HB VAL 28 20.890 -9.093 -5.392 210 HG11 VAL 28 1HG1 VAL 28 21.276 -7.808 -3.500 211 HG12 VAL 28 2HG1 VAL 28 19.680 -8.490 -3.183 212 HG13 VAL 28 3HG1 VAL 28 21.105 -9.182 -2.408 213 HG21 VAL 28 3HG2 VAL 28 23.038 -9.672 -4.338 214 HG22 VAL 28 1HG2 VAL 28 22.254 -11.018 -3.512 215 HG23 VAL 28 2HG2 VAL 28 22.372 -11.012 -5.271 216 H THR 29 H THR 29 17.629 -10.250 -3.212 217 HA THR 29 HA THR 29 16.304 -8.842 -5.439 218 HB THR 29 HB THR 29 15.204 -10.974 -5.073 219 HG1 THR 29 HG1 THR 29 13.863 -9.160 -5.525 220 HG21 THR 29 3HG2 THR 29 14.525 -10.129 -2.271 221 HG22 THR 29 1HG2 THR 29 15.969 -11.077 -2.621 222 HG23 THR 29 2HG2 THR 29 14.374 -11.722 -3.011 223 H GLN 30 H GLN 30 17.503 -8.595 -2.318 224 HA GLN 30 HA GLN 30 15.597 -6.636 -1.369 225 HB2 GLN 30 2HB GLN 30 17.658 -8.260 -0.213 226 HB3 GLN 30 3HB GLN 30 17.946 -6.578 0.209 227 HG2 GLN 30 2HG GLN 30 15.202 -7.008 0.579 228 HG3 GLN 30 3HG GLN 30 16.018 -8.413 1.262 229 HE21 GLN 30 2HE2 GLN 30 17.101 -4.768 2.783 230 HE22 GLN 30 1HE2 GLN 30 16.891 -4.982 1.082 231 H THR 31 H THR 31 17.854 -6.485 -3.665 232 HA THR 31 HA THR 31 18.731 -3.765 -2.949 233 HB THR 31 HB THR 31 20.388 -4.243 -4.934 234 HG1 THR 31 HG1 THR 31 19.491 -6.295 -5.454 235 HG21 THR 31 3HG2 THR 31 20.677 -4.118 -2.274 236 HG22 THR 31 1HG2 THR 31 22.008 -4.516 -3.361 237 HG23 THR 31 2HG2 THR 31 21.135 -5.802 -2.528 238 H TYR 32 H TYR 32 16.224 -4.884 -4.359 239 HA TYR 32 HA TYR 32 16.392 -3.113 -6.709 240 HB2 TYR 32 2HB TYR 32 15.625 -5.889 -6.540 241 HB3 TYR 32 3HB TYR 32 14.280 -4.922 -7.134 242 HD1 TYR 32 HD1 TYR 32 14.523 -3.614 -9.220 243 HD2 TYR 32 HD2 TYR 32 17.574 -6.257 -7.876 244 HE1 TYR 32 HE1 TYR 32 15.535 -3.577 -11.462 245 HE2 TYR 32 HE2 TYR 32 18.595 -6.227 -10.114 246 HH TYR 32 HH TYR 32 18.648 -4.952 -12.096 247 H THR 33 H THR 33 14.606 -1.823 -7.171 248 HA THR 33 HA THR 33 12.252 -1.913 -5.503 249 HB THR 33 HB THR 33 13.878 0.624 -5.408 250 HG1 THR 33 HG1 THR 33 14.705 -0.044 -3.475 251 HG21 THR 33 3HG2 THR 33 11.252 -0.200 -4.516 252 HG22 THR 33 1HG2 THR 33 11.963 1.413 -4.572 253 HG23 THR 33 2HG2 THR 33 12.234 0.378 -3.170 254 H GLY 34 H GLY 34 10.544 -0.611 -6.283 255 HA2 GLY 34 2HA GLY 34 10.967 1.083 -8.589 256 HA3 GLY 34 3HA GLY 34 10.138 -0.424 -8.947 257 H SER 35 H SER 35 8.712 -0.565 -6.446 258 HA SER 35 HA SER 35 6.716 1.526 -6.979 259 HB2 SER 35 2HB SER 35 6.229 -1.008 -5.418 260 HB3 SER 35 3HB SER 35 5.045 0.040 -6.199 261 HG SER 35 HG SER 35 5.603 -0.754 -8.146 262 H ASN 36 H ASN 36 5.723 2.635 -5.264 263 HA ASN 36 HA ASN 36 5.733 3.829 -3.326 264 HB2 ASN 36 2HB ASN 36 5.515 1.177 -2.648 265 HB3 ASN 36 3HB ASN 36 6.882 1.696 -1.665 266 HD21 ASN 36 2HD2 ASN 36 4.908 3.238 0.691 267 HD22 ASN 36 1HD2 ASN 36 6.421 2.545 0.228 268 H GLY 37 H GLY 37 8.166 3.802 -4.967 269 HA2 GLY 37 2HA GLY 37 9.834 5.373 -3.397 270 HA3 GLY 37 3HA GLY 37 10.464 3.735 -3.304 271 H GLY 38 H GLY 38 10.759 2.639 -5.485 272 HA2 GLY 38 2HA GLY 38 11.571 2.636 -7.651 273 HA3 GLY 38 3HA GLY 38 11.167 4.342 -7.764 274 H ALA 39 H ALA 39 13.586 2.034 -6.682 275 HA ALA 39 HA ALA 39 15.758 3.582 -7.507 276 HB1 ALA 39 1HB ALA 39 15.572 5.158 -5.856 277 HB2 ALA 39 2HB ALA 39 14.895 4.019 -4.691 278 HB3 ALA 39 3HB ALA 39 16.620 3.985 -5.058 279 H ASP 40 H ASP 40 16.075 1.387 -8.259 280 HA ASP 40 HA ASP 40 16.631 -0.710 -6.384 281 HB2 ASP 40 2HB ASP 40 17.296 -2.009 -8.356 282 HB3 ASP 40 3HB ASP 40 15.750 -1.207 -8.620 283 H LEU 41 H LEU 41 18.410 -0.800 -5.196 284 HA LEU 41 HA LEU 41 21.008 -0.585 -6.364 285 HB2 LEU 41 2HB LEU 41 19.974 1.815 -5.638 286 HB3 LEU 41 3HB LEU 41 20.780 1.333 -4.147 287 HG LEU 41 HG LEU 41 22.768 0.884 -5.899 288 HD11 LEU 41 1HD1 LEU 41 22.783 2.902 -7.417 289 HD12 LEU 41 2HD1 LEU 41 21.057 3.052 -7.088 290 HD13 LEU 41 3HD1 LEU 41 21.683 1.600 -7.870 291 HD21 LEU 41 3HD2 LEU 41 22.103 3.575 -4.711 292 HD22 LEU 41 1HD2 LEU 41 23.702 2.995 -5.178 293 HD23 LEU 41 2HD2 LEU 41 22.844 2.233 -3.839 294 H MET 42 H MET 42 22.513 -0.130 -4.075 295 HA MET 42 HA MET 42 21.723 -2.420 -2.399 296 HB2 MET 42 2HB MET 42 24.523 -1.368 -2.810 297 HB3 MET 42 3HB MET 42 24.053 -2.869 -2.024 298 HG2 MET 42 2HG MET 42 22.939 -3.136 -4.506 299 HG3 MET 42 3HG MET 42 24.433 -2.267 -4.848 300 HE1 MET 42 3HE MET 42 26.503 -2.859 -4.646 301 HE2 MET 42 1HE MET 42 27.057 -3.868 -3.309 302 HE3 MET 42 2HE MET 42 27.037 -4.512 -4.951 303 H GLY 43 H GLY 43 21.129 -1.934 -0.396 304 HA2 GLY 43 2HA GLY 43 22.611 -0.072 1.211 305 HA3 GLY 43 3HA GLY 43 21.030 0.545 0.755 306 HA PRO 44 HA PRO 44 19.046 -1.681 3.963 307 HB2 PRO 44 2HB PRO 44 16.894 -2.831 2.774 308 HB3 PRO 44 3HB PRO 44 17.017 -1.091 3.062 309 HG2 PRO 44 2HG PRO 44 17.535 -2.636 0.551 310 HG3 PRO 44 3HG PRO 44 16.678 -1.098 0.762 311 HD2 PRO 44 2HD PRO 44 19.240 -1.232 -0.106 312 HD3 PRO 44 3HD PRO 44 18.632 0.120 0.872 313 H ALA 45 H ALA 45 19.990 -3.488 1.152 314 HA ALA 45 HA ALA 45 19.448 -6.082 2.238 315 HB1 ALA 45 1HB ALA 45 21.434 -5.614 0.054 316 HB2 ALA 45 2HB ALA 45 20.293 -6.942 0.268 317 HB3 ALA 45 3HB ALA 45 19.714 -5.357 -0.243 318 H PHE 46 H PHE 46 22.388 -4.131 1.800 319 HA PHE 46 HA PHE 46 24.120 -6.030 3.011 320 HB2 PHE 46 2HB PHE 46 24.749 -4.116 1.429 321 HB3 PHE 46 3HB PHE 46 24.647 -3.068 2.841 322 HD1 PHE 46 HD1 PHE 46 26.661 -2.549 3.783 323 HD2 PHE 46 HD2 PHE 46 26.143 -6.396 2.037 324 HE1 PHE 46 HE1 PHE 46 28.976 -3.129 4.382 325 HE2 PHE 46 HE2 PHE 46 28.456 -6.982 2.634 326 HZ PHE 46 HZ PHE 46 29.876 -5.348 3.809 327 H ALA 47 H ALA 47 22.061 -3.526 4.229 328 HA ALA 47 HA ALA 47 23.321 -3.260 6.781 329 HB1 ALA 47 1HB ALA 47 20.690 -2.384 5.648 330 HB2 ALA 47 2HB ALA 47 21.048 -2.202 7.366 331 HB3 ALA 47 3HB ALA 47 22.063 -1.404 6.165 332 H ALA 48 H ALA 48 20.919 -5.376 5.414 333 HA ALA 48 HA ALA 48 20.235 -6.455 8.046 334 HB1 ALA 48 1HB ALA 48 18.716 -7.924 6.462 335 HB2 ALA 48 2HB ALA 48 18.261 -6.281 6.916 336 HB3 ALA 48 3HB ALA 48 19.003 -6.589 5.346 337 H GLY 49 H GLY 49 22.151 -7.151 5.260 338 HA2 GLY 49 2HA GLY 49 23.925 -8.737 5.343 339 HA3 GLY 49 3HA GLY 49 23.008 -9.656 6.527 340 H LEU 50 H LEU 50 21.194 -8.539 3.865 341 HA LEU 50 HA LEU 50 20.570 -11.170 3.014 342 HB2 LEU 50 2HB LEU 50 19.946 -8.423 2.026 343 HB3 LEU 50 3HB LEU 50 19.575 -9.815 1.012 344 HG LEU 50 HG LEU 50 17.620 -9.067 2.266 345 HD11 LEU 50 1HD1 LEU 50 16.880 -11.171 2.901 346 HD12 LEU 50 2HD1 LEU 50 18.464 -11.659 3.502 347 HD13 LEU 50 3HD1 LEU 50 18.179 -11.535 1.766 348 HD21 LEU 50 3HD2 LEU 50 19.294 -8.440 4.269 349 HD22 LEU 50 1HD2 LEU 50 18.701 -9.996 4.850 350 HD23 LEU 50 2HD2 LEU 50 17.563 -8.697 4.493 351 H ARG 51 H ARG 51 21.940 -12.441 1.959 352 HA ARG 51 HA ARG 51 23.293 -11.392 -0.409 353 HB2 ARG 51 2HB ARG 51 24.617 -12.120 2.060 354 HB3 ARG 51 3HB ARG 51 25.161 -13.138 0.733 355 HG2 ARG 51 2HG ARG 51 25.065 -10.416 -0.137 356 HG3 ARG 51 3HG ARG 51 25.984 -10.530 1.366 357 HD2 ARG 51 2HD ARG 51 27.515 -12.053 0.438 358 HD3 ARG 51 3HD ARG 51 26.463 -12.400 -0.934 359 HE ARG 51 HE ARG 51 26.993 -9.766 -1.219 360 HH11 ARG 51 1HH1 ARG 51 29.005 -12.570 -0.764 361 HH12 ARG 51 2HH1 ARG 51 30.343 -11.916 -1.649 362 HH21 ARG 51 2HH2 ARG 51 30.196 -9.823 -2.570 363 HH22 ARG 51 1HH2 ARG 51 28.748 -8.893 -2.386 364 H VAL 52 H VAL 52 24.044 -13.078 -1.863 365 HA VAL 52 HA VAL 52 22.158 -15.061 -2.339 366 HB VAL 52 HB VAL 52 23.742 -16.020 -3.939 367 HG11 VAL 52 1HG1 VAL 52 23.754 -14.232 -5.411 368 HG12 VAL 52 2HG1 VAL 52 22.495 -13.770 -4.264 369 HG13 VAL 52 3HG1 VAL 52 24.104 -13.058 -4.142 370 HG21 VAL 52 3HG2 VAL 52 25.854 -16.045 -3.084 371 HG22 VAL 52 1HG2 VAL 52 25.972 -14.584 -4.065 372 HG23 VAL 52 2HG2 VAL 52 25.687 -14.460 -2.329 373 H GLY 53 H GLY 53 21.831 -17.062 -1.590 374 HA2 GLY 53 2HA GLY 53 22.862 -19.214 -0.959 375 HA3 GLY 53 3HA GLY 53 23.976 -18.286 0.034 376 H ASP 54 H ASP 54 22.137 -16.502 1.196 377 HA ASP 54 HA ASP 54 21.197 -18.075 3.350 378 HB2 ASP 54 2HB ASP 54 20.975 -15.198 2.570 379 HB3 ASP 54 3HB ASP 54 19.926 -15.812 3.845 380 H GLN 55 H GLN 55 19.102 -18.593 3.992 381 HA GLN 55 HA GLN 55 17.209 -18.841 1.785 382 HB2 GLN 55 2HB GLN 55 16.911 -20.008 4.547 383 HB3 GLN 55 3HB GLN 55 16.122 -20.523 3.063 384 HG2 GLN 55 2HG GLN 55 18.363 -21.190 2.193 385 HG3 GLN 55 3HG GLN 55 19.021 -20.842 3.791 386 HE21 GLN 55 2HE2 GLN 55 16.311 -23.904 3.564 387 HE22 GLN 55 1HE2 GLN 55 16.046 -22.432 2.699 388 H LEU 56 H LEU 56 15.416 -17.658 1.615 389 HA LEU 56 HA LEU 56 14.716 -15.890 3.858 390 HB2 LEU 56 2HB LEU 56 15.309 -14.709 1.840 391 HB3 LEU 56 3HB LEU 56 14.155 -15.658 0.906 392 HG LEU 56 HG LEU 56 13.013 -14.117 3.144 393 HD11 LEU 56 1HD1 LEU 56 13.007 -12.044 1.704 394 HD12 LEU 56 2HD1 LEU 56 14.300 -12.795 0.770 395 HD13 LEU 56 3HD1 LEU 56 14.539 -12.441 2.481 396 HD21 LEU 56 3HD2 LEU 56 11.288 -13.675 1.469 397 HD22 LEU 56 1HD2 LEU 56 11.637 -15.400 1.593 398 HD23 LEU 56 2HD2 LEU 56 12.275 -14.467 0.239 399 H VAL 57 H VAL 57 13.028 -16.509 5.019 400 HA VAL 57 HA VAL 57 10.904 -18.074 3.711 401 HB VAL 57 HB VAL 57 11.624 -17.929 6.642 402 HG11 VAL 57 1HG1 VAL 57 9.935 -20.124 6.008 403 HG12 VAL 57 2HG1 VAL 57 9.617 -18.764 7.086 404 HG13 VAL 57 3HG1 VAL 57 9.191 -18.654 5.378 405 HG21 VAL 57 3HG2 VAL 57 12.881 -19.770 6.386 406 HG22 VAL 57 1HG2 VAL 57 11.746 -20.502 5.252 407 HG23 VAL 57 2HG2 VAL 57 12.922 -19.318 4.682 408 H ARG 58 H ARG 58 11.326 -15.701 6.344 409 HA ARG 58 HA ARG 58 10.020 -13.987 7.073 410 HB2 ARG 58 2HB ARG 58 8.708 -13.963 4.364 411 HB3 ARG 58 3HB ARG 58 8.987 -12.613 5.456 412 HG2 ARG 58 2HG ARG 58 11.523 -13.609 4.913 413 HG3 ARG 58 3HG ARG 58 10.669 -13.673 3.369 414 HD2 ARG 58 2HD ARG 58 10.416 -11.212 5.018 415 HD3 ARG 58 3HD ARG 58 11.940 -11.495 4.177 416 HE ARG 58 HE ARG 58 9.740 -11.840 2.423 417 HH11 ARG 58 1HH1 ARG 58 11.628 -9.396 4.030 418 HH12 ARG 58 2HH1 ARG 58 11.320 -8.185 2.830 419 HH21 ARG 58 2HH2 ARG 58 10.010 -8.673 1.015 420 HH22 ARG 58 1HH2 ARG 58 9.327 -10.254 0.837 421 H PHE 59 H PHE 59 9.075 -16.760 7.292 422 HA PHE 59 HA PHE 59 6.275 -16.146 7.861 423 HB2 PHE 59 2HB PHE 59 6.276 -17.247 5.658 424 HB3 PHE 59 3HB PHE 59 7.155 -18.610 6.342 425 HD1 PHE 59 HD1 PHE 59 3.932 -16.933 6.082 426 HD2 PHE 59 HD2 PHE 59 6.053 -20.181 7.832 427 HE1 PHE 59 HE1 PHE 59 1.797 -18.000 6.680 428 HE2 PHE 59 HE2 PHE 59 3.922 -21.254 8.432 429 HZ PHE 59 HZ PHE 59 1.790 -20.165 7.855 430 H ALA 60 H ALA 60 5.382 -17.334 9.558 431 HA ALA 60 HA ALA 60 7.274 -18.305 11.475 432 HB1 ALA 60 1HB ALA 60 5.650 -17.448 12.742 433 HB2 ALA 60 2HB ALA 60 4.460 -17.564 11.444 434 HB3 ALA 60 3HB ALA 60 4.793 -18.965 12.462 435 H GLY 61 H GLY 61 8.206 -20.230 11.095 436 HA2 GLY 61 2HA GLY 61 7.495 -22.641 11.619 437 HA3 GLY 61 3HA GLY 61 6.496 -22.451 10.186 438 H TYR 62 H TYR 62 9.123 -20.669 9.519 439 HA TYR 62 HA TYR 62 10.937 -20.937 8.174 440 HB2 TYR 62 2HB TYR 62 11.229 -23.756 9.169 441 HB3 TYR 62 3HB TYR 62 12.485 -22.603 8.732 442 HD1 TYR 62 HD1 TYR 62 11.946 -20.251 10.256 443 HD2 TYR 62 HD2 TYR 62 11.425 -24.317 11.397 444 HE1 TYR 62 HE1 TYR 62 12.186 -19.613 12.619 445 HE2 TYR 62 HE2 TYR 62 11.662 -23.690 13.763 446 HH TYR 62 HH TYR 62 11.439 -21.751 15.185 447 H THR 63 H THR 63 8.402 -21.496 7.070 448 HA THR 63 HA THR 63 9.085 -23.586 5.105 449 HB THR 63 HB THR 63 7.190 -24.394 6.283 450 HG1 THR 63 HG1 THR 63 6.850 -24.688 4.112 451 HG21 THR 63 3HG2 THR 63 5.916 -22.970 7.430 452 HG22 THR 63 1HG2 THR 63 5.150 -22.507 5.912 453 HG23 THR 63 2HG2 THR 63 6.537 -21.599 6.512 454 H VAL 64 H VAL 64 8.519 -23.208 2.926 455 HA VAL 64 HA VAL 64 7.598 -20.529 2.213 456 HB VAL 64 HB VAL 64 10.099 -21.654 0.963 457 HG11 VAL 64 1HG1 VAL 64 9.011 -20.119 -0.480 458 HG12 VAL 64 2HG1 VAL 64 8.704 -18.989 0.841 459 HG13 VAL 64 3HG1 VAL 64 10.351 -19.247 0.264 460 HG21 VAL 64 3HG2 VAL 64 11.244 -19.809 2.293 461 HG22 VAL 64 1HG2 VAL 64 9.790 -19.778 3.290 462 HG23 VAL 64 2HG2 VAL 64 10.757 -21.249 3.187 463 H THR 65 H THR 65 6.890 -20.343 0.016 464 HA THR 65 HA THR 65 6.045 -22.925 -1.094 465 HB THR 65 HB THR 65 4.781 -20.806 -2.482 466 HG1 THR 65 HG1 THR 65 4.663 -20.498 0.352 467 HG21 THR 65 3HG2 THR 65 3.754 -22.662 -0.331 468 HG22 THR 65 1HG2 THR 65 3.813 -23.003 -2.060 469 HG23 THR 65 2HG2 THR 65 2.751 -21.736 -1.447 470 H GLU 66 H GLU 66 6.743 -19.724 -2.505 471 HA GLU 66 HA GLU 66 8.924 -20.574 -4.069 472 HB2 GLU 66 2HB GLU 66 7.917 -20.668 -6.278 473 HB3 GLU 66 3HB GLU 66 7.193 -21.884 -5.235 474 HG2 GLU 66 2HG GLU 66 5.159 -20.962 -5.355 475 HG3 GLU 66 3HG GLU 66 5.786 -19.318 -5.256 476 H LEU 67 H LEU 67 9.037 -18.954 -6.129 477 HA LEU 67 HA LEU 67 9.480 -16.423 -5.087 478 HB2 LEU 67 2HB LEU 67 9.500 -15.678 -7.488 479 HB3 LEU 67 3HB LEU 67 10.576 -17.014 -7.086 480 HG LEU 67 HG LEU 67 8.578 -18.475 -7.960 481 HD11 LEU 67 1HD1 LEU 67 7.821 -16.928 -10.061 482 HD12 LEU 67 2HD1 LEU 67 7.850 -15.750 -8.750 483 HD13 LEU 67 3HD1 LEU 67 6.855 -17.199 -8.611 484 HD21 LEU 67 3HD2 LEU 67 9.915 -18.880 -9.712 485 HD22 LEU 67 1HD2 LEU 67 10.996 -17.709 -8.956 486 HD23 LEU 67 2HD2 LEU 67 9.899 -17.196 -10.239 487 H ALA 68 H ALA 68 6.563 -17.839 -6.313 488 HA ALA 68 HA ALA 68 5.113 -15.498 -6.894 489 HB1 ALA 68 1HB ALA 68 3.157 -16.869 -6.859 490 HB2 ALA 68 2HB ALA 68 4.471 -17.819 -7.554 491 HB3 ALA 68 3HB ALA 68 3.969 -18.097 -5.886 492 H ALA 69 H ALA 69 5.430 -17.390 -3.911 493 HA ALA 69 HA ALA 69 3.602 -15.852 -2.390 494 HB1 ALA 69 1HB ALA 69 3.984 -17.920 -1.459 495 HB2 ALA 69 2HB ALA 69 5.724 -17.846 -1.742 496 HB3 ALA 69 3HB ALA 69 5.000 -16.894 -0.446 497 H PHE 70 H PHE 70 7.044 -15.580 -3.027 498 HA PHE 70 HA PHE 70 7.647 -13.682 -1.027 499 HB2 PHE 70 2HB PHE 70 9.339 -15.024 -2.280 500 HB3 PHE 70 3HB PHE 70 9.015 -14.036 -3.701 501 HD1 PHE 70 HD1 PHE 70 10.738 -12.593 -4.127 502 HD2 PHE 70 HD2 PHE 70 9.588 -13.287 -0.088 503 HE1 PHE 70 HE1 PHE 70 12.414 -10.957 -3.372 504 HE2 PHE 70 HE2 PHE 70 11.261 -11.653 0.673 505 HZ PHE 70 HZ PHE 70 12.676 -10.484 -0.969 506 H ASN 71 H ASN 71 6.389 -13.398 -4.288 507 HA ASN 71 HA ASN 71 6.772 -10.652 -4.677 508 HB2 ASN 71 2HB ASN 71 5.826 -12.612 -6.235 509 HB3 ASN 71 3HB ASN 71 4.292 -11.898 -5.748 510 HD21 ASN 71 2HD2 ASN 71 6.754 -10.014 -8.351 511 HD22 ASN 71 1HD2 ASN 71 7.225 -11.458 -7.527 512 H THR 72 H THR 72 4.230 -12.434 -3.021 513 HA THR 72 HA THR 72 2.495 -10.211 -2.642 514 HB THR 72 HB THR 72 2.294 -12.278 -0.588 515 HG1 THR 72 HG1 THR 72 2.373 -13.997 -1.826 516 HG21 THR 72 3HG2 THR 72 0.046 -12.441 -2.087 517 HG22 THR 72 1HG2 THR 72 0.586 -10.813 -2.493 518 HG23 THR 72 2HG2 THR 72 0.293 -11.250 -0.810 519 H VAL 73 H VAL 73 5.005 -11.728 -0.661 520 HA VAL 73 HA VAL 73 4.576 -10.091 1.626 521 HB VAL 73 HB VAL 73 7.014 -11.676 0.804 522 HG11 VAL 73 1HG1 VAL 73 6.316 -10.411 3.452 523 HG12 VAL 73 2HG1 VAL 73 7.668 -11.511 3.172 524 HG13 VAL 73 3HG1 VAL 73 7.630 -9.936 2.376 525 HG21 VAL 73 3HG2 VAL 73 6.109 -13.191 2.665 526 HG22 VAL 73 1HG2 VAL 73 4.594 -12.310 2.461 527 HG23 VAL 73 2HG2 VAL 73 5.278 -13.214 1.110 528 H VAL 74 H VAL 74 6.845 -9.950 -1.093 529 HA VAL 74 HA VAL 74 8.390 -7.791 -0.225 530 HB VAL 74 HB VAL 74 7.674 -8.626 -3.038 531 HG11 VAL 74 1HG1 VAL 74 8.454 -6.563 -3.536 532 HG12 VAL 74 2HG1 VAL 74 9.322 -6.402 -2.007 533 HG13 VAL 74 3HG1 VAL 74 10.017 -7.351 -3.322 534 HG21 VAL 74 3HG2 VAL 74 9.187 -10.237 -2.797 535 HG22 VAL 74 1HG2 VAL 74 10.396 -9.074 -2.252 536 HG23 VAL 74 2HG2 VAL 74 9.303 -9.821 -1.087 537 H ALA 75 H ALA 75 5.396 -7.847 -2.122 538 HA ALA 75 HA ALA 75 5.215 -5.134 -2.718 539 HB1 ALA 75 1HB ALA 75 2.971 -5.515 -3.267 540 HB2 ALA 75 2HB ALA 75 3.766 -7.063 -3.554 541 HB3 ALA 75 3HB ALA 75 2.812 -6.820 -2.091 542 H ARG 76 H ARG 76 4.142 -6.907 0.152 543 HA ARG 76 HA ARG 76 3.002 -4.573 1.385 544 HB2 ARG 76 2HB ARG 76 3.413 -7.423 2.168 545 HB3 ARG 76 3HB ARG 76 3.127 -6.241 3.439 546 HG2 ARG 76 2HG ARG 76 1.070 -7.359 2.712 547 HG3 ARG 76 3HG ARG 76 1.021 -5.617 2.436 548 HD2 ARG 76 2HD ARG 76 1.629 -5.995 0.082 549 HD3 ARG 76 3HD ARG 76 1.619 -7.734 0.373 550 HE ARG 76 HE ARG 76 -0.856 -6.579 1.123 551 HH11 ARG 76 1HH1 ARG 76 1.016 -7.504 -1.663 552 HH12 ARG 76 2HH1 ARG 76 -0.370 -7.770 -2.668 553 HH21 ARG 76 2HH2 ARG 76 -2.476 -7.439 -1.830 554 HH22 ARG 76 1HH2 ARG 76 -2.689 -6.926 -0.191 555 H HIS 77 H HIS 77 6.085 -6.181 1.377 556 HA HIS 77 HA HIS 77 7.088 -4.881 3.731 557 HB2 HIS 77 2HB HIS 77 8.108 -6.781 1.723 558 HB3 HIS 77 3HB HIS 77 9.322 -5.697 2.396 559 HD1 HIS 77 HD1 HIS 77 6.673 -8.130 3.623 560 HD2 HIS 77 HD2 HIS 77 10.320 -6.512 4.782 561 HE1 HIS 77 HE1 HIS 77 7.301 -9.335 5.739 562 H VAL 78 H VAL 78 6.949 -4.168 0.337 563 HA VAL 78 HA VAL 78 9.023 -2.267 0.186 564 HB VAL 78 HB VAL 78 6.503 -2.597 -1.436 565 HG11 VAL 78 1HG1 VAL 78 7.002 -0.299 -1.646 566 HG12 VAL 78 2HG1 VAL 78 8.737 -0.607 -1.747 567 HG13 VAL 78 3HG1 VAL 78 7.679 -1.071 -3.080 568 HG21 VAL 78 3HG2 VAL 78 8.798 -4.086 -1.389 569 HG22 VAL 78 1HG2 VAL 78 7.686 -3.970 -2.754 570 HG23 VAL 78 2HG2 VAL 78 9.120 -2.945 -2.694 571 H ARG 79 H ARG 79 9.037 -0.774 1.810 572 HA ARG 79 HA ARG 79 7.088 1.353 1.620 573 HB2 ARG 79 2HB ARG 79 6.951 -0.632 3.724 574 HB3 ARG 79 3HB ARG 79 7.238 0.971 4.388 575 HG2 ARG 79 2HG ARG 79 5.250 1.381 2.511 576 HG3 ARG 79 3HG ARG 79 4.830 -0.164 3.254 577 HD2 ARG 79 2HD ARG 79 5.634 2.098 5.015 578 HD3 ARG 79 3HD ARG 79 4.028 2.125 4.289 579 HE ARG 79 HE ARG 79 4.594 -0.378 5.530 580 HH11 ARG 79 1HH1 ARG 79 3.613 2.903 6.160 581 HH12 ARG 79 2HH1 ARG 79 2.769 2.508 7.620 582 HH21 ARG 79 2HH2 ARG 79 2.698 0.339 8.355 583 HH22 ARG 79 1HH2 ARG 79 3.486 -0.910 7.451 584 HA PRO 80 HA PRO 80 10.533 3.862 2.662 585 HB2 PRO 80 2HB PRO 80 9.346 5.919 3.977 586 HB3 PRO 80 3HB PRO 80 9.200 5.683 2.231 587 HG2 PRO 80 2HG PRO 80 7.278 4.956 4.408 588 HG3 PRO 80 3HG PRO 80 6.953 5.693 2.828 589 HD2 PRO 80 2HD PRO 80 6.567 3.057 3.313 590 HD3 PRO 80 3HD PRO 80 7.061 3.673 1.723 591 H SER 81 H SER 81 11.885 2.921 4.108 592 HA SER 81 HA SER 81 12.897 2.423 6.084 593 HB2 SER 81 2HB SER 81 11.107 4.512 7.334 594 HB3 SER 81 3HB SER 81 12.702 3.991 7.877 595 HG SER 81 HG SER 81 12.328 6.036 6.471 596 H ALA 82 H ALA 82 10.721 0.821 5.343 597 HA ALA 82 HA ALA 82 9.131 0.362 7.732 598 HB1 ALA 82 1HB ALA 82 8.560 -1.704 6.019 599 HB2 ALA 82 2HB ALA 82 7.688 -0.174 6.113 600 HB3 ALA 82 3HB ALA 82 8.969 -0.387 4.920 601 H SER 83 H SER 83 10.198 -0.605 9.350 602 HA SER 83 HA SER 83 12.142 -2.700 8.778 603 HB2 SER 83 2HB SER 83 11.367 -1.709 11.518 604 HB3 SER 83 3HB SER 83 12.879 -2.464 11.013 605 HG SER 83 HG SER 83 11.945 0.149 10.502 606 H ILE 84 H ILE 84 11.431 -4.708 8.551 607 HA ILE 84 HA ILE 84 9.287 -5.648 10.340 608 HB ILE 84 HB ILE 84 9.686 -6.479 7.464 609 HG12 ILE 84 2HG1 ILE 84 8.754 -4.232 7.607 610 HG13 ILE 84 3HG1 ILE 84 7.511 -5.362 7.083 611 HG21 ILE 84 1HG2 ILE 84 8.859 -8.269 8.946 612 HG22 ILE 84 2HG2 ILE 84 7.510 -7.233 9.409 613 HG23 ILE 84 3HG2 ILE 84 7.668 -7.781 7.740 614 HD11 ILE 84 3HD1 ILE 84 7.511 -3.588 9.311 615 HD12 ILE 84 1HD1 ILE 84 6.214 -4.617 8.705 616 HD13 ILE 84 2HD1 ILE 84 7.363 -5.248 9.886 617 HA PRO 85 HA PRO 85 12.276 -8.685 11.527 618 HB2 PRO 85 2HB PRO 85 10.589 -10.316 12.891 619 HB3 PRO 85 3HB PRO 85 11.154 -8.768 13.530 620 HG2 PRO 85 2HG PRO 85 8.557 -9.433 12.198 621 HG3 PRO 85 3HG PRO 85 8.855 -8.434 13.632 622 HD2 PRO 85 2HD PRO 85 8.410 -7.369 11.183 623 HD3 PRO 85 3HD PRO 85 9.468 -6.598 12.381 624 H VAL 86 H VAL 86 13.043 -9.984 9.970 625 HA VAL 86 HA VAL 86 11.201 -11.902 8.704 626 HB VAL 86 HB VAL 86 13.809 -10.754 7.708 627 HG11 VAL 86 1HG1 VAL 86 12.176 -13.064 6.717 628 HG12 VAL 86 2HG1 VAL 86 13.173 -12.112 5.616 629 HG13 VAL 86 3HG1 VAL 86 13.918 -12.962 6.970 630 HG21 VAL 86 3HG2 VAL 86 12.116 -9.200 7.283 631 HG22 VAL 86 1HG2 VAL 86 12.242 -10.113 5.779 632 HG23 VAL 86 2HG2 VAL 86 10.932 -10.452 6.911 633 H VAL 87 H VAL 87 11.676 -14.063 8.674 634 HA VAL 87 HA VAL 87 13.760 -14.930 10.535 635 HB VAL 87 HB VAL 87 11.466 -16.469 9.312 636 HG11 VAL 87 1HG1 VAL 87 12.126 -18.115 11.177 637 HG12 VAL 87 2HG1 VAL 87 13.097 -18.088 9.703 638 HG13 VAL 87 3HG1 VAL 87 13.680 -17.283 11.161 639 HG21 VAL 87 3HG2 VAL 87 10.256 -16.077 11.198 640 HG22 VAL 87 1HG2 VAL 87 11.687 -15.964 12.224 641 HG23 VAL 87 2HG2 VAL 87 11.225 -14.604 11.200 642 H PHE 88 H PHE 88 15.567 -15.914 9.892 643 HA PHE 88 HA PHE 88 15.747 -16.774 7.080 644 HB2 PHE 88 2HB PHE 88 17.928 -15.708 8.885 645 HB3 PHE 88 3HB PHE 88 18.173 -16.294 7.243 646 HD1 PHE 88 HD1 PHE 88 17.310 -13.498 9.289 647 HD2 PHE 88 HD2 PHE 88 16.983 -15.091 5.355 648 HE1 PHE 88 HE1 PHE 88 16.829 -11.247 8.421 649 HE2 PHE 88 HE2 PHE 88 16.503 -12.842 4.481 650 HZ PHE 88 HZ PHE 88 16.426 -10.916 6.014 651 H SER 89 H SER 89 17.169 -18.583 6.631 652 HA SER 89 HA SER 89 17.668 -20.351 8.919 653 HB2 SER 89 2HB SER 89 15.835 -20.834 6.644 654 HB3 SER 89 3HB SER 89 16.890 -22.177 7.079 655 HG SER 89 HG SER 89 14.663 -21.472 8.257 656 H ARG 90 H ARG 90 19.363 -21.815 8.652 657 HA ARG 90 HA ARG 90 20.916 -21.592 6.169 658 HB2 ARG 90 2HB ARG 90 21.712 -20.153 8.227 659 HB3 ARG 90 3HB ARG 90 22.352 -21.691 8.789 660 HG2 ARG 90 2HG ARG 90 23.162 -21.502 6.130 661 HG3 ARG 90 3HG ARG 90 23.390 -19.887 6.804 662 HD2 ARG 90 2HD ARG 90 24.395 -21.360 8.810 663 HD3 ARG 90 3HD ARG 90 24.745 -22.432 7.454 664 HE ARG 90 HE ARG 90 26.369 -20.975 6.779 665 HH11 ARG 90 1HH1 ARG 90 24.226 -19.333 8.978 666 HH12 ARG 90 2HH1 ARG 90 25.196 -17.899 9.057 667 HH21 ARG 90 2HH2 ARG 90 27.144 -17.763 7.859 668 HH22 ARG 90 1HH2 ARG 90 27.653 -19.093 6.875 669 H ASP 91 H ASP 91 20.170 -23.661 5.599 670 HA ASP 91 HA ASP 91 20.289 -25.927 5.435 671 HB2 ASP 91 2HB ASP 91 22.581 -25.959 7.372 672 HB3 ASP 91 3HB ASP 91 22.315 -26.964 5.950 673 H GLY 92 H GLY 92 18.536 -24.845 7.359 674 HA2 GLY 92 2HA GLY 92 17.059 -26.134 8.730 675 HA3 GLY 92 3HA GLY 92 18.432 -27.112 9.229 676 H VAL 93 H VAL 93 19.837 -24.315 9.435 677 HA VAL 93 HA VAL 93 19.606 -24.101 12.246 678 HB VAL 93 HB VAL 93 20.808 -22.201 10.230 679 HG11 VAL 93 1HG1 VAL 93 20.236 -20.939 12.196 680 HG12 VAL 93 2HG1 VAL 93 20.948 -22.169 13.242 681 HG13 VAL 93 3HG1 VAL 93 21.979 -21.209 12.180 682 HG21 VAL 93 3HG2 VAL 93 22.699 -23.401 10.357 683 HG22 VAL 93 1HG2 VAL 93 22.541 -23.639 12.097 684 HG23 VAL 93 2HG2 VAL 93 21.664 -24.686 10.981 685 H VAL 94 H VAL 94 18.591 -22.595 13.536 686 HA VAL 94 HA VAL 94 16.478 -21.026 12.216 687 HB VAL 94 HB VAL 94 15.546 -22.683 13.698 688 HG11 VAL 94 1HG1 VAL 94 16.404 -21.776 16.255 689 HG12 VAL 94 2HG1 VAL 94 16.611 -23.368 15.521 690 HG13 VAL 94 3HG1 VAL 94 17.830 -22.117 15.274 691 HG21 VAL 94 3HG2 VAL 94 14.417 -20.530 13.628 692 HG22 VAL 94 1HG2 VAL 94 14.290 -21.240 15.237 693 HG23 VAL 94 2HG2 VAL 94 15.436 -19.933 14.938 694 H MET 95 H MET 95 16.788 -18.907 12.161 695 HA MET 95 HA MET 95 17.962 -17.561 14.470 696 HB2 MET 95 2HB MET 95 18.932 -16.904 11.696 697 HB3 MET 95 3HB MET 95 19.603 -16.383 13.236 698 HG2 MET 95 2HG MET 95 19.999 -18.931 13.604 699 HG3 MET 95 3HG MET 95 19.856 -19.007 11.850 700 HE1 MET 95 3HE MET 95 22.876 -18.954 14.346 701 HE2 MET 95 1HE MET 95 23.078 -17.204 14.441 702 HE3 MET 95 2HE MET 95 21.537 -17.939 14.886 703 H SER 96 H SER 96 17.704 -15.169 14.322 704 HA SER 96 HA SER 96 15.534 -14.315 12.554 705 HB2 SER 96 2HB SER 96 14.211 -13.414 14.348 706 HB3 SER 96 3HB SER 96 14.553 -15.099 14.737 707 HG SER 96 HG SER 96 15.528 -14.443 16.468 708 H ALA 97 H ALA 97 15.896 -12.361 11.726 709 HA ALA 97 HA ALA 97 17.515 -10.428 13.205 710 HB1 ALA 97 1HB ALA 97 19.227 -11.381 11.932 711 HB2 ALA 97 2HB ALA 97 18.202 -11.539 10.505 712 HB3 ALA 97 3HB ALA 97 18.757 -9.946 11.020 713 H THR 98 H THR 98 16.960 -8.327 12.846 714 HA THR 98 HA THR 98 14.497 -7.867 11.400 715 HB THR 98 HB THR 98 16.191 -5.868 12.908 716 HG1 THR 98 HG1 THR 98 15.367 -6.708 14.660 717 HG21 THR 98 3HG2 THR 98 13.335 -5.407 12.837 718 HG22 THR 98 1HG2 THR 98 14.014 -5.481 11.211 719 HG23 THR 98 2HG2 THR 98 14.657 -4.332 12.384 720 H ILE 99 H ILE 99 14.353 -7.131 9.388 721 HA ILE 99 HA ILE 99 16.750 -5.936 8.163 722 HB ILE 99 HB ILE 99 15.894 -6.653 6.005 723 HG12 ILE 99 2HG1 ILE 99 13.876 -8.455 6.469 724 HG13 ILE 99 3HG1 ILE 99 13.472 -7.159 7.589 725 HG21 ILE 99 1HG2 ILE 99 15.645 -9.099 7.692 726 HG22 ILE 99 2HG2 ILE 99 16.520 -8.858 6.181 727 HG23 ILE 99 3HG2 ILE 99 17.163 -8.202 7.686 728 HD11 ILE 99 3HD1 ILE 99 13.403 -7.218 4.649 729 HD12 ILE 99 1HD1 ILE 99 12.375 -6.362 5.798 730 HD13 ILE 99 2HD1 ILE 99 13.965 -5.717 5.385 731 H VAL 100 H VAL 100 16.673 -3.880 7.541 732 HA VAL 100 HA VAL 100 14.062 -2.527 7.526 733 HB VAL 100 HB VAL 100 15.566 -1.522 9.096 734 HG11 VAL 100 1HG1 VAL 100 17.763 -1.657 8.812 735 HG12 VAL 100 2HG1 VAL 100 17.544 -2.182 7.141 736 HG13 VAL 100 3HG1 VAL 100 17.649 -0.462 7.519 737 HG21 VAL 100 3HG2 VAL 100 14.224 -0.122 7.285 738 HG22 VAL 100 1HG2 VAL 100 15.252 0.654 8.490 739 HG23 VAL 100 2HG2 VAL 100 15.851 0.402 6.851 740 H VAL 101 H VAL 101 13.215 -2.303 5.567 741 HA VAL 101 HA VAL 101 14.956 -2.102 3.232 742 HB VAL 101 HB VAL 101 12.799 -2.249 1.947 743 HG11 VAL 101 1HG1 VAL 101 12.734 -4.639 3.649 744 HG12 VAL 101 2HG1 VAL 101 13.000 -4.487 1.911 745 HG13 VAL 101 3HG1 VAL 101 14.330 -4.209 3.036 746 HG21 VAL 101 3HG2 VAL 101 11.228 -3.381 4.058 747 HG22 VAL 101 1HG2 VAL 101 11.689 -1.731 4.477 748 HG23 VAL 101 2HG2 VAL 101 10.835 -2.052 2.968 749 H GLY 102 H GLY 102 15.444 -0.217 2.326 750 HA2 GLY 102 2HA GLY 102 13.819 2.134 3.050 751 HA3 GLY 102 3HA GLY 102 15.510 2.184 2.577 752 H GLU 103 H GLU 103 12.354 2.618 1.547 753 HA GLU 103 HA GLU 103 12.919 2.094 -1.263 754 HB2 GLU 103 2HB GLU 103 10.464 2.794 0.303 755 HB3 GLU 103 3HB GLU 103 10.490 3.069 -1.433 756 HG2 GLU 103 2HG GLU 103 9.512 0.880 -0.647 757 HG3 GLU 103 3HG GLU 103 10.745 0.787 -1.903 758 H LEU 104 H LEU 104 12.488 4.778 0.947 759 HA LEU 104 HA LEU 104 13.258 6.610 -1.227 760 HB2 LEU 104 2HB LEU 104 11.260 7.028 0.982 761 HB3 LEU 104 3HB LEU 104 11.951 8.359 0.056 762 HG LEU 104 HG LEU 104 9.824 7.917 -0.875 763 HD11 LEU 104 1HD1 LEU 104 11.463 6.364 -2.803 764 HD12 LEU 104 2HD1 LEU 104 11.990 7.995 -2.388 765 HD13 LEU 104 3HD1 LEU 104 10.387 7.735 -3.074 766 HD21 LEU 104 3HD2 LEU 104 8.882 5.861 -1.242 767 HD22 LEU 104 1HD2 LEU 104 9.897 5.501 0.154 768 HD23 LEU 104 2HD2 LEU 104 10.439 5.063 -1.466 769 H GLU 105 H GLU 105 13.963 8.817 -0.133 770 HA GLU 105 HA GLU 105 15.476 8.386 2.315 771 HB2 GLU 105 2HB GLU 105 17.603 8.967 1.390 772 HB3 GLU 105 3HB GLU 105 16.946 7.657 0.419 773 HG2 GLU 105 2HG GLU 105 16.088 9.521 -1.130 774 HG3 GLU 105 3HG GLU 105 17.239 10.549 -0.278 Start of MODEL 17 1 HA PRO 1 HA PRO 1 2.486 0.147 -1.728 2 HB2 PRO 1 2HB PRO 1 4.902 -0.972 -1.201 3 HB3 PRO 1 3HB PRO 1 4.316 0.479 -0.380 4 HG2 PRO 1 2HG PRO 1 4.305 -2.363 0.559 5 HG3 PRO 1 3HG PRO 1 4.719 -0.890 1.456 6 HD2 PRO 1 2HD PRO 1 2.313 -2.110 1.689 7 HD3 PRO 1 3HD PRO 1 2.511 -0.352 1.839 8 H LEU 2 H LEU 2 4.337 -1.100 -3.161 9 HA LEU 2 HA LEU 2 3.648 -3.860 -3.659 10 HB2 LEU 2 2HB LEU 2 2.225 -1.872 -5.000 11 HB3 LEU 2 3HB LEU 2 3.426 -2.433 -6.161 12 HG LEU 2 HG LEU 2 2.051 -4.630 -4.843 13 HD11 LEU 2 1HD1 LEU 2 -0.076 -4.256 -6.124 14 HD12 LEU 2 2HD1 LEU 2 0.434 -2.582 -6.340 15 HD13 LEU 2 3HD1 LEU 2 0.152 -3.214 -4.719 16 HD21 LEU 2 3HD2 LEU 2 1.569 -4.996 -7.408 17 HD22 LEU 2 1HD2 LEU 2 3.174 -5.265 -6.730 18 HD23 LEU 2 2HD2 LEU 2 2.819 -3.763 -7.583 19 H THR 3 H THR 3 4.918 -4.716 -5.573 20 HA THR 3 HA THR 3 7.469 -3.267 -5.854 21 HB THR 3 HB THR 3 7.780 -5.130 -4.294 22 HG1 THR 3 HG1 THR 3 8.962 -5.927 -6.741 23 HG21 THR 3 3HG2 THR 3 6.117 -6.512 -6.191 24 HG22 THR 3 1HG2 THR 3 6.603 -7.004 -4.570 25 HG23 THR 3 2HG2 THR 3 7.628 -7.388 -5.953 26 H ARG 4 H ARG 4 8.789 -4.131 -7.723 27 HA ARG 4 HA ARG 4 7.515 -3.753 -10.120 28 HB2 ARG 4 2HB ARG 4 9.973 -5.421 -9.563 29 HB3 ARG 4 3HB ARG 4 9.464 -4.910 -11.167 30 HG2 ARG 4 2HG ARG 4 9.959 -2.915 -8.989 31 HG3 ARG 4 3HG ARG 4 11.278 -3.553 -9.972 32 HD2 ARG 4 2HD ARG 4 8.816 -2.160 -11.019 33 HD3 ARG 4 3HD ARG 4 10.415 -1.434 -10.857 34 HE ARG 4 HE ARG 4 9.512 -3.158 -12.950 35 HH11 ARG 4 1HH1 ARG 4 12.307 -2.160 -11.129 36 HH12 ARG 4 2HH1 ARG 4 13.430 -2.563 -12.384 37 HH21 ARG 4 2HH2 ARG 4 12.676 -3.433 -14.365 38 HH22 ARG 4 1HH2 ARG 4 10.982 -3.692 -14.610 39 HA PRO 5 HA PRO 5 5.232 -7.372 -11.101 40 HB2 PRO 5 2HB PRO 5 5.490 -7.437 -13.803 41 HB3 PRO 5 3HB PRO 5 4.486 -6.251 -12.962 42 HG2 PRO 5 2HG PRO 5 7.256 -5.953 -14.055 43 HG3 PRO 5 3HG PRO 5 5.890 -4.826 -14.148 44 HD2 PRO 5 2HD PRO 5 7.904 -4.531 -12.361 45 HD3 PRO 5 3HD PRO 5 6.235 -4.035 -12.010 46 H TYR 6 H TYR 6 8.274 -7.184 -12.960 47 HA TYR 6 HA TYR 6 8.484 -10.081 -12.983 48 HB2 TYR 6 2HB TYR 6 9.744 -7.840 -14.427 49 HB3 TYR 6 3HB TYR 6 10.810 -9.201 -14.095 50 HD1 TYR 6 HD1 TYR 6 11.061 -10.492 -15.989 51 HD2 TYR 6 HD2 TYR 6 7.204 -8.952 -15.061 52 HE1 TYR 6 HE1 TYR 6 10.122 -11.700 -17.914 53 HE2 TYR 6 HE2 TYR 6 6.254 -10.157 -16.983 54 HH TYR 6 HH TYR 6 6.903 -12.261 -18.340 55 H LEU 7 H LEU 7 10.291 -11.230 -12.158 56 HA LEU 7 HA LEU 7 11.620 -9.861 -9.913 57 HB2 LEU 7 2HB LEU 7 11.899 -12.307 -9.100 58 HB3 LEU 7 3HB LEU 7 10.354 -11.484 -8.892 59 HG LEU 7 HG LEU 7 10.657 -13.085 -11.358 60 HD11 LEU 7 1HD1 LEU 7 10.155 -14.490 -8.753 61 HD12 LEU 7 2HD1 LEU 7 11.757 -14.410 -9.485 62 HD13 LEU 7 3HD1 LEU 7 10.431 -15.190 -10.348 63 HD21 LEU 7 3HD2 LEU 7 8.521 -12.491 -9.338 64 HD22 LEU 7 1HD2 LEU 7 8.331 -13.780 -10.527 65 HD23 LEU 7 2HD2 LEU 7 8.557 -12.114 -11.061 66 H GLY 8 H GLY 8 13.812 -10.078 -9.635 67 HA2 GLY 8 2HA GLY 8 15.243 -11.346 -11.885 68 HA3 GLY 8 3HA GLY 8 15.831 -9.954 -10.989 69 H PHE 9 H PHE 9 14.474 -13.012 -9.805 70 HA PHE 9 HA PHE 9 17.084 -13.850 -8.839 71 HB2 PHE 9 2HB PHE 9 16.484 -13.974 -6.534 72 HB3 PHE 9 3HB PHE 9 16.069 -12.351 -7.073 73 HD1 PHE 9 HD1 PHE 9 14.875 -15.376 -5.588 74 HD2 PHE 9 HD2 PHE 9 13.657 -11.857 -7.649 75 HE1 PHE 9 HE1 PHE 9 12.575 -15.701 -4.777 76 HE2 PHE 9 HE2 PHE 9 11.356 -12.175 -6.840 77 HZ PHE 9 HZ PHE 9 10.812 -14.099 -5.402 78 H ARG 10 H ARG 10 17.177 -16.054 -8.237 79 HA ARG 10 HA ARG 10 14.860 -17.625 -9.159 80 HB2 ARG 10 2HB ARG 10 16.364 -19.320 -9.918 81 HB3 ARG 10 3HB ARG 10 16.950 -17.784 -10.541 82 HG2 ARG 10 2HG ARG 10 18.632 -17.699 -8.780 83 HG3 ARG 10 3HG ARG 10 18.035 -19.227 -8.131 84 HD2 ARG 10 2HD ARG 10 18.843 -20.452 -9.922 85 HD3 ARG 10 3HD ARG 10 18.887 -19.049 -10.990 86 HE ARG 10 HE ARG 10 20.938 -19.905 -9.155 87 HH11 ARG 10 1HH1 ARG 10 19.634 -17.248 -10.988 88 HH12 ARG 10 2HH1 ARG 10 21.127 -16.369 -11.021 89 HH21 ARG 10 2HH2 ARG 10 22.989 -17.229 -10.000 90 HH22 ARG 10 1HH2 ARG 10 22.908 -18.757 -9.192 91 H VAL 11 H VAL 11 14.408 -19.611 -8.072 92 HA VAL 11 HA VAL 11 15.610 -19.889 -5.405 93 HB VAL 11 HB VAL 11 13.444 -18.662 -5.223 94 HG11 VAL 11 1HG1 VAL 11 11.383 -19.667 -5.754 95 HG12 VAL 11 2HG1 VAL 11 12.410 -19.942 -7.162 96 HG13 VAL 11 3HG1 VAL 11 12.125 -21.246 -6.008 97 HG21 VAL 11 3HG2 VAL 11 14.284 -19.957 -3.350 98 HG22 VAL 11 1HG2 VAL 11 12.527 -20.081 -3.433 99 HG23 VAL 11 2HG2 VAL 11 13.532 -21.417 -3.993 100 H ALA 12 H ALA 12 15.733 -21.972 -4.613 101 HA ALA 12 HA ALA 12 14.852 -24.107 -6.446 102 HB1 ALA 12 1HB ALA 12 16.970 -24.709 -6.707 103 HB2 ALA 12 2HB ALA 12 17.499 -23.457 -5.583 104 HB3 ALA 12 3HB ALA 12 17.060 -25.055 -4.979 105 H VAL 13 H VAL 13 13.447 -25.459 -5.557 106 HA VAL 13 HA VAL 13 13.035 -25.453 -2.686 107 HB VAL 13 HB VAL 13 11.076 -25.402 -4.136 108 HG11 VAL 13 1HG1 VAL 13 12.475 -27.168 -5.718 109 HG12 VAL 13 2HG1 VAL 13 11.202 -28.172 -5.020 110 HG13 VAL 13 3HG1 VAL 13 10.783 -26.713 -5.919 111 HG21 VAL 13 3HG2 VAL 13 11.349 -26.868 -1.900 112 HG22 VAL 13 1HG2 VAL 13 9.826 -26.704 -2.775 113 HG23 VAL 13 2HG2 VAL 13 10.838 -28.127 -3.024 114 H GLY 14 H GLY 14 13.546 -27.057 -1.295 115 HA2 GLY 14 2HA GLY 14 14.093 -29.737 -2.123 116 HA3 GLY 14 3HA GLY 14 15.574 -28.851 -1.789 117 H ARG 15 H ARG 15 16.130 -30.110 -0.017 118 HA ARG 15 HA ARG 15 14.507 -29.603 2.381 119 HB2 ARG 15 2HB ARG 15 15.609 -32.225 1.410 120 HB3 ARG 15 3HB ARG 15 15.318 -31.949 3.122 121 HG2 ARG 15 2HG ARG 15 13.400 -33.032 2.318 122 HG3 ARG 15 3HG ARG 15 12.948 -31.334 2.480 123 HD2 ARG 15 2HD ARG 15 12.683 -31.059 0.258 124 HD3 ARG 15 3HD ARG 15 14.055 -32.095 -0.136 125 HE ARG 15 HE ARG 15 12.003 -33.717 0.835 126 HH11 ARG 15 1HH1 ARG 15 12.666 -31.661 -1.895 127 HH12 ARG 15 2HH1 ARG 15 11.654 -32.555 -2.980 128 HH21 ARG 15 2HH2 ARG 15 10.516 -34.398 -2.233 129 HH22 ARG 15 1HH2 ARG 15 10.667 -34.903 -0.584 130 H ASP 16 H ASP 16 15.635 -29.212 4.251 131 HA ASP 16 HA ASP 16 18.511 -28.763 3.910 132 HB2 ASP 16 2HB ASP 16 16.424 -27.623 5.736 133 HB3 ASP 16 3HB ASP 16 18.123 -27.543 6.193 134 H SER 17 H SER 17 19.612 -28.893 6.271 135 HA SER 17 HA SER 17 19.864 -31.640 6.812 136 HB2 SER 17 2HB SER 17 21.452 -29.569 7.306 137 HB3 SER 17 3HB SER 17 20.668 -29.646 8.884 138 HG SER 17 HG SER 17 21.878 -31.294 9.320 139 H SER 18 H SER 18 17.782 -29.196 8.118 140 HA SER 18 HA SER 18 17.072 -30.673 10.482 141 HB2 SER 18 2HB SER 18 16.841 -28.354 10.749 142 HB3 SER 18 3HB SER 18 16.056 -28.158 9.182 143 HG SER 18 HG SER 18 14.989 -28.939 11.628 144 H GLY 19 H GLY 19 15.009 -29.543 7.798 145 HA2 GLY 19 2HA GLY 19 13.830 -31.248 6.455 146 HA3 GLY 19 3HA GLY 19 13.596 -32.135 7.954 147 H CYS 20 H CYS 20 13.145 -28.698 7.155 148 HA CYS 20 HA CYS 20 10.366 -28.959 8.097 149 HB2 CYS 20 2HB CYS 20 12.464 -27.060 8.727 150 HB3 CYS 20 3HB CYS 20 11.032 -26.242 8.112 151 HG CYS 20 HG CYS 20 9.396 -26.794 10.114 152 H THR 21 H THR 21 11.856 -29.044 5.333 153 HA THR 21 HA THR 21 11.393 -28.484 3.175 154 HB THR 21 HB THR 21 8.647 -27.576 3.936 155 HG1 THR 21 HG1 THR 21 8.099 -29.493 4.682 156 HG21 THR 21 3HG2 THR 21 9.310 -29.581 1.828 157 HG22 THR 21 1HG2 THR 21 9.712 -27.887 1.547 158 HG23 THR 21 2HG2 THR 21 8.041 -28.356 1.858 159 H THR 22 H THR 22 12.807 -26.707 3.101 160 HA THR 22 HA THR 22 11.430 -24.116 2.970 161 HB THR 22 HB THR 22 12.536 -23.896 5.037 162 HG1 THR 22 HG1 THR 22 13.638 -22.139 4.534 163 HG21 THR 22 3HG2 THR 22 13.958 -25.713 5.255 164 HG22 THR 22 1HG2 THR 22 15.097 -24.378 5.090 165 HG23 THR 22 2HG2 THR 22 14.747 -25.414 3.706 166 H LEU 23 H LEU 23 12.513 -22.532 1.625 167 HA LEU 23 HA LEU 23 14.041 -23.820 -0.528 168 HB2 LEU 23 2HB LEU 23 12.060 -21.624 -0.415 169 HB3 LEU 23 3HB LEU 23 13.359 -21.461 -1.595 170 HG LEU 23 HG LEU 23 12.687 -23.490 -2.696 171 HD11 LEU 23 1HD1 LEU 23 10.493 -24.559 -1.869 172 HD12 LEU 23 2HD1 LEU 23 10.878 -23.788 -0.331 173 HD13 LEU 23 3HD1 LEU 23 11.996 -24.955 -1.035 174 HD21 LEU 23 3HD2 LEU 23 10.795 -21.292 -2.250 175 HD22 LEU 23 1HD2 LEU 23 10.079 -22.767 -2.902 176 HD23 LEU 23 2HD2 LEU 23 11.407 -21.980 -3.755 177 H SER 24 H SER 24 15.727 -22.539 -1.584 178 HA SER 24 HA SER 24 17.079 -20.732 0.312 179 HB2 SER 24 2HB SER 24 18.001 -23.170 -0.844 180 HB3 SER 24 3HB SER 24 18.964 -21.852 -1.512 181 HG SER 24 HG SER 24 19.643 -22.845 0.579 182 H ILE 25 H ILE 25 18.048 -18.890 -0.485 183 HA ILE 25 HA ILE 25 17.117 -18.049 -3.117 184 HB ILE 25 HB ILE 25 16.852 -16.612 -1.042 185 HG12 ILE 25 2HG1 ILE 25 17.832 -14.535 -2.378 186 HG13 ILE 25 3HG1 ILE 25 18.014 -15.738 -3.649 187 HG21 ILE 25 1HG2 ILE 25 18.635 -15.585 -0.031 188 HG22 ILE 25 2HG2 ILE 25 19.359 -17.134 -0.459 189 HG23 ILE 25 3HG2 ILE 25 19.660 -15.714 -1.460 190 HD11 ILE 25 3HD1 ILE 25 15.406 -15.383 -2.232 191 HD12 ILE 25 1HD1 ILE 25 15.870 -14.338 -3.574 192 HD13 ILE 25 2HD1 ILE 25 15.727 -16.079 -3.820 193 H GLN 26 H GLN 26 18.405 -17.674 -4.832 194 HA GLN 26 HA GLN 26 21.277 -18.208 -4.488 195 HB2 GLN 26 2HB GLN 26 19.352 -18.709 -6.721 196 HB3 GLN 26 3HB GLN 26 21.054 -18.479 -7.097 197 HG2 GLN 26 2HG GLN 26 21.379 -20.621 -6.670 198 HG3 GLN 26 3HG GLN 26 20.996 -20.299 -4.980 199 HE21 GLN 26 2HE2 GLN 26 18.474 -22.381 -7.332 200 HE22 GLN 26 1HE2 GLN 26 19.968 -21.733 -7.908 201 H GLU 27 H GLU 27 18.977 -15.826 -5.374 202 HA GLU 27 HA GLU 27 21.166 -14.036 -6.192 203 HB2 GLU 27 2HB GLU 27 18.362 -13.962 -7.316 204 HB3 GLU 27 3HB GLU 27 19.726 -12.968 -7.810 205 HG2 GLU 27 2HG GLU 27 20.408 -15.742 -8.033 206 HG3 GLU 27 3HG GLU 27 18.901 -15.416 -8.887 207 H VAL 28 H VAL 28 19.815 -11.679 -6.354 208 HA VAL 28 HA VAL 28 18.622 -11.336 -3.682 209 HB VAL 28 HB VAL 28 19.713 -8.977 -3.835 210 HG11 VAL 28 1HG1 VAL 28 20.969 -11.565 -3.054 211 HG12 VAL 28 2HG1 VAL 28 21.920 -10.082 -2.947 212 HG13 VAL 28 3HG1 VAL 28 20.412 -10.231 -2.043 213 HG21 VAL 28 3HG2 VAL 28 20.577 -9.854 -6.238 214 HG22 VAL 28 1HG2 VAL 28 21.389 -8.603 -5.296 215 HG23 VAL 28 2HG2 VAL 28 21.962 -10.270 -5.229 216 H THR 29 H THR 29 16.795 -10.167 -3.588 217 HA THR 29 HA THR 29 15.953 -8.747 -6.032 218 HB THR 29 HB THR 29 14.607 -10.756 -5.743 219 HG1 THR 29 HG1 THR 29 12.511 -9.501 -5.281 220 HG21 THR 29 3HG2 THR 29 14.972 -10.730 -3.183 221 HG22 THR 29 1HG2 THR 29 13.429 -11.311 -3.808 222 HG23 THR 29 2HG2 THR 29 13.555 -9.681 -3.148 223 H GLN 30 H GLN 30 17.034 -8.216 -3.041 224 HA GLN 30 HA GLN 30 15.085 -6.251 -2.182 225 HB2 GLN 30 2HB GLN 30 17.657 -7.310 -1.062 226 HB3 GLN 30 3HB GLN 30 16.969 -5.821 -0.429 227 HG2 GLN 30 2HG GLN 30 16.376 -7.869 0.851 228 HG3 GLN 30 3HG GLN 30 14.995 -6.935 0.278 229 HE21 GLN 30 2HE2 GLN 30 15.789 -10.615 -1.320 230 HE22 GLN 30 1HE2 GLN 30 17.038 -9.696 -0.559 231 H THR 31 H THR 31 17.169 -6.192 -4.597 232 HA THR 31 HA THR 31 18.169 -3.476 -4.079 233 HB THR 31 HB THR 31 19.438 -4.039 -6.331 234 HG1 THR 31 HG1 THR 31 18.393 -6.090 -6.575 235 HG21 THR 31 3HG2 THR 31 21.271 -4.186 -5.030 236 HG22 THR 31 1HG2 THR 31 20.639 -5.559 -4.123 237 HG23 THR 31 2HG2 THR 31 20.143 -3.920 -3.702 238 H TYR 32 H TYR 32 15.421 -4.479 -5.042 239 HA TYR 32 HA TYR 32 15.273 -2.726 -7.407 240 HB2 TYR 32 2HB TYR 32 13.794 -5.291 -6.825 241 HB3 TYR 32 3HB TYR 32 13.256 -4.145 -8.048 242 HD1 TYR 32 HD1 TYR 32 16.261 -6.116 -7.045 243 HD2 TYR 32 HD2 TYR 32 14.051 -4.343 -10.219 244 HE1 TYR 32 HE1 TYR 32 17.783 -7.152 -8.676 245 HE2 TYR 32 HE2 TYR 32 15.566 -5.375 -11.859 246 HH TYR 32 HH TYR 32 18.025 -6.218 -11.815 247 H THR 33 H THR 33 13.412 -1.429 -7.622 248 HA THR 33 HA THR 33 11.399 -1.382 -5.569 249 HB THR 33 HB THR 33 13.204 1.033 -5.768 250 HG1 THR 33 HG1 THR 33 14.433 -0.325 -4.615 251 HG21 THR 33 3HG2 THR 33 10.925 0.311 -3.925 252 HG22 THR 33 1HG2 THR 33 10.949 1.600 -5.127 253 HG23 THR 33 2HG2 THR 33 11.985 1.702 -3.703 254 H GLY 34 H GLY 34 9.654 0.030 -6.054 255 HA2 GLY 34 2HA GLY 34 9.760 1.659 -8.442 256 HA3 GLY 34 3HA GLY 34 8.793 0.201 -8.608 257 H SER 35 H SER 35 7.788 0.157 -5.932 258 HA SER 35 HA SER 35 5.892 2.395 -6.130 259 HB2 SER 35 2HB SER 35 5.457 -0.353 -5.888 260 HB3 SER 35 3HB SER 35 5.115 0.292 -4.282 261 HG SER 35 HG SER 35 3.856 0.833 -6.730 262 H ASN 36 H ASN 36 5.417 3.672 -4.370 263 HA ASN 36 HA ASN 36 5.918 4.876 -2.501 264 HB2 ASN 36 2HB ASN 36 6.078 2.029 -1.547 265 HB3 ASN 36 3HB ASN 36 6.378 3.367 -0.442 266 HD21 ASN 36 2HD2 ASN 36 3.042 4.022 0.093 267 HD22 ASN 36 1HD2 ASN 36 4.696 4.238 0.541 268 H GLY 37 H GLY 37 8.122 4.266 -4.348 269 HA2 GLY 37 2HA GLY 37 10.254 5.306 -2.792 270 HA3 GLY 37 3HA GLY 37 10.504 3.592 -3.088 271 H GLY 38 H GLY 38 9.840 3.113 -5.581 272 HA2 GLY 38 2HA GLY 38 10.680 3.234 -7.717 273 HA3 GLY 38 3HA GLY 38 10.326 4.950 -7.583 274 H ALA 39 H ALA 39 12.790 2.495 -6.969 275 HA ALA 39 HA ALA 39 14.890 4.021 -8.006 276 HB1 ALA 39 1HB ALA 39 14.392 4.358 -5.094 277 HB2 ALA 39 2HB ALA 39 16.062 4.257 -5.654 278 HB3 ALA 39 3HB ALA 39 14.997 5.514 -6.281 279 H ASP 40 H ASP 40 14.862 1.772 -8.841 280 HA ASP 40 HA ASP 40 15.647 -0.391 -7.161 281 HB2 ASP 40 2HB ASP 40 16.024 -1.604 -9.291 282 HB3 ASP 40 3HB ASP 40 14.447 -0.823 -9.227 283 H LEU 41 H LEU 41 17.560 -0.490 -6.194 284 HA LEU 41 HA LEU 41 19.982 -0.425 -7.704 285 HB2 LEU 41 2HB LEU 41 19.166 2.040 -6.927 286 HB3 LEU 41 3HB LEU 41 20.140 1.560 -5.539 287 HG LEU 41 HG LEU 41 21.873 0.973 -7.487 288 HD11 LEU 41 1HD1 LEU 41 21.329 1.785 -9.474 289 HD12 LEU 41 2HD1 LEU 41 21.277 3.409 -8.787 290 HD13 LEU 41 3HD1 LEU 41 19.817 2.420 -8.825 291 HD21 LEU 41 3HD2 LEU 41 22.657 2.341 -5.817 292 HD22 LEU 41 1HD2 LEU 41 21.327 3.488 -5.981 293 HD23 LEU 41 2HD2 LEU 41 22.621 3.463 -7.178 294 H MET 42 H MET 42 21.810 -0.001 -5.669 295 HA MET 42 HA MET 42 21.147 -2.193 -3.817 296 HB2 MET 42 2HB MET 42 22.953 -2.800 -5.308 297 HB3 MET 42 3HB MET 42 23.821 -1.320 -4.920 298 HG2 MET 42 2HG MET 42 23.207 -2.881 -2.558 299 HG3 MET 42 3HG MET 42 24.155 -3.786 -3.735 300 HE1 MET 42 3HE MET 42 26.110 -4.184 -3.073 301 HE2 MET 42 1HE MET 42 27.128 -3.071 -3.988 302 HE3 MET 42 2HE MET 42 27.295 -3.181 -2.235 303 H GLY 43 H GLY 43 20.658 -1.443 -1.860 304 HA2 GLY 43 2HA GLY 43 22.525 0.199 -0.425 305 HA3 GLY 43 3HA GLY 43 21.047 1.060 -0.829 306 HA PRO 44 HA PRO 44 18.897 -0.674 2.571 307 HB2 PRO 44 2HB PRO 44 16.532 -1.520 1.542 308 HB3 PRO 44 3HB PRO 44 16.941 0.189 1.729 309 HG2 PRO 44 2HG PRO 44 17.079 -1.535 -0.714 310 HG3 PRO 44 3HG PRO 44 16.487 0.128 -0.551 311 HD2 PRO 44 2HD PRO 44 18.946 -0.454 -1.521 312 HD3 PRO 44 3HD PRO 44 18.611 1.022 -0.593 313 H ALA 45 H ALA 45 19.653 -2.709 -0.073 314 HA ALA 45 HA ALA 45 18.655 -5.150 1.079 315 HB1 ALA 45 1HB ALA 45 20.054 -6.196 -0.766 316 HB2 ALA 45 2HB ALA 45 18.742 -5.130 -1.272 317 HB3 ALA 45 3HB ALA 45 20.407 -4.548 -1.287 318 H PHE 46 H PHE 46 21.760 -3.489 0.880 319 HA PHE 46 HA PHE 46 23.142 -5.643 2.238 320 HB2 PHE 46 2HB PHE 46 23.895 -3.206 0.792 321 HB3 PHE 46 3HB PHE 46 24.884 -3.514 2.215 322 HD1 PHE 46 HD1 PHE 46 23.371 -5.672 -0.430 323 HD2 PHE 46 HD2 PHE 46 26.881 -4.485 1.665 324 HE1 PHE 46 HE1 PHE 46 24.684 -7.316 -1.706 325 HE2 PHE 46 HE2 PHE 46 28.200 -6.127 0.393 326 HZ PHE 46 HZ PHE 46 27.102 -7.544 -1.296 327 H ALA 47 H ALA 47 21.355 -2.897 3.100 328 HA ALA 47 HA ALA 47 22.678 -2.091 5.455 329 HB1 ALA 47 1HB ALA 47 20.551 -1.028 6.057 330 HB2 ALA 47 2HB ALA 47 20.998 -0.700 4.383 331 HB3 ALA 47 3HB ALA 47 19.753 -1.896 4.745 332 H ALA 48 H ALA 48 20.232 -4.554 4.826 333 HA ALA 48 HA ALA 48 20.130 -5.264 7.655 334 HB1 ALA 48 1HB ALA 48 18.587 -6.323 5.291 335 HB2 ALA 48 2HB ALA 48 18.353 -6.831 6.964 336 HB3 ALA 48 3HB ALA 48 18.015 -5.166 6.493 337 H GLY 49 H GLY 49 21.615 -6.276 4.712 338 HA2 GLY 49 2HA GLY 49 23.521 -7.723 4.757 339 HA3 GLY 49 3HA GLY 49 22.827 -8.536 6.151 340 H LEU 50 H LEU 50 20.607 -7.860 3.656 341 HA LEU 50 HA LEU 50 20.077 -10.607 3.201 342 HB2 LEU 50 2HB LEU 50 19.199 -8.372 1.401 343 HB3 LEU 50 3HB LEU 50 18.382 -9.899 1.732 344 HG LEU 50 HG LEU 50 18.616 -8.448 4.175 345 HD11 LEU 50 1HD1 LEU 50 16.963 -6.602 3.293 346 HD12 LEU 50 2HD1 LEU 50 17.858 -6.838 1.792 347 HD13 LEU 50 3HD1 LEU 50 18.710 -6.356 3.259 348 HD21 LEU 50 3HD2 LEU 50 16.942 -10.153 3.643 349 HD22 LEU 50 1HD2 LEU 50 16.232 -9.078 2.437 350 HD23 LEU 50 2HD2 LEU 50 16.189 -8.638 4.145 351 H ARG 51 H ARG 51 21.378 -11.915 2.106 352 HA ARG 51 HA ARG 51 22.353 -11.055 -0.515 353 HB2 ARG 51 2HB ARG 51 24.021 -11.230 1.737 354 HB3 ARG 51 3HB ARG 51 24.350 -12.678 0.796 355 HG2 ARG 51 2HG ARG 51 24.281 -10.612 -1.069 356 HG3 ARG 51 3HG ARG 51 25.152 -9.956 0.318 357 HD2 ARG 51 2HD ARG 51 26.227 -12.458 0.098 358 HD3 ARG 51 3HD ARG 51 25.930 -12.038 -1.589 359 HE ARG 51 HE ARG 51 27.675 -10.579 -1.465 360 HH11 ARG 51 1HH1 ARG 51 26.531 -11.209 1.762 361 HH12 ARG 51 2HH1 ARG 51 27.787 -10.292 2.526 362 HH21 ARG 51 2HH2 ARG 51 29.380 -9.246 1.256 363 HH22 ARG 51 1HH2 ARG 51 29.334 -9.370 -0.471 364 H VAL 52 H VAL 52 23.532 -13.089 -1.547 365 HA VAL 52 HA VAL 52 21.522 -15.095 -1.782 366 HB VAL 52 HB VAL 52 23.009 -16.178 -3.371 367 HG11 VAL 52 1HG1 VAL 52 23.182 -14.412 -4.995 368 HG12 VAL 52 2HG1 VAL 52 21.711 -14.174 -4.050 369 HG13 VAL 52 3HG1 VAL 52 23.137 -13.187 -3.728 370 HG21 VAL 52 3HG2 VAL 52 25.168 -16.125 -2.648 371 HG22 VAL 52 1HG2 VAL 52 25.225 -14.766 -3.770 372 HG23 VAL 52 2HG2 VAL 52 25.042 -14.474 -2.041 373 H GLY 53 H GLY 53 21.349 -17.038 -0.830 374 HA2 GLY 53 2HA GLY 53 22.495 -19.042 0.011 375 HA3 GLY 53 3HA GLY 53 23.627 -17.962 0.810 376 H ASP 54 H ASP 54 21.105 -16.246 1.391 377 HA ASP 54 HA ASP 54 20.540 -17.567 3.932 378 HB2 ASP 54 2HB ASP 54 20.608 -14.806 2.975 379 HB3 ASP 54 3HB ASP 54 19.190 -15.155 3.959 380 H GLN 55 H GLN 55 18.699 -18.602 4.333 381 HA GLN 55 HA GLN 55 16.680 -18.795 2.302 382 HB2 GLN 55 2HB GLN 55 16.656 -19.912 5.111 383 HB3 GLN 55 3HB GLN 55 15.618 -20.405 3.779 384 HG2 GLN 55 2HG GLN 55 17.753 -21.053 2.563 385 HG3 GLN 55 3HG GLN 55 18.560 -20.870 4.119 386 HE21 GLN 55 2HE2 GLN 55 16.917 -24.314 3.264 387 HE22 GLN 55 1HE2 GLN 55 17.450 -23.111 2.144 388 H LEU 56 H LEU 56 14.874 -17.643 2.121 389 HA LEU 56 HA LEU 56 14.068 -15.961 4.401 390 HB2 LEU 56 2HB LEU 56 13.274 -15.416 1.568 391 HB3 LEU 56 3HB LEU 56 13.357 -14.303 2.932 392 HG LEU 56 HG LEU 56 15.982 -15.117 2.577 393 HD11 LEU 56 1HD1 LEU 56 16.519 -15.073 0.321 394 HD12 LEU 56 2HD1 LEU 56 14.965 -14.378 -0.139 395 HD13 LEU 56 3HD1 LEU 56 15.062 -16.065 0.364 396 HD21 LEU 56 3HD2 LEU 56 16.364 -12.890 2.344 397 HD22 LEU 56 1HD2 LEU 56 14.696 -12.812 2.914 398 HD23 LEU 56 2HD2 LEU 56 15.047 -12.670 1.191 399 H VAL 57 H VAL 57 12.384 -16.828 5.415 400 HA VAL 57 HA VAL 57 10.250 -18.055 3.792 401 HB VAL 57 HB VAL 57 9.631 -19.308 5.869 402 HG11 VAL 57 1HG1 VAL 57 10.809 -21.010 5.049 403 HG12 VAL 57 2HG1 VAL 57 11.594 -19.846 3.979 404 HG13 VAL 57 3HG1 VAL 57 12.337 -20.269 5.523 405 HG21 VAL 57 3HG2 VAL 57 11.434 -19.519 7.597 406 HG22 VAL 57 1HG2 VAL 57 12.225 -18.131 6.849 407 HG23 VAL 57 2HG2 VAL 57 10.623 -17.953 7.565 408 H ARG 58 H ARG 58 10.958 -16.033 6.603 409 HA ARG 58 HA ARG 58 9.693 -14.553 7.789 410 HB2 ARG 58 2HB ARG 58 9.745 -13.641 5.346 411 HB3 ARG 58 3HB ARG 58 8.049 -14.106 5.321 412 HG2 ARG 58 2HG ARG 58 8.422 -12.676 7.703 413 HG3 ARG 58 3HG ARG 58 9.281 -11.780 6.447 414 HD2 ARG 58 2HD ARG 58 7.268 -10.892 6.006 415 HD3 ARG 58 3HD ARG 58 6.968 -12.414 5.169 416 HE ARG 58 HE ARG 58 6.306 -12.566 7.939 417 HH11 ARG 58 1HH1 ARG 58 5.171 -11.456 4.841 418 HH12 ARG 58 2HH1 ARG 58 3.496 -11.556 5.273 419 HH21 ARG 58 2HH2 ARG 58 2.891 -12.264 7.365 420 HH22 ARG 58 1HH2 ARG 58 4.105 -12.702 8.519 421 H PHE 59 H PHE 59 8.780 -17.337 7.694 422 HA PHE 59 HA PHE 59 6.015 -16.857 8.539 423 HB2 PHE 59 2HB PHE 59 5.887 -17.778 6.271 424 HB3 PHE 59 3HB PHE 59 6.891 -19.140 6.757 425 HD1 PHE 59 HD1 PHE 59 5.984 -20.980 7.966 426 HD2 PHE 59 HD2 PHE 59 3.588 -17.569 7.107 427 HE1 PHE 59 HE1 PHE 59 3.971 -22.233 8.623 428 HE2 PHE 59 HE2 PHE 59 1.571 -18.815 7.764 429 HZ PHE 59 HZ PHE 59 1.761 -21.150 8.524 430 H ALA 60 H ALA 60 5.266 -18.216 10.180 431 HA ALA 60 HA ALA 60 7.276 -19.209 11.939 432 HB1 ALA 60 1HB ALA 60 4.928 -20.174 12.951 433 HB2 ALA 60 2HB ALA 60 5.601 -18.577 13.283 434 HB3 ALA 60 3HB ALA 60 4.386 -18.777 12.020 435 H GLY 61 H GLY 61 8.344 -21.035 11.514 436 HA2 GLY 61 2HA GLY 61 7.825 -23.527 11.798 437 HA3 GLY 61 3HA GLY 61 6.847 -23.296 10.356 438 H TYR 62 H TYR 62 9.364 -21.264 9.963 439 HA TYR 62 HA TYR 62 11.234 -21.272 8.670 440 HB2 TYR 62 2HB TYR 62 11.720 -24.159 9.288 441 HB3 TYR 62 3HB TYR 62 12.875 -22.838 9.154 442 HD1 TYR 62 HD1 TYR 62 11.971 -20.839 10.987 443 HD2 TYR 62 HD2 TYR 62 11.836 -25.071 11.404 444 HE1 TYR 62 HE1 TYR 62 11.977 -20.592 13.435 445 HE2 TYR 62 HE2 TYR 62 11.841 -24.836 13.853 446 HH TYR 62 HH TYR 62 11.478 -23.322 15.558 447 H THR 63 H THR 63 8.782 -21.837 7.409 448 HA THR 63 HA THR 63 9.732 -23.467 5.155 449 HB THR 63 HB THR 63 8.170 -24.904 6.249 450 HG1 THR 63 HG1 THR 63 6.528 -25.006 4.618 451 HG21 THR 63 3HG2 THR 63 6.593 -24.071 7.583 452 HG22 THR 63 1HG2 THR 63 5.716 -23.511 6.160 453 HG23 THR 63 2HG2 THR 63 6.879 -22.449 6.953 454 H VAL 64 H VAL 64 8.896 -22.882 3.101 455 HA VAL 64 HA VAL 64 7.281 -20.467 2.915 456 HB VAL 64 HB VAL 64 9.759 -19.822 3.036 457 HG11 VAL 64 1HG1 VAL 64 9.936 -20.446 0.145 458 HG12 VAL 64 2HG1 VAL 64 11.207 -20.347 1.365 459 HG13 VAL 64 3HG1 VAL 64 10.177 -21.777 1.276 460 HG21 VAL 64 3HG2 VAL 64 7.892 -18.389 2.196 461 HG22 VAL 64 1HG2 VAL 64 9.463 -18.034 1.475 462 HG23 VAL 64 2HG2 VAL 64 8.263 -18.954 0.567 463 H THR 65 H THR 65 6.619 -19.999 0.682 464 HA THR 65 HA THR 65 6.017 -22.457 -0.715 465 HB THR 65 HB THR 65 5.230 -19.601 -1.325 466 HG1 THR 65 HG1 THR 65 3.824 -21.775 -0.128 467 HG21 THR 65 3HG2 THR 65 3.399 -21.185 -2.571 468 HG22 THR 65 1HG2 THR 65 4.880 -22.111 -2.812 469 HG23 THR 65 2HG2 THR 65 4.784 -20.440 -3.369 470 H GLU 66 H GLU 66 6.985 -19.328 -2.098 471 HA GLU 66 HA GLU 66 9.401 -20.210 -3.237 472 HB2 GLU 66 2HB GLU 66 8.782 -20.482 -5.560 473 HB3 GLU 66 3HB GLU 66 7.879 -21.627 -4.578 474 HG2 GLU 66 2HG GLU 66 6.241 -19.397 -4.703 475 HG3 GLU 66 3HG GLU 66 6.929 -19.528 -6.320 476 H LEU 67 H LEU 67 9.615 -18.723 -5.496 477 HA LEU 67 HA LEU 67 10.027 -16.144 -4.571 478 HB2 LEU 67 2HB LEU 67 10.117 -15.519 -7.008 479 HB3 LEU 67 3HB LEU 67 11.184 -16.828 -6.502 480 HG LEU 67 HG LEU 67 9.170 -18.319 -7.355 481 HD11 LEU 67 1HD1 LEU 67 7.542 -17.098 -8.263 482 HD12 LEU 67 2HD1 LEU 67 8.648 -16.835 -9.610 483 HD13 LEU 67 3HD1 LEU 67 8.540 -15.645 -8.313 484 HD21 LEU 67 3HD2 LEU 67 11.483 -18.366 -8.177 485 HD22 LEU 67 1HD2 LEU 67 11.137 -16.977 -9.209 486 HD23 LEU 67 2HD2 LEU 67 10.313 -18.512 -9.490 487 H ALA 68 H ALA 68 7.201 -17.552 -6.107 488 HA ALA 68 HA ALA 68 5.781 -15.229 -6.711 489 HB1 ALA 68 1HB ALA 68 4.823 -17.977 -5.938 490 HB2 ALA 68 2HB ALA 68 3.748 -16.690 -6.485 491 HB3 ALA 68 3HB ALA 68 5.002 -17.306 -7.560 492 H ALA 69 H ALA 69 5.897 -17.114 -3.710 493 HA ALA 69 HA ALA 69 3.981 -15.546 -2.321 494 HB1 ALA 69 1HB ALA 69 5.864 -17.709 -1.656 495 HB2 ALA 69 2HB ALA 69 5.428 -16.639 -0.323 496 HB3 ALA 69 3HB ALA 69 4.170 -17.497 -1.212 497 H PHE 70 H PHE 70 7.466 -15.356 -2.704 498 HA PHE 70 HA PHE 70 7.925 -13.441 -0.663 499 HB2 PHE 70 2HB PHE 70 9.679 -14.901 -1.713 500 HB3 PHE 70 3HB PHE 70 9.583 -13.889 -3.150 501 HD1 PHE 70 HD1 PHE 70 10.891 -14.219 0.196 502 HD2 PHE 70 HD2 PHE 70 10.264 -11.506 -3.023 503 HE1 PHE 70 HE1 PHE 70 12.538 -12.678 1.179 504 HE2 PHE 70 HE2 PHE 70 11.911 -9.961 -2.046 505 HZ PHE 70 HZ PHE 70 13.051 -10.546 0.057 506 H ASN 71 H ASN 71 7.014 -13.220 -4.035 507 HA ASN 71 HA ASN 71 7.567 -10.513 -4.483 508 HB2 ASN 71 2HB ASN 71 6.723 -12.451 -6.082 509 HB3 ASN 71 3HB ASN 71 5.148 -11.752 -5.722 510 HD21 ASN 71 2HD2 ASN 71 7.751 -9.894 -8.191 511 HD22 ASN 71 1HD2 ASN 71 8.162 -11.338 -7.336 512 H THR 72 H THR 72 4.823 -12.105 -2.975 513 HA THR 72 HA THR 72 3.185 -9.770 -2.838 514 HB THR 72 HB THR 72 2.770 -11.937 -0.854 515 HG1 THR 72 HG1 THR 72 2.907 -12.340 -3.629 516 HG21 THR 72 3HG2 THR 72 0.735 -11.061 -2.832 517 HG22 THR 72 1HG2 THR 72 1.260 -9.884 -1.629 518 HG23 THR 72 2HG2 THR 72 0.561 -11.419 -1.114 519 H VAL 73 H VAL 73 5.441 -11.363 -0.641 520 HA VAL 73 HA VAL 73 4.870 -9.710 1.605 521 HB VAL 73 HB VAL 73 7.297 -11.397 0.980 522 HG11 VAL 73 1HG1 VAL 73 8.053 -9.828 2.552 523 HG12 VAL 73 2HG1 VAL 73 6.527 -9.851 3.438 524 HG13 VAL 73 3HG1 VAL 73 7.610 -11.242 3.508 525 HG21 VAL 73 3HG2 VAL 73 4.710 -11.894 2.391 526 HG22 VAL 73 1HG2 VAL 73 5.565 -12.904 1.225 527 HG23 VAL 73 2HG2 VAL 73 6.159 -12.772 2.881 528 H VAL 74 H VAL 74 7.531 -9.734 -0.762 529 HA VAL 74 HA VAL 74 8.921 -7.522 0.229 530 HB VAL 74 HB VAL 74 9.899 -9.018 -1.428 531 HG11 VAL 74 1HG1 VAL 74 7.599 -9.073 -2.704 532 HG12 VAL 74 2HG1 VAL 74 8.336 -7.765 -3.632 533 HG13 VAL 74 3HG1 VAL 74 9.118 -9.345 -3.557 534 HG21 VAL 74 3HG2 VAL 74 10.453 -6.468 -1.205 535 HG22 VAL 74 1HG2 VAL 74 11.169 -7.428 -2.500 536 HG23 VAL 74 2HG2 VAL 74 9.783 -6.389 -2.835 537 H ALA 75 H ALA 75 6.240 -7.721 -2.060 538 HA ALA 75 HA ALA 75 6.228 -5.058 -2.921 539 HB1 ALA 75 1HB ALA 75 4.769 -6.136 -4.232 540 HB2 ALA 75 2HB ALA 75 4.375 -7.320 -2.985 541 HB3 ALA 75 3HB ALA 75 3.588 -5.742 -2.983 542 H ARG 76 H ARG 76 4.634 -6.599 -0.156 543 HA ARG 76 HA ARG 76 3.379 -4.156 0.697 544 HB2 ARG 76 2HB ARG 76 3.517 -6.959 1.690 545 HB3 ARG 76 3HB ARG 76 3.120 -5.702 2.854 546 HG2 ARG 76 2HG ARG 76 1.126 -6.743 1.888 547 HG3 ARG 76 3HG ARG 76 1.222 -5.019 1.520 548 HD2 ARG 76 2HD ARG 76 2.157 -5.579 -0.695 549 HD3 ARG 76 3HD ARG 76 1.963 -7.291 -0.320 550 HE ARG 76 HE ARG 76 -0.236 -7.096 -0.880 551 HH11 ARG 76 1HH1 ARG 76 0.985 -3.934 -0.082 552 HH12 ARG 76 2HH1 ARG 76 -0.483 -3.117 -0.507 553 HH21 ARG 76 2HH2 ARG 76 -2.279 -4.312 -1.280 554 HH22 ARG 76 1HH2 ARG 76 -2.173 -6.032 -1.442 555 H HIS 77 H HIS 77 6.370 -5.804 1.305 556 HA HIS 77 HA HIS 77 6.993 -4.399 3.728 557 HB2 HIS 77 2HB HIS 77 7.906 -6.690 2.847 558 HB3 HIS 77 3HB HIS 77 9.075 -5.685 1.996 559 HD1 HIS 77 HD1 HIS 77 8.645 -3.799 4.865 560 HD2 HIS 77 HD2 HIS 77 10.439 -7.483 4.176 561 HE1 HIS 77 HE1 HIS 77 10.228 -4.146 6.788 562 H VAL 78 H VAL 78 7.484 -3.881 0.321 563 HA VAL 78 HA VAL 78 9.586 -2.050 0.366 564 HB VAL 78 HB VAL 78 7.246 -2.345 -1.504 565 HG11 VAL 78 1HG1 VAL 78 9.008 -0.866 -2.927 566 HG12 VAL 78 2HG1 VAL 78 7.616 -0.197 -2.071 567 HG13 VAL 78 3HG1 VAL 78 9.213 -0.165 -1.322 568 HG21 VAL 78 3HG2 VAL 78 9.865 -2.698 -2.634 569 HG22 VAL 78 1HG2 VAL 78 9.675 -3.708 -1.200 570 HG23 VAL 78 2HG2 VAL 78 8.528 -3.843 -2.533 571 H ARG 79 H ARG 79 9.536 -0.496 1.920 572 HA ARG 79 HA ARG 79 7.710 1.706 1.504 573 HB2 ARG 79 2HB ARG 79 7.347 -0.190 3.680 574 HB3 ARG 79 3HB ARG 79 7.580 1.450 4.269 575 HG2 ARG 79 2HG ARG 79 5.782 1.735 2.183 576 HG3 ARG 79 3HG ARG 79 5.281 0.249 2.994 577 HD2 ARG 79 2HD ARG 79 5.959 2.544 4.730 578 HD3 ARG 79 3HD ARG 79 4.490 2.693 3.767 579 HE ARG 79 HE ARG 79 4.471 0.193 5.020 580 HH11 ARG 79 1HH1 ARG 79 4.284 3.571 5.841 581 HH12 ARG 79 2HH1 ARG 79 3.329 3.307 7.263 582 HH21 ARG 79 2HH2 ARG 79 2.721 1.180 7.858 583 HH22 ARG 79 1HH2 ARG 79 3.213 -0.168 6.888 584 HA PRO 80 HA PRO 80 11.132 4.124 2.802 585 HB2 PRO 80 2HB PRO 80 9.934 6.202 4.074 586 HB3 PRO 80 3HB PRO 80 9.877 5.988 2.320 587 HG2 PRO 80 2HG PRO 80 7.818 5.295 4.380 588 HG3 PRO 80 3HG PRO 80 7.602 6.057 2.793 589 HD2 PRO 80 2HD PRO 80 7.115 3.429 3.226 590 HD3 PRO 80 3HD PRO 80 7.713 4.046 1.672 591 H SER 81 H SER 81 12.383 3.146 4.308 592 HA SER 81 HA SER 81 13.274 2.608 6.331 593 HB2 SER 81 2HB SER 81 12.531 5.192 6.570 594 HB3 SER 81 3HB SER 81 11.544 4.480 7.846 595 HG SER 81 HG SER 81 13.278 4.350 9.005 596 H ALA 82 H ALA 82 11.111 1.058 5.438 597 HA ALA 82 HA ALA 82 9.436 0.562 7.772 598 HB1 ALA 82 1HB ALA 82 9.363 -0.231 4.915 599 HB2 ALA 82 2HB ALA 82 8.617 -1.318 6.087 600 HB3 ALA 82 3HB ALA 82 8.071 0.354 5.964 601 H SER 83 H SER 83 10.650 -0.422 9.317 602 HA SER 83 HA SER 83 12.331 -2.695 8.591 603 HB2 SER 83 2HB SER 83 11.948 -1.565 11.362 604 HB3 SER 83 3HB SER 83 13.302 -2.516 10.750 605 HG SER 83 HG SER 83 12.727 0.190 10.425 606 H ILE 84 H ILE 84 11.849 -4.768 9.022 607 HA ILE 84 HA ILE 84 9.716 -5.424 10.892 608 HB ILE 84 HB ILE 84 9.609 -6.331 8.012 609 HG12 ILE 84 2HG1 ILE 84 7.796 -4.465 9.558 610 HG13 ILE 84 3HG1 ILE 84 8.912 -3.992 8.281 611 HG21 ILE 84 1HG2 ILE 84 7.558 -7.453 8.617 612 HG22 ILE 84 2HG2 ILE 84 8.868 -8.019 9.651 613 HG23 ILE 84 3HG2 ILE 84 7.690 -6.865 10.274 614 HD11 ILE 84 3HD1 ILE 84 7.186 -4.197 6.904 615 HD12 ILE 84 1HD1 ILE 84 7.375 -5.940 7.092 616 HD13 ILE 84 2HD1 ILE 84 6.227 -5.062 8.104 617 HA PRO 85 HA PRO 85 12.580 -8.694 11.712 618 HB2 PRO 85 2HB PRO 85 10.981 -10.153 13.351 619 HB3 PRO 85 3HB PRO 85 11.762 -8.651 13.859 620 HG2 PRO 85 2HG PRO 85 8.950 -9.106 12.936 621 HG3 PRO 85 3HG PRO 85 9.539 -8.117 14.285 622 HD2 PRO 85 2HD PRO 85 8.829 -7.053 11.898 623 HD3 PRO 85 3HD PRO 85 10.113 -6.359 12.909 624 H VAL 86 H VAL 86 13.038 -10.184 10.223 625 HA VAL 86 HA VAL 86 10.857 -11.886 9.206 626 HB VAL 86 HB VAL 86 13.508 -11.334 7.870 627 HG11 VAL 86 1HG1 VAL 86 11.100 -12.946 7.167 628 HG12 VAL 86 2HG1 VAL 86 12.034 -12.183 5.879 629 HG13 VAL 86 3HG1 VAL 86 12.809 -13.332 6.971 630 HG21 VAL 86 3HG2 VAL 86 10.802 -10.077 7.461 631 HG22 VAL 86 1HG2 VAL 86 12.317 -9.277 7.882 632 HG23 VAL 86 2HG2 VAL 86 12.107 -9.980 6.278 633 H VAL 87 H VAL 87 11.200 -14.114 8.986 634 HA VAL 87 HA VAL 87 13.157 -15.193 10.859 635 HB VAL 87 HB VAL 87 10.880 -16.542 9.403 636 HG11 VAL 87 1HG1 VAL 87 12.128 -18.379 9.805 637 HG12 VAL 87 2HG1 VAL 87 13.087 -17.587 11.056 638 HG13 VAL 87 3HG1 VAL 87 11.478 -18.203 11.434 639 HG21 VAL 87 3HG2 VAL 87 10.741 -16.450 12.293 640 HG22 VAL 87 1HG2 VAL 87 10.824 -14.835 11.589 641 HG23 VAL 87 2HG2 VAL 87 9.551 -15.949 11.091 642 H PHE 88 H PHE 88 15.036 -15.984 10.203 643 HA PHE 88 HA PHE 88 15.282 -16.892 7.410 644 HB2 PHE 88 2HB PHE 88 17.151 -15.358 9.178 645 HB3 PHE 88 3HB PHE 88 17.811 -16.387 7.911 646 HD1 PHE 88 HD1 PHE 88 17.752 -15.731 5.645 647 HD2 PHE 88 HD2 PHE 88 15.641 -13.479 8.576 648 HE1 PHE 88 HE1 PHE 88 17.384 -13.939 3.998 649 HE2 PHE 88 HE2 PHE 88 15.269 -11.684 6.934 650 HZ PHE 88 HZ PHE 88 16.140 -11.913 4.642 651 H SER 89 H SER 89 16.606 -18.709 6.988 652 HA SER 89 HA SER 89 17.331 -20.337 9.322 653 HB2 SER 89 2HB SER 89 15.241 -20.903 7.386 654 HB3 SER 89 3HB SER 89 16.460 -22.178 7.409 655 HG SER 89 HG SER 89 15.852 -22.731 9.357 656 H ARG 90 H ARG 90 19.047 -21.771 9.011 657 HA ARG 90 HA ARG 90 20.467 -21.536 6.444 658 HB2 ARG 90 2HB ARG 90 21.339 -20.694 9.078 659 HB3 ARG 90 3HB ARG 90 22.435 -21.888 8.395 660 HG2 ARG 90 2HG ARG 90 23.082 -20.519 6.679 661 HG3 ARG 90 3HG ARG 90 21.572 -19.606 6.694 662 HD2 ARG 90 2HD ARG 90 23.554 -19.483 8.951 663 HD3 ARG 90 3HD ARG 90 23.653 -18.417 7.550 664 HE ARG 90 HE ARG 90 21.081 -18.425 8.843 665 HH11 ARG 90 1HH1 ARG 90 24.259 -17.007 8.768 666 HH12 ARG 90 2HH1 ARG 90 23.762 -15.532 9.529 667 HH21 ARG 90 2HH2 ARG 90 21.574 -15.238 10.142 668 HH22 ARG 90 1HH2 ARG 90 20.413 -16.488 9.846 669 H ASP 91 H ASP 91 19.711 -23.571 5.806 670 HA ASP 91 HA ASP 91 19.797 -25.830 5.555 671 HB2 ASP 91 2HB ASP 91 22.186 -25.783 7.401 672 HB3 ASP 91 3HB ASP 91 21.811 -26.969 6.154 673 H GLY 92 H GLY 92 18.093 -24.820 7.550 674 HA2 GLY 92 2HA GLY 92 16.643 -26.157 8.904 675 HA3 GLY 92 3HA GLY 92 18.025 -27.147 9.346 676 H VAL 93 H VAL 93 19.429 -24.354 9.613 677 HA VAL 93 HA VAL 93 19.254 -24.230 12.433 678 HB VAL 93 HB VAL 93 20.412 -22.271 10.449 679 HG11 VAL 93 1HG1 VAL 93 20.332 -22.238 13.441 680 HG12 VAL 93 2HG1 VAL 93 21.684 -21.511 12.569 681 HG13 VAL 93 3HG1 VAL 93 20.042 -20.924 12.302 682 HG21 VAL 93 3HG2 VAL 93 21.293 -24.765 11.135 683 HG22 VAL 93 1HG2 VAL 93 22.310 -23.461 10.523 684 HG23 VAL 93 2HG2 VAL 93 22.181 -23.739 12.260 685 H VAL 94 H VAL 94 18.249 -22.784 13.792 686 HA VAL 94 HA VAL 94 16.135 -21.143 12.559 687 HB VAL 94 HB VAL 94 15.152 -22.860 13.910 688 HG11 VAL 94 1HG1 VAL 94 16.010 -22.269 16.535 689 HG12 VAL 94 2HG1 VAL 94 16.262 -23.753 15.613 690 HG13 VAL 94 3HG1 VAL 94 17.456 -22.456 15.544 691 HG21 VAL 94 3HG2 VAL 94 13.924 -21.536 15.548 692 HG22 VAL 94 1HG2 VAL 94 15.137 -20.260 15.440 693 HG23 VAL 94 2HG2 VAL 94 14.128 -20.638 14.044 694 H MET 95 H MET 95 16.625 -19.054 12.546 695 HA MET 95 HA MET 95 17.583 -17.802 14.994 696 HB2 MET 95 2HB MET 95 19.597 -18.400 13.610 697 HB3 MET 95 3HB MET 95 18.989 -17.317 12.365 698 HG2 MET 95 2HG MET 95 20.644 -16.160 13.625 699 HG3 MET 95 3HG MET 95 19.071 -15.466 14.011 700 HE1 MET 95 3HE MET 95 22.079 -17.251 16.841 701 HE2 MET 95 1HE MET 95 21.778 -18.127 15.340 702 HE3 MET 95 2HE MET 95 22.298 -16.443 15.288 703 H SER 96 H SER 96 17.023 -15.637 15.189 704 HA SER 96 HA SER 96 15.146 -14.667 13.139 705 HB2 SER 96 2HB SER 96 14.235 -13.239 15.017 706 HB3 SER 96 3HB SER 96 14.010 -14.975 15.225 707 HG SER 96 HG SER 96 14.872 -13.669 17.070 708 H ALA 97 H ALA 97 15.564 -12.827 12.089 709 HA ALA 97 HA ALA 97 17.476 -10.919 13.217 710 HB1 ALA 97 1HB ALA 97 17.744 -11.695 10.338 711 HB2 ALA 97 2HB ALA 97 18.909 -10.893 11.393 712 HB3 ALA 97 3HB ALA 97 18.569 -12.611 11.599 713 H THR 98 H THR 98 17.046 -8.818 12.736 714 HA THR 98 HA THR 98 14.540 -8.299 11.332 715 HB THR 98 HB THR 98 16.212 -6.272 12.813 716 HG1 THR 98 HG1 THR 98 15.412 -6.998 14.656 717 HG21 THR 98 3HG2 THR 98 13.868 -6.084 11.285 718 HG22 THR 98 1HG2 THR 98 14.560 -4.851 12.338 719 HG23 THR 98 2HG2 THR 98 13.353 -5.972 12.968 720 H ILE 99 H ILE 99 14.428 -7.402 9.373 721 HA ILE 99 HA ILE 99 16.905 -6.300 8.216 722 HB ILE 99 HB ILE 99 15.973 -6.904 6.001 723 HG12 ILE 99 2HG1 ILE 99 14.101 -8.892 6.737 724 HG13 ILE 99 3HG1 ILE 99 13.632 -7.423 7.585 725 HG21 ILE 99 1HG2 ILE 99 15.991 -9.529 6.667 726 HG22 ILE 99 2HG2 ILE 99 17.438 -8.540 6.478 727 HG23 ILE 99 3HG2 ILE 99 16.763 -8.817 8.084 728 HD11 ILE 99 3HD1 ILE 99 13.354 -6.233 5.584 729 HD12 ILE 99 1HD1 ILE 99 14.207 -7.456 4.643 730 HD13 ILE 99 2HD1 ILE 99 12.611 -7.808 5.306 731 H VAL 100 H VAL 100 16.889 -4.208 7.752 732 HA VAL 100 HA VAL 100 14.333 -2.779 7.720 733 HB VAL 100 HB VAL 100 17.126 -1.632 7.800 734 HG11 VAL 100 1HG1 VAL 100 16.160 0.343 7.505 735 HG12 VAL 100 2HG1 VAL 100 14.592 -0.449 7.329 736 HG13 VAL 100 3HG1 VAL 100 15.147 0.069 8.922 737 HG21 VAL 100 3HG2 VAL 100 16.732 -2.952 9.790 738 HG22 VAL 100 1HG2 VAL 100 16.672 -1.237 10.194 739 HG23 VAL 100 2HG2 VAL 100 15.177 -2.159 10.042 740 H VAL 101 H VAL 101 13.425 -2.460 5.804 741 HA VAL 101 HA VAL 101 15.133 -2.227 3.427 742 HB VAL 101 HB VAL 101 12.853 -2.452 2.230 743 HG11 VAL 101 1HG1 VAL 101 13.249 -4.688 1.963 744 HG12 VAL 101 2HG1 VAL 101 14.778 -4.197 2.694 745 HG13 VAL 101 3HG1 VAL 101 13.531 -4.957 3.683 746 HG21 VAL 101 3HG2 VAL 101 12.107 -3.588 4.924 747 HG22 VAL 101 1HG2 VAL 101 11.501 -2.070 4.262 748 HG23 VAL 101 2HG2 VAL 101 11.116 -3.595 3.465 749 H GLY 102 H GLY 102 15.706 -0.133 3.199 750 HA2 GLY 102 2HA GLY 102 13.595 1.910 3.438 751 HA3 GLY 102 3HA GLY 102 15.318 2.219 3.584 752 H GLU 103 H GLU 103 12.661 2.343 1.545 753 HA GLU 103 HA GLU 103 14.205 2.183 -0.918 754 HB2 GLU 103 2HB GLU 103 11.280 2.525 -0.304 755 HB3 GLU 103 3HB GLU 103 11.909 2.796 -1.923 756 HG2 GLU 103 2HG GLU 103 11.020 0.560 -1.720 757 HG3 GLU 103 3HG GLU 103 12.762 0.509 -1.979 758 H LEU 104 H LEU 104 13.319 4.511 1.364 759 HA LEU 104 HA LEU 104 14.321 6.633 -0.357 760 HB2 LEU 104 2HB LEU 104 11.715 6.947 1.118 761 HB3 LEU 104 3HB LEU 104 12.489 8.122 0.057 762 HG LEU 104 HG LEU 104 11.479 5.460 -0.919 763 HD11 LEU 104 1HD1 LEU 104 9.518 6.450 -0.142 764 HD12 LEU 104 2HD1 LEU 104 9.583 6.921 -1.839 765 HD13 LEU 104 3HD1 LEU 104 10.047 8.072 -0.587 766 HD21 LEU 104 3HD2 LEU 104 13.129 7.323 -2.091 767 HD22 LEU 104 1HD2 LEU 104 11.537 7.742 -2.725 768 HD23 LEU 104 2HD2 LEU 104 12.169 6.110 -2.940 769 H GLU 105 H GLU 105 15.652 5.461 1.720 770 HA GLU 105 HA GLU 105 15.264 6.749 4.217 771 HB2 GLU 105 2HB GLU 105 17.512 5.880 4.767 772 HB3 GLU 105 3HB GLU 105 16.460 4.646 4.089 773 HG2 GLU 105 2HG GLU 105 17.857 4.255 2.416 774 HG3 GLU 105 3HG GLU 105 17.978 5.970 2.025 Start of MODEL 18 1 HA PRO 1 HA PRO 1 2.264 1.957 -2.093 2 HB2 PRO 1 2HB PRO 1 4.468 0.416 -1.718 3 HB3 PRO 1 3HB PRO 1 4.319 2.053 -1.069 4 HG2 PRO 1 2HG PRO 1 3.904 -0.574 0.305 5 HG3 PRO 1 3HG PRO 1 4.738 0.876 0.892 6 HD2 PRO 1 2HD PRO 1 2.210 0.249 1.633 7 HD3 PRO 1 3HD PRO 1 2.770 1.926 1.473 8 H LEU 2 H LEU 2 3.302 0.369 -3.746 9 HA LEU 2 HA LEU 2 2.159 -2.306 -3.637 10 HB2 LEU 2 2HB LEU 2 0.943 -0.176 -5.075 11 HB3 LEU 2 3HB LEU 2 1.618 -1.312 -6.241 12 HG LEU 2 HG LEU 2 -0.659 -1.904 -5.882 13 HD11 LEU 2 1HD1 LEU 2 -0.464 -4.172 -5.169 14 HD12 LEU 2 2HD1 LEU 2 0.986 -3.812 -4.232 15 HD13 LEU 2 3HD1 LEU 2 1.033 -3.737 -5.993 16 HD21 LEU 2 3HD2 LEU 2 -1.756 -1.917 -3.897 17 HD22 LEU 2 1HD2 LEU 2 -0.496 -0.756 -3.481 18 HD23 LEU 2 2HD2 LEU 2 -0.338 -2.442 -2.988 19 H THR 3 H THR 3 2.957 -3.701 -5.370 20 HA THR 3 HA THR 3 5.459 -2.731 -6.582 21 HB THR 3 HB THR 3 5.837 -4.190 -4.538 22 HG1 THR 3 HG1 THR 3 7.645 -4.804 -5.492 23 HG21 THR 3 3HG2 THR 3 5.270 -6.413 -4.506 24 HG22 THR 3 1HG2 THR 3 5.250 -6.546 -6.263 25 HG23 THR 3 2HG2 THR 3 3.909 -5.769 -5.423 26 H ARG 4 H ARG 4 6.236 -4.227 -8.345 27 HA ARG 4 HA ARG 4 3.918 -5.171 -9.896 28 HB2 ARG 4 2HB ARG 4 6.231 -3.542 -10.574 29 HB3 ARG 4 3HB ARG 4 6.055 -4.916 -11.658 30 HG2 ARG 4 2HG ARG 4 4.735 -3.477 -12.780 31 HG3 ARG 4 3HG ARG 4 3.522 -4.056 -11.636 32 HD2 ARG 4 2HD ARG 4 5.096 -1.875 -10.551 33 HD3 ARG 4 3HD ARG 4 4.288 -1.424 -12.052 34 HE ARG 4 HE ARG 4 3.067 -1.839 -9.516 35 HH11 ARG 4 1HH1 ARG 4 2.558 -2.193 -12.942 36 HH12 ARG 4 2HH1 ARG 4 0.833 -2.073 -12.830 37 HH21 ARG 4 2HH2 ARG 4 -0.167 -1.779 -10.790 38 HH22 ARG 4 1HH2 ARG 4 0.797 -1.678 -9.356 39 HA PRO 5 HA PRO 5 5.460 -9.274 -10.053 40 HB2 PRO 5 2HB PRO 5 4.907 -10.011 -12.607 41 HB3 PRO 5 3HB PRO 5 3.657 -9.801 -11.376 42 HG2 PRO 5 2HG PRO 5 4.525 -7.917 -13.535 43 HG3 PRO 5 3HG PRO 5 2.884 -8.321 -12.995 44 HD2 PRO 5 2HD PRO 5 4.154 -6.056 -12.229 45 HD3 PRO 5 3HD PRO 5 2.997 -6.902 -11.182 46 H TYR 6 H TYR 6 7.702 -8.322 -9.846 47 HA TYR 6 HA TYR 6 9.261 -8.934 -12.271 48 HB2 TYR 6 2HB TYR 6 9.502 -6.665 -10.337 49 HB3 TYR 6 3HB TYR 6 10.958 -7.283 -11.110 50 HD1 TYR 6 HD1 TYR 6 10.632 -7.642 -13.768 51 HD2 TYR 6 HD2 TYR 6 8.480 -4.874 -11.358 52 HE1 TYR 6 HE1 TYR 6 10.155 -6.286 -15.764 53 HE2 TYR 6 HE2 TYR 6 7.996 -3.510 -13.347 54 HH TYR 6 HH TYR 6 9.067 -3.152 -15.637 55 H LEU 7 H LEU 7 10.914 -10.333 -12.054 56 HA LEU 7 HA LEU 7 11.515 -11.299 -9.337 57 HB2 LEU 7 2HB LEU 7 12.142 -13.436 -10.432 58 HB3 LEU 7 3HB LEU 7 10.436 -13.018 -10.584 59 HG LEU 7 HG LEU 7 11.896 -12.060 -12.869 60 HD11 LEU 7 1HD1 LEU 7 12.411 -14.338 -13.790 61 HD12 LEU 7 2HD1 LEU 7 12.252 -14.960 -12.148 62 HD13 LEU 7 3HD1 LEU 7 13.502 -13.774 -12.524 63 HD21 LEU 7 3HD2 LEU 7 9.585 -13.862 -12.292 64 HD22 LEU 7 1HD2 LEU 7 10.254 -13.788 -13.923 65 HD23 LEU 7 2HD2 LEU 7 9.626 -12.327 -13.160 66 H GLY 8 H GLY 8 13.503 -10.923 -8.619 67 HA2 GLY 8 2HA GLY 8 15.659 -10.580 -10.611 68 HA3 GLY 8 3HA GLY 8 15.511 -9.534 -9.206 69 H PHE 9 H PHE 9 14.813 -12.925 -8.939 70 HA PHE 9 HA PHE 9 17.458 -13.655 -8.070 71 HB2 PHE 9 2HB PHE 9 16.926 -14.124 -5.765 72 HB3 PHE 9 3HB PHE 9 16.529 -12.440 -6.094 73 HD1 PHE 9 HD1 PHE 9 15.391 -15.427 -4.661 74 HD2 PHE 9 HD2 PHE 9 14.038 -12.015 -6.816 75 HE1 PHE 9 HE1 PHE 9 13.109 -15.807 -3.824 76 HE2 PHE 9 HE2 PHE 9 11.754 -12.389 -5.982 77 HZ PHE 9 HZ PHE 9 11.287 -14.287 -4.483 78 H ARG 10 H ARG 10 17.495 -15.944 -7.252 79 HA ARG 10 HA ARG 10 15.413 -17.514 -8.624 80 HB2 ARG 10 2HB ARG 10 18.356 -18.048 -8.237 81 HB3 ARG 10 3HB ARG 10 17.226 -19.297 -8.742 82 HG2 ARG 10 2HG ARG 10 16.630 -17.415 -10.549 83 HG3 ARG 10 3HG ARG 10 18.320 -17.007 -10.242 84 HD2 ARG 10 2HD ARG 10 18.729 -19.547 -10.549 85 HD3 ARG 10 3HD ARG 10 17.150 -19.537 -11.335 86 HE ARG 10 HE ARG 10 18.691 -17.501 -12.463 87 HH11 ARG 10 1HH1 ARG 10 18.648 -20.977 -12.272 88 HH12 ARG 10 2HH1 ARG 10 19.428 -21.201 -13.802 89 HH21 ARG 10 2HH2 ARG 10 20.037 -19.383 -15.057 90 HH22 ARG 10 1HH2 ARG 10 19.718 -17.783 -14.480 91 H VAL 11 H VAL 11 14.748 -19.495 -7.671 92 HA VAL 11 HA VAL 11 15.454 -19.846 -4.840 93 HB VAL 11 HB VAL 11 13.014 -20.415 -4.422 94 HG11 VAL 11 1HG1 VAL 11 13.864 -18.432 -3.467 95 HG12 VAL 11 2HG1 VAL 11 13.917 -17.611 -5.028 96 HG13 VAL 11 3HG1 VAL 11 12.365 -17.970 -4.271 97 HG21 VAL 11 3HG2 VAL 11 12.253 -20.641 -6.696 98 HG22 VAL 11 1HG2 VAL 11 11.392 -19.303 -5.934 99 HG23 VAL 11 2HG2 VAL 11 12.712 -18.976 -7.056 100 H ALA 12 H ALA 12 16.083 -21.858 -4.462 101 HA ALA 12 HA ALA 12 15.144 -23.991 -6.265 102 HB1 ALA 12 1HB ALA 12 17.256 -25.172 -5.308 103 HB2 ALA 12 2HB ALA 12 17.431 -23.949 -6.567 104 HB3 ALA 12 3HB ALA 12 17.753 -23.534 -4.884 105 H VAL 13 H VAL 13 13.801 -25.431 -5.420 106 HA VAL 13 HA VAL 13 13.291 -25.492 -2.585 107 HB VAL 13 HB VAL 13 11.409 -25.702 -4.087 108 HG11 VAL 13 1HG1 VAL 13 11.831 -28.375 -5.065 109 HG12 VAL 13 2HG1 VAL 13 11.456 -26.901 -5.959 110 HG13 VAL 13 3HG1 VAL 13 13.132 -27.309 -5.592 111 HG21 VAL 13 3HG2 VAL 13 11.966 -28.286 -2.631 112 HG22 VAL 13 1HG2 VAL 13 11.231 -26.835 -1.948 113 HG23 VAL 13 2HG2 VAL 13 10.382 -27.752 -3.193 114 H GLY 14 H GLY 14 14.281 -26.756 -1.161 115 HA2 GLY 14 2HA GLY 14 15.168 -29.423 -1.960 116 HA3 GLY 14 3HA GLY 14 16.403 -28.317 -1.377 117 H ARG 15 H ARG 15 16.814 -29.813 0.336 118 HA ARG 15 HA ARG 15 14.897 -29.516 2.544 119 HB2 ARG 15 2HB ARG 15 16.455 -32.055 2.087 120 HB3 ARG 15 3HB ARG 15 15.118 -31.787 3.197 121 HG2 ARG 15 2HG ARG 15 14.918 -31.780 0.192 122 HG3 ARG 15 3HG ARG 15 14.457 -33.114 1.252 123 HD2 ARG 15 2HD ARG 15 13.183 -30.773 2.210 124 HD3 ARG 15 3HD ARG 15 12.929 -30.841 0.466 125 HE ARG 15 HE ARG 15 11.729 -32.512 2.428 126 HH11 ARG 15 1HH1 ARG 15 12.942 -32.488 -0.835 127 HH12 ARG 15 2HH1 ARG 15 11.910 -33.773 -1.367 128 HH21 ARG 15 2HH2 ARG 15 10.443 -34.749 0.098 129 HH22 ARG 15 1HH2 ARG 15 10.365 -34.205 1.740 130 H ASP 16 H ASP 16 15.772 -29.078 4.507 131 HA ASP 16 HA ASP 16 18.670 -28.644 4.570 132 HB2 ASP 16 2HB ASP 16 18.043 -27.377 6.729 133 HB3 ASP 16 3HB ASP 16 17.577 -26.663 5.187 134 H SER 17 H SER 17 19.379 -28.754 7.104 135 HA SER 17 HA SER 17 19.575 -31.507 7.659 136 HB2 SER 17 2HB SER 17 21.071 -29.457 8.392 137 HB3 SER 17 3HB SER 17 20.033 -29.485 9.817 138 HG SER 17 HG SER 17 21.680 -31.569 8.828 139 H SER 18 H SER 18 17.295 -29.086 8.635 140 HA SER 18 HA SER 18 16.222 -30.650 10.817 141 HB2 SER 18 2HB SER 18 15.667 -28.555 11.425 142 HB3 SER 18 3HB SER 18 15.909 -27.937 9.792 143 HG SER 18 HG SER 18 13.776 -27.693 10.137 144 H GLY 19 H GLY 19 15.143 -29.650 7.577 145 HA2 GLY 19 2HA GLY 19 13.921 -30.995 6.085 146 HA3 GLY 19 3HA GLY 19 13.533 -32.078 7.413 147 H CYS 20 H CYS 20 13.026 -28.606 6.774 148 HA CYS 20 HA CYS 20 10.201 -29.001 7.510 149 HB2 CYS 20 2HB CYS 20 12.173 -26.974 8.253 150 HB3 CYS 20 3HB CYS 20 10.665 -26.281 7.669 151 HG CYS 20 HG CYS 20 9.187 -28.003 9.532 152 H THR 21 H THR 21 11.886 -28.957 4.858 153 HA THR 21 HA THR 21 11.553 -28.363 2.685 154 HB THR 21 HB THR 21 8.721 -27.598 3.275 155 HG1 THR 21 HG1 THR 21 9.682 -30.283 3.235 156 HG21 THR 21 3HG2 THR 21 9.250 -27.524 0.985 157 HG22 THR 21 1HG2 THR 21 8.432 -29.071 1.201 158 HG23 THR 21 2HG2 THR 21 10.190 -29.014 1.066 159 H THR 22 H THR 22 12.846 -26.538 2.601 160 HA THR 22 HA THR 22 11.381 -24.005 2.474 161 HB THR 22 HB THR 22 12.322 -23.769 4.618 162 HG1 THR 22 HG1 THR 22 13.529 -22.002 4.271 163 HG21 THR 22 3HG2 THR 22 14.968 -24.117 4.710 164 HG22 THR 22 1HG2 THR 22 14.585 -25.295 3.456 165 HG23 THR 22 2HG2 THR 22 13.831 -25.422 5.045 166 H LEU 23 H LEU 23 12.481 -22.352 1.232 167 HA LEU 23 HA LEU 23 14.223 -23.529 -0.820 168 HB2 LEU 23 2HB LEU 23 12.301 -21.229 -0.833 169 HB3 LEU 23 3HB LEU 23 13.544 -21.385 -2.073 170 HG LEU 23 HG LEU 23 12.577 -23.630 -2.632 171 HD11 LEU 23 1HD1 LEU 23 9.974 -23.392 -1.757 172 HD12 LEU 23 2HD1 LEU 23 10.927 -22.956 -0.339 173 HD13 LEU 23 3HD1 LEU 23 11.187 -24.510 -1.131 174 HD21 LEU 23 3HD2 LEU 23 11.904 -22.172 -4.221 175 HD22 LEU 23 1HD2 LEU 23 11.289 -21.007 -3.049 176 HD23 LEU 23 2HD2 LEU 23 10.328 -22.425 -3.470 177 H SER 24 H SER 24 15.968 -22.238 -1.679 178 HA SER 24 HA SER 24 17.048 -20.332 0.294 179 HB2 SER 24 2HB SER 24 18.976 -21.701 -1.473 180 HB3 SER 24 3HB SER 24 19.077 -21.350 0.252 181 HG SER 24 HG SER 24 18.810 -23.478 0.268 182 H ILE 25 H ILE 25 18.258 -18.566 -0.500 183 HA ILE 25 HA ILE 25 17.468 -17.760 -3.197 184 HB ILE 25 HB ILE 25 18.846 -16.012 -1.173 185 HG12 ILE 25 2HG1 ILE 25 16.879 -16.931 -0.071 186 HG13 ILE 25 3HG1 ILE 25 16.593 -15.244 -0.485 187 HG21 ILE 25 1HG2 ILE 25 16.926 -15.309 -3.385 188 HG22 ILE 25 2HG2 ILE 25 17.900 -14.205 -2.417 189 HG23 ILE 25 3HG2 ILE 25 18.681 -15.296 -3.560 190 HD11 ILE 25 3HD1 ILE 25 15.605 -17.604 -2.068 191 HD12 ILE 25 1HD1 ILE 25 14.649 -16.676 -0.912 192 HD13 ILE 25 2HD1 ILE 25 15.252 -15.904 -2.379 193 H GLN 26 H GLN 26 18.868 -17.496 -4.834 194 HA GLN 26 HA GLN 26 21.701 -18.048 -4.285 195 HB2 GLN 26 2HB GLN 26 20.299 -18.170 -6.955 196 HB3 GLN 26 3HB GLN 26 21.894 -18.794 -6.558 197 HG2 GLN 26 2HG GLN 26 21.018 -20.748 -6.029 198 HG3 GLN 26 3HG GLN 26 20.014 -19.985 -4.797 199 HE21 GLN 26 2HE2 GLN 26 17.087 -20.573 -6.507 200 HE22 GLN 26 1HE2 GLN 26 17.920 -20.251 -5.028 201 H GLU 27 H GLU 27 19.535 -15.605 -5.265 202 HA GLU 27 HA GLU 27 21.806 -13.902 -6.050 203 HB2 GLU 27 2HB GLU 27 19.790 -14.667 -7.748 204 HB3 GLU 27 3HB GLU 27 19.199 -13.124 -7.148 205 HG2 GLU 27 2HG GLU 27 21.861 -12.647 -7.750 206 HG3 GLU 27 3HG GLU 27 21.294 -13.689 -9.054 207 H VAL 28 H VAL 28 20.548 -11.489 -6.205 208 HA VAL 28 HA VAL 28 19.623 -11.081 -3.437 209 HB VAL 28 HB VAL 28 20.893 -8.992 -5.202 210 HG11 VAL 28 1HG1 VAL 28 19.562 -8.098 -3.392 211 HG12 VAL 28 2HG1 VAL 28 20.392 -9.136 -2.231 212 HG13 VAL 28 3HG1 VAL 28 21.274 -7.847 -3.050 213 HG21 VAL 28 3HG2 VAL 28 22.482 -10.815 -4.862 214 HG22 VAL 28 1HG2 VAL 28 22.969 -9.376 -3.967 215 HG23 VAL 28 2HG2 VAL 28 22.220 -10.729 -3.121 216 H THR 29 H THR 29 17.714 -10.112 -3.075 217 HA THR 29 HA THR 29 16.243 -9.091 -5.417 218 HB THR 29 HB THR 29 15.286 -11.171 -4.444 219 HG1 THR 29 HG1 THR 29 13.904 -9.665 -5.473 220 HG21 THR 29 3HG2 THR 29 15.942 -10.202 -2.033 221 HG22 THR 29 1HG2 THR 29 14.662 -11.392 -2.268 222 HG23 THR 29 2HG2 THR 29 14.257 -9.684 -2.098 223 H GLN 30 H GLN 30 17.357 -8.446 -2.219 224 HA GLN 30 HA GLN 30 15.594 -6.263 -1.667 225 HB2 GLN 30 2HB GLN 30 18.284 -6.871 -0.430 226 HB3 GLN 30 3HB GLN 30 17.039 -5.820 0.233 227 HG2 GLN 30 2HG GLN 30 16.510 -8.719 -0.296 228 HG3 GLN 30 3HG GLN 30 17.283 -8.178 1.193 229 HE21 GLN 30 2HE2 GLN 30 13.855 -8.320 2.185 230 HE22 GLN 30 1HE2 GLN 30 15.249 -9.314 1.955 231 H THR 31 H THR 31 18.085 -6.614 -3.829 232 HA THR 31 HA THR 31 19.013 -3.850 -3.629 233 HB THR 31 HB THR 31 20.429 -4.661 -5.684 234 HG1 THR 31 HG1 THR 31 19.847 -6.663 -6.146 235 HG21 THR 31 3HG2 THR 31 21.056 -5.855 -2.991 236 HG22 THR 31 1HG2 THR 31 21.196 -4.129 -3.326 237 HG23 THR 31 2HG2 THR 31 22.186 -5.284 -4.219 238 H TYR 32 H TYR 32 16.295 -4.855 -4.635 239 HA TYR 32 HA TYR 32 16.360 -3.428 -7.213 240 HB2 TYR 32 2HB TYR 32 14.936 -5.918 -6.387 241 HB3 TYR 32 3HB TYR 32 14.146 -4.849 -7.540 242 HD1 TYR 32 HD1 TYR 32 15.345 -4.295 -9.694 243 HD2 TYR 32 HD2 TYR 32 16.663 -7.371 -7.067 244 HE1 TYR 32 HE1 TYR 32 16.666 -5.280 -11.520 245 HE2 TYR 32 HE2 TYR 32 17.988 -8.364 -8.885 246 HH TYR 32 HH TYR 32 18.984 -6.974 -11.407 247 H THR 33 H THR 33 14.741 -1.949 -7.636 248 HA THR 33 HA THR 33 12.523 -1.562 -5.859 249 HB THR 33 HB THR 33 13.917 0.966 -5.849 250 HG1 THR 33 HG1 THR 33 15.778 0.432 -4.929 251 HG21 THR 33 3HG2 THR 33 12.924 1.126 -3.838 252 HG22 THR 33 1HG2 THR 33 13.531 -0.442 -3.308 253 HG23 THR 33 2HG2 THR 33 12.081 -0.351 -4.307 254 H GLY 34 H GLY 34 11.201 0.342 -6.498 255 HA2 GLY 34 2HA GLY 34 11.630 1.926 -8.728 256 HA3 GLY 34 3HA GLY 34 10.924 0.432 -9.328 257 H SER 35 H SER 35 9.379 0.113 -6.792 258 HA SER 35 HA SER 35 7.285 2.092 -7.405 259 HB2 SER 35 2HB SER 35 6.974 -0.515 -7.736 260 HB3 SER 35 3HB SER 35 6.658 -0.473 -6.002 261 HG SER 35 HG SER 35 5.057 0.262 -8.037 262 H ASN 36 H ASN 36 6.698 3.464 -5.857 263 HA ASN 36 HA ASN 36 6.697 4.571 -3.864 264 HB2 ASN 36 2HB ASN 36 6.281 1.743 -2.872 265 HB3 ASN 36 3HB ASN 36 6.031 3.189 -1.898 266 HD21 ASN 36 2HD2 ASN 36 3.373 2.165 -4.818 267 HD22 ASN 36 1HD2 ASN 36 4.973 1.513 -4.805 268 H GLY 37 H GLY 37 9.273 3.986 -4.841 269 HA2 GLY 37 2HA GLY 37 10.763 4.190 -2.361 270 HA3 GLY 37 3HA GLY 37 11.147 2.779 -3.336 271 H GLY 38 H GLY 38 11.765 3.226 -5.632 272 HA2 GLY 38 2HA GLY 38 12.519 5.720 -6.597 273 HA3 GLY 38 3HA GLY 38 13.890 5.105 -5.685 274 H ALA 39 H ALA 39 14.825 3.064 -6.348 275 HA ALA 39 HA ALA 39 14.076 1.779 -8.761 276 HB1 ALA 39 1HB ALA 39 15.270 2.792 -10.357 277 HB2 ALA 39 2HB ALA 39 15.345 4.156 -9.241 278 HB3 ALA 39 3HB ALA 39 16.673 2.998 -9.307 279 H ASP 40 H ASP 40 15.796 0.215 -9.492 280 HA ASP 40 HA ASP 40 16.764 -1.226 -7.250 281 HB2 ASP 40 2HB ASP 40 17.682 -2.786 -8.877 282 HB3 ASP 40 3HB ASP 40 16.058 -2.306 -9.361 283 H LEU 41 H LEU 41 18.779 -1.415 -6.393 284 HA LEU 41 HA LEU 41 21.179 -0.623 -7.581 285 HB2 LEU 41 2HB LEU 41 19.701 1.583 -6.913 286 HB3 LEU 41 3HB LEU 41 20.725 1.376 -5.494 287 HG LEU 41 HG LEU 41 22.524 1.167 -7.554 288 HD11 LEU 41 1HD1 LEU 41 21.950 3.339 -8.835 289 HD12 LEU 41 2HD1 LEU 41 20.290 2.985 -8.358 290 HD13 LEU 41 3HD1 LEU 41 21.194 1.824 -9.330 291 HD21 LEU 41 3HD2 LEU 41 22.810 2.415 -5.476 292 HD22 LEU 41 1HD2 LEU 41 21.689 3.648 -6.055 293 HD23 LEU 41 2HD2 LEU 41 23.232 3.404 -6.875 294 H MET 42 H MET 42 22.704 0.192 -5.468 295 HA MET 42 HA MET 42 22.329 -1.994 -3.529 296 HB2 MET 42 2HB MET 42 24.508 -1.448 -5.207 297 HB3 MET 42 3HB MET 42 25.023 -0.947 -3.603 298 HG2 MET 42 2HG MET 42 23.678 -3.535 -3.646 299 HG3 MET 42 3HG MET 42 25.158 -3.482 -4.601 300 HE1 MET 42 3HE MET 42 27.402 -4.614 -2.871 301 HE2 MET 42 1HE MET 42 27.234 -3.271 -4.003 302 HE3 MET 42 2HE MET 42 27.963 -3.004 -2.419 303 H GLY 43 H GLY 43 21.604 -1.234 -1.651 304 HA2 GLY 43 2HA GLY 43 23.079 0.691 -0.163 305 HA3 GLY 43 3HA GLY 43 21.602 1.400 -0.797 306 HA PRO 44 HA PRO 44 19.199 -0.289 2.451 307 HB2 PRO 44 2HB PRO 44 17.018 -1.331 1.216 308 HB3 PRO 44 3HB PRO 44 17.305 0.408 1.354 309 HG2 PRO 44 2HG PRO 44 17.816 -1.418 -0.962 310 HG3 PRO 44 3HG PRO 44 17.115 0.210 -0.955 311 HD2 PRO 44 2HD PRO 44 19.698 -0.261 -1.617 312 HD3 PRO 44 3HD PRO 44 19.176 1.233 -0.813 313 H ALA 45 H ALA 45 19.813 -2.504 -0.215 314 HA ALA 45 HA ALA 45 19.021 -4.886 1.068 315 HB1 ALA 45 1HB ALA 45 20.078 -6.036 -0.696 316 HB2 ALA 45 2HB ALA 45 19.474 -4.536 -1.401 317 HB3 ALA 45 3HB ALA 45 21.186 -4.700 -1.009 318 H PHE 46 H PHE 46 21.874 -2.934 1.313 319 HA PHE 46 HA PHE 46 23.337 -5.036 2.719 320 HB2 PHE 46 2HB PHE 46 24.302 -3.323 0.964 321 HB3 PHE 46 3HB PHE 46 24.403 -2.263 2.366 322 HD1 PHE 46 HD1 PHE 46 25.116 -5.874 1.731 323 HD2 PHE 46 HD2 PHE 46 26.521 -2.142 3.219 324 HE1 PHE 46 HE1 PHE 46 27.242 -6.934 2.372 325 HE2 PHE 46 HE2 PHE 46 28.649 -3.195 3.861 326 HZ PHE 46 HZ PHE 46 29.013 -5.594 3.437 327 H ALA 47 H ALA 47 21.188 -2.570 3.416 328 HA ALA 47 HA ALA 47 22.226 -1.517 5.814 329 HB1 ALA 47 1HB ALA 47 20.177 -0.492 6.104 330 HB2 ALA 47 2HB ALA 47 20.224 -0.736 4.358 331 HB3 ALA 47 3HB ALA 47 19.287 -1.829 5.375 332 H ALA 48 H ALA 48 20.224 -4.344 5.135 333 HA ALA 48 HA ALA 48 20.227 -5.041 7.984 334 HB1 ALA 48 1HB ALA 48 18.701 -6.364 5.747 335 HB2 ALA 48 2HB ALA 48 18.476 -6.601 7.480 336 HB3 ALA 48 3HB ALA 48 18.073 -5.050 6.743 337 H GLY 49 H GLY 49 21.628 -5.911 4.953 338 HA2 GLY 49 2HA GLY 49 23.578 -7.234 4.766 339 HA3 GLY 49 3HA GLY 49 23.183 -7.991 6.302 340 H LEU 50 H LEU 50 20.569 -7.725 4.129 341 HA LEU 50 HA LEU 50 20.377 -10.574 3.891 342 HB2 LEU 50 2HB LEU 50 18.750 -8.437 2.523 343 HB3 LEU 50 3HB LEU 50 18.329 -10.142 2.670 344 HG LEU 50 HG LEU 50 18.732 -8.584 5.171 345 HD11 LEU 50 1HD1 LEU 50 16.071 -8.258 4.755 346 HD12 LEU 50 2HD1 LEU 50 16.710 -7.977 3.136 347 HD13 LEU 50 3HD1 LEU 50 17.288 -7.009 4.491 348 HD21 LEU 50 3HD2 LEU 50 17.729 -11.121 4.401 349 HD22 LEU 50 1HD2 LEU 50 16.395 -10.197 5.093 350 HD23 LEU 50 2HD2 LEU 50 17.874 -10.442 6.023 351 H ARG 51 H ARG 51 21.624 -11.664 2.522 352 HA ARG 51 HA ARG 51 21.735 -10.804 -0.265 353 HB2 ARG 51 2HB ARG 51 24.256 -11.541 -0.149 354 HB3 ARG 51 3HB ARG 51 23.782 -9.900 0.271 355 HG2 ARG 51 2HG ARG 51 25.378 -10.780 1.870 356 HG3 ARG 51 3HG ARG 51 23.816 -10.491 2.639 357 HD2 ARG 51 2HD ARG 51 23.351 -12.744 2.843 358 HD3 ARG 51 3HD ARG 51 24.438 -13.192 1.530 359 HE ARG 51 HE ARG 51 26.072 -12.175 3.474 360 HH11 ARG 51 1HH1 ARG 51 23.713 -14.730 3.301 361 HH12 ARG 51 2HH1 ARG 51 24.495 -15.710 4.498 362 HH21 ARG 51 2HH2 ARG 51 26.426 -14.983 5.493 363 HH22 ARG 51 1HH2 ARG 51 27.110 -13.455 5.051 364 H VAL 52 H VAL 52 23.073 -12.600 -1.519 365 HA VAL 52 HA VAL 52 21.573 -14.943 -1.439 366 HB VAL 52 HB VAL 52 22.707 -14.436 -3.457 367 HG11 VAL 52 1HG1 VAL 52 25.165 -14.342 -1.744 368 HG12 VAL 52 2HG1 VAL 52 25.275 -14.584 -3.489 369 HG13 VAL 52 3HG1 VAL 52 24.530 -13.120 -2.846 370 HG21 VAL 52 3HG2 VAL 52 22.497 -16.833 -2.934 371 HG22 VAL 52 1HG2 VAL 52 23.897 -16.492 -3.951 372 HG23 VAL 52 2HG2 VAL 52 24.114 -16.807 -2.230 373 H GLY 53 H GLY 53 21.716 -16.821 -0.355 374 HA2 GLY 53 2HA GLY 53 23.476 -18.441 0.556 375 HA3 GLY 53 3HA GLY 53 23.931 -17.081 1.573 376 H ASP 54 H ASP 54 21.771 -16.063 2.600 377 HA ASP 54 HA ASP 54 20.780 -18.144 4.325 378 HB2 ASP 54 2HB ASP 54 19.516 -16.215 5.387 379 HB3 ASP 54 3HB ASP 54 21.272 -16.075 5.388 380 H GLN 55 H GLN 55 18.678 -18.868 4.531 381 HA GLN 55 HA GLN 55 17.057 -18.618 2.135 382 HB2 GLN 55 2HB GLN 55 16.642 -20.316 4.602 383 HB3 GLN 55 3HB GLN 55 15.712 -20.422 3.114 384 HG2 GLN 55 2HG GLN 55 17.963 -20.895 1.979 385 HG3 GLN 55 3HG GLN 55 18.556 -21.204 3.610 386 HE21 GLN 55 2HE2 GLN 55 16.884 -24.254 3.999 387 HE22 GLN 55 1HE2 GLN 55 17.671 -22.938 4.794 388 H LEU 56 H LEU 56 14.999 -17.785 2.038 389 HA LEU 56 HA LEU 56 14.103 -16.292 4.416 390 HB2 LEU 56 2HB LEU 56 13.917 -15.593 1.496 391 HB3 LEU 56 3HB LEU 56 12.989 -14.763 2.743 392 HG LEU 56 HG LEU 56 14.855 -13.395 2.245 393 HD11 LEU 56 1HD1 LEU 56 14.310 -13.659 4.636 394 HD12 LEU 56 2HD1 LEU 56 16.008 -13.274 4.360 395 HD13 LEU 56 3HD1 LEU 56 15.531 -14.926 4.752 396 HD21 LEU 56 3HD2 LEU 56 16.821 -14.157 1.534 397 HD22 LEU 56 1HD2 LEU 56 16.126 -15.777 1.588 398 HD23 LEU 56 2HD2 LEU 56 17.029 -15.158 2.971 399 H VAL 57 H VAL 57 12.273 -17.014 5.258 400 HA VAL 57 HA VAL 57 10.329 -18.342 3.481 401 HB VAL 57 HB VAL 57 9.584 -19.505 5.661 402 HG11 VAL 57 1HG1 VAL 57 12.181 -20.666 5.068 403 HG12 VAL 57 2HG1 VAL 57 10.562 -21.314 4.795 404 HG13 VAL 57 3HG1 VAL 57 11.289 -20.224 3.613 405 HG21 VAL 57 3HG2 VAL 57 12.430 -18.957 6.464 406 HG22 VAL 57 1HG2 VAL 57 11.071 -18.004 7.061 407 HG23 VAL 57 2HG2 VAL 57 11.157 -19.731 7.408 408 H ARG 58 H ARG 58 10.796 -16.246 6.275 409 HA ARG 58 HA ARG 58 9.416 -14.791 7.358 410 HB2 ARG 58 2HB ARG 58 7.967 -14.547 4.726 411 HB3 ARG 58 3HB ARG 58 8.157 -13.324 5.974 412 HG2 ARG 58 2HG ARG 58 10.533 -13.169 5.489 413 HG3 ARG 58 3HG ARG 58 10.377 -14.434 4.269 414 HD2 ARG 58 2HD ARG 58 9.688 -12.973 2.738 415 HD3 ARG 58 3HD ARG 58 8.461 -12.325 3.826 416 HE ARG 58 HE ARG 58 9.846 -10.563 4.265 417 HH11 ARG 58 1HH1 ARG 58 11.717 -13.145 2.868 418 HH12 ARG 58 2HH1 ARG 58 13.164 -12.201 2.736 419 HH21 ARG 58 2HH2 ARG 58 13.179 -10.020 3.436 420 HH22 ARG 58 1HH2 ARG 58 11.745 -9.310 4.096 421 H PHE 59 H PHE 59 8.639 -17.611 7.333 422 HA PHE 59 HA PHE 59 5.827 -17.237 8.058 423 HB2 PHE 59 2HB PHE 59 6.914 -19.321 6.176 424 HB3 PHE 59 3HB PHE 59 5.414 -19.574 7.062 425 HD1 PHE 59 HD1 PHE 59 6.428 -18.921 3.970 426 HD2 PHE 59 HD2 PHE 59 4.061 -17.059 6.977 427 HE1 PHE 59 HE1 PHE 59 5.201 -17.684 2.233 428 HE2 PHE 59 HE2 PHE 59 2.829 -15.820 5.245 429 HZ PHE 59 HZ PHE 59 3.398 -16.132 2.869 430 H ALA 60 H ALA 60 5.088 -18.569 9.716 431 HA ALA 60 HA ALA 60 7.086 -19.464 11.544 432 HB1 ALA 60 1HB ALA 60 4.110 -19.363 11.535 433 HB2 ALA 60 2HB ALA 60 4.924 -20.383 12.722 434 HB3 ALA 60 3HB ALA 60 5.261 -18.653 12.667 435 H GLY 61 H GLY 61 8.203 -21.276 11.193 436 HA2 GLY 61 2HA GLY 61 7.788 -23.763 11.525 437 HA3 GLY 61 3HA GLY 61 6.765 -23.612 10.105 438 H TYR 62 H TYR 62 9.251 -21.516 9.652 439 HA TYR 62 HA TYR 62 11.093 -21.502 8.319 440 HB2 TYR 62 2HB TYR 62 11.642 -24.381 8.898 441 HB3 TYR 62 3HB TYR 62 12.762 -23.028 8.795 442 HD1 TYR 62 HD1 TYR 62 11.883 -21.099 10.676 443 HD2 TYR 62 HD2 TYR 62 11.711 -25.338 10.992 444 HE1 TYR 62 HE1 TYR 62 11.888 -20.910 13.128 445 HE2 TYR 62 HE2 TYR 62 11.714 -25.161 13.445 446 HH TYR 62 HH TYR 62 11.069 -22.373 15.089 447 H THR 63 H THR 63 8.619 -22.099 7.111 448 HA THR 63 HA THR 63 9.541 -23.721 4.837 449 HB THR 63 HB THR 63 8.007 -25.162 5.969 450 HG1 THR 63 HG1 THR 63 7.643 -25.207 3.773 451 HG21 THR 63 3HG2 THR 63 6.451 -24.321 7.323 452 HG22 THR 63 1HG2 THR 63 5.540 -23.800 5.906 453 HG23 THR 63 2HG2 THR 63 6.700 -22.706 6.660 454 H VAL 64 H VAL 64 8.738 -23.108 2.800 455 HA VAL 64 HA VAL 64 7.054 -20.740 2.622 456 HB VAL 64 HB VAL 64 9.476 -19.984 2.789 457 HG11 VAL 64 1HG1 VAL 64 9.692 -20.886 -0.063 458 HG12 VAL 64 2HG1 VAL 64 10.965 -20.328 1.023 459 HG13 VAL 64 3HG1 VAL 64 10.226 -21.911 1.268 460 HG21 VAL 64 3HG2 VAL 64 8.080 -19.236 0.226 461 HG22 VAL 64 1HG2 VAL 64 7.582 -18.662 1.818 462 HG23 VAL 64 2HG2 VAL 64 9.174 -18.241 1.187 463 H THR 65 H THR 65 6.358 -20.288 0.415 464 HA THR 65 HA THR 65 5.853 -22.735 -1.023 465 HB THR 65 HB THR 65 5.012 -19.891 -1.616 466 HG1 THR 65 HG1 THR 65 3.058 -20.549 -0.725 467 HG21 THR 65 3HG2 THR 65 4.798 -20.845 -3.695 468 HG22 THR 65 1HG2 THR 65 3.245 -21.289 -2.989 469 HG23 THR 65 2HG2 THR 65 4.557 -22.467 -3.047 470 H GLU 66 H GLU 66 6.761 -19.579 -2.382 471 HA GLU 66 HA GLU 66 9.214 -20.397 -3.490 472 HB2 GLU 66 2HB GLU 66 8.666 -20.742 -5.794 473 HB3 GLU 66 3HB GLU 66 7.666 -21.830 -4.842 474 HG2 GLU 66 2HG GLU 66 6.152 -19.509 -5.102 475 HG3 GLU 66 3HG GLU 66 6.892 -19.757 -6.682 476 H LEU 67 H LEU 67 9.414 -18.896 -5.746 477 HA LEU 67 HA LEU 67 9.760 -16.313 -4.805 478 HB2 LEU 67 2HB LEU 67 9.868 -15.671 -7.230 479 HB3 LEU 67 3HB LEU 67 10.942 -16.977 -6.735 480 HG LEU 67 HG LEU 67 8.894 -18.445 -7.617 481 HD11 LEU 67 1HD1 LEU 67 8.579 -16.866 -9.895 482 HD12 LEU 67 2HD1 LEU 67 8.314 -15.779 -8.533 483 HD13 LEU 67 3HD1 LEU 67 7.357 -17.253 -8.683 484 HD21 LEU 67 3HD2 LEU 67 11.442 -17.970 -8.403 485 HD22 LEU 67 1HD2 LEU 67 10.547 -17.421 -9.820 486 HD23 LEU 67 2HD2 LEU 67 10.334 -19.068 -9.227 487 H ALA 68 H ALA 68 6.972 -17.784 -6.344 488 HA ALA 68 HA ALA 68 5.501 -15.500 -6.969 489 HB1 ALA 68 1HB ALA 68 4.780 -18.327 -6.349 490 HB2 ALA 68 2HB ALA 68 3.502 -17.119 -6.491 491 HB3 ALA 68 3HB ALA 68 4.589 -17.417 -7.848 492 H ALA 69 H ALA 69 5.785 -17.277 -3.930 493 HA ALA 69 HA ALA 69 3.779 -15.824 -2.542 494 HB1 ALA 69 1HB ALA 69 4.222 -17.824 -1.513 495 HB2 ALA 69 2HB ALA 69 5.964 -17.691 -1.758 496 HB3 ALA 69 3HB ALA 69 5.173 -16.728 -0.510 497 H PHE 70 H PHE 70 7.223 -15.360 -3.034 498 HA PHE 70 HA PHE 70 7.570 -13.343 -1.067 499 HB2 PHE 70 2HB PHE 70 9.410 -14.703 -2.121 500 HB3 PHE 70 3HB PHE 70 9.209 -13.732 -3.576 501 HD1 PHE 70 HD1 PHE 70 10.876 -12.191 -3.841 502 HD2 PHE 70 HD2 PHE 70 9.433 -13.002 0.081 503 HE1 PHE 70 HE1 PHE 70 12.419 -10.506 -2.929 504 HE2 PHE 70 HE2 PHE 70 10.973 -11.317 0.999 505 HZ PHE 70 HZ PHE 70 12.468 -10.066 -0.506 506 H ASN 71 H ASN 71 6.387 -13.345 -4.327 507 HA ASN 71 HA ASN 71 6.790 -10.669 -5.025 508 HB2 ASN 71 2HB ASN 71 5.185 -12.901 -5.981 509 HB3 ASN 71 3HB ASN 71 4.349 -11.363 -6.171 510 HD21 ASN 71 2HD2 ASN 71 7.078 -10.049 -8.228 511 HD22 ASN 71 1HD2 ASN 71 6.270 -9.615 -6.764 512 H THR 72 H THR 72 4.144 -12.215 -3.255 513 HA THR 72 HA THR 72 2.582 -9.845 -3.006 514 HB THR 72 HB THR 72 2.070 -11.715 -0.872 515 HG1 THR 72 HG1 THR 72 2.015 -13.586 -1.934 516 HG21 THR 72 3HG2 THR 72 0.646 -10.589 -3.239 517 HG22 THR 72 1HG2 THR 72 0.237 -10.488 -1.527 518 HG23 THR 72 2HG2 THR 72 -0.047 -11.985 -2.415 519 H VAL 73 H VAL 73 5.048 -11.395 -1.039 520 HA VAL 73 HA VAL 73 4.663 -9.782 1.274 521 HB VAL 73 HB VAL 73 7.086 -11.353 0.386 522 HG11 VAL 73 1HG1 VAL 73 6.756 -9.473 2.521 523 HG12 VAL 73 2HG1 VAL 73 7.012 -11.088 3.185 524 HG13 VAL 73 3HG1 VAL 73 8.186 -10.399 2.063 525 HG21 VAL 73 3HG2 VAL 73 6.243 -12.921 2.198 526 HG22 VAL 73 1HG2 VAL 73 4.733 -12.012 2.138 527 HG23 VAL 73 2HG2 VAL 73 5.306 -12.866 0.705 528 H VAL 74 H VAL 74 6.815 -9.583 -1.527 529 HA VAL 74 HA VAL 74 8.426 -7.467 -0.685 530 HB VAL 74 HB VAL 74 7.533 -8.200 -3.475 531 HG11 VAL 74 1HG1 VAL 74 9.825 -6.933 -3.917 532 HG12 VAL 74 2HG1 VAL 74 8.276 -6.087 -3.891 533 HG13 VAL 74 3HG1 VAL 74 9.323 -6.056 -2.472 534 HG21 VAL 74 3HG2 VAL 74 10.280 -8.713 -2.963 535 HG22 VAL 74 1HG2 VAL 74 9.335 -9.406 -1.644 536 HG23 VAL 74 2HG2 VAL 74 8.992 -9.867 -3.312 537 H ALA 75 H ALA 75 5.242 -7.468 -2.190 538 HA ALA 75 HA ALA 75 5.061 -4.730 -2.777 539 HB1 ALA 75 1HB ALA 75 2.549 -5.978 -1.949 540 HB2 ALA 75 2HB ALA 75 2.996 -5.231 -3.483 541 HB3 ALA 75 3HB ALA 75 3.449 -6.902 -3.151 542 H ARG 76 H ARG 76 4.185 -6.550 0.138 543 HA ARG 76 HA ARG 76 3.246 -4.203 1.514 544 HB2 ARG 76 2HB ARG 76 3.943 -6.827 2.813 545 HB3 ARG 76 3HB ARG 76 2.756 -5.634 3.325 546 HG2 ARG 76 2HG ARG 76 2.576 -7.497 0.971 547 HG3 ARG 76 3HG ARG 76 1.591 -7.510 2.436 548 HD2 ARG 76 2HD ARG 76 1.645 -5.358 0.323 549 HD3 ARG 76 3HD ARG 76 0.354 -6.528 0.594 550 HE ARG 76 HE ARG 76 0.860 -4.122 2.090 551 HH11 ARG 76 1HH1 ARG 76 -0.623 -7.271 2.126 552 HH12 ARG 76 2HH1 ARG 76 -1.767 -6.863 3.362 553 HH21 ARG 76 2HH2 ARG 76 -1.776 -4.758 4.266 554 HH22 ARG 76 1HH2 ARG 76 -0.641 -3.572 3.717 555 H HIS 77 H HIS 77 6.247 -5.895 1.166 556 HA HIS 77 HA HIS 77 7.492 -4.763 3.495 557 HB2 HIS 77 2HB HIS 77 8.066 -6.918 1.960 558 HB3 HIS 77 3HB HIS 77 9.203 -5.750 1.292 559 HD1 HIS 77 HD1 HIS 77 9.858 -4.305 4.008 560 HD2 HIS 77 HD2 HIS 77 9.881 -8.413 3.384 561 HE1 HIS 77 HE1 HIS 77 11.376 -5.246 5.779 562 H VAL 78 H VAL 78 7.344 -4.011 0.063 563 HA VAL 78 HA VAL 78 9.378 -2.097 -0.065 564 HB VAL 78 HB VAL 78 6.835 -2.408 -1.648 565 HG11 VAL 78 1HG1 VAL 78 7.062 -0.246 -2.205 566 HG12 VAL 78 2HG1 VAL 78 8.710 -0.156 -1.582 567 HG13 VAL 78 3HG1 VAL 78 8.409 -0.812 -3.192 568 HG21 VAL 78 3HG2 VAL 78 8.042 -3.670 -3.062 569 HG22 VAL 78 1HG2 VAL 78 9.460 -2.629 -2.937 570 HG23 VAL 78 2HG2 VAL 78 9.146 -3.845 -1.698 571 H ARG 79 H ARG 79 9.434 -0.649 1.602 572 HA ARG 79 HA ARG 79 7.511 1.507 1.493 573 HB2 ARG 79 2HB ARG 79 7.392 -0.525 3.559 574 HB3 ARG 79 3HB ARG 79 7.682 1.068 4.245 575 HG2 ARG 79 2HG ARG 79 5.710 1.777 2.687 576 HG3 ARG 79 3HG ARG 79 5.326 0.056 2.731 577 HD2 ARG 79 2HD ARG 79 5.008 0.076 5.057 578 HD3 ARG 79 3HD ARG 79 5.817 1.632 5.238 579 HE ARG 79 HE ARG 79 3.511 1.883 3.612 580 HH11 ARG 79 1HH1 ARG 79 4.517 1.489 6.921 581 HH12 ARG 79 2HH1 ARG 79 3.113 2.264 7.577 582 HH21 ARG 79 2HH2 ARG 79 1.487 3.069 6.178 583 HH22 ARG 79 1HH2 ARG 79 1.658 2.905 4.463 584 HA PRO 80 HA PRO 80 10.995 3.950 2.562 585 HB2 PRO 80 2HB PRO 80 9.857 5.968 3.978 586 HB3 PRO 80 3HB PRO 80 9.671 5.798 2.228 587 HG2 PRO 80 2HG PRO 80 7.789 5.008 4.418 588 HG3 PRO 80 3HG PRO 80 7.437 5.806 2.874 589 HD2 PRO 80 2HD PRO 80 7.037 3.157 3.270 590 HD3 PRO 80 3HD PRO 80 7.502 3.827 1.694 591 H SER 81 H SER 81 12.313 2.829 3.938 592 HA SER 81 HA SER 81 13.351 2.229 5.872 593 HB2 SER 81 2HB SER 81 11.878 4.169 7.554 594 HB3 SER 81 3HB SER 81 13.613 3.901 7.396 595 HG SER 81 HG SER 81 13.271 5.834 6.449 596 H ALA 82 H ALA 82 11.068 0.776 5.183 597 HA ALA 82 HA ALA 82 9.454 0.412 7.556 598 HB1 ALA 82 1HB ALA 82 9.360 -0.462 4.769 599 HB2 ALA 82 2HB ALA 82 8.845 -1.693 5.923 600 HB3 ALA 82 3HB ALA 82 8.049 -0.120 5.898 601 H SER 83 H SER 83 10.537 -0.470 9.228 602 HA SER 83 HA SER 83 12.394 -2.665 8.781 603 HB2 SER 83 2HB SER 83 11.636 -1.070 11.231 604 HB3 SER 83 3HB SER 83 12.703 -2.472 11.302 605 HG SER 83 HG SER 83 13.280 0.048 10.589 606 H ILE 84 H ILE 84 11.778 -4.713 8.835 607 HA ILE 84 HA ILE 84 9.619 -5.522 10.640 608 HB ILE 84 HB ILE 84 9.733 -6.332 7.732 609 HG12 ILE 84 2HG1 ILE 84 8.925 -4.017 8.087 610 HG13 ILE 84 3HG1 ILE 84 7.660 -5.079 7.479 611 HG21 ILE 84 1HG2 ILE 84 7.694 -7.018 9.844 612 HG22 ILE 84 2HG2 ILE 84 7.694 -7.552 8.164 613 HG23 ILE 84 3HG2 ILE 84 8.956 -8.105 9.265 614 HD11 ILE 84 3HD1 ILE 84 7.667 -5.046 10.354 615 HD12 ILE 84 1HD1 ILE 84 7.546 -3.413 9.701 616 HD13 ILE 84 2HD1 ILE 84 6.375 -4.643 9.225 617 HA PRO 85 HA PRO 85 12.545 -8.714 11.545 618 HB2 PRO 85 2HB PRO 85 10.899 -10.284 13.027 619 HB3 PRO 85 3HB PRO 85 11.588 -8.773 13.633 620 HG2 PRO 85 2HG PRO 85 8.861 -9.297 12.512 621 HG3 PRO 85 3HG PRO 85 9.323 -8.333 13.927 622 HD2 PRO 85 2HD PRO 85 8.730 -7.215 11.533 623 HD3 PRO 85 3HD PRO 85 9.918 -6.510 12.648 624 H VAL 86 H VAL 86 13.163 -10.167 10.080 625 HA VAL 86 HA VAL 86 11.116 -11.855 8.802 626 HB VAL 86 HB VAL 86 13.889 -11.159 7.825 627 HG11 VAL 86 1HG1 VAL 86 12.651 -12.204 5.683 628 HG12 VAL 86 2HG1 VAL 86 13.646 -13.154 6.789 629 HG13 VAL 86 3HG1 VAL 86 11.890 -13.152 6.961 630 HG21 VAL 86 3HG2 VAL 86 11.235 -10.364 6.645 631 HG22 VAL 86 1HG2 VAL 86 12.156 -9.340 7.746 632 HG23 VAL 86 2HG2 VAL 86 12.838 -9.793 6.184 633 H VAL 87 H VAL 87 11.381 -14.069 8.694 634 HA VAL 87 HA VAL 87 13.294 -15.179 10.617 635 HB VAL 87 HB VAL 87 11.022 -15.834 11.041 636 HG11 VAL 87 1HG1 VAL 87 10.352 -17.470 8.839 637 HG12 VAL 87 2HG1 VAL 87 9.550 -15.997 9.387 638 HG13 VAL 87 3HG1 VAL 87 10.847 -15.905 8.194 639 HG21 VAL 87 3HG2 VAL 87 12.822 -17.520 11.347 640 HG22 VAL 87 1HG2 VAL 87 11.236 -18.228 11.041 641 HG23 VAL 87 2HG2 VAL 87 12.437 -18.164 9.751 642 H PHE 88 H PHE 88 15.099 -16.072 9.892 643 HA PHE 88 HA PHE 88 15.102 -17.248 7.189 644 HB2 PHE 88 2HB PHE 88 17.446 -16.605 6.980 645 HB3 PHE 88 3HB PHE 88 16.458 -15.188 7.322 646 HD1 PHE 88 HD1 PHE 88 19.258 -17.154 8.335 647 HD2 PHE 88 HD2 PHE 88 16.375 -14.343 9.715 648 HE1 PHE 88 HE1 PHE 88 20.705 -16.616 10.250 649 HE2 PHE 88 HE2 PHE 88 17.818 -13.799 11.632 650 HZ PHE 88 HZ PHE 88 19.986 -14.936 11.902 651 H SER 89 H SER 89 16.521 -19.063 6.858 652 HA SER 89 HA SER 89 17.293 -20.476 9.317 653 HB2 SER 89 2HB SER 89 15.267 -21.263 7.371 654 HB3 SER 89 3HB SER 89 16.505 -22.500 7.587 655 HG SER 89 HG SER 89 14.494 -21.811 9.234 656 H ARG 90 H ARG 90 19.162 -21.637 9.208 657 HA ARG 90 HA ARG 90 20.550 -21.687 6.610 658 HB2 ARG 90 2HB ARG 90 21.348 -20.038 8.500 659 HB3 ARG 90 3HB ARG 90 22.080 -21.489 9.172 660 HG2 ARG 90 2HG ARG 90 23.163 -21.812 6.897 661 HG3 ARG 90 3HG ARG 90 22.654 -20.159 6.546 662 HD2 ARG 90 2HD ARG 90 23.828 -19.956 9.033 663 HD3 ARG 90 3HD ARG 90 24.842 -21.134 8.201 664 HE ARG 90 HE ARG 90 24.703 -18.334 7.692 665 HH11 ARG 90 1HH1 ARG 90 25.217 -21.427 6.179 666 HH12 ARG 90 2HH1 ARG 90 26.175 -20.782 4.887 667 HH21 ARG 90 2HH2 ARG 90 26.600 -18.534 4.785 668 HH22 ARG 90 1HH2 ARG 90 25.963 -17.473 5.997 669 H ASP 91 H ASP 91 20.298 -23.786 6.053 670 HA ASP 91 HA ASP 91 20.603 -26.040 6.042 671 HB2 ASP 91 2HB ASP 91 22.494 -25.826 8.359 672 HB3 ASP 91 3HB ASP 91 22.574 -26.882 6.951 673 H GLY 92 H GLY 92 18.550 -24.852 7.729 674 HA2 GLY 92 2HA GLY 92 16.880 -26.118 8.874 675 HA3 GLY 92 3HA GLY 92 18.149 -27.152 9.514 676 H VAL 93 H VAL 93 19.572 -24.373 9.951 677 HA VAL 93 HA VAL 93 19.032 -24.233 12.723 678 HB VAL 93 HB VAL 93 20.444 -22.261 10.923 679 HG11 VAL 93 1HG1 VAL 93 21.461 -21.457 13.074 680 HG12 VAL 93 2HG1 VAL 93 19.752 -21.068 12.864 681 HG13 VAL 93 3HG1 VAL 93 20.232 -22.394 13.924 682 HG21 VAL 93 3HG2 VAL 93 21.272 -24.725 11.370 683 HG22 VAL 93 1HG2 VAL 93 22.400 -23.370 11.348 684 HG23 VAL 93 2HG2 VAL 93 21.830 -24.017 12.886 685 H VAL 94 H VAL 94 17.932 -22.707 13.939 686 HA VAL 94 HA VAL 94 15.984 -21.083 12.437 687 HB VAL 94 HB VAL 94 14.833 -22.754 13.711 688 HG11 VAL 94 1HG1 VAL 94 15.738 -23.615 15.546 689 HG12 VAL 94 2HG1 VAL 94 16.945 -22.329 15.585 690 HG13 VAL 94 3HG1 VAL 94 15.396 -22.111 16.400 691 HG21 VAL 94 3HG2 VAL 94 13.451 -21.373 15.172 692 HG22 VAL 94 1HG2 VAL 94 14.685 -20.113 15.163 693 HG23 VAL 94 2HG2 VAL 94 13.829 -20.520 13.676 694 H MET 95 H MET 95 16.498 -19.000 12.429 695 HA MET 95 HA MET 95 17.240 -17.713 14.940 696 HB2 MET 95 2HB MET 95 19.365 -18.277 13.790 697 HB3 MET 95 3HB MET 95 18.837 -17.337 12.401 698 HG2 MET 95 2HG MET 95 20.348 -16.012 13.680 699 HG3 MET 95 3HG MET 95 18.730 -15.338 13.859 700 HE1 MET 95 3HE MET 95 20.656 -18.346 16.298 701 HE2 MET 95 1HE MET 95 21.495 -17.358 15.101 702 HE3 MET 95 2HE MET 95 21.609 -16.954 16.814 703 H SER 96 H SER 96 16.660 -15.548 15.073 704 HA SER 96 HA SER 96 15.069 -14.531 12.810 705 HB2 SER 96 2HB SER 96 13.626 -13.405 14.463 706 HB3 SER 96 3HB SER 96 13.633 -15.153 14.697 707 HG SER 96 HG SER 96 13.916 -14.260 16.692 708 H ALA 97 H ALA 97 15.576 -12.577 12.039 709 HA ALA 97 HA ALA 97 17.132 -10.730 13.693 710 HB1 ALA 97 1HB ALA 97 17.982 -11.804 11.019 711 HB2 ALA 97 2HB ALA 97 18.598 -10.282 11.665 712 HB3 ALA 97 3HB ALA 97 18.883 -11.790 12.535 713 H THR 98 H THR 98 16.711 -8.600 13.324 714 HA THR 98 HA THR 98 14.402 -8.001 11.688 715 HB THR 98 HB THR 98 16.057 -6.072 13.322 716 HG1 THR 98 HG1 THR 98 14.795 -6.595 15.035 717 HG21 THR 98 3HG2 THR 98 13.270 -5.968 12.176 718 HG22 THR 98 1HG2 THR 98 14.628 -4.906 11.807 719 HG23 THR 98 2HG2 THR 98 13.862 -4.841 13.395 720 H ILE 99 H ILE 99 14.478 -7.285 9.668 721 HA ILE 99 HA ILE 99 16.992 -6.091 8.697 722 HB ILE 99 HB ILE 99 16.365 -6.860 6.449 723 HG12 ILE 99 2HG1 ILE 99 14.473 -8.836 6.861 724 HG13 ILE 99 3HG1 ILE 99 13.870 -7.498 7.832 725 HG21 ILE 99 1HG2 ILE 99 16.901 -8.654 8.711 726 HG22 ILE 99 2HG2 ILE 99 16.324 -9.450 7.247 727 HG23 ILE 99 3HG2 ILE 99 17.773 -8.446 7.192 728 HD11 ILE 99 3HD1 ILE 99 14.725 -6.565 5.255 729 HD12 ILE 99 1HD1 ILE 99 13.563 -7.881 5.092 730 HD13 ILE 99 2HD1 ILE 99 13.145 -6.445 6.028 731 H VAL 100 H VAL 100 16.920 -4.044 8.053 732 HA VAL 100 HA VAL 100 14.307 -2.751 7.769 733 HB VAL 100 HB VAL 100 15.758 -1.634 9.317 734 HG11 VAL 100 1HG1 VAL 100 17.795 -2.399 7.477 735 HG12 VAL 100 2HG1 VAL 100 17.866 -0.651 7.711 736 HG13 VAL 100 3HG1 VAL 100 17.964 -1.733 9.101 737 HG21 VAL 100 3HG2 VAL 100 15.344 0.467 8.590 738 HG22 VAL 100 1HG2 VAL 100 16.124 0.197 7.032 739 HG23 VAL 100 2HG2 VAL 100 14.482 -0.384 7.308 740 H VAL 101 H VAL 101 13.523 -2.680 5.771 741 HA VAL 101 HA VAL 101 15.381 -2.434 3.509 742 HB VAL 101 HB VAL 101 12.463 -3.216 3.515 743 HG11 VAL 101 1HG1 VAL 101 13.134 -3.984 1.143 744 HG12 VAL 101 2HG1 VAL 101 12.811 -2.271 1.420 745 HG13 VAL 101 3HG1 VAL 101 14.474 -2.852 1.325 746 HG21 VAL 101 3HG2 VAL 101 13.218 -5.219 4.136 747 HG22 VAL 101 1HG2 VAL 101 13.996 -5.323 2.557 748 HG23 VAL 101 2HG2 VAL 101 14.899 -4.720 3.947 749 H GLY 102 H GLY 102 15.726 -0.401 2.888 750 HA2 GLY 102 2HA GLY 102 13.507 1.527 3.081 751 HA3 GLY 102 3HA GLY 102 15.212 1.948 3.034 752 H GLU 103 H GLU 103 12.386 1.665 1.243 753 HA GLU 103 HA GLU 103 13.754 1.365 -1.316 754 HB2 GLU 103 2HB GLU 103 10.805 1.808 -0.856 755 HB3 GLU 103 3HB GLU 103 11.584 1.177 -2.300 756 HG2 GLU 103 2HG GLU 103 11.246 -0.173 0.359 757 HG3 GLU 103 3HG GLU 103 10.590 -0.659 -1.203 758 H LEU 104 H LEU 104 12.003 3.768 0.564 759 HA LEU 104 HA LEU 104 12.398 5.762 -1.540 760 HB2 LEU 104 2HB LEU 104 10.294 5.292 0.134 761 HB3 LEU 104 3HB LEU 104 11.126 6.607 0.961 762 HG LEU 104 HG LEU 104 9.562 7.712 -0.340 763 HD11 LEU 104 1HD1 LEU 104 12.130 8.203 -0.817 764 HD12 LEU 104 2HD1 LEU 104 10.834 9.075 -1.634 765 HD13 LEU 104 3HD1 LEU 104 11.645 7.737 -2.447 766 HD21 LEU 104 3HD2 LEU 104 10.128 6.419 -2.923 767 HD22 LEU 104 1HD2 LEU 104 8.596 6.937 -2.220 768 HD23 LEU 104 2HD2 LEU 104 9.320 5.407 -1.726 769 H GLU 105 H GLU 105 14.363 6.655 -1.503 770 HA GLU 105 HA GLU 105 16.124 6.783 0.628 771 HB2 GLU 105 2HB GLU 105 16.144 7.586 -2.026 772 HB3 GLU 105 3HB GLU 105 16.354 9.090 -1.140 773 HG2 GLU 105 2HG GLU 105 18.525 8.456 -1.378 774 HG3 GLU 105 3HG GLU 105 18.151 7.697 0.168 Start of MODEL 19 1 HA PRO 1 HA PRO 1 1.514 0.846 -1.740 2 HB2 PRO 1 2HB PRO 1 3.992 -0.182 -1.324 3 HB3 PRO 1 3HB PRO 1 3.513 1.426 -0.767 4 HG2 PRO 1 2HG PRO 1 3.663 -1.143 0.763 5 HG3 PRO 1 3HG PRO 1 4.184 0.481 1.249 6 HD2 PRO 1 2HD PRO 1 1.848 -0.608 2.078 7 HD3 PRO 1 3HD PRO 1 2.047 1.135 1.810 8 H LEU 2 H LEU 2 2.584 -0.512 -3.437 9 HA LEU 2 HA LEU 2 2.529 -3.361 -3.172 10 HB2 LEU 2 2HB LEU 2 0.756 -3.830 -4.728 11 HB3 LEU 2 3HB LEU 2 0.129 -2.875 -3.386 12 HG LEU 2 HG LEU 2 0.762 -0.972 -5.286 13 HD11 LEU 2 1HD1 LEU 2 -0.198 -1.706 -7.360 14 HD12 LEU 2 2HD1 LEU 2 -0.567 -3.290 -6.679 15 HD13 LEU 2 3HD1 LEU 2 1.111 -2.803 -6.921 16 HD21 LEU 2 3HD2 LEU 2 -1.273 -1.352 -3.743 17 HD22 LEU 2 1HD2 LEU 2 -1.954 -2.222 -5.118 18 HD23 LEU 2 2HD2 LEU 2 -1.516 -0.521 -5.281 19 H THR 3 H THR 3 3.352 -4.446 -5.027 20 HA THR 3 HA THR 3 4.490 -2.681 -7.090 21 HB THR 3 HB THR 3 6.202 -3.364 -5.365 22 HG1 THR 3 HG1 THR 3 7.517 -3.118 -6.996 23 HG21 THR 3 3HG2 THR 3 5.067 -5.869 -5.669 24 HG22 THR 3 1HG2 THR 3 6.581 -5.507 -4.843 25 HG23 THR 3 2HG2 THR 3 6.597 -5.997 -6.537 26 H ARG 4 H ARG 4 5.281 -3.956 -9.015 27 HA ARG 4 HA ARG 4 3.173 -5.745 -9.844 28 HB2 ARG 4 2HB ARG 4 5.293 -4.180 -11.143 29 HB3 ARG 4 3HB ARG 4 4.980 -5.735 -11.903 30 HG2 ARG 4 2HG ARG 4 3.339 -4.725 -13.002 31 HG3 ARG 4 3HG ARG 4 2.457 -4.698 -11.474 32 HD2 ARG 4 2HD ARG 4 2.878 -2.490 -11.111 33 HD3 ARG 4 3HD ARG 4 4.429 -2.537 -11.948 34 HE ARG 4 HE ARG 4 1.920 -1.818 -13.063 35 HH11 ARG 4 1HH1 ARG 4 4.916 -3.429 -13.804 36 HH12 ARG 4 2HH1 ARG 4 4.828 -3.094 -15.501 37 HH21 ARG 4 2HH2 ARG 4 3.051 -1.922 -16.349 38 HH22 ARG 4 1HH2 ARG 4 1.792 -1.370 -15.296 39 HA PRO 5 HA PRO 5 5.164 -9.617 -9.306 40 HB2 PRO 5 2HB PRO 5 4.485 -10.953 -11.570 41 HB3 PRO 5 3HB PRO 5 3.328 -10.594 -10.283 42 HG2 PRO 5 2HG PRO 5 3.782 -9.165 -12.874 43 HG3 PRO 5 3HG PRO 5 2.252 -9.592 -12.085 44 HD2 PRO 5 2HD PRO 5 3.310 -7.103 -11.960 45 HD3 PRO 5 3HD PRO 5 2.353 -7.801 -10.638 46 H TYR 6 H TYR 6 7.333 -8.695 -9.443 47 HA TYR 6 HA TYR 6 8.697 -9.464 -11.939 48 HB2 TYR 6 2HB TYR 6 8.513 -6.918 -11.194 49 HB3 TYR 6 3HB TYR 6 9.884 -7.365 -10.184 50 HD1 TYR 6 HD1 TYR 6 11.973 -8.218 -11.260 51 HD2 TYR 6 HD2 TYR 6 8.763 -6.593 -13.532 52 HE1 TYR 6 HE1 TYR 6 13.487 -7.922 -13.176 53 HE2 TYR 6 HE2 TYR 6 10.268 -6.293 -15.454 54 HH TYR 6 HH TYR 6 12.373 -7.217 -16.306 55 H LEU 7 H LEU 7 10.764 -10.384 -11.744 56 HA LEU 7 HA LEU 7 11.376 -11.411 -9.051 57 HB2 LEU 7 2HB LEU 7 11.474 -12.657 -11.753 58 HB3 LEU 7 3HB LEU 7 12.643 -13.181 -10.542 59 HG LEU 7 HG LEU 7 10.880 -13.941 -9.093 60 HD11 LEU 7 1HD1 LEU 7 8.499 -13.893 -10.117 61 HD12 LEU 7 2HD1 LEU 7 9.120 -12.537 -11.057 62 HD13 LEU 7 3HD1 LEU 7 9.119 -12.461 -9.296 63 HD21 LEU 7 3HD2 LEU 7 10.930 -14.847 -11.921 64 HD22 LEU 7 1HD2 LEU 7 9.667 -15.485 -10.868 65 HD23 LEU 7 2HD2 LEU 7 11.364 -15.711 -10.445 66 H GLY 8 H GLY 8 13.451 -11.298 -8.288 67 HA2 GLY 8 2HA GLY 8 15.454 -10.049 -10.059 68 HA3 GLY 8 3HA GLY 8 15.178 -9.436 -8.435 69 H PHE 9 H PHE 9 14.914 -12.831 -8.854 70 HA PHE 9 HA PHE 9 17.641 -13.519 -8.471 71 HB2 PHE 9 2HB PHE 9 17.719 -14.061 -6.181 72 HB3 PHE 9 3HB PHE 9 16.951 -12.477 -6.228 73 HD1 PHE 9 HD1 PHE 9 16.853 -15.419 -4.564 74 HD2 PHE 9 HD2 PHE 9 14.230 -12.831 -6.696 75 HE1 PHE 9 HE1 PHE 9 14.943 -16.315 -3.296 76 HE2 PHE 9 HE2 PHE 9 12.317 -13.722 -5.431 77 HZ PHE 9 HZ PHE 9 12.672 -15.466 -3.728 78 H ARG 10 H ARG 10 17.704 -15.900 -7.493 79 HA ARG 10 HA ARG 10 15.570 -17.394 -8.870 80 HB2 ARG 10 2HB ARG 10 18.519 -17.804 -8.677 81 HB3 ARG 10 3HB ARG 10 17.489 -19.225 -8.787 82 HG2 ARG 10 2HG ARG 10 16.468 -17.756 -10.794 83 HG3 ARG 10 3HG ARG 10 18.141 -17.194 -10.813 84 HD2 ARG 10 2HD ARG 10 18.940 -19.185 -11.523 85 HD3 ARG 10 3HD ARG 10 17.771 -20.108 -10.579 86 HE ARG 10 HE ARG 10 16.359 -20.125 -12.391 87 HH11 ARG 10 1HH1 ARG 10 18.927 -17.837 -12.932 88 HH12 ARG 10 2HH1 ARG 10 18.524 -17.580 -14.597 89 HH21 ARG 10 2HH2 ARG 10 16.755 -18.694 -15.535 90 HH22 ARG 10 1HH2 ARG 10 15.819 -19.796 -14.583 91 H VAL 11 H VAL 11 14.951 -19.448 -7.958 92 HA VAL 11 HA VAL 11 15.588 -19.776 -5.108 93 HB VAL 11 HB VAL 11 13.271 -20.200 -4.548 94 HG11 VAL 11 1HG1 VAL 11 12.322 -17.886 -5.122 95 HG12 VAL 11 2HG1 VAL 11 13.825 -17.957 -4.199 96 HG13 VAL 11 3HG1 VAL 11 13.865 -17.603 -5.927 97 HG21 VAL 11 3HG2 VAL 11 12.823 -19.791 -7.488 98 HG22 VAL 11 1HG2 VAL 11 12.325 -21.141 -6.469 99 HG23 VAL 11 2HG2 VAL 11 11.522 -19.579 -6.317 100 H ALA 12 H ALA 12 15.833 -21.845 -4.447 101 HA ALA 12 HA ALA 12 15.163 -23.975 -6.371 102 HB1 ALA 12 1HB ALA 12 17.273 -25.004 -4.970 103 HB2 ALA 12 2HB ALA 12 17.373 -24.263 -6.568 104 HB3 ALA 12 3HB ALA 12 17.721 -23.305 -5.128 105 H VAL 13 H VAL 13 13.761 -25.393 -5.587 106 HA VAL 13 HA VAL 13 13.152 -25.450 -2.760 107 HB VAL 13 HB VAL 13 11.347 -25.544 -4.444 108 HG11 VAL 13 1HG1 VAL 13 11.712 -28.373 -5.063 109 HG12 VAL 13 2HG1 VAL 13 11.265 -27.029 -6.116 110 HG13 VAL 13 3HG1 VAL 13 12.963 -27.336 -5.747 111 HG21 VAL 13 3HG2 VAL 13 10.791 -26.364 -2.293 112 HG22 VAL 13 1HG2 VAL 13 10.159 -27.540 -3.446 113 HG23 VAL 13 2HG2 VAL 13 11.651 -27.879 -2.568 114 H GLY 14 H GLY 14 13.748 -26.963 -1.321 115 HA2 GLY 14 2HA GLY 14 14.573 -29.602 -2.131 116 HA3 GLY 14 3HA GLY 14 15.907 -28.595 -1.589 117 H ARG 15 H ARG 15 16.252 -30.077 0.140 118 HA ARG 15 HA ARG 15 14.404 -29.628 2.380 119 HB2 ARG 15 2HB ARG 15 15.741 -32.267 1.761 120 HB3 ARG 15 3HB ARG 15 14.654 -31.935 3.103 121 HG2 ARG 15 2HG ARG 15 13.471 -31.289 0.532 122 HG3 ARG 15 3HG ARG 15 13.955 -32.981 0.657 123 HD2 ARG 15 2HD ARG 15 12.765 -32.958 2.923 124 HD3 ARG 15 3HD ARG 15 12.043 -31.442 2.385 125 HE ARG 15 HE ARG 15 10.688 -32.627 0.968 126 HH11 ARG 15 1HH1 ARG 15 13.270 -34.682 2.077 127 HH12 ARG 15 2HH1 ARG 15 12.592 -36.123 1.393 128 HH21 ARG 15 2HH2 ARG 15 10.611 -36.027 0.248 129 HH22 ARG 15 1HH2 ARG 15 9.786 -34.517 0.064 130 H ASP 16 H ASP 16 15.343 -29.291 4.348 131 HA ASP 16 HA ASP 16 18.257 -28.984 4.335 132 HB2 ASP 16 2HB ASP 16 17.760 -27.722 6.521 133 HB3 ASP 16 3HB ASP 16 17.251 -26.971 5.011 134 H SER 17 H SER 17 19.023 -29.166 6.853 135 HA SER 17 HA SER 17 18.965 -31.973 7.367 136 HB2 SER 17 2HB SER 17 20.097 -29.723 9.048 137 HB3 SER 17 3HB SER 17 20.431 -31.440 9.270 138 HG SER 17 HG SER 17 21.978 -30.103 7.983 139 H SER 18 H SER 18 17.215 -29.229 8.556 140 HA SER 18 HA SER 18 16.294 -30.415 10.979 141 HB2 SER 18 2HB SER 18 16.201 -28.066 10.952 142 HB3 SER 18 3HB SER 18 15.441 -28.024 9.362 143 HG SER 18 HG SER 18 14.088 -27.654 11.339 144 H GLY 19 H GLY 19 14.508 -29.619 7.988 145 HA2 GLY 19 2HA GLY 19 13.271 -31.456 6.895 146 HA3 GLY 19 3HA GLY 19 12.829 -31.996 8.508 147 H CYS 20 H CYS 20 12.811 -28.743 7.080 148 HA CYS 20 HA CYS 20 9.940 -28.597 7.721 149 HB2 CYS 20 2HB CYS 20 12.137 -26.559 7.852 150 HB3 CYS 20 3HB CYS 20 10.472 -26.037 7.626 151 HG CYS 20 HG CYS 20 11.153 -28.140 10.196 152 H THR 21 H THR 21 12.234 -28.562 5.229 153 HA THR 21 HA THR 21 12.067 -28.326 2.970 154 HB THR 21 HB THR 21 9.094 -27.968 3.189 155 HG1 THR 21 HG1 THR 21 8.830 -30.059 3.688 156 HG21 THR 21 3HG2 THR 21 11.051 -28.887 1.162 157 HG22 THR 21 1HG2 THR 21 9.568 -27.956 0.962 158 HG23 THR 21 2HG2 THR 21 9.488 -29.703 1.193 159 H THR 22 H THR 22 13.075 -26.376 2.712 160 HA THR 22 HA THR 22 11.316 -24.088 2.230 161 HB THR 22 HB THR 22 11.991 -23.443 4.359 162 HG1 THR 22 HG1 THR 22 12.697 -21.623 3.556 163 HG21 THR 22 3HG2 THR 22 14.620 -23.596 4.822 164 HG22 THR 22 1HG2 THR 22 14.458 -24.958 3.714 165 HG23 THR 22 2HG2 THR 22 13.512 -24.914 5.202 166 H LEU 23 H LEU 23 12.281 -22.436 0.893 167 HA LEU 23 HA LEU 23 14.219 -23.572 -0.974 168 HB2 LEU 23 2HB LEU 23 12.210 -21.369 -1.098 169 HB3 LEU 23 3HB LEU 23 13.568 -21.363 -2.221 170 HG LEU 23 HG LEU 23 12.863 -23.516 -3.112 171 HD11 LEU 23 1HD1 LEU 23 10.801 -23.328 -0.946 172 HD12 LEU 23 2HD1 LEU 23 11.887 -24.661 -1.334 173 HD13 LEU 23 3HD1 LEU 23 10.527 -24.295 -2.395 174 HD21 LEU 23 3HD2 LEU 23 11.491 -22.488 -4.533 175 HD22 LEU 23 1HD2 LEU 23 11.605 -21.077 -3.480 176 HD23 LEU 23 2HD2 LEU 23 10.275 -22.220 -3.282 177 H SER 24 H SER 24 15.948 -22.208 -1.828 178 HA SER 24 HA SER 24 16.947 -20.293 0.179 179 HB2 SER 24 2HB SER 24 19.118 -21.386 -1.318 180 HB3 SER 24 3HB SER 24 18.795 -21.535 0.409 181 HG SER 24 HG SER 24 18.499 -23.563 -0.047 182 H ILE 25 H ILE 25 18.190 -18.532 -0.595 183 HA ILE 25 HA ILE 25 17.475 -17.756 -3.323 184 HB ILE 25 HB ILE 25 17.992 -15.498 -2.700 185 HG12 ILE 25 2HG1 ILE 25 19.066 -16.702 -0.143 186 HG13 ILE 25 3HG1 ILE 25 19.981 -15.836 -1.373 187 HG21 ILE 25 1HG2 ILE 25 15.985 -17.009 -1.543 188 HG22 ILE 25 2HG2 ILE 25 16.659 -16.093 -0.195 189 HG23 ILE 25 3HG2 ILE 25 16.058 -15.249 -1.622 190 HD11 ILE 25 3HD1 ILE 25 17.985 -14.738 0.577 191 HD12 ILE 25 1HD1 ILE 25 19.692 -14.333 0.405 192 HD13 ILE 25 2HD1 ILE 25 18.538 -13.832 -0.831 193 H GLN 26 H GLN 26 18.924 -17.483 -4.919 194 HA GLN 26 HA GLN 26 21.719 -18.127 -4.318 195 HB2 GLN 26 2HB GLN 26 20.293 -18.031 -6.983 196 HB3 GLN 26 3HB GLN 26 21.944 -18.575 -6.715 197 HG2 GLN 26 2HG GLN 26 21.246 -20.622 -6.271 198 HG3 GLN 26 3HG GLN 26 20.182 -20.025 -4.999 199 HE21 GLN 26 2HE2 GLN 26 17.298 -20.642 -6.775 200 HE22 GLN 26 1HE2 GLN 26 18.087 -20.304 -5.276 201 H GLU 27 H GLU 27 19.669 -15.557 -5.362 202 HA GLU 27 HA GLU 27 22.043 -13.858 -5.749 203 HB2 GLU 27 2HB GLU 27 20.212 -14.504 -7.725 204 HB3 GLU 27 3HB GLU 27 19.663 -12.931 -7.161 205 HG2 GLU 27 2HG GLU 27 21.136 -12.539 -8.962 206 HG3 GLU 27 3HG GLU 27 22.004 -12.101 -7.491 207 H VAL 28 H VAL 28 20.866 -11.419 -5.948 208 HA VAL 28 HA VAL 28 19.710 -11.090 -3.270 209 HB VAL 28 HB VAL 28 20.640 -8.763 -4.889 210 HG11 VAL 28 1HG1 VAL 28 21.039 -7.768 -2.808 211 HG12 VAL 28 2HG1 VAL 28 19.547 -8.682 -2.576 212 HG13 VAL 28 3HG1 VAL 28 21.077 -9.320 -1.972 213 HG21 VAL 28 3HG2 VAL 28 22.944 -9.106 -4.027 214 HG22 VAL 28 1HG2 VAL 28 22.464 -10.717 -3.493 215 HG23 VAL 28 2HG2 VAL 28 22.450 -10.317 -5.210 216 H THR 29 H THR 29 17.699 -10.350 -2.977 217 HA THR 29 HA THR 29 16.244 -9.340 -5.335 218 HB THR 29 HB THR 29 15.399 -11.539 -4.737 219 HG1 THR 29 HG1 THR 29 13.765 -10.229 -5.420 220 HG21 THR 29 3HG2 THR 29 16.100 -11.554 -2.381 221 HG22 THR 29 1HG2 THR 29 14.398 -11.982 -2.556 222 HG23 THR 29 2HG2 THR 29 14.850 -10.368 -2.007 223 H GLN 30 H GLN 30 17.353 -8.650 -2.238 224 HA GLN 30 HA GLN 30 15.237 -6.754 -1.607 225 HB2 GLN 30 2HB GLN 30 17.798 -7.164 -0.074 226 HB3 GLN 30 3HB GLN 30 16.284 -6.486 0.508 227 HG2 GLN 30 2HG GLN 30 15.621 -9.036 -0.376 228 HG3 GLN 30 3HG GLN 30 17.172 -9.226 0.441 229 HE21 GLN 30 2HE2 GLN 30 15.330 -9.584 3.368 230 HE22 GLN 30 1HE2 GLN 30 16.342 -10.326 2.180 231 H THR 31 H THR 31 17.418 -6.594 -3.829 232 HA THR 31 HA THR 31 18.374 -3.888 -3.163 233 HB THR 31 HB THR 31 19.904 -4.438 -5.259 234 HG1 THR 31 HG1 THR 31 19.297 -6.997 -4.153 235 HG21 THR 31 3HG2 THR 31 20.442 -4.054 -2.732 236 HG22 THR 31 1HG2 THR 31 21.650 -4.791 -3.783 237 HG23 THR 31 2HG2 THR 31 20.679 -5.801 -2.712 238 H TYR 32 H TYR 32 15.776 -4.930 -4.432 239 HA TYR 32 HA TYR 32 15.885 -3.212 -6.825 240 HB2 TYR 32 2HB TYR 32 14.378 -5.779 -6.352 241 HB3 TYR 32 3HB TYR 32 13.918 -4.650 -7.621 242 HD1 TYR 32 HD1 TYR 32 15.125 -4.543 -9.662 243 HD2 TYR 32 HD2 TYR 32 16.628 -6.866 -6.430 244 HE1 TYR 32 HE1 TYR 32 16.784 -5.555 -11.170 245 HE2 TYR 32 HE2 TYR 32 18.293 -7.883 -7.928 246 HH TYR 32 HH TYR 32 19.202 -6.682 -10.754 247 H THR 33 H THR 33 14.150 -1.834 -7.206 248 HA THR 33 HA THR 33 11.927 -1.755 -5.348 249 HB THR 33 HB THR 33 13.640 0.715 -5.591 250 HG1 THR 33 HG1 THR 33 14.156 0.065 -3.301 251 HG21 THR 33 3HG2 THR 33 12.357 1.220 -3.430 252 HG22 THR 33 1HG2 THR 33 11.294 -0.105 -3.899 253 HG23 THR 33 2HG2 THR 33 11.459 1.305 -4.945 254 H GLY 34 H GLY 34 10.261 -0.236 -5.989 255 HA2 GLY 34 2HA GLY 34 10.498 1.189 -8.473 256 HA3 GLY 34 3HA GLY 34 9.564 -0.291 -8.630 257 H SER 35 H SER 35 8.415 -0.162 -5.981 258 HA SER 35 HA SER 35 6.470 1.986 -6.476 259 HB2 SER 35 2HB SER 35 5.780 -0.097 -4.507 260 HB3 SER 35 3HB SER 35 4.817 0.577 -5.822 261 HG SER 35 HG SER 35 6.541 -0.725 -7.113 262 H ASN 36 H ASN 36 5.690 3.249 -4.743 263 HA ASN 36 HA ASN 36 5.999 4.613 -2.944 264 HB2 ASN 36 2HB ASN 36 5.704 2.014 -2.033 265 HB3 ASN 36 3HB ASN 36 7.131 2.585 -1.174 266 HD21 ASN 36 2HD2 ASN 36 3.681 4.723 -0.635 267 HD22 ASN 36 1HD2 ASN 36 4.111 4.137 -2.203 268 H GLY 37 H GLY 37 8.232 4.354 -4.775 269 HA2 GLY 37 2HA GLY 37 10.163 5.847 -3.451 270 HA3 GLY 37 3HA GLY 37 10.683 4.171 -3.355 271 H GLY 38 H GLY 38 10.651 2.984 -5.515 272 HA2 GLY 38 2HA GLY 38 11.207 2.857 -7.759 273 HA3 GLY 38 3HA GLY 38 10.964 4.594 -7.881 274 H ALA 39 H ALA 39 13.243 2.092 -6.892 275 HA ALA 39 HA ALA 39 15.464 3.360 -8.025 276 HB1 ALA 39 1HB ALA 39 16.385 3.608 -5.415 277 HB2 ALA 39 2HB ALA 39 15.980 4.919 -6.525 278 HB3 ALA 39 3HB ALA 39 14.771 4.321 -5.389 279 H ASP 40 H ASP 40 15.780 1.230 -8.717 280 HA ASP 40 HA ASP 40 16.234 -0.857 -6.755 281 HB2 ASP 40 2HB ASP 40 16.561 -2.319 -8.700 282 HB3 ASP 40 3HB ASP 40 15.064 -1.402 -8.840 283 H LEU 41 H LEU 41 18.117 -0.925 -5.727 284 HA LEU 41 HA LEU 41 20.576 -1.134 -7.153 285 HB2 LEU 41 2HB LEU 41 19.853 1.441 -6.728 286 HB3 LEU 41 3HB LEU 41 20.759 1.107 -5.254 287 HG LEU 41 HG LEU 41 22.502 0.187 -7.089 288 HD11 LEU 41 1HD1 LEU 41 21.321 0.731 -9.047 289 HD12 LEU 41 2HD1 LEU 41 22.546 1.988 -8.876 290 HD13 LEU 41 3HD1 LEU 41 20.872 2.323 -8.433 291 HD21 LEU 41 3HD2 LEU 41 23.196 2.823 -6.987 292 HD22 LEU 41 1HD2 LEU 41 23.543 1.633 -5.732 293 HD23 LEU 41 2HD2 LEU 41 22.125 2.673 -5.592 294 H MET 42 H MET 42 22.388 -0.578 -5.167 295 HA MET 42 HA MET 42 21.553 -2.426 -3.031 296 HB2 MET 42 2HB MET 42 24.409 -1.927 -3.833 297 HB3 MET 42 3HB MET 42 23.749 -3.279 -2.924 298 HG2 MET 42 2HG MET 42 22.406 -3.578 -5.228 299 HG3 MET 42 3HG MET 42 23.883 -2.830 -5.830 300 HE1 MET 42 3HE MET 42 26.107 -3.650 -5.684 301 HE2 MET 42 1HE MET 42 26.325 -4.149 -4.006 302 HE3 MET 42 2HE MET 42 26.623 -5.295 -5.313 303 H GLY 43 H GLY 43 21.323 -1.526 -1.098 304 HA2 GLY 43 2HA GLY 43 23.277 0.287 -0.034 305 HA3 GLY 43 3HA GLY 43 21.760 1.089 -0.417 306 HA PRO 44 HA PRO 44 20.027 -0.132 3.414 307 HB2 PRO 44 2HB PRO 44 17.467 -0.753 2.758 308 HB3 PRO 44 3HB PRO 44 18.080 0.905 2.771 309 HG2 PRO 44 2HG PRO 44 17.699 -0.955 0.457 310 HG3 PRO 44 3HG PRO 44 17.318 0.773 0.579 311 HD2 PRO 44 2HD PRO 44 19.546 -0.144 -0.657 312 HD3 PRO 44 3HD PRO 44 19.501 1.410 0.202 313 H ALA 45 H ALA 45 20.342 -2.378 0.896 314 HA ALA 45 HA ALA 45 19.123 -4.634 2.159 315 HB1 ALA 45 1HB ALA 45 20.990 -5.631 0.371 316 HB2 ALA 45 2HB ALA 45 19.289 -5.300 0.041 317 HB3 ALA 45 3HB ALA 45 20.511 -4.081 -0.322 318 H PHE 46 H PHE 46 22.482 -3.527 1.785 319 HA PHE 46 HA PHE 46 23.646 -5.664 3.223 320 HB2 PHE 46 2HB PHE 46 24.842 -4.093 1.651 321 HB3 PHE 46 3HB PHE 46 24.778 -2.879 2.924 322 HD1 PHE 46 HD1 PHE 46 25.601 -6.520 2.847 323 HD2 PHE 46 HD2 PHE 46 26.829 -2.581 3.895 324 HE1 PHE 46 HE1 PHE 46 27.677 -7.426 3.809 325 HE2 PHE 46 HE2 PHE 46 28.907 -3.481 4.857 326 HZ PHE 46 HZ PHE 46 29.333 -5.906 4.814 327 H ALA 47 H ALA 47 21.855 -2.963 4.233 328 HA ALA 47 HA ALA 47 23.038 -2.583 6.801 329 HB1 ALA 47 1HB ALA 47 21.051 -1.319 5.257 330 HB2 ALA 47 2HB ALA 47 20.294 -1.788 6.780 331 HB3 ALA 47 3HB ALA 47 21.743 -0.783 6.789 332 H ALA 48 H ALA 48 20.757 -4.818 5.490 333 HA ALA 48 HA ALA 48 19.842 -5.643 8.142 334 HB1 ALA 48 1HB ALA 48 18.989 -6.597 5.410 335 HB2 ALA 48 2HB ALA 48 18.259 -7.067 6.945 336 HB3 ALA 48 3HB ALA 48 18.155 -5.395 6.396 337 H GLY 49 H GLY 49 22.055 -6.559 5.661 338 HA2 GLY 49 2HA GLY 49 23.825 -8.085 6.013 339 HA3 GLY 49 3HA GLY 49 22.881 -8.850 7.282 340 H LEU 50 H LEU 50 21.138 -8.213 4.428 341 HA LEU 50 HA LEU 50 20.692 -10.980 3.944 342 HB2 LEU 50 2HB LEU 50 19.400 -10.202 1.999 343 HB3 LEU 50 3HB LEU 50 18.955 -9.384 3.495 344 HG LEU 50 HG LEU 50 20.820 -7.682 2.413 345 HD11 LEU 50 1HD1 LEU 50 19.770 -7.394 0.058 346 HD12 LEU 50 2HD1 LEU 50 19.359 -9.101 0.226 347 HD13 LEU 50 3HD1 LEU 50 21.044 -8.589 0.302 348 HD21 LEU 50 3HD2 LEU 50 18.957 -6.701 3.323 349 HD22 LEU 50 1HD2 LEU 50 17.843 -7.788 2.494 350 HD23 LEU 50 2HD2 LEU 50 18.629 -6.485 1.603 351 H ARG 51 H ARG 51 21.863 -12.350 2.783 352 HA ARG 51 HA ARG 51 23.409 -11.371 0.505 353 HB2 ARG 51 2HB ARG 51 24.536 -12.757 2.919 354 HB3 ARG 51 3HB ARG 51 25.303 -12.939 1.347 355 HG2 ARG 51 2HG ARG 51 24.723 -10.231 2.487 356 HG3 ARG 51 3HG ARG 51 26.180 -11.126 2.925 357 HD2 ARG 51 2HD ARG 51 26.329 -11.374 0.276 358 HD3 ARG 51 3HD ARG 51 25.414 -9.868 0.351 359 HE ARG 51 HE ARG 51 27.294 -8.799 1.115 360 HH11 ARG 51 1HH1 ARG 51 27.758 -12.243 1.323 361 HH12 ARG 51 2HH1 ARG 51 29.442 -12.124 1.714 362 HH21 ARG 51 2HH2 ARG 51 30.437 -10.068 1.889 363 HH22 ARG 51 1HH2 ARG 51 29.510 -8.629 1.629 364 H VAL 52 H VAL 52 24.072 -13.065 -0.962 365 HA VAL 52 HA VAL 52 22.077 -14.909 -1.540 366 HB VAL 52 HB VAL 52 23.742 -15.994 -3.049 367 HG11 VAL 52 1HG1 VAL 52 23.855 -12.996 -3.274 368 HG12 VAL 52 2HG1 VAL 52 23.854 -14.190 -4.574 369 HG13 VAL 52 3HG1 VAL 52 22.397 -13.928 -3.615 370 HG21 VAL 52 3HG2 VAL 52 25.600 -14.076 -1.667 371 HG22 VAL 52 1HG2 VAL 52 25.773 -15.820 -1.866 372 HG23 VAL 52 2HG2 VAL 52 25.949 -14.751 -3.258 373 H GLY 53 H GLY 53 21.503 -16.745 -0.591 374 HA2 GLY 53 2HA GLY 53 22.328 -19.032 -0.040 375 HA3 GLY 53 3HA GLY 53 23.564 -18.232 0.919 376 H ASP 54 H ASP 54 20.796 -16.462 1.234 377 HA ASP 54 HA ASP 54 20.196 -17.747 3.802 378 HB2 ASP 54 2HB ASP 54 19.290 -15.017 2.884 379 HB3 ASP 54 3HB ASP 54 19.312 -15.651 4.528 380 H GLN 55 H GLN 55 18.512 -19.069 3.840 381 HA GLN 55 HA GLN 55 16.556 -19.161 1.784 382 HB2 GLN 55 2HB GLN 55 16.428 -20.432 4.522 383 HB3 GLN 55 3HB GLN 55 15.507 -20.903 3.100 384 HG2 GLN 55 2HG GLN 55 18.098 -21.069 2.221 385 HG3 GLN 55 3HG GLN 55 18.215 -21.606 3.896 386 HE21 GLN 55 2HE2 GLN 55 16.474 -24.599 3.408 387 HE22 GLN 55 1HE2 GLN 55 17.040 -23.436 4.552 388 H LEU 56 H LEU 56 15.077 -17.622 1.523 389 HA LEU 56 HA LEU 56 14.107 -16.060 3.744 390 HB2 LEU 56 2HB LEU 56 13.632 -16.053 0.788 391 HB3 LEU 56 3HB LEU 56 12.602 -15.113 1.865 392 HG LEU 56 HG LEU 56 15.538 -14.723 2.086 393 HD11 LEU 56 1HD1 LEU 56 15.875 -13.990 0.023 394 HD12 LEU 56 2HD1 LEU 56 14.479 -12.919 0.134 395 HD13 LEU 56 3HD1 LEU 56 14.273 -14.581 -0.419 396 HD21 LEU 56 3HD2 LEU 56 13.049 -13.079 2.390 397 HD22 LEU 56 1HD2 LEU 56 14.637 -12.323 2.256 398 HD23 LEU 56 2HD2 LEU 56 14.299 -13.435 3.582 399 H VAL 57 H VAL 57 12.625 -16.881 5.064 400 HA VAL 57 HA VAL 57 10.558 -18.657 3.962 401 HB VAL 57 HB VAL 57 11.282 -18.226 6.863 402 HG11 VAL 57 1HG1 VAL 57 9.750 -20.524 5.684 403 HG12 VAL 57 2HG1 VAL 57 9.859 -20.019 7.371 404 HG13 VAL 57 3HG1 VAL 57 8.949 -19.045 6.215 405 HG21 VAL 57 3HG2 VAL 57 12.034 -20.779 6.241 406 HG22 VAL 57 1HG2 VAL 57 12.486 -19.894 4.784 407 HG23 VAL 57 2HG2 VAL 57 13.125 -19.397 6.351 408 H ARG 58 H ARG 58 10.891 -16.051 6.377 409 HA ARG 58 HA ARG 58 9.413 -14.495 7.143 410 HB2 ARG 58 2HB ARG 58 9.581 -14.269 4.380 411 HB3 ARG 58 3HB ARG 58 7.852 -14.255 4.697 412 HG2 ARG 58 2HG ARG 58 9.209 -12.549 6.563 413 HG3 ARG 58 3HG ARG 58 9.648 -12.124 4.907 414 HD2 ARG 58 2HD ARG 58 7.600 -11.331 4.445 415 HD3 ARG 58 3HD ARG 58 6.797 -12.657 5.285 416 HE ARG 58 HE ARG 58 8.023 -10.744 7.046 417 HH11 ARG 58 1HH1 ARG 58 5.168 -11.539 5.219 418 HH12 ARG 58 2HH1 ARG 58 4.110 -10.592 6.212 419 HH21 ARG 58 2HH2 ARG 58 4.949 -9.428 7.999 420 HH22 ARG 58 1HH2 ARG 58 6.641 -9.493 8.361 421 H PHE 59 H PHE 59 8.640 -17.329 7.317 422 HA PHE 59 HA PHE 59 5.792 -16.895 7.810 423 HB2 PHE 59 2HB PHE 59 6.950 -19.084 6.096 424 HB3 PHE 59 3HB PHE 59 5.394 -19.268 6.899 425 HD1 PHE 59 HD1 PHE 59 6.756 -18.605 3.873 426 HD2 PHE 59 HD2 PHE 59 3.950 -16.914 6.591 427 HE1 PHE 59 HE1 PHE 59 5.661 -17.431 2.008 428 HE2 PHE 59 HE2 PHE 59 2.851 -15.739 4.730 429 HZ PHE 59 HZ PHE 59 3.706 -15.997 2.435 430 H ALA 60 H ALA 60 4.944 -18.103 9.499 431 HA ALA 60 HA ALA 60 6.822 -18.970 11.464 432 HB1 ALA 60 1HB ALA 60 4.478 -19.801 12.479 433 HB2 ALA 60 2HB ALA 60 5.039 -18.131 12.564 434 HB3 ALA 60 3HB ALA 60 3.898 -18.614 11.309 435 H GLY 61 H GLY 61 7.888 -20.835 11.242 436 HA2 GLY 61 2HA GLY 61 7.372 -23.285 11.684 437 HA3 GLY 61 3HA GLY 61 6.404 -23.173 10.221 438 H TYR 62 H TYR 62 8.985 -21.192 9.762 439 HA TYR 62 HA TYR 62 10.871 -21.311 8.497 440 HB2 TYR 62 2HB TYR 62 11.174 -24.172 9.392 441 HB3 TYR 62 3HB TYR 62 12.437 -23.018 8.976 442 HD1 TYR 62 HD1 TYR 62 11.675 -20.660 10.539 443 HD2 TYR 62 HD2 TYR 62 11.577 -24.780 11.599 444 HE1 TYR 62 HE1 TYR 62 11.902 -20.049 12.910 445 HE2 TYR 62 HE2 TYR 62 11.802 -24.180 13.974 446 HH TYR 62 HH TYR 62 12.260 -20.820 14.984 447 H THR 63 H THR 63 8.416 -21.879 7.232 448 HA THR 63 HA THR 63 9.350 -23.654 5.079 449 HB THR 63 HB THR 63 7.705 -24.964 6.201 450 HG1 THR 63 HG1 THR 63 6.173 -23.786 4.139 451 HG21 THR 63 3HG2 THR 63 5.316 -23.480 6.016 452 HG22 THR 63 1HG2 THR 63 6.511 -22.418 6.759 453 HG23 THR 63 2HG2 THR 63 6.160 -23.990 7.477 454 H VAL 64 H VAL 64 8.721 -23.087 2.985 455 HA VAL 64 HA VAL 64 7.131 -20.677 2.601 456 HB VAL 64 HB VAL 64 9.578 -20.012 2.883 457 HG11 VAL 64 1HG1 VAL 64 10.001 -20.818 0.057 458 HG12 VAL 64 2HG1 VAL 64 11.170 -20.601 1.362 459 HG13 VAL 64 3HG1 VAL 64 10.173 -22.056 1.301 460 HG21 VAL 64 3HG2 VAL 64 7.553 -19.009 1.299 461 HG22 VAL 64 1HG2 VAL 64 9.044 -18.174 1.734 462 HG23 VAL 64 2HG2 VAL 64 8.940 -19.057 0.211 463 H THR 65 H THR 65 6.470 -20.353 0.401 464 HA THR 65 HA THR 65 6.125 -22.857 -1.006 465 HB THR 65 HB THR 65 5.018 -20.876 -2.605 466 HG1 THR 65 HG1 THR 65 4.436 -20.244 0.108 467 HG21 THR 65 3HG2 THR 65 3.858 -22.891 -2.175 468 HG22 THR 65 1HG2 THR 65 2.861 -21.614 -1.480 469 HG23 THR 65 2HG2 THR 65 3.867 -22.615 -0.434 470 H GLU 66 H GLU 66 6.839 -19.642 -2.348 471 HA GLU 66 HA GLU 66 9.301 -20.484 -3.539 472 HB2 GLU 66 2HB GLU 66 8.661 -20.454 -5.842 473 HB3 GLU 66 3HB GLU 66 7.587 -21.570 -5.011 474 HG2 GLU 66 2HG GLU 66 6.283 -19.123 -4.884 475 HG3 GLU 66 3HG GLU 66 6.971 -19.183 -6.506 476 H LEU 67 H LEU 67 9.548 -18.698 -5.586 477 HA LEU 67 HA LEU 67 10.190 -16.321 -4.326 478 HB2 LEU 67 2HB LEU 67 10.272 -15.341 -6.610 479 HB3 LEU 67 3HB LEU 67 11.162 -16.852 -6.431 480 HG LEU 67 HG LEU 67 8.865 -17.840 -7.366 481 HD11 LEU 67 1HD1 LEU 67 8.790 -14.964 -7.953 482 HD12 LEU 67 2HD1 LEU 67 7.486 -16.149 -7.893 483 HD13 LEU 67 3HD1 LEU 67 8.493 -16.020 -9.334 484 HD21 LEU 67 3HD2 LEU 67 9.964 -17.425 -9.704 485 HD22 LEU 67 1HD2 LEU 67 10.765 -18.444 -8.508 486 HD23 LEU 67 2HD2 LEU 67 11.291 -16.776 -8.738 487 H ALA 68 H ALA 68 7.185 -17.292 -5.857 488 HA ALA 68 HA ALA 68 5.914 -14.818 -6.037 489 HB1 ALA 68 1HB ALA 68 4.429 -17.317 -5.310 490 HB2 ALA 68 2HB ALA 68 3.926 -15.988 -6.355 491 HB3 ALA 68 3HB ALA 68 5.162 -17.120 -6.901 492 H ALA 69 H ALA 69 6.141 -17.077 -3.325 493 HA ALA 69 HA ALA 69 4.372 -15.731 -1.594 494 HB1 ALA 69 1HB ALA 69 4.730 -17.624 -0.493 495 HB2 ALA 69 2HB ALA 69 6.173 -17.967 -1.449 496 HB3 ALA 69 3HB ALA 69 6.295 -16.980 0.007 497 H PHE 70 H PHE 70 7.783 -15.307 -2.295 498 HA PHE 70 HA PHE 70 8.182 -13.436 -0.131 499 HB2 PHE 70 2HB PHE 70 10.068 -14.787 -0.718 500 HB3 PHE 70 3HB PHE 70 9.937 -14.339 -2.416 501 HD1 PHE 70 HD1 PHE 70 11.093 -13.323 0.884 502 HD2 PHE 70 HD2 PHE 70 10.675 -12.153 -3.187 503 HE1 PHE 70 HE1 PHE 70 12.674 -11.475 1.256 504 HE2 PHE 70 HE2 PHE 70 12.256 -10.304 -2.822 505 HZ PHE 70 HZ PHE 70 13.259 -9.963 -0.599 506 H ASN 71 H ASN 71 7.318 -13.337 -3.483 507 HA ASN 71 HA ASN 71 7.985 -10.589 -3.914 508 HB2 ASN 71 2HB ASN 71 7.885 -12.007 -5.837 509 HB3 ASN 71 3HB ASN 71 6.255 -12.539 -5.438 510 HD21 ASN 71 2HD2 ASN 71 6.841 -9.325 -7.722 511 HD22 ASN 71 1HD2 ASN 71 8.097 -10.402 -7.225 512 H THR 72 H THR 72 5.135 -12.342 -2.865 513 HA THR 72 HA THR 72 3.345 -10.124 -3.060 514 HB THR 72 HB THR 72 2.428 -12.356 -3.109 515 HG1 THR 72 HG1 THR 72 0.756 -11.950 -1.751 516 HG21 THR 72 3HG2 THR 72 4.130 -13.469 -1.733 517 HG22 THR 72 1HG2 THR 72 2.501 -13.839 -1.169 518 HG23 THR 72 2HG2 THR 72 3.491 -12.668 -0.298 519 H VAL 73 H VAL 73 5.288 -11.539 -0.473 520 HA VAL 73 HA VAL 73 4.245 -9.880 1.595 521 HB VAL 73 HB VAL 73 6.197 -10.639 2.912 522 HG11 VAL 73 1HG1 VAL 73 5.666 -13.225 2.327 523 HG12 VAL 73 2HG1 VAL 73 4.606 -12.189 3.284 524 HG13 VAL 73 3HG1 VAL 73 4.290 -12.429 1.566 525 HG21 VAL 73 3HG2 VAL 73 7.659 -12.395 1.850 526 HG22 VAL 73 1HG2 VAL 73 7.004 -11.886 0.293 527 HG23 VAL 73 2HG2 VAL 73 7.920 -10.747 1.280 528 H VAL 74 H VAL 74 7.104 -9.722 -0.485 529 HA VAL 74 HA VAL 74 8.244 -7.435 0.741 530 HB VAL 74 HB VAL 74 9.507 -9.002 -0.721 531 HG11 VAL 74 1HG1 VAL 74 7.762 -9.253 -2.451 532 HG12 VAL 74 2HG1 VAL 74 8.084 -7.601 -2.982 533 HG13 VAL 74 3HG1 VAL 74 9.337 -8.835 -3.125 534 HG21 VAL 74 3HG2 VAL 74 9.890 -6.437 -2.102 535 HG22 VAL 74 1HG2 VAL 74 9.888 -6.346 -0.340 536 HG23 VAL 74 2HG2 VAL 74 11.029 -7.406 -1.167 537 H ALA 75 H ALA 75 5.953 -7.886 -1.890 538 HA ALA 75 HA ALA 75 5.952 -5.311 -2.959 539 HB1 ALA 75 1HB ALA 75 3.633 -5.844 -3.705 540 HB2 ALA 75 2HB ALA 75 4.824 -7.084 -4.101 541 HB3 ALA 75 3HB ALA 75 3.719 -7.323 -2.747 542 H ARG 76 H ARG 76 4.087 -6.656 -0.259 543 HA ARG 76 HA ARG 76 2.720 -4.173 0.240 544 HB2 ARG 76 2HB ARG 76 2.777 -6.877 1.503 545 HB3 ARG 76 3HB ARG 76 2.183 -5.523 2.455 546 HG2 ARG 76 2HG ARG 76 0.384 -6.749 1.322 547 HG3 ARG 76 3HG ARG 76 0.477 -5.061 0.813 548 HD2 ARG 76 2HD ARG 76 1.699 -5.741 -1.198 549 HD3 ARG 76 3HD ARG 76 1.598 -7.426 -0.687 550 HE ARG 76 HE ARG 76 -0.449 -5.888 -1.958 551 HH11 ARG 76 1HH1 ARG 76 0.146 -8.515 0.248 552 HH12 ARG 76 2HH1 ARG 76 -1.371 -9.292 -0.064 553 HH21 ARG 76 2HH2 ARG 76 -2.845 -8.375 -1.557 554 HH22 ARG 76 1HH2 ARG 76 -2.449 -6.902 -2.377 555 H HIS 77 H HIS 77 5.633 -5.717 1.311 556 HA HIS 77 HA HIS 77 5.960 -4.116 3.673 557 HB2 HIS 77 2HB HIS 77 6.980 -6.309 3.601 558 HB3 HIS 77 3HB HIS 77 7.890 -5.881 2.155 559 HD1 HIS 77 HD1 HIS 77 7.593 -3.793 5.301 560 HD2 HIS 77 HD2 HIS 77 10.428 -5.946 3.159 561 HE1 HIS 77 HE1 HIS 77 9.793 -3.302 6.415 562 H VAL 78 H VAL 78 6.749 -3.817 0.315 563 HA VAL 78 HA VAL 78 8.890 -2.099 0.283 564 HB VAL 78 HB VAL 78 6.450 -2.163 -1.482 565 HG11 VAL 78 1HG1 VAL 78 8.764 -0.291 -1.498 566 HG12 VAL 78 2HG1 VAL 78 8.117 -0.850 -3.041 567 HG13 VAL 78 3HG1 VAL 78 7.073 0.000 -1.902 568 HG21 VAL 78 3HG2 VAL 78 7.521 -3.940 -2.298 569 HG22 VAL 78 1HG2 VAL 78 8.731 -2.818 -2.921 570 HG23 VAL 78 2HG2 VAL 78 8.968 -3.589 -1.353 571 H ARG 79 H ARG 79 9.069 -0.524 1.791 572 HA ARG 79 HA ARG 79 7.395 1.808 1.482 573 HB2 ARG 79 2HB ARG 79 6.978 -0.060 3.661 574 HB3 ARG 79 3HB ARG 79 7.420 1.533 4.261 575 HG2 ARG 79 2HG ARG 79 5.536 2.039 2.289 576 HG3 ARG 79 3HG ARG 79 4.931 0.611 3.130 577 HD2 ARG 79 2HD ARG 79 4.698 1.718 5.128 578 HD3 ARG 79 3HD ARG 79 5.952 2.896 4.742 579 HE ARG 79 HE ARG 79 3.755 3.232 3.006 580 HH11 ARG 79 1HH1 ARG 79 4.701 3.733 6.319 581 HH12 ARG 79 2HH1 ARG 79 3.618 5.064 6.563 582 HH21 ARG 79 2HH2 ARG 79 2.268 5.773 4.854 583 HH22 ARG 79 1HH2 ARG 79 2.326 4.983 3.315 584 HA PRO 80 HA PRO 80 11.088 3.924 2.544 585 HB2 PRO 80 2HB PRO 80 10.131 6.142 3.785 586 HB3 PRO 80 3HB PRO 80 9.989 5.879 2.043 587 HG2 PRO 80 2HG PRO 80 7.956 5.442 4.196 588 HG3 PRO 80 3HG PRO 80 7.748 6.170 2.593 589 HD2 PRO 80 2HD PRO 80 7.044 3.612 3.134 590 HD3 PRO 80 3HD PRO 80 7.635 4.123 1.540 591 H SER 81 H SER 81 12.387 3.047 4.043 592 HA SER 81 HA SER 81 13.318 2.520 6.050 593 HB2 SER 81 2HB SER 81 11.539 4.741 7.087 594 HB3 SER 81 3HB SER 81 12.929 4.053 7.927 595 HG SER 81 HG SER 81 13.115 6.091 6.523 596 H ALA 82 H ALA 82 11.146 0.962 5.230 597 HA ALA 82 HA ALA 82 9.476 0.524 7.573 598 HB1 ALA 82 1HB ALA 82 8.096 0.165 5.826 599 HB2 ALA 82 2HB ALA 82 9.409 -0.301 4.744 600 HB3 ALA 82 3HB ALA 82 8.769 -1.463 5.905 601 H SER 83 H SER 83 10.018 -0.830 9.142 602 HA SER 83 HA SER 83 11.980 -2.950 8.554 603 HB2 SER 83 2HB SER 83 11.514 -2.000 11.348 604 HB3 SER 83 3HB SER 83 12.986 -2.628 10.607 605 HG SER 83 HG SER 83 11.944 -0.043 10.600 606 H ILE 84 H ILE 84 11.476 -5.016 9.015 607 HA ILE 84 HA ILE 84 9.250 -5.633 10.780 608 HB ILE 84 HB ILE 84 8.145 -7.090 9.129 609 HG12 ILE 84 2HG1 ILE 84 8.899 -6.179 6.660 610 HG13 ILE 84 3HG1 ILE 84 10.444 -6.235 7.502 611 HG21 ILE 84 1HG2 ILE 84 7.081 -5.309 7.819 612 HG22 ILE 84 2HG2 ILE 84 7.286 -4.851 9.509 613 HG23 ILE 84 3HG2 ILE 84 8.376 -4.205 8.282 614 HD11 ILE 84 3HD1 ILE 84 9.973 -8.593 8.094 615 HD12 ILE 84 1HD1 ILE 84 8.516 -8.507 7.104 616 HD13 ILE 84 2HD1 ILE 84 10.101 -8.304 6.359 617 HA PRO 85 HA PRO 85 11.717 -9.123 11.790 618 HB2 PRO 85 2HB PRO 85 9.808 -10.890 12.566 619 HB3 PRO 85 3HB PRO 85 10.267 -9.485 13.535 620 HG2 PRO 85 2HG PRO 85 7.933 -9.835 11.694 621 HG3 PRO 85 3HG PRO 85 7.988 -9.089 13.302 622 HD2 PRO 85 2HD PRO 85 7.978 -7.632 11.019 623 HD3 PRO 85 3HD PRO 85 8.821 -7.100 12.489 624 H VAL 86 H VAL 86 12.588 -10.876 10.809 625 HA VAL 86 HA VAL 86 11.018 -12.333 8.815 626 HB VAL 86 HB VAL 86 13.786 -11.298 8.203 627 HG11 VAL 86 1HG1 VAL 86 11.722 -12.610 6.437 628 HG12 VAL 86 2HG1 VAL 86 13.335 -12.081 5.952 629 HG13 VAL 86 3HG1 VAL 86 13.148 -13.405 7.103 630 HG21 VAL 86 3HG2 VAL 86 11.135 -10.287 7.175 631 HG22 VAL 86 1HG2 VAL 86 12.178 -9.449 8.324 632 HG23 VAL 86 2HG2 VAL 86 12.730 -9.727 6.672 633 H VAL 87 H VAL 87 11.404 -14.471 8.811 634 HA VAL 87 HA VAL 87 13.477 -15.468 10.625 635 HB VAL 87 HB VAL 87 11.254 -16.306 11.079 636 HG11 VAL 87 1HG1 VAL 87 10.984 -16.294 8.285 637 HG12 VAL 87 2HG1 VAL 87 10.826 -17.978 8.790 638 HG13 VAL 87 3HG1 VAL 87 9.773 -16.745 9.484 639 HG21 VAL 87 3HG2 VAL 87 12.428 -18.707 9.818 640 HG22 VAL 87 1HG2 VAL 87 13.461 -17.821 10.939 641 HG23 VAL 87 2HG2 VAL 87 11.901 -18.440 11.480 642 H PHE 88 H PHE 88 15.285 -16.336 9.867 643 HA PHE 88 HA PHE 88 15.329 -17.261 7.069 644 HB2 PHE 88 2HB PHE 88 17.424 -15.843 8.705 645 HB3 PHE 88 3HB PHE 88 17.841 -16.747 7.252 646 HD1 PHE 88 HD1 PHE 88 17.244 -15.940 5.069 647 HD2 PHE 88 HD2 PHE 88 16.115 -13.800 8.571 648 HE1 PHE 88 HE1 PHE 88 16.689 -13.981 3.689 649 HE2 PHE 88 HE2 PHE 88 15.557 -11.838 7.196 650 HZ PHE 88 HZ PHE 88 15.843 -11.926 4.752 651 H SER 89 H SER 89 16.568 -19.109 6.573 652 HA SER 89 HA SER 89 17.387 -20.739 8.882 653 HB2 SER 89 2HB SER 89 15.368 -21.337 6.822 654 HB3 SER 89 3HB SER 89 16.535 -22.630 7.100 655 HG SER 89 HG SER 89 15.184 -23.060 8.677 656 H ARG 90 H ARG 90 19.106 -22.159 8.541 657 HA ARG 90 HA ARG 90 20.443 -22.037 5.935 658 HB2 ARG 90 2HB ARG 90 21.585 -21.221 8.587 659 HB3 ARG 90 3HB ARG 90 22.635 -21.864 7.331 660 HG2 ARG 90 2HG ARG 90 21.832 -20.088 5.809 661 HG3 ARG 90 3HG ARG 90 20.896 -19.415 7.145 662 HD2 ARG 90 2HD ARG 90 23.515 -19.794 8.104 663 HD3 ARG 90 3HD ARG 90 23.666 -19.056 6.510 664 HE ARG 90 HE ARG 90 21.716 -17.642 7.895 665 HH11 ARG 90 1HH1 ARG 90 25.127 -18.294 8.141 666 HH12 ARG 90 2HH1 ARG 90 25.490 -16.792 8.925 667 HH21 ARG 90 2HH2 ARG 90 23.814 -15.296 9.373 668 HH22 ARG 90 1HH2 ARG 90 22.181 -15.661 8.927 669 H ASP 91 H ASP 91 20.111 -24.151 5.434 670 HA ASP 91 HA ASP 91 20.412 -26.405 5.430 671 HB2 ASP 91 2HB ASP 91 22.522 -26.147 7.545 672 HB3 ASP 91 3HB ASP 91 22.463 -27.235 6.162 673 H GLY 92 H GLY 92 18.542 -25.180 7.306 674 HA2 GLY 92 2HA GLY 92 16.990 -26.423 8.629 675 HA3 GLY 92 3HA GLY 92 18.310 -27.463 9.142 676 H VAL 93 H VAL 93 19.767 -24.664 9.392 677 HA VAL 93 HA VAL 93 19.547 -24.510 12.207 678 HB VAL 93 HB VAL 93 20.734 -22.555 10.235 679 HG11 VAL 93 1HG1 VAL 93 20.697 -22.577 13.234 680 HG12 VAL 93 2HG1 VAL 93 21.997 -21.793 12.335 681 HG13 VAL 93 3HG1 VAL 93 20.331 -21.251 12.131 682 HG21 VAL 93 3HG2 VAL 93 22.596 -23.793 10.265 683 HG22 VAL 93 1HG2 VAL 93 22.517 -24.020 12.012 684 HG23 VAL 93 2HG2 VAL 93 21.590 -25.073 10.943 685 H VAL 94 H VAL 94 18.552 -23.017 13.534 686 HA VAL 94 HA VAL 94 16.424 -21.429 12.260 687 HB VAL 94 HB VAL 94 16.541 -22.471 15.093 688 HG11 VAL 94 1HG1 VAL 94 14.283 -21.117 13.623 689 HG12 VAL 94 2HG1 VAL 94 14.259 -21.693 15.291 690 HG13 VAL 94 3HG1 VAL 94 15.308 -20.350 14.834 691 HG21 VAL 94 3HG2 VAL 94 14.705 -23.963 14.361 692 HG22 VAL 94 1HG2 VAL 94 14.955 -23.409 12.705 693 HG23 VAL 94 2HG2 VAL 94 16.231 -24.295 13.541 694 H MET 95 H MET 95 16.911 -19.342 12.133 695 HA MET 95 HA MET 95 18.000 -18.004 14.496 696 HB2 MET 95 2HB MET 95 19.817 -18.590 12.767 697 HB3 MET 95 3HB MET 95 19.074 -17.353 11.762 698 HG2 MET 95 2HG MET 95 20.906 -16.369 12.911 699 HG3 MET 95 3HG MET 95 19.419 -15.730 13.607 700 HE1 MET 95 3HE MET 95 22.278 -15.616 14.462 701 HE2 MET 95 1HE MET 95 21.668 -15.240 16.074 702 HE3 MET 95 2HE MET 95 22.782 -16.588 15.846 703 H SER 96 H SER 96 17.671 -15.678 14.478 704 HA SER 96 HA SER 96 15.539 -14.811 12.642 705 HB2 SER 96 2HB SER 96 14.942 -13.412 14.898 706 HB3 SER 96 3HB SER 96 14.179 -14.939 14.455 707 HG SER 96 HG SER 96 16.336 -14.517 16.241 708 H ALA 97 H ALA 97 15.871 -12.899 11.698 709 HA ALA 97 HA ALA 97 17.689 -10.968 12.936 710 HB1 ALA 97 1HB ALA 97 18.068 -12.251 10.257 711 HB2 ALA 97 2HB ALA 97 18.677 -10.626 10.576 712 HB3 ALA 97 3HB ALA 97 19.244 -11.986 11.545 713 H THR 98 H THR 98 17.171 -8.863 12.555 714 HA THR 98 HA THR 98 14.592 -8.360 11.343 715 HB THR 98 HB THR 98 16.480 -6.336 12.554 716 HG1 THR 98 HG1 THR 98 15.449 -6.737 14.494 717 HG21 THR 98 3HG2 THR 98 13.784 -6.246 11.431 718 HG22 THR 98 1HG2 THR 98 14.919 -4.936 11.752 719 HG23 THR 98 2HG2 THR 98 13.895 -5.552 13.049 720 H ILE 99 H ILE 99 14.209 -7.431 9.419 721 HA ILE 99 HA ILE 99 16.544 -6.572 7.842 722 HB ILE 99 HB ILE 99 13.888 -7.466 6.731 723 HG12 ILE 99 2HG1 ILE 99 14.913 -9.313 7.987 724 HG13 ILE 99 3HG1 ILE 99 14.953 -9.625 6.255 725 HG21 ILE 99 1HG2 ILE 99 15.033 -7.614 4.638 726 HG22 ILE 99 2HG2 ILE 99 15.365 -6.026 5.327 727 HG23 ILE 99 3HG2 ILE 99 16.588 -7.294 5.407 728 HD11 ILE 99 3HD1 ILE 99 17.030 -10.261 7.398 729 HD12 ILE 99 1HD1 ILE 99 17.284 -9.027 6.164 730 HD13 ILE 99 2HD1 ILE 99 17.265 -8.578 7.870 731 H VAL 100 H VAL 100 16.676 -4.498 7.311 732 HA VAL 100 HA VAL 100 14.217 -2.872 7.371 733 HB VAL 100 HB VAL 100 15.766 -0.936 7.913 734 HG11 VAL 100 1HG1 VAL 100 14.772 -1.247 9.876 735 HG12 VAL 100 2HG1 VAL 100 14.676 -2.989 9.607 736 HG13 VAL 100 3HG1 VAL 100 16.120 -2.286 10.339 737 HG21 VAL 100 3HG2 VAL 100 17.717 -2.658 9.205 738 HG22 VAL 100 1HG2 VAL 100 17.742 -2.809 7.448 739 HG23 VAL 100 2HG2 VAL 100 17.960 -1.229 8.200 740 H VAL 101 H VAL 101 13.653 -2.383 5.356 741 HA VAL 101 HA VAL 101 15.753 -1.910 3.356 742 HB VAL 101 HB VAL 101 12.803 -2.283 2.840 743 HG11 VAL 101 1HG1 VAL 101 15.176 -1.810 1.181 744 HG12 VAL 101 2HG1 VAL 101 14.133 -3.120 0.624 745 HG13 VAL 101 3HG1 VAL 101 13.473 -1.499 0.845 746 HG21 VAL 101 3HG2 VAL 101 15.003 -4.282 3.158 747 HG22 VAL 101 1HG2 VAL 101 13.344 -4.337 3.752 748 HG23 VAL 101 2HG2 VAL 101 13.677 -4.600 2.041 749 H GLY 102 H GLY 102 15.666 -0.084 1.985 750 HA2 GLY 102 2HA GLY 102 13.963 2.115 2.982 751 HA3 GLY 102 3HA GLY 102 15.666 2.355 2.622 752 H GLU 103 H GLU 103 12.549 2.566 1.422 753 HA GLU 103 HA GLU 103 13.151 2.129 -1.355 754 HB2 GLU 103 2HB GLU 103 10.777 3.123 0.175 755 HB3 GLU 103 3HB GLU 103 10.854 3.379 -1.562 756 HG2 GLU 103 2HG GLU 103 9.653 1.293 -0.654 757 HG3 GLU 103 3HG GLU 103 10.731 1.126 -2.038 758 H LEU 104 H LEU 104 13.138 4.834 0.841 759 HA LEU 104 HA LEU 104 14.097 6.550 -1.347 760 HB2 LEU 104 2HB LEU 104 12.164 7.257 0.848 761 HB3 LEU 104 3HB LEU 104 12.994 8.461 -0.136 762 HG LEU 104 HG LEU 104 10.836 8.250 -1.052 763 HD11 LEU 104 1HD1 LEU 104 12.046 6.382 -2.958 764 HD12 LEU 104 2HD1 LEU 104 13.057 7.765 -2.541 765 HD13 LEU 104 3HD1 LEU 104 11.440 8.021 -3.197 766 HD21 LEU 104 3HD2 LEU 104 10.991 5.333 -1.543 767 HD22 LEU 104 1HD2 LEU 104 9.596 6.356 -1.198 768 HD23 LEU 104 2HD2 LEU 104 10.668 5.857 0.111 769 H GLU 105 H GLU 105 16.201 6.791 -0.934 770 HA GLU 105 HA GLU 105 17.409 6.596 1.591 771 HB2 GLU 105 2HB GLU 105 19.411 7.500 0.512 772 HB3 GLU 105 3HB GLU 105 18.648 6.277 -0.494 773 HG2 GLU 105 2HG GLU 105 17.779 7.903 -1.975 774 HG3 GLU 105 3HG GLU 105 18.194 9.220 -0.879 Start of MODEL 20 1 HA PRO 1 HA PRO 1 1.350 0.451 -1.360 2 HB2 PRO 1 2HB PRO 1 3.877 -0.507 -1.105 3 HB3 PRO 1 3HB PRO 1 3.368 1.048 -0.437 4 HG2 PRO 1 2HG PRO 1 3.670 -1.594 0.936 5 HG3 PRO 1 3HG PRO 1 4.156 0.018 1.493 6 HD2 PRO 1 2HD PRO 1 1.895 -1.200 2.352 7 HD3 PRO 1 3HD PRO 1 2.023 0.562 2.176 8 H LEU 2 H LEU 2 2.489 -0.795 -3.142 9 HA LEU 2 HA LEU 2 2.481 -3.651 -3.036 10 HB2 LEU 2 2HB LEU 2 0.734 -3.911 -4.816 11 HB3 LEU 2 3HB LEU 2 0.134 -3.476 -3.217 12 HG LEU 2 HG LEU 2 0.289 -1.030 -4.275 13 HD11 LEU 2 1HD1 LEU 2 0.810 -1.131 -6.443 14 HD12 LEU 2 2HD1 LEU 2 -0.837 -1.716 -6.675 15 HD13 LEU 2 3HD1 LEU 2 0.495 -2.864 -6.534 16 HD21 LEU 2 3HD2 LEU 2 -2.089 -1.203 -4.746 17 HD22 LEU 2 1HD2 LEU 2 -1.686 -2.080 -3.270 18 HD23 LEU 2 2HD2 LEU 2 -1.973 -2.964 -4.769 19 H THR 3 H THR 3 3.280 -4.618 -4.973 20 HA THR 3 HA THR 3 4.376 -2.715 -6.934 21 HB THR 3 HB THR 3 6.120 -3.493 -5.290 22 HG1 THR 3 HG1 THR 3 7.302 -3.033 -6.976 23 HG21 THR 3 3HG2 THR 3 6.492 -5.659 -4.882 24 HG22 THR 3 1HG2 THR 3 6.514 -6.053 -6.601 25 HG23 THR 3 2HG2 THR 3 4.981 -5.984 -5.731 26 H ARG 4 H ARG 4 5.140 -3.851 -8.952 27 HA ARG 4 HA ARG 4 3.017 -5.518 -9.920 28 HB2 ARG 4 2HB ARG 4 5.297 -4.051 -11.066 29 HB3 ARG 4 3HB ARG 4 4.886 -5.537 -11.912 30 HG2 ARG 4 2HG ARG 4 2.471 -4.623 -11.862 31 HG3 ARG 4 3HG ARG 4 3.243 -3.073 -11.521 32 HD2 ARG 4 2HD ARG 4 3.609 -2.821 -13.697 33 HD3 ARG 4 3HD ARG 4 4.674 -4.225 -13.649 34 HE ARG 4 HE ARG 4 3.064 -5.415 -14.741 35 HH11 ARG 4 1HH1 ARG 4 1.587 -2.621 -13.281 36 HH12 ARG 4 2HH1 ARG 4 0.036 -2.903 -14.002 37 HH21 ARG 4 2HH2 ARG 4 -0.280 -4.709 -15.375 38 HH22 ARG 4 1HH2 ARG 4 1.028 -5.796 -15.696 39 HA PRO 5 HA PRO 5 4.742 -9.527 -9.475 40 HB2 PRO 5 2HB PRO 5 4.063 -10.724 -11.815 41 HB3 PRO 5 3HB PRO 5 2.885 -10.345 -10.553 42 HG2 PRO 5 2HG PRO 5 3.520 -8.844 -13.064 43 HG3 PRO 5 3HG PRO 5 1.940 -9.205 -12.346 44 HD2 PRO 5 2HD PRO 5 3.145 -6.795 -12.080 45 HD3 PRO 5 3HD PRO 5 2.100 -7.483 -10.821 46 H TYR 6 H TYR 6 6.953 -8.541 -9.570 47 HA TYR 6 HA TYR 6 8.371 -9.452 -11.987 48 HB2 TYR 6 2HB TYR 6 8.235 -6.840 -11.040 49 HB3 TYR 6 3HB TYR 6 9.798 -7.417 -10.472 50 HD1 TYR 6 HD1 TYR 6 11.594 -7.046 -11.862 51 HD2 TYR 6 HD2 TYR 6 7.743 -7.552 -13.598 52 HE1 TYR 6 HE1 TYR 6 12.554 -6.652 -14.092 53 HE2 TYR 6 HE2 TYR 6 8.692 -7.160 -15.833 54 HH TYR 6 HH TYR 6 11.853 -5.946 -16.299 55 H LEU 7 H LEU 7 10.143 -10.708 -11.705 56 HA LEU 7 HA LEU 7 10.884 -11.348 -8.927 57 HB2 LEU 7 2HB LEU 7 11.676 -13.538 -9.954 58 HB3 LEU 7 3HB LEU 7 9.938 -13.287 -9.808 59 HG LEU 7 HG LEU 7 11.047 -12.472 -12.394 60 HD11 LEU 7 1HD1 LEU 7 11.002 -15.015 -13.031 61 HD12 LEU 7 2HD1 LEU 7 11.458 -15.226 -11.341 62 HD13 LEU 7 3HD1 LEU 7 12.473 -14.263 -12.414 63 HD21 LEU 7 3HD2 LEU 7 9.096 -13.752 -13.187 64 HD22 LEU 7 1HD2 LEU 7 8.666 -12.551 -11.970 65 HD23 LEU 7 2HD2 LEU 7 8.773 -14.255 -11.527 66 H GLY 8 H GLY 8 12.874 -10.811 -8.328 67 HA2 GLY 8 2HA GLY 8 14.932 -10.538 -10.433 68 HA3 GLY 8 3HA GLY 8 14.790 -9.400 -9.101 69 H PHE 9 H PHE 9 14.477 -12.909 -8.907 70 HA PHE 9 HA PHE 9 17.127 -13.324 -7.924 71 HB2 PHE 9 2HB PHE 9 16.480 -13.977 -5.622 72 HB3 PHE 9 3HB PHE 9 16.221 -12.263 -5.934 73 HD1 PHE 9 HD1 PHE 9 14.723 -15.365 -4.943 74 HD2 PHE 9 HD2 PHE 9 13.886 -11.466 -6.431 75 HE1 PHE 9 HE1 PHE 9 12.383 -15.594 -4.218 76 HE2 PHE 9 HE2 PHE 9 11.545 -11.688 -5.707 77 HZ PHE 9 HZ PHE 9 10.791 -13.754 -4.599 78 H ARG 10 H ARG 10 17.264 -15.609 -6.894 79 HA ARG 10 HA ARG 10 15.430 -17.395 -8.356 80 HB2 ARG 10 2HB ARG 10 18.405 -17.421 -8.101 81 HB3 ARG 10 3HB ARG 10 17.560 -18.959 -8.217 82 HG2 ARG 10 2HG ARG 10 16.590 -17.152 -10.222 83 HG3 ARG 10 3HG ARG 10 18.348 -17.275 -10.305 84 HD2 ARG 10 2HD ARG 10 17.993 -19.805 -10.178 85 HD3 ARG 10 3HD ARG 10 16.301 -19.460 -10.536 86 HE ARG 10 HE ARG 10 18.066 -18.215 -12.398 87 HH11 ARG 10 1HH1 ARG 10 16.537 -21.229 -11.567 88 HH12 ARG 10 2HH1 ARG 10 16.578 -21.847 -13.185 89 HH21 ARG 10 2HH2 ARG 10 17.483 -20.588 -14.872 90 HH22 ARG 10 1HH2 ARG 10 18.127 -19.016 -14.533 91 H VAL 11 H VAL 11 14.618 -19.141 -7.290 92 HA VAL 11 HA VAL 11 15.563 -19.655 -4.556 93 HB VAL 11 HB VAL 11 13.217 -19.933 -3.802 94 HG11 VAL 11 1HG1 VAL 11 14.461 -17.854 -3.382 95 HG12 VAL 11 2HG1 VAL 11 13.828 -17.185 -4.887 96 HG13 VAL 11 3HG1 VAL 11 12.730 -17.569 -3.561 97 HG21 VAL 11 3HG2 VAL 11 12.657 -18.968 -6.585 98 HG22 VAL 11 1HG2 VAL 11 11.968 -20.345 -5.726 99 HG23 VAL 11 2HG2 VAL 11 11.502 -18.704 -5.279 100 H ALA 12 H ALA 12 15.938 -21.740 -4.203 101 HA ALA 12 HA ALA 12 14.648 -23.711 -5.976 102 HB1 ALA 12 1HB ALA 12 16.727 -24.262 -6.556 103 HB2 ALA 12 2HB ALA 12 17.429 -23.309 -5.249 104 HB3 ALA 12 3HB ALA 12 16.884 -24.959 -4.943 105 H VAL 13 H VAL 13 13.280 -25.048 -5.010 106 HA VAL 13 HA VAL 13 13.091 -25.149 -2.137 107 HB VAL 13 HB VAL 13 11.041 -25.145 -3.420 108 HG11 VAL 13 1HG1 VAL 13 12.434 -26.890 -5.122 109 HG12 VAL 13 2HG1 VAL 13 11.065 -27.806 -4.488 110 HG13 VAL 13 3HG1 VAL 13 10.794 -26.272 -5.317 111 HG21 VAL 13 3HG2 VAL 13 11.207 -27.932 -2.338 112 HG22 VAL 13 1HG2 VAL 13 11.354 -26.542 -1.262 113 HG23 VAL 13 2HG2 VAL 13 9.890 -26.765 -2.220 114 H GLY 14 H GLY 14 13.968 -26.614 -0.823 115 HA2 GLY 14 2HA GLY 14 14.677 -29.255 -1.881 116 HA3 GLY 14 3HA GLY 14 15.956 -28.283 -1.168 117 H ARG 15 H ARG 15 16.348 -29.764 0.483 118 HA ARG 15 HA ARG 15 14.313 -29.751 2.603 119 HB2 ARG 15 2HB ARG 15 15.989 -32.146 1.828 120 HB3 ARG 15 3HB ARG 15 14.830 -32.076 3.149 121 HG2 ARG 15 2HG ARG 15 13.796 -31.392 0.472 122 HG3 ARG 15 3HG ARG 15 14.261 -33.075 0.733 123 HD2 ARG 15 2HD ARG 15 12.799 -33.205 2.665 124 HD3 ARG 15 3HD ARG 15 12.383 -31.500 2.491 125 HE ARG 15 HE ARG 15 10.861 -32.095 0.902 126 HH11 ARG 15 1HH1 ARG 15 13.190 -34.663 1.225 127 HH12 ARG 15 2HH1 ARG 15 12.356 -35.731 0.146 128 HH21 ARG 15 2HH2 ARG 15 10.402 -35.064 -0.848 129 HH22 ARG 15 1HH2 ARG 15 9.754 -33.492 -0.521 130 H ASP 16 H ASP 16 15.069 -29.209 4.557 131 HA ASP 16 HA ASP 16 17.958 -28.813 4.836 132 HB2 ASP 16 2HB ASP 16 17.321 -27.413 6.809 133 HB3 ASP 16 3HB ASP 16 16.657 -26.836 5.283 134 H SER 17 H SER 17 18.432 -28.886 7.444 135 HA SER 17 HA SER 17 18.476 -31.667 8.029 136 HB2 SER 17 2HB SER 17 20.017 -29.570 8.788 137 HB3 SER 17 3HB SER 17 19.032 -29.774 10.236 138 HG SER 17 HG SER 17 19.943 -31.661 10.612 139 H SER 18 H SER 18 16.369 -29.051 8.886 140 HA SER 18 HA SER 18 15.153 -30.409 11.115 141 HB2 SER 18 2HB SER 18 14.156 -28.424 11.541 142 HB3 SER 18 3HB SER 18 15.272 -27.785 10.335 143 HG SER 18 HG SER 18 12.809 -27.483 10.159 144 H GLY 19 H GLY 19 14.373 -29.827 7.718 145 HA2 GLY 19 2HA GLY 19 13.114 -31.258 6.350 146 HA3 GLY 19 3HA GLY 19 12.534 -32.086 7.788 147 H CYS 20 H CYS 20 12.440 -28.633 6.976 148 HA CYS 20 HA CYS 20 9.507 -28.767 7.212 149 HB2 CYS 20 2HB CYS 20 11.516 -26.831 8.212 150 HB3 CYS 20 3HB CYS 20 10.018 -26.145 7.594 151 HG CYS 20 HG CYS 20 9.227 -28.634 9.549 152 H THR 21 H THR 21 11.680 -28.784 4.907 153 HA THR 21 HA THR 21 11.757 -28.155 2.721 154 HB THR 21 HB THR 21 8.893 -27.262 3.068 155 HG1 THR 21 HG1 THR 21 8.784 -29.337 3.692 156 HG21 THR 21 3HG2 THR 21 9.879 -26.598 0.955 157 HG22 THR 21 1HG2 THR 21 8.729 -27.907 0.684 158 HG23 THR 21 2HG2 THR 21 10.460 -28.240 0.679 159 H THR 22 H THR 22 13.182 -26.485 2.687 160 HA THR 22 HA THR 22 12.048 -23.773 2.922 161 HB THR 22 HB THR 22 13.982 -22.948 3.931 162 HG1 THR 22 HG1 THR 22 15.699 -23.691 2.864 163 HG21 THR 22 3HG2 THR 22 12.622 -24.756 5.261 164 HG22 THR 22 1HG2 THR 22 14.118 -24.100 5.925 165 HG23 THR 22 2HG2 THR 22 14.120 -25.677 5.136 166 H LEU 23 H LEU 23 13.586 -22.134 1.792 167 HA LEU 23 HA LEU 23 14.563 -23.268 -0.739 168 HB2 LEU 23 2HB LEU 23 12.603 -21.062 -0.300 169 HB3 LEU 23 3HB LEU 23 13.678 -20.994 -1.695 170 HG LEU 23 HG LEU 23 12.782 -23.198 -2.420 171 HD11 LEU 23 1HD1 LEU 23 11.484 -23.013 0.170 172 HD12 LEU 23 2HD1 LEU 23 11.731 -24.411 -0.876 173 HD13 LEU 23 3HD1 LEU 23 10.346 -23.350 -1.135 174 HD21 LEU 23 3HD2 LEU 23 10.319 -21.662 -2.250 175 HD22 LEU 23 1HD2 LEU 23 11.283 -22.107 -3.658 176 HD23 LEU 23 2HD2 LEU 23 11.707 -20.678 -2.716 177 H SER 24 H SER 24 16.580 -22.688 -1.175 178 HA SER 24 HA SER 24 17.833 -20.589 0.400 179 HB2 SER 24 2HB SER 24 18.835 -22.926 -0.102 180 HB3 SER 24 3HB SER 24 19.235 -22.250 -1.681 181 HG SER 24 HG SER 24 20.977 -21.845 -0.413 182 H ILE 25 H ILE 25 18.782 -18.751 -0.425 183 HA ILE 25 HA ILE 25 17.821 -17.944 -3.067 184 HB ILE 25 HB ILE 25 17.402 -16.481 -1.080 185 HG12 ILE 25 2HG1 ILE 25 18.214 -14.369 -2.234 186 HG13 ILE 25 3HG1 ILE 25 19.021 -15.416 -3.397 187 HG21 ILE 25 1HG2 ILE 25 19.849 -17.005 -0.261 188 HG22 ILE 25 2HG2 ILE 25 20.229 -15.563 -1.201 189 HG23 ILE 25 3HG2 ILE 25 19.067 -15.472 0.123 190 HD11 ILE 25 3HD1 ILE 25 17.147 -15.660 -4.541 191 HD12 ILE 25 1HD1 ILE 25 16.285 -16.209 -3.104 192 HD13 ILE 25 2HD1 ILE 25 16.389 -14.486 -3.466 193 H GLN 26 H GLN 26 19.127 -17.567 -4.760 194 HA GLN 26 HA GLN 26 22.011 -17.962 -4.350 195 HB2 GLN 26 2HB GLN 26 20.317 -18.321 -6.826 196 HB3 GLN 26 3HB GLN 26 22.065 -18.508 -6.780 197 HG2 GLN 26 2HG GLN 26 21.887 -20.592 -6.065 198 HG3 GLN 26 3HG GLN 26 20.843 -20.103 -4.732 199 HE21 GLN 26 2HE2 GLN 26 17.825 -20.668 -6.590 200 HE22 GLN 26 1HE2 GLN 26 18.547 -19.524 -5.515 201 H GLU 27 H GLU 27 19.651 -15.664 -5.225 202 HA GLU 27 HA GLU 27 21.760 -13.846 -6.192 203 HB2 GLU 27 2HB GLU 27 18.847 -13.690 -6.965 204 HB3 GLU 27 3HB GLU 27 20.186 -12.778 -7.647 205 HG2 GLU 27 2HG GLU 27 20.958 -15.369 -8.075 206 HG3 GLU 27 3HG GLU 27 19.210 -15.444 -8.294 207 H VAL 28 H VAL 28 20.414 -11.483 -6.162 208 HA VAL 28 HA VAL 28 19.721 -11.152 -3.315 209 HB VAL 28 HB VAL 28 20.909 -9.015 -5.080 210 HG11 VAL 28 1HG1 VAL 28 19.585 -8.497 -2.935 211 HG12 VAL 28 2HG1 VAL 28 20.986 -9.153 -2.086 212 HG13 VAL 28 3HG1 VAL 28 21.169 -7.751 -3.140 213 HG21 VAL 28 3HG2 VAL 28 23.055 -9.470 -4.004 214 HG22 VAL 28 1HG2 VAL 28 22.342 -10.838 -3.150 215 HG23 VAL 28 2HG2 VAL 28 22.488 -10.875 -4.907 216 H THR 29 H THR 29 17.809 -10.273 -2.833 217 HA THR 29 HA THR 29 16.277 -9.010 -5.014 218 HB THR 29 HB THR 29 15.296 -11.167 -4.434 219 HG1 THR 29 HG1 THR 29 14.013 -9.035 -4.694 220 HG21 THR 29 3HG2 THR 29 14.680 -10.159 -1.680 221 HG22 THR 29 1HG2 THR 29 16.200 -10.991 -2.005 222 HG23 THR 29 2HG2 THR 29 14.666 -11.813 -2.291 223 H GLN 30 H GLN 30 17.684 -8.585 -1.992 224 HA GLN 30 HA GLN 30 15.799 -6.620 -1.013 225 HB2 GLN 30 2HB GLN 30 18.556 -7.315 0.013 226 HB3 GLN 30 3HB GLN 30 17.344 -6.358 0.854 227 HG2 GLN 30 2HG GLN 30 16.440 -9.020 0.033 228 HG3 GLN 30 3HG GLN 30 17.753 -9.013 1.210 229 HE21 GLN 30 2HE2 GLN 30 15.218 -8.886 3.601 230 HE22 GLN 30 1HE2 GLN 30 16.428 -9.842 2.823 231 H THR 31 H THR 31 17.907 -6.540 -3.456 232 HA THR 31 HA THR 31 18.754 -3.767 -2.936 233 HB THR 31 HB THR 31 20.279 -4.336 -5.022 234 HG1 THR 31 HG1 THR 31 20.222 -6.386 -5.514 235 HG21 THR 31 3HG2 THR 31 21.987 -4.326 -3.546 236 HG22 THR 31 1HG2 THR 31 21.325 -5.668 -2.614 237 HG23 THR 31 2HG2 THR 31 20.715 -4.033 -2.360 238 H TYR 32 H TYR 32 16.187 -4.994 -4.112 239 HA TYR 32 HA TYR 32 16.171 -3.369 -6.572 240 HB2 TYR 32 2HB TYR 32 14.867 -6.017 -5.988 241 HB3 TYR 32 3HB TYR 32 14.256 -4.958 -7.254 242 HD1 TYR 32 HD1 TYR 32 16.706 -7.424 -6.380 243 HD2 TYR 32 HD2 TYR 32 15.841 -4.292 -9.127 244 HE1 TYR 32 HE1 TYR 32 18.375 -8.338 -7.937 245 HE2 TYR 32 HE2 TYR 32 17.508 -5.198 -10.693 246 HH TYR 32 HH TYR 32 18.531 -7.836 -10.969 247 H THR 33 H THR 33 14.352 -2.113 -6.983 248 HA THR 33 HA THR 33 12.168 -2.083 -5.069 249 HB THR 33 HB THR 33 13.721 0.464 -5.521 250 HG1 THR 33 HG1 THR 33 14.373 0.054 -3.257 251 HG21 THR 33 3HG2 THR 33 12.363 0.712 -3.175 252 HG22 THR 33 1HG2 THR 33 11.258 -0.296 -4.109 253 HG23 THR 33 2HG2 THR 33 11.768 1.271 -4.737 254 H GLY 34 H GLY 34 10.362 -0.794 -5.760 255 HA2 GLY 34 2HA GLY 34 10.446 0.459 -8.365 256 HA3 GLY 34 3HA GLY 34 9.553 -1.053 -8.326 257 H SER 35 H SER 35 8.526 -0.709 -5.655 258 HA SER 35 HA SER 35 6.499 1.337 -6.242 259 HB2 SER 35 2HB SER 35 5.130 0.057 -4.530 260 HB3 SER 35 3HB SER 35 5.489 -0.815 -6.020 261 HG SER 35 HG SER 35 5.838 -1.945 -3.932 262 H ASN 36 H ASN 36 5.764 2.731 -4.589 263 HA ASN 36 HA ASN 36 6.116 4.259 -2.936 264 HB2 ASN 36 2HB ASN 36 5.981 1.735 -1.784 265 HB3 ASN 36 3HB ASN 36 7.408 2.455 -1.047 266 HD21 ASN 36 2HD2 ASN 36 5.355 5.283 0.147 267 HD22 ASN 36 1HD2 ASN 36 6.692 5.093 -0.930 268 H GLY 37 H GLY 37 8.257 3.907 -4.857 269 HA2 GLY 37 2HA GLY 37 10.201 5.571 -3.777 270 HA3 GLY 37 3HA GLY 37 10.784 3.927 -3.564 271 H GLY 38 H GLY 38 10.623 2.552 -5.628 272 HA2 GLY 38 2HA GLY 38 11.122 2.231 -7.858 273 HA3 GLY 38 3HA GLY 38 10.743 3.924 -8.138 274 H ALA 39 H ALA 39 13.254 1.763 -6.882 275 HA ALA 39 HA ALA 39 15.325 2.955 -8.339 276 HB1 ALA 39 1HB ALA 39 14.728 4.216 -5.756 277 HB2 ALA 39 2HB ALA 39 16.423 3.798 -6.008 278 HB3 ALA 39 3HB ALA 39 15.593 4.847 -7.158 279 H ASP 40 H ASP 40 15.877 0.811 -8.672 280 HA ASP 40 HA ASP 40 16.418 -0.951 -6.458 281 HB2 ASP 40 2HB ASP 40 17.115 -2.553 -8.202 282 HB3 ASP 40 3HB ASP 40 15.527 -1.867 -8.535 283 H LEU 41 H LEU 41 18.241 -0.982 -5.337 284 HA LEU 41 HA LEU 41 20.808 -0.825 -6.578 285 HB2 LEU 41 2HB LEU 41 19.741 1.613 -6.059 286 HB3 LEU 41 3HB LEU 41 20.583 1.290 -4.545 287 HG LEU 41 HG LEU 41 22.606 0.770 -6.121 288 HD11 LEU 41 1HD1 LEU 41 20.668 2.168 -7.892 289 HD12 LEU 41 2HD1 LEU 41 21.832 0.899 -8.267 290 HD13 LEU 41 3HD1 LEU 41 22.381 2.558 -8.037 291 HD21 LEU 41 3HD2 LEU 41 21.640 3.101 -4.778 292 HD22 LEU 41 1HD2 LEU 41 22.502 3.583 -6.240 293 HD23 LEU 41 2HD2 LEU 41 23.304 2.574 -5.036 294 H MET 42 H MET 42 22.363 -0.148 -4.391 295 HA MET 42 HA MET 42 21.645 -2.269 -2.478 296 HB2 MET 42 2HB MET 42 23.655 -2.777 -3.778 297 HB3 MET 42 3HB MET 42 24.381 -1.256 -3.273 298 HG2 MET 42 2HG MET 42 24.777 -1.995 -1.135 299 HG3 MET 42 3HG MET 42 23.505 -3.212 -1.206 300 HE1 MET 42 3HE MET 42 27.880 -3.671 -2.013 301 HE2 MET 42 1HE MET 42 26.991 -2.187 -1.669 302 HE3 MET 42 2HE MET 42 27.075 -3.466 -0.457 303 H GLY 43 H GLY 43 21.180 -1.641 -0.478 304 HA2 GLY 43 2HA GLY 43 22.657 0.431 0.852 305 HA3 GLY 43 3HA GLY 43 21.025 0.932 0.436 306 HA PRO 44 HA PRO 44 19.328 -1.063 3.947 307 HB2 PRO 44 2HB PRO 44 17.191 -2.441 2.999 308 HB3 PRO 44 3HB PRO 44 17.226 -0.677 3.105 309 HG2 PRO 44 2HG PRO 44 17.708 -2.442 0.736 310 HG3 PRO 44 3HG PRO 44 16.775 -0.938 0.839 311 HD2 PRO 44 2HD PRO 44 19.294 -1.024 -0.151 312 HD3 PRO 44 3HD PRO 44 18.657 0.387 0.719 313 H ALA 45 H ALA 45 19.872 -3.219 1.209 314 HA ALA 45 HA ALA 45 19.686 -5.648 2.663 315 HB1 ALA 45 1HB ALA 45 20.598 -6.703 0.719 316 HB2 ALA 45 2HB ALA 45 19.485 -5.441 0.188 317 HB3 ALA 45 3HB ALA 45 21.226 -5.168 0.118 318 H PHE 46 H PHE 46 22.455 -3.665 1.640 319 HA PHE 46 HA PHE 46 24.412 -5.348 2.825 320 HB2 PHE 46 2HB PHE 46 24.659 -3.498 0.994 321 HB3 PHE 46 3HB PHE 46 24.860 -2.417 2.369 322 HD1 PHE 46 HD1 PHE 46 27.000 -1.997 3.064 323 HD2 PHE 46 HD2 PHE 46 26.141 -5.716 1.179 324 HE1 PHE 46 HE1 PHE 46 29.379 -2.613 3.201 325 HE2 PHE 46 HE2 PHE 46 28.517 -6.338 1.314 326 HZ PHE 46 HZ PHE 46 30.140 -4.786 2.327 327 H ALA 47 H ALA 47 22.378 -2.817 4.023 328 HA ALA 47 HA ALA 47 23.904 -2.138 6.323 329 HB1 ALA 47 1HB ALA 47 22.312 -0.552 5.643 330 HB2 ALA 47 2HB ALA 47 21.019 -1.750 5.582 331 HB3 ALA 47 3HB ALA 47 21.668 -1.233 7.138 332 H ALA 48 H ALA 48 21.399 -4.524 5.665 333 HA ALA 48 HA ALA 48 21.404 -5.401 8.448 334 HB1 ALA 48 1HB ALA 48 19.402 -5.248 6.601 335 HB2 ALA 48 2HB ALA 48 19.825 -6.959 6.541 336 HB3 ALA 48 3HB ALA 48 19.354 -6.220 8.072 337 H GLY 49 H GLY 49 22.752 -6.250 5.389 338 HA2 GLY 49 2HA GLY 49 24.612 -7.718 5.207 339 HA3 GLY 49 3HA GLY 49 24.054 -8.559 6.646 340 H LEU 50 H LEU 50 21.602 -7.851 4.393 341 HA LEU 50 HA LEU 50 21.069 -10.602 3.924 342 HB2 LEU 50 2HB LEU 50 19.950 -8.259 2.403 343 HB3 LEU 50 3HB LEU 50 19.235 -9.860 2.586 344 HG LEU 50 HG LEU 50 19.686 -8.299 5.065 345 HD11 LEU 50 1HD1 LEU 50 17.181 -7.475 4.287 346 HD12 LEU 50 2HD1 LEU 50 18.139 -7.288 2.818 347 HD13 LEU 50 3HD1 LEU 50 18.640 -6.483 4.305 348 HD21 LEU 50 3HD2 LEU 50 17.178 -9.269 5.158 349 HD22 LEU 50 1HD2 LEU 50 18.602 -10.194 5.634 350 HD23 LEU 50 2HD2 LEU 50 17.908 -10.410 4.027 351 H ARG 51 H ARG 51 22.264 -11.839 2.640 352 HA ARG 51 HA ARG 51 22.883 -10.886 -0.053 353 HB2 ARG 51 2HB ARG 51 24.865 -11.652 2.033 354 HB3 ARG 51 3HB ARG 51 25.177 -12.173 0.382 355 HG2 ARG 51 2HG ARG 51 24.416 -9.374 0.545 356 HG3 ARG 51 3HG ARG 51 25.865 -9.750 1.479 357 HD2 ARG 51 2HD ARG 51 25.499 -10.643 -1.368 358 HD3 ARG 51 3HD ARG 51 26.202 -9.080 -0.951 359 HE ARG 51 HE ARG 51 27.640 -10.903 0.494 360 HH11 ARG 51 1HH1 ARG 51 26.902 -10.437 -2.876 361 HH12 ARG 51 2HH1 ARG 51 28.385 -11.139 -3.432 362 HH21 ARG 51 2HH2 ARG 51 29.917 -11.931 -1.924 363 HH22 ARG 51 1HH2 ARG 51 29.597 -11.829 -0.226 364 H VAL 52 H VAL 52 24.018 -12.846 -1.264 365 HA VAL 52 HA VAL 52 22.088 -14.898 -1.409 366 HB VAL 52 HB VAL 52 23.654 -16.016 -2.960 367 HG11 VAL 52 1HG1 VAL 52 22.176 -14.328 -3.840 368 HG12 VAL 52 2HG1 VAL 52 23.298 -13.049 -3.370 369 HG13 VAL 52 3HG1 VAL 52 23.743 -14.194 -4.636 370 HG21 VAL 52 3HG2 VAL 52 25.794 -15.657 -2.136 371 HG22 VAL 52 1HG2 VAL 52 25.732 -14.582 -3.533 372 HG23 VAL 52 2HG2 VAL 52 25.526 -13.929 -1.908 373 H GLY 53 H GLY 53 21.874 -16.736 -0.308 374 HA2 GLY 53 2HA GLY 53 23.207 -18.754 0.441 375 HA3 GLY 53 3HA GLY 53 24.139 -17.597 1.379 376 H ASP 54 H ASP 54 21.413 -16.156 1.739 377 HA ASP 54 HA ASP 54 20.681 -17.688 4.127 378 HB2 ASP 54 2HB ASP 54 20.080 -14.831 3.336 379 HB3 ASP 54 3HB ASP 54 19.519 -15.594 4.821 380 H GLN 55 H GLN 55 18.909 -18.890 4.126 381 HA GLN 55 HA GLN 55 17.117 -18.943 1.921 382 HB2 GLN 55 2HB GLN 55 17.051 -20.256 4.636 383 HB3 GLN 55 3HB GLN 55 15.802 -20.513 3.425 384 HG2 GLN 55 2HG GLN 55 17.243 -21.641 1.995 385 HG3 GLN 55 3HG GLN 55 18.682 -20.991 2.778 386 HE21 GLN 55 2HE2 GLN 55 18.068 -24.574 3.714 387 HE22 GLN 55 1HE2 GLN 55 18.108 -23.736 2.204 388 H LEU 56 H LEU 56 15.096 -18.120 1.677 389 HA LEU 56 HA LEU 56 14.106 -16.379 3.838 390 HB2 LEU 56 2HB LEU 56 14.297 -15.981 0.898 391 HB3 LEU 56 3HB LEU 56 12.928 -15.267 1.747 392 HG LEU 56 HG LEU 56 14.713 -13.645 1.450 393 HD11 LEU 56 1HD1 LEU 56 15.123 -13.891 4.272 394 HD12 LEU 56 2HD1 LEU 56 13.458 -14.308 3.872 395 HD13 LEU 56 3HD1 LEU 56 14.117 -12.747 3.385 396 HD21 LEU 56 3HD2 LEU 56 16.486 -15.192 3.288 397 HD22 LEU 56 1HD2 LEU 56 16.897 -13.931 2.126 398 HD23 LEU 56 2HD2 LEU 56 16.490 -15.551 1.561 399 H VAL 57 H VAL 57 12.258 -17.026 4.702 400 HA VAL 57 HA VAL 57 10.398 -18.599 3.038 401 HB VAL 57 HB VAL 57 11.369 -20.000 4.777 402 HG11 VAL 57 1HG1 VAL 57 11.638 -19.412 6.934 403 HG12 VAL 57 2HG1 VAL 57 11.501 -17.771 6.300 404 HG13 VAL 57 3HG1 VAL 57 10.093 -18.566 7.006 405 HG21 VAL 57 3HG2 VAL 57 8.592 -19.494 4.417 406 HG22 VAL 57 1HG2 VAL 57 9.393 -21.010 4.830 407 HG23 VAL 57 2HG2 VAL 57 8.869 -19.913 6.108 408 H ARG 58 H ARG 58 10.734 -16.170 5.569 409 HA ARG 58 HA ARG 58 9.289 -14.631 6.430 410 HB2 ARG 58 2HB ARG 58 9.266 -14.438 3.645 411 HB3 ARG 58 3HB ARG 58 7.570 -14.380 4.106 412 HG2 ARG 58 2HG ARG 58 7.782 -12.384 5.177 413 HG3 ARG 58 3HG ARG 58 9.467 -12.673 5.616 414 HD2 ARG 58 2HD ARG 58 9.353 -12.578 2.799 415 HD3 ARG 58 3HD ARG 58 8.402 -11.218 3.396 416 HE ARG 58 HE ARG 58 11.224 -11.459 3.445 417 HH11 ARG 58 1HH1 ARG 58 8.533 -10.256 5.297 418 HH12 ARG 58 2HH1 ARG 58 9.463 -9.032 6.097 419 HH21 ARG 58 2HH2 ARG 58 11.695 -8.803 5.638 420 HH22 ARG 58 1HH2 ARG 58 12.459 -9.852 4.493 421 H PHE 59 H PHE 59 8.554 -17.445 6.710 422 HA PHE 59 HA PHE 59 5.721 -17.039 7.311 423 HB2 PHE 59 2HB PHE 59 6.842 -19.330 5.697 424 HB3 PHE 59 3HB PHE 59 5.273 -19.402 6.492 425 HD1 PHE 59 HD1 PHE 59 6.501 -19.194 3.430 426 HD2 PHE 59 HD2 PHE 59 4.112 -16.815 6.029 427 HE1 PHE 59 HE1 PHE 59 5.471 -18.104 1.480 428 HE2 PHE 59 HE2 PHE 59 3.077 -15.723 4.082 429 HZ PHE 59 HZ PHE 59 3.756 -16.367 1.804 430 H ALA 60 H ALA 60 4.984 -18.138 9.106 431 HA ALA 60 HA ALA 60 6.977 -18.952 10.987 432 HB1 ALA 60 1HB ALA 60 4.773 -19.617 12.277 433 HB2 ALA 60 2HB ALA 60 5.251 -17.930 12.078 434 HB3 ALA 60 3HB ALA 60 4.022 -18.629 11.023 435 H GLY 61 H GLY 61 7.981 -20.852 10.734 436 HA2 GLY 61 2HA GLY 61 7.508 -23.257 11.334 437 HA3 GLY 61 3HA GLY 61 6.333 -23.199 10.029 438 H TYR 62 H TYR 62 8.904 -21.311 9.147 439 HA TYR 62 HA TYR 62 10.583 -21.540 7.631 440 HB2 TYR 62 2HB TYR 62 10.969 -24.404 8.408 441 HB3 TYR 62 3HB TYR 62 12.174 -23.177 8.035 442 HD1 TYR 62 HD1 TYR 62 11.670 -21.004 9.801 443 HD2 TYR 62 HD2 TYR 62 11.253 -25.170 10.563 444 HE1 TYR 62 HE1 TYR 62 11.999 -20.592 12.203 445 HE2 TYR 62 HE2 TYR 62 11.579 -24.768 12.968 446 HH TYR 62 HH TYR 62 11.481 -21.661 14.343 447 H THR 63 H THR 63 7.953 -22.030 6.738 448 HA THR 63 HA THR 63 8.480 -23.951 4.568 449 HB THR 63 HB THR 63 6.847 -25.004 5.971 450 HG1 THR 63 HG1 THR 63 5.548 -25.449 4.338 451 HG21 THR 63 3HG2 THR 63 5.494 -23.806 7.271 452 HG22 THR 63 1HG2 THR 63 4.613 -23.266 5.842 453 HG23 THR 63 2HG2 THR 63 5.979 -22.326 6.443 454 H VAL 64 H VAL 64 8.329 -23.120 2.589 455 HA VAL 64 HA VAL 64 6.635 -20.763 2.150 456 HB VAL 64 HB VAL 64 9.029 -20.064 2.466 457 HG11 VAL 64 1HG1 VAL 64 9.864 -20.811 -0.199 458 HG12 VAL 64 2HG1 VAL 64 10.701 -21.012 1.342 459 HG13 VAL 64 3HG1 VAL 64 9.543 -22.228 0.800 460 HG21 VAL 64 3HG2 VAL 64 8.458 -19.380 -0.339 461 HG22 VAL 64 1HG2 VAL 64 7.136 -19.100 0.794 462 HG23 VAL 64 2HG2 VAL 64 8.702 -18.333 1.059 463 H THR 65 H THR 65 6.001 -20.438 -0.054 464 HA THR 65 HA THR 65 5.610 -22.932 -1.455 465 HB THR 65 HB THR 65 4.631 -20.911 -3.097 466 HG1 THR 65 HG1 THR 65 3.448 -19.617 -1.544 467 HG21 THR 65 3HG2 THR 65 3.415 -22.700 -1.020 468 HG22 THR 65 1HG2 THR 65 3.320 -22.811 -2.777 469 HG23 THR 65 2HG2 THR 65 2.416 -21.561 -1.923 470 H GLU 66 H GLU 66 6.492 -19.764 -2.810 471 HA GLU 66 HA GLU 66 8.928 -20.761 -3.958 472 HB2 GLU 66 2HB GLU 66 8.315 -20.594 -6.278 473 HB3 GLU 66 3HB GLU 66 7.197 -21.695 -5.486 474 HG2 GLU 66 2HG GLU 66 5.969 -19.228 -5.264 475 HG3 GLU 66 3HG GLU 66 6.684 -19.211 -6.876 476 H LEU 67 H LEU 67 9.333 -18.955 -5.967 477 HA LEU 67 HA LEU 67 10.140 -16.662 -4.648 478 HB2 LEU 67 2HB LEU 67 10.461 -15.669 -6.841 479 HB3 LEU 67 3HB LEU 67 11.014 -17.342 -6.814 480 HG LEU 67 HG LEU 67 8.545 -17.724 -7.778 481 HD11 LEU 67 1HD1 LEU 67 8.948 -14.890 -7.940 482 HD12 LEU 67 2HD1 LEU 67 7.537 -15.847 -8.388 483 HD13 LEU 67 3HD1 LEU 67 8.827 -15.579 -9.559 484 HD21 LEU 67 3HD2 LEU 67 10.639 -18.491 -8.780 485 HD22 LEU 67 1HD2 LEU 67 10.934 -16.870 -9.410 486 HD23 LEU 67 2HD2 LEU 67 9.558 -17.805 -9.995 487 H ALA 68 H ALA 68 7.112 -17.323 -6.322 488 HA ALA 68 HA ALA 68 6.049 -14.746 -6.380 489 HB1 ALA 68 1HB ALA 68 4.057 -15.715 -6.972 490 HB2 ALA 68 2HB ALA 68 5.179 -17.021 -7.355 491 HB3 ALA 68 3HB ALA 68 4.255 -17.065 -5.854 492 H ALA 69 H ALA 69 6.174 -17.113 -3.788 493 HA ALA 69 HA ALA 69 4.364 -15.806 -2.040 494 HB1 ALA 69 1HB ALA 69 4.781 -17.501 -0.613 495 HB2 ALA 69 2HB ALA 69 5.534 -18.230 -2.032 496 HB3 ALA 69 3HB ALA 69 6.528 -17.402 -0.833 497 H PHE 70 H PHE 70 7.803 -15.491 -2.643 498 HA PHE 70 HA PHE 70 8.241 -13.784 -0.357 499 HB2 PHE 70 2HB PHE 70 10.028 -15.267 -1.162 500 HB3 PHE 70 3HB PHE 70 10.041 -14.417 -2.704 501 HD1 PHE 70 HD1 PHE 70 11.171 -14.420 0.722 502 HD2 PHE 70 HD2 PHE 70 10.806 -12.057 -2.800 503 HE1 PHE 70 HE1 PHE 70 12.826 -12.835 1.618 504 HE2 PHE 70 HE2 PHE 70 12.461 -10.469 -1.910 505 HZ PHE 70 HZ PHE 70 13.474 -10.857 0.301 506 H ASN 71 H ASN 71 7.511 -13.424 -3.738 507 HA ASN 71 HA ASN 71 8.243 -10.663 -3.917 508 HB2 ASN 71 2HB ASN 71 7.980 -12.408 -5.825 509 HB3 ASN 71 3HB ASN 71 6.268 -11.999 -5.747 510 HD21 ASN 71 2HD2 ASN 71 6.666 -9.269 -7.794 511 HD22 ASN 71 1HD2 ASN 71 5.702 -10.578 -7.209 512 H THR 72 H THR 72 5.317 -12.441 -3.161 513 HA THR 72 HA THR 72 3.568 -10.186 -3.284 514 HB THR 72 HB THR 72 2.655 -12.419 -3.546 515 HG1 THR 72 HG1 THR 72 0.881 -11.834 -2.531 516 HG21 THR 72 3HG2 THR 72 4.254 -13.591 -2.069 517 HG22 THR 72 1HG2 THR 72 2.579 -14.016 -1.721 518 HG23 THR 72 2HG2 THR 72 3.441 -12.893 -0.669 519 H VAL 73 H VAL 73 5.357 -11.816 -0.714 520 HA VAL 73 HA VAL 73 4.219 -10.310 1.419 521 HB VAL 73 HB VAL 73 6.114 -11.175 2.765 522 HG11 VAL 73 1HG1 VAL 73 4.399 -12.976 1.114 523 HG12 VAL 73 2HG1 VAL 73 5.589 -13.676 2.214 524 HG13 VAL 73 3HG1 VAL 73 4.322 -12.619 2.840 525 HG21 VAL 73 3HG2 VAL 73 7.894 -11.188 1.182 526 HG22 VAL 73 1HG2 VAL 73 7.606 -12.862 1.655 527 HG23 VAL 73 2HG2 VAL 73 7.011 -12.269 0.104 528 H VAL 74 H VAL 74 7.178 -10.011 -0.499 529 HA VAL 74 HA VAL 74 8.259 -7.830 0.954 530 HB VAL 74 HB VAL 74 9.605 -9.282 -0.539 531 HG11 VAL 74 1HG1 VAL 74 7.954 -9.442 -2.365 532 HG12 VAL 74 2HG1 VAL 74 8.278 -7.757 -2.778 533 HG13 VAL 74 3HG1 VAL 74 9.553 -8.966 -2.936 534 HG21 VAL 74 3HG2 VAL 74 11.126 -7.651 -0.719 535 HG22 VAL 74 1HG2 VAL 74 10.099 -6.693 -1.785 536 HG23 VAL 74 2HG2 VAL 74 9.888 -6.596 -0.037 537 H ALA 75 H ALA 75 6.110 -8.071 -1.820 538 HA ALA 75 HA ALA 75 6.170 -5.430 -2.702 539 HB1 ALA 75 1HB ALA 75 3.927 -5.878 -3.633 540 HB2 ALA 75 2HB ALA 75 5.083 -7.164 -3.982 541 HB3 ALA 75 3HB ALA 75 3.874 -7.385 -2.717 542 H ARG 76 H ARG 76 4.305 -6.924 -0.102 543 HA ARG 76 HA ARG 76 2.815 -4.532 0.465 544 HB2 ARG 76 2HB ARG 76 3.028 -7.258 1.655 545 HB3 ARG 76 3HB ARG 76 2.386 -5.965 2.660 546 HG2 ARG 76 2HG ARG 76 0.636 -7.255 1.506 547 HG3 ARG 76 3HG ARG 76 0.623 -5.543 1.077 548 HD2 ARG 76 2HD ARG 76 1.843 -6.059 -0.984 549 HD3 ARG 76 3HD ARG 76 1.842 -7.769 -0.554 550 HE ARG 76 HE ARG 76 -0.802 -6.818 -0.572 551 HH11 ARG 76 1HH1 ARG 76 1.813 -7.530 -2.757 552 HH12 ARG 76 2HH1 ARG 76 0.771 -7.902 -4.090 553 HH21 ARG 76 2HH2 ARG 76 -1.503 -7.772 -3.841 554 HH22 ARG 76 1HH2 ARG 76 -2.185 -7.305 -2.320 555 H HIS 77 H HIS 77 5.785 -5.986 1.556 556 HA HIS 77 HA HIS 77 6.037 -4.353 3.906 557 HB2 HIS 77 2HB HIS 77 7.890 -6.223 2.447 558 HB3 HIS 77 3HB HIS 77 8.460 -5.230 3.785 559 HD1 HIS 77 HD1 HIS 77 6.373 -5.507 5.869 560 HD2 HIS 77 HD2 HIS 77 7.485 -8.693 3.445 561 HE1 HIS 77 HE1 HIS 77 5.713 -7.577 7.135 562 H VAL 78 H VAL 78 6.908 -4.093 0.557 563 HA VAL 78 HA VAL 78 8.991 -2.295 0.575 564 HB VAL 78 HB VAL 78 6.635 -2.448 -1.304 565 HG11 VAL 78 1HG1 VAL 78 8.766 -0.472 -1.127 566 HG12 VAL 78 2HG1 VAL 78 8.691 -1.268 -2.700 567 HG13 VAL 78 3HG1 VAL 78 7.269 -0.444 -2.059 568 HG21 VAL 78 3HG2 VAL 78 9.190 -3.178 -2.395 569 HG22 VAL 78 1HG2 VAL 78 8.870 -4.096 -0.923 570 HG23 VAL 78 2HG2 VAL 78 7.718 -4.140 -2.258 571 H ARG 79 H ARG 79 9.081 -0.615 1.949 572 HA ARG 79 HA ARG 79 7.245 1.580 1.542 573 HB2 ARG 79 2HB ARG 79 6.974 -0.199 3.803 574 HB3 ARG 79 3HB ARG 79 7.363 1.429 4.341 575 HG2 ARG 79 2HG ARG 79 5.407 1.776 2.394 576 HG3 ARG 79 3HG ARG 79 4.885 0.370 3.323 577 HD2 ARG 79 2HD ARG 79 5.740 2.130 5.262 578 HD3 ARG 79 3HD ARG 79 4.974 3.183 4.073 579 HE ARG 79 HE ARG 79 3.264 1.031 4.524 580 HH11 ARG 79 1HH1 ARG 79 4.585 3.738 6.269 581 HH12 ARG 79 2HH1 ARG 79 3.221 3.888 7.327 582 HH21 ARG 79 2HH2 ARG 79 1.447 2.453 7.124 583 HH22 ARG 79 1HH2 ARG 79 1.464 1.217 5.912 584 HA PRO 80 HA PRO 80 10.822 3.981 2.379 585 HB2 PRO 80 2HB PRO 80 9.729 6.236 3.423 586 HB3 PRO 80 3HB PRO 80 9.608 5.814 1.711 587 HG2 PRO 80 2HG PRO 80 7.598 5.444 3.899 588 HG3 PRO 80 3HG PRO 80 7.353 6.016 2.238 589 HD2 PRO 80 2HD PRO 80 6.802 3.477 3.001 590 HD3 PRO 80 3HD PRO 80 7.367 3.882 1.367 591 H SER 81 H SER 81 12.163 3.306 3.946 592 HA SER 81 HA SER 81 13.115 3.009 5.991 593 HB2 SER 81 2HB SER 81 11.252 5.048 7.167 594 HB3 SER 81 3HB SER 81 12.955 4.762 7.522 595 HG SER 81 HG SER 81 13.520 5.958 5.856 596 H ALA 82 H ALA 82 11.015 1.280 5.315 597 HA ALA 82 HA ALA 82 9.536 0.911 7.822 598 HB1 ALA 82 1HB ALA 82 9.079 0.077 5.006 599 HB2 ALA 82 2HB ALA 82 8.433 -0.939 6.296 600 HB3 ALA 82 3HB ALA 82 7.954 0.754 6.184 601 H SER 83 H SER 83 10.561 -0.308 9.267 602 HA SER 83 HA SER 83 12.380 -2.409 8.389 603 HB2 SER 83 2HB SER 83 12.647 -2.586 11.002 604 HB3 SER 83 3HB SER 83 13.388 -1.248 10.124 605 HG SER 83 HG SER 83 12.268 -0.031 11.411 606 H ILE 84 H ILE 84 12.100 -4.570 8.768 607 HA ILE 84 HA ILE 84 9.803 -5.502 10.280 608 HB ILE 84 HB ILE 84 8.902 -5.124 8.007 609 HG12 ILE 84 2HG1 ILE 84 8.303 -7.693 7.667 610 HG13 ILE 84 3HG1 ILE 84 9.070 -7.833 9.245 611 HG21 ILE 84 1HG2 ILE 84 11.298 -5.891 7.077 612 HG22 ILE 84 2HG2 ILE 84 10.409 -7.401 6.888 613 HG23 ILE 84 3HG2 ILE 84 9.826 -5.931 6.108 614 HD11 ILE 84 3HD1 ILE 84 7.501 -6.190 10.144 615 HD12 ILE 84 1HD1 ILE 84 6.726 -6.075 8.564 616 HD13 ILE 84 2HD1 ILE 84 6.673 -7.591 9.465 617 HA PRO 85 HA PRO 85 12.824 -8.592 11.239 618 HB2 PRO 85 2HB PRO 85 11.184 -10.241 12.641 619 HB3 PRO 85 3HB PRO 85 11.802 -8.719 13.293 620 HG2 PRO 85 2HG PRO 85 9.133 -9.313 12.075 621 HG3 PRO 85 3HG PRO 85 9.516 -8.359 13.520 622 HD2 PRO 85 2HD PRO 85 8.964 -7.219 11.127 623 HD3 PRO 85 3HD PRO 85 10.091 -6.495 12.291 624 H VAL 86 H VAL 86 13.446 -9.749 9.493 625 HA VAL 86 HA VAL 86 11.545 -11.455 8.098 626 HB VAL 86 HB VAL 86 13.223 -10.066 6.857 627 HG11 VAL 86 1HG1 VAL 86 15.338 -12.064 7.324 628 HG12 VAL 86 2HG1 VAL 86 15.455 -10.322 7.067 629 HG13 VAL 86 3HG1 VAL 86 15.024 -10.953 8.657 630 HG21 VAL 86 3HG2 VAL 86 12.109 -12.303 6.102 631 HG22 VAL 86 1HG2 VAL 86 13.404 -11.592 5.139 632 HG23 VAL 86 2HG2 VAL 86 13.749 -12.938 6.226 633 H VAL 87 H VAL 87 11.780 -13.694 7.858 634 HA VAL 87 HA VAL 87 13.388 -14.970 9.970 635 HB VAL 87 HB VAL 87 11.060 -15.396 10.330 636 HG11 VAL 87 1HG1 VAL 87 10.957 -15.440 7.466 637 HG12 VAL 87 2HG1 VAL 87 10.224 -16.908 8.115 638 HG13 VAL 87 3HG1 VAL 87 9.636 -15.326 8.628 639 HG21 VAL 87 3HG2 VAL 87 12.096 -17.889 9.007 640 HG22 VAL 87 1HG2 VAL 87 12.746 -17.285 10.530 641 HG23 VAL 87 2HG2 VAL 87 11.050 -17.752 10.419 642 H PHE 88 H PHE 88 15.158 -15.944 9.262 643 HA PHE 88 HA PHE 88 15.079 -17.268 6.631 644 HB2 PHE 88 2HB PHE 88 17.458 -16.719 6.355 645 HB3 PHE 88 3HB PHE 88 16.484 -15.263 6.534 646 HD1 PHE 88 HD1 PHE 88 19.276 -17.111 7.749 647 HD2 PHE 88 HD2 PHE 88 16.390 -14.177 8.838 648 HE1 PHE 88 HE1 PHE 88 20.724 -16.378 9.598 649 HE2 PHE 88 HE2 PHE 88 17.834 -13.439 10.688 650 HZ PHE 88 HZ PHE 88 20.004 -14.539 11.069 651 H SER 89 H SER 89 16.594 -19.079 6.399 652 HA SER 89 HA SER 89 17.210 -20.390 8.962 653 HB2 SER 89 2HB SER 89 15.402 -21.278 6.858 654 HB3 SER 89 3HB SER 89 16.659 -22.468 7.193 655 HG SER 89 HG SER 89 15.402 -22.978 8.802 656 H ARG 90 H ARG 90 19.017 -21.746 8.984 657 HA ARG 90 HA ARG 90 20.778 -21.490 6.635 658 HB2 ARG 90 2HB ARG 90 21.350 -20.300 8.899 659 HB3 ARG 90 3HB ARG 90 21.845 -21.911 9.402 660 HG2 ARG 90 2HG ARG 90 23.784 -21.678 8.367 661 HG3 ARG 90 3HG ARG 90 22.967 -21.345 6.838 662 HD2 ARG 90 2HD ARG 90 22.645 -18.970 7.772 663 HD3 ARG 90 3HD ARG 90 23.885 -19.417 8.944 664 HE ARG 90 HE ARG 90 24.810 -20.019 6.365 665 HH11 ARG 90 1HH1 ARG 90 24.061 -17.271 8.366 666 HH12 ARG 90 2HH1 ARG 90 25.206 -16.228 7.589 667 HH21 ARG 90 2HH2 ARG 90 26.491 -17.018 5.864 668 HH22 ARG 90 1HH2 ARG 90 26.322 -18.657 5.334 669 H ASP 91 H ASP 91 19.803 -23.487 5.873 670 HA ASP 91 HA ASP 91 19.853 -25.728 5.486 671 HB2 ASP 91 2HB ASP 91 22.162 -26.076 7.356 672 HB3 ASP 91 3HB ASP 91 21.863 -26.836 5.795 673 H GLY 92 H GLY 92 18.162 -24.800 7.532 674 HA2 GLY 92 2HA GLY 92 16.680 -26.184 8.802 675 HA3 GLY 92 3HA GLY 92 18.040 -27.227 9.189 676 H VAL 93 H VAL 93 18.781 -23.928 9.416 677 HA VAL 93 HA VAL 93 18.736 -24.117 12.340 678 HB VAL 93 HB VAL 93 20.183 -22.191 10.517 679 HG11 VAL 93 1HG1 VAL 93 19.713 -20.966 12.472 680 HG12 VAL 93 2HG1 VAL 93 20.024 -22.355 13.515 681 HG13 VAL 93 3HG1 VAL 93 21.360 -21.561 12.679 682 HG21 VAL 93 3HG2 VAL 93 22.056 -23.455 10.768 683 HG22 VAL 93 1HG2 VAL 93 21.593 -24.020 12.373 684 HG23 VAL 93 2HG2 VAL 93 20.857 -24.736 10.939 685 H VAL 94 H VAL 94 17.779 -22.567 13.639 686 HA VAL 94 HA VAL 94 15.756 -20.914 12.298 687 HB VAL 94 HB VAL 94 15.894 -21.639 15.225 688 HG11 VAL 94 1HG1 VAL 94 13.714 -20.453 13.513 689 HG12 VAL 94 2HG1 VAL 94 13.498 -20.997 15.178 690 HG13 VAL 94 3HG1 VAL 94 14.589 -19.658 14.821 691 HG21 VAL 94 3HG2 VAL 94 15.649 -23.680 13.986 692 HG22 VAL 94 1HG2 VAL 94 14.083 -23.259 14.680 693 HG23 VAL 94 2HG2 VAL 94 14.397 -22.967 12.969 694 H MET 95 H MET 95 16.335 -18.870 11.987 695 HA MET 95 HA MET 95 17.490 -17.378 14.216 696 HB2 MET 95 2HB MET 95 19.298 -18.231 12.585 697 HB3 MET 95 3HB MET 95 18.647 -17.048 11.459 698 HG2 MET 95 2HG MET 95 20.491 -16.038 12.529 699 HG3 MET 95 3HG MET 95 19.041 -15.302 13.206 700 HE1 MET 95 3HE MET 95 21.611 -18.051 13.523 701 HE2 MET 95 1HE MET 95 22.502 -16.755 14.321 702 HE3 MET 95 2HE MET 95 21.965 -18.156 15.248 703 H SER 96 H SER 96 17.108 -15.130 14.133 704 HA SER 96 HA SER 96 15.388 -14.156 11.974 705 HB2 SER 96 2HB SER 96 13.771 -13.222 13.552 706 HB3 SER 96 3HB SER 96 13.886 -14.969 13.765 707 HG SER 96 HG SER 96 14.290 -14.513 15.769 708 H ALA 97 H ALA 97 15.870 -12.139 11.364 709 HA ALA 97 HA ALA 97 17.250 -10.357 13.232 710 HB1 ALA 97 1HB ALA 97 19.012 -9.837 11.720 711 HB2 ALA 97 2HB ALA 97 18.946 -11.594 11.858 712 HB3 ALA 97 3HB ALA 97 18.277 -10.796 10.436 713 H THR 98 H THR 98 16.773 -8.222 12.975 714 HA THR 98 HA THR 98 14.552 -7.591 11.233 715 HB THR 98 HB THR 98 16.025 -5.708 13.080 716 HG1 THR 98 HG1 THR 98 13.662 -7.165 13.693 717 HG21 THR 98 3HG2 THR 98 13.124 -5.496 12.498 718 HG22 THR 98 1HG2 THR 98 14.237 -5.046 11.208 719 HG23 THR 98 2HG2 THR 98 14.319 -4.229 12.769 720 H ILE 99 H ILE 99 14.736 -6.749 9.269 721 HA ILE 99 HA ILE 99 17.257 -5.403 8.549 722 HB ILE 99 HB ILE 99 16.822 -6.050 6.224 723 HG12 ILE 99 2HG1 ILE 99 14.979 -8.088 6.317 724 HG13 ILE 99 3HG1 ILE 99 14.262 -6.890 7.389 725 HG21 ILE 99 1HG2 ILE 99 17.597 -7.736 8.342 726 HG22 ILE 99 2HG2 ILE 99 16.627 -8.713 7.240 727 HG23 ILE 99 3HG2 ILE 99 18.045 -7.853 6.640 728 HD11 ILE 99 3HD1 ILE 99 15.034 -5.388 5.231 729 HD12 ILE 99 1HD1 ILE 99 14.509 -6.901 4.495 730 HD13 ILE 99 2HD1 ILE 99 13.410 -6.000 5.540 731 H VAL 100 H VAL 100 17.146 -3.324 8.021 732 HA VAL 100 HA VAL 100 14.542 -2.049 7.800 733 HB VAL 100 HB VAL 100 17.296 -0.806 7.807 734 HG11 VAL 100 1HG1 VAL 100 14.526 0.347 7.865 735 HG12 VAL 100 2HG1 VAL 100 15.915 1.236 8.493 736 HG13 VAL 100 3HG1 VAL 100 15.870 0.752 6.797 737 HG21 VAL 100 3HG2 VAL 100 15.707 -1.917 9.922 738 HG22 VAL 100 1HG2 VAL 100 17.318 -1.203 9.993 739 HG23 VAL 100 2HG2 VAL 100 15.892 -0.179 10.156 740 H VAL 101 H VAL 101 13.600 -1.912 5.879 741 HA VAL 101 HA VAL 101 15.205 -1.943 3.447 742 HB VAL 101 HB VAL 101 12.195 -1.903 3.672 743 HG11 VAL 101 1HG1 VAL 101 12.198 -1.863 1.453 744 HG12 VAL 101 2HG1 VAL 101 13.954 -1.688 1.477 745 HG13 VAL 101 3HG1 VAL 101 13.227 -3.294 1.402 746 HG21 VAL 101 3HG2 VAL 101 12.583 -3.885 4.730 747 HG22 VAL 101 1HG2 VAL 101 12.677 -4.439 3.058 748 HG23 VAL 101 2HG2 VAL 101 14.155 -4.115 3.964 749 H GLY 102 H GLY 102 15.568 -0.219 2.186 750 HA2 GLY 102 2HA GLY 102 14.110 2.270 2.835 751 HA3 GLY 102 3HA GLY 102 15.813 2.237 2.404 752 H GLU 103 H GLU 103 12.698 2.688 1.264 753 HA GLU 103 HA GLU 103 13.210 1.862 -1.462 754 HB2 GLU 103 2HB GLU 103 10.895 3.079 -0.008 755 HB3 GLU 103 3HB GLU 103 10.951 3.171 -1.762 756 HG2 GLU 103 2HG GLU 103 9.717 1.208 -0.597 757 HG3 GLU 103 3HG GLU 103 10.698 0.909 -2.031 758 H LEU 104 H LEU 104 13.394 4.755 0.448 759 HA LEU 104 HA LEU 104 14.310 6.219 -1.935 760 HB2 LEU 104 2HB LEU 104 12.527 7.212 0.278 761 HB3 LEU 104 3HB LEU 104 13.356 8.282 -0.851 762 HG LEU 104 HG LEU 104 11.150 8.096 -1.644 763 HD11 LEU 104 1HD1 LEU 104 13.259 7.372 -3.187 764 HD12 LEU 104 2HD1 LEU 104 11.620 7.623 -3.786 765 HD13 LEU 104 3HD1 LEU 104 12.181 5.994 -3.412 766 HD21 LEU 104 3HD2 LEU 104 10.917 5.845 -0.248 767 HD22 LEU 104 1HD2 LEU 104 11.152 5.138 -1.846 768 HD23 LEU 104 2HD2 LEU 104 9.817 6.256 -1.565 769 H GLU 105 H GLU 105 16.472 5.968 -1.485 770 HA GLU 105 HA GLU 105 18.494 6.431 -0.551 771 HB2 GLU 105 2HB GLU 105 17.100 8.747 -0.390 772 HB3 GLU 105 3HB GLU 105 17.442 8.471 1.312 773 HG2 GLU 105 2HG GLU 105 19.869 8.152 0.591 774 HG3 GLU 105 3HG GLU 105 19.374 8.865 -0.943
Contact the webmaster for help, if required. Thursday, May 23, 2024 7:11:54 AM GMT (wattos1)