NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26083 | 2keo | 16155 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLU 21 H GLU 21 3.362 -2.821 0.338 2 HA GLU 21 HA GLU 21 5.548 -1.315 -0.939 3 HB2 GLU 21 HB2 GLU 21 6.625 -1.159 1.261 4 HB3 GLU 21 HB3 GLU 21 5.048 -0.392 1.311 5 HG2 GLU 21 HG2 GLU 21 5.705 -3.147 2.408 6 HG3 GLU 21 HG3 GLU 21 5.578 -1.672 3.364 7 H LYS 22 H LYS 22 4.434 -4.279 0.660 8 HA LYS 22 HA LYS 22 6.555 -5.811 -0.715 9 HB2 LYS 22 HB2 LYS 22 6.496 -7.398 1.318 10 HB3 LYS 22 HB3 LYS 22 7.293 -5.853 1.543 11 HG2 LYS 22 HG2 LYS 22 6.095 -6.114 3.525 12 HG3 LYS 22 HG3 LYS 22 5.082 -5.035 2.579 13 HD2 LYS 22 HD2 LYS 22 3.669 -6.639 3.688 14 HD3 LYS 22 HD3 LYS 22 3.646 -6.997 1.962 15 HE2 LYS 22 HE2 LYS 22 5.198 -8.850 2.294 16 HE3 LYS 22 HE3 LYS 22 5.363 -8.445 4.004 17 HZ1 LYS 22 HZ1 LYS 22 3.864 -10.271 3.707 18 HZ2 LYS 22 HZ2 LYS 22 2.892 -9.375 2.656 19 HZ3 LYS 22 HZ3 LYS 22 3.003 -8.937 4.283 20 H VAL 23 H VAL 23 5.956 -7.924 -1.370 21 HA VAL 23 HA VAL 23 3.097 -8.182 -1.937 22 HB VAL 23 HB VAL 23 4.615 -8.268 -3.869 23 HG11 VAL 23 HG11 VAL 23 6.634 -9.240 -2.866 24 HG12 VAL 23 HG12 VAL 23 6.153 -10.144 -4.302 25 HG13 VAL 23 HG13 VAL 23 5.820 -10.797 -2.696 26 HG21 VAL 23 HG21 VAL 23 2.484 -9.458 -4.007 27 HG22 VAL 23 HG22 VAL 23 3.226 -10.920 -3.356 28 HG23 VAL 23 HG23 VAL 23 3.714 -10.313 -4.939 29 H THR 24 H THR 24 1.973 -9.265 -0.466 30 HA THR 24 HA THR 24 2.945 -11.334 1.249 31 HB THR 24 HB THR 24 0.084 -10.575 0.490 32 HG1 THR 24 HG1 THR 24 0.374 -9.602 2.754 33 HG21 THR 24 HG21 THR 24 0.153 -12.833 1.501 34 HG22 THR 24 HG22 THR 24 -0.594 -11.678 2.602 35 HG23 THR 24 HG23 THR 24 1.069 -12.203 2.875 36 H LEU 25 H LEU 25 3.615 -13.246 0.382 37 HA LEU 25 HA LEU 25 2.311 -14.350 -2.012 38 HB2 LEU 25 HB2 LEU 25 4.948 -15.055 -0.674 39 HB3 LEU 25 HB3 LEU 25 4.311 -15.867 -2.100 40 HG LEU 25 HG LEU 25 5.117 -12.932 -1.934 41 HD11 LEU 25 HD11 LEU 25 7.057 -14.417 -1.951 42 HD12 LEU 25 HD12 LEU 25 6.928 -13.538 -3.472 43 HD13 LEU 25 HD13 LEU 25 6.445 -15.235 -3.392 44 HD21 LEU 25 HD21 LEU 25 4.693 -12.855 -4.364 45 HD22 LEU 25 HD22 LEU 25 3.221 -13.200 -3.462 46 HD23 LEU 25 HD23 LEU 25 4.059 -14.501 -4.314 47 H VAL 26 H VAL 26 0.673 -15.571 -1.576 48 HA VAL 26 HA VAL 26 0.524 -17.330 0.767 49 HB VAL 26 HB VAL 26 -1.590 -16.681 -1.346 50 HG11 VAL 26 HG11 VAL 26 -1.903 -18.126 1.310 51 HG12 VAL 26 HG12 VAL 26 -2.020 -18.859 -0.291 52 HG13 VAL 26 HG13 VAL 26 -3.222 -17.675 0.228 53 HG21 VAL 26 HG21 VAL 26 -1.029 -14.663 -0.054 54 HG22 VAL 26 HG22 VAL 26 -1.287 -15.534 1.459 55 HG23 VAL 26 HG23 VAL 26 -2.646 -15.233 0.373 56 H ARG 27 H ARG 27 0.745 -19.481 0.588 57 HA ARG 27 HA ARG 27 1.271 -20.697 -2.055 58 HB2 ARG 27 HB2 ARG 27 1.892 -21.845 0.708 59 HB3 ARG 27 HB3 ARG 27 2.457 -22.455 -0.848 60 HG2 ARG 27 HG2 ARG 27 3.228 -19.810 0.417 61 HG3 ARG 27 HG3 ARG 27 4.229 -21.266 0.352 62 HD2 ARG 27 HD2 ARG 27 4.374 -21.125 -2.061 63 HD3 ARG 27 HD3 ARG 27 3.213 -19.789 -2.100 64 HE ARG 27 HE ARG 27 5.347 -19.026 -0.457 65 HH11 ARG 27 HH11 ARG 27 4.762 -19.688 -3.851 66 HH12 ARG 27 HH12 ARG 27 6.039 -18.645 -4.398 67 HH21 ARG 27 HH21 ARG 27 6.988 -17.629 -1.178 68 HH22 ARG 27 HH22 ARG 27 7.313 -17.486 -2.880 69 H ILE 28 H ILE 28 0.564 -23.045 -2.185 70 HA ILE 28 HA ILE 28 -2.203 -23.378 -1.854 71 HB ILE 28 HB ILE 28 -1.061 -24.635 -3.565 72 HG12 ILE 28 HG12 ILE 28 -2.133 -26.620 -1.500 73 HG13 ILE 28 HG13 ILE 28 -3.119 -25.682 -2.615 74 HG21 ILE 28 HG21 ILE 28 0.538 -26.468 -3.131 75 HG22 ILE 28 HG22 ILE 28 0.503 -26.086 -1.409 76 HG23 ILE 28 HG23 ILE 28 1.142 -24.909 -2.561 77 HD11 ILE 28 HD11 ILE 28 -2.092 -26.850 -4.501 78 HD12 ILE 28 HD12 ILE 28 -2.865 -27.964 -3.376 79 HD13 ILE 28 HD13 ILE 28 -1.109 -27.796 -3.381 80 H ALA 29 H ALA 29 0.513 -24.289 0.215 81 HA ALA 29 HA ALA 29 -0.772 -25.896 2.121 82 HB1 ALA 29 HB1 ALA 29 1.065 -25.276 3.660 83 HB2 ALA 29 HB2 ALA 29 1.535 -23.962 2.580 84 HB3 ALA 29 HB3 ALA 29 1.684 -25.636 2.046 85 H ASP 30 H ASP 30 -0.289 -22.351 2.103 86 HA ASP 30 HA ASP 30 -1.626 -21.692 4.491 87 HB2 ASP 30 HB2 ASP 30 -1.383 -19.989 1.971 88 HB3 ASP 30 HB3 ASP 30 -1.801 -19.389 3.579 89 H LEU 31 H LEU 31 -2.777 -21.962 1.173 90 HA LEU 31 HA LEU 31 -5.382 -20.986 1.434 91 HB2 LEU 31 HB2 LEU 31 -4.165 -21.420 -0.708 92 HB3 LEU 31 HB3 LEU 31 -4.326 -23.145 -0.438 93 HG LEU 31 HG LEU 31 -6.822 -22.916 -0.645 94 HD11 LEU 31 HD11 LEU 31 -7.083 -20.586 0.033 95 HD12 LEU 31 HD12 LEU 31 -7.775 -20.841 -1.566 96 HD13 LEU 31 HD13 LEU 31 -6.209 -20.044 -1.403 97 HD21 LEU 31 HD21 LEU 31 -6.858 -22.614 -3.090 98 HD22 LEU 31 HD22 LEU 31 -5.475 -23.588 -2.596 99 HD23 LEU 31 HD23 LEU 31 -5.247 -21.893 -3.037 100 H GLU 32 H GLU 32 -4.147 -24.305 1.788 101 HA GLU 32 HA GLU 32 -6.683 -25.544 2.250 102 HB2 GLU 32 HB2 GLU 32 -3.880 -26.603 2.811 103 HB3 GLU 32 HB3 GLU 32 -5.354 -27.570 2.787 104 HG2 GLU 32 HG2 GLU 32 -4.085 -26.136 0.432 105 HG3 GLU 32 HG3 GLU 32 -4.102 -27.873 0.720 106 H ASN 33 H ASN 33 -3.963 -24.723 4.445 107 HA ASN 33 HA ASN 33 -5.211 -25.893 6.742 108 HB2 ASN 33 HB2 ASN 33 -2.716 -24.169 6.465 109 HB3 ASN 33 HB3 ASN 33 -3.283 -24.767 8.016 110 HD21 ASN 33 HD21 ASN 33 -1.661 -25.607 5.078 111 HD22 ASN 33 HD22 ASN 33 -1.286 -27.232 5.497 112 H HIS 34 H HIS 34 -5.187 -22.623 5.419 113 HA HIS 34 HA HIS 34 -6.164 -21.348 7.804 114 HB2 HIS 34 HB2 HIS 34 -4.921 -20.170 5.872 115 HB3 HIS 34 HB3 HIS 34 -6.450 -20.194 5.002 116 HD1 HIS 34 HD1 HIS 34 -4.549 -18.322 7.510 117 HD2 HIS 34 HD2 HIS 34 -8.528 -18.604 6.353 118 HE1 HIS 34 HE1 HIS 34 -5.679 -16.288 8.453 119 HE2 HIS 34 HE2 HIS 34 -8.113 -16.602 7.925 120 H ASN 35 H ASN 35 -7.660 -22.949 5.066 121 HA ASN 35 HA ASN 35 -10.349 -22.192 5.464 122 HB2 ASN 35 HB2 ASN 35 -9.573 -23.448 3.473 123 HB3 ASN 35 HB3 ASN 35 -9.240 -24.856 4.477 124 HD21 ASN 35 HD21 ASN 35 -10.683 -26.223 3.458 125 HD22 ASN 35 HD22 ASN 35 -12.397 -26.020 3.510 126 H ASN 36 H ASN 36 -8.358 -24.717 6.968 127 HA ASN 36 HA ASN 36 -10.347 -25.834 8.685 128 HB2 ASN 36 HB2 ASN 36 -8.300 -27.078 8.143 129 HB3 ASN 36 HB3 ASN 36 -7.304 -25.836 8.892 130 HD21 ASN 36 HD21 ASN 36 -9.605 -28.425 9.503 131 HD22 ASN 36 HD22 ASN 36 -9.206 -28.634 11.172 132 H ASP 37 H ASP 37 -8.094 -23.139 8.979 133 HA ASP 37 HA ASP 37 -8.484 -22.479 11.716 134 HB2 ASP 37 HB2 ASP 37 -6.573 -21.565 10.629 135 HB3 ASP 37 HB3 ASP 37 -7.514 -20.958 9.281 136 H GLY 38 H GLY 38 -10.519 -22.061 8.951 137 HA2 GLY 38 HA2 GLY 38 -12.898 -21.774 9.384 138 HA3 GLY 38 HA3 GLY 38 -12.505 -20.570 10.603 139 H GLY 39 H GLY 39 -10.451 -20.155 8.025 140 HA2 GLY 39 HA2 GLY 39 -12.156 -18.072 6.763 141 HA3 GLY 39 HA3 GLY 39 -10.403 -18.018 6.890 142 H PHE 40 H PHE 40 -13.112 -19.342 5.145 143 HA PHE 40 HA PHE 40 -11.561 -21.008 3.385 144 HB2 PHE 40 HB2 PHE 40 -13.966 -21.502 3.743 145 HB3 PHE 40 HB3 PHE 40 -14.404 -19.948 3.041 146 HD1 PHE 40 HD1 PHE 40 -12.737 -23.204 2.229 147 HD2 PHE 40 HD2 PHE 40 -14.719 -19.755 0.661 148 HE1 PHE 40 HE1 PHE 40 -12.801 -24.246 -0.001 149 HE2 PHE 40 HE2 PHE 40 -14.788 -20.812 -1.558 150 HZ PHE 40 HZ PHE 40 -13.829 -23.054 -1.893 151 H TRP 41 H TRP 41 -10.244 -20.220 1.929 152 HA TRP 41 HA TRP 41 -10.616 -17.549 0.724 153 HB2 TRP 41 HB2 TRP 41 -8.170 -19.329 1.098 154 HB3 TRP 41 HB3 TRP 41 -8.152 -17.901 0.074 155 HD1 TRP 41 HD1 TRP 41 -10.120 -16.587 2.720 156 HE1 TRP 41 HE1 TRP 41 -8.694 -15.414 4.504 157 HE3 TRP 41 HE3 TRP 41 -5.557 -18.634 1.604 158 HZ2 TRP 41 HZ2 TRP 41 -6.018 -15.351 5.330 159 HZ3 TRP 41 HZ3 TRP 41 -3.610 -17.964 2.957 160 HH2 TRP 41 HH2 TRP 41 -3.843 -16.354 4.785 161 H THR 42 H THR 42 -9.542 -17.537 -1.579 162 HA THR 42 HA THR 42 -9.599 -20.008 -3.089 163 HB THR 42 HB THR 42 -11.998 -19.212 -3.266 164 HG1 THR 42 HG1 THR 42 -11.751 -19.044 -5.776 165 HG21 THR 42 HG21 THR 42 -10.814 -16.856 -4.793 166 HG22 THR 42 HG22 THR 42 -11.581 -16.763 -3.205 167 HG23 THR 42 HG23 THR 42 -12.531 -17.235 -4.612 168 H VAL 43 H VAL 43 -8.648 -19.710 -5.229 169 HA VAL 43 HA VAL 43 -6.828 -17.380 -5.406 170 HB VAL 43 HB VAL 43 -6.545 -20.160 -6.649 171 HG11 VAL 43 HG11 VAL 43 -4.621 -17.795 -6.710 172 HG12 VAL 43 HG12 VAL 43 -5.525 -18.434 -8.085 173 HG13 VAL 43 HG13 VAL 43 -4.272 -19.414 -7.324 174 HG21 VAL 43 HG21 VAL 43 -6.215 -20.195 -4.209 175 HG22 VAL 43 HG22 VAL 43 -5.032 -18.890 -4.333 176 HG23 VAL 43 HG23 VAL 43 -4.684 -20.466 -5.046 177 H ILE 44 H ILE 44 -7.673 -15.899 -6.741 178 HA ILE 44 HA ILE 44 -8.441 -16.654 -9.485 179 HB ILE 44 HB ILE 44 -10.088 -14.733 -7.755 180 HG12 ILE 44 HG12 ILE 44 -10.821 -17.449 -8.939 181 HG13 ILE 44 HG13 ILE 44 -10.646 -17.069 -7.233 182 HG21 ILE 44 HG21 ILE 44 -11.559 -14.451 -9.731 183 HG22 ILE 44 HG22 ILE 44 -10.463 -15.443 -10.695 184 HG23 ILE 44 HG23 ILE 44 -9.919 -13.888 -10.059 185 HD11 ILE 44 HD11 ILE 44 -12.823 -16.208 -9.110 186 HD12 ILE 44 HD12 ILE 44 -12.611 -15.513 -7.512 187 HD13 ILE 44 HD13 ILE 44 -12.945 -17.230 -7.683 188 H ASP 45 H ASP 45 -7.521 -15.317 -10.964 189 HA ASP 45 HA ASP 45 -6.372 -13.655 -11.990 190 HB2 ASP 45 HB2 ASP 45 -8.290 -12.269 -11.201 191 HB3 ASP 45 HB3 ASP 45 -7.444 -11.943 -9.696 192 H GLY 46 H GLY 46 -5.031 -15.373 -10.134 193 HA2 GLY 46 HA2 GLY 46 -2.948 -15.727 -9.242 194 HA3 GLY 46 HA3 GLY 46 -2.466 -14.183 -9.927 195 H LYS 47 H LYS 47 -5.155 -14.272 -7.785 196 HA LYS 47 HA LYS 47 -3.606 -13.194 -5.503 197 HB2 LYS 47 HB2 LYS 47 -6.229 -12.154 -6.671 198 HB3 LYS 47 HB3 LYS 47 -5.564 -11.628 -5.128 199 HG2 LYS 47 HG2 LYS 47 -4.120 -11.295 -7.775 200 HG3 LYS 47 HG3 LYS 47 -5.194 -10.070 -7.089 201 HD2 LYS 47 HD2 LYS 47 -3.758 -9.866 -5.117 202 HD3 LYS 47 HD3 LYS 47 -2.707 -11.156 -5.711 203 HE2 LYS 47 HE2 LYS 47 -1.754 -8.897 -6.097 204 HE3 LYS 47 HE3 LYS 47 -2.022 -9.770 -7.606 205 HZ1 LYS 47 HZ1 LYS 47 -4.048 -8.521 -7.943 206 HZ2 LYS 47 HZ2 LYS 47 -2.744 -7.466 -7.745 207 HZ3 LYS 47 HZ3 LYS 47 -3.836 -7.701 -6.478 208 H VAL 48 H VAL 48 -4.836 -13.346 -3.472 209 HA VAL 48 HA VAL 48 -6.710 -15.627 -3.379 210 HB VAL 48 HB VAL 48 -4.623 -14.844 -1.294 211 HG11 VAL 48 HG11 VAL 48 -5.318 -16.879 -0.074 212 HG12 VAL 48 HG12 VAL 48 -6.610 -17.141 -1.246 213 HG13 VAL 48 HG13 VAL 48 -6.643 -15.719 -0.202 214 HG21 VAL 48 HG21 VAL 48 -3.603 -15.935 -3.237 215 HG22 VAL 48 HG22 VAL 48 -4.756 -17.266 -3.123 216 HG23 VAL 48 HG23 VAL 48 -3.569 -17.018 -1.845 217 H TYR 49 H TYR 49 -8.659 -15.041 -2.759 218 HA TYR 49 HA TYR 49 -9.061 -12.568 -1.171 219 HB2 TYR 49 HB2 TYR 49 -10.979 -13.910 -3.129 220 HB3 TYR 49 HB3 TYR 49 -11.316 -12.452 -2.201 221 HD1 TYR 49 HD1 TYR 49 -9.285 -13.838 -4.992 222 HD2 TYR 49 HD2 TYR 49 -10.500 -10.280 -2.951 223 HE1 TYR 49 HE1 TYR 49 -8.363 -12.472 -6.814 224 HE2 TYR 49 HE2 TYR 49 -9.577 -8.921 -4.782 225 HH TYR 49 HH TYR 49 -8.684 -10.227 -7.780 226 H ASP 50 H ASP 50 -10.574 -12.612 0.499 227 HA ASP 50 HA ASP 50 -10.932 -15.194 1.801 228 HB2 ASP 50 HB2 ASP 50 -10.138 -12.990 2.945 229 HB3 ASP 50 HB3 ASP 50 -11.824 -12.498 2.908 230 H ILE 51 H ILE 51 -12.582 -16.297 0.905 231 HA ILE 51 HA ILE 51 -14.997 -15.067 -0.084 232 HB ILE 51 HB ILE 51 -14.129 -17.971 0.173 233 HG12 ILE 51 HG12 ILE 51 -12.989 -16.633 -1.570 234 HG13 ILE 51 HG13 ILE 51 -13.992 -17.887 -2.292 235 HG21 ILE 51 HG21 ILE 51 -16.752 -16.996 -1.019 236 HG22 ILE 51 HG22 ILE 51 -16.560 -18.005 0.415 237 HG23 ILE 51 HG23 ILE 51 -16.115 -18.636 -1.169 238 HD11 ILE 51 HD11 ILE 51 -14.701 -14.960 -2.072 239 HD12 ILE 51 HD12 ILE 51 -15.715 -16.217 -2.791 240 HD13 ILE 51 HD13 ILE 51 -14.162 -15.814 -3.516 241 H LYS 52 H LYS 52 -14.031 -16.617 2.911 242 HA LYS 52 HA LYS 52 -16.576 -17.319 3.926 243 HB2 LYS 52 HB2 LYS 52 -14.222 -17.980 4.799 244 HB3 LYS 52 HB3 LYS 52 -14.216 -16.447 5.648 245 HG2 LYS 52 HG2 LYS 52 -16.307 -18.616 6.053 246 HG3 LYS 52 HG3 LYS 52 -14.846 -18.472 7.024 247 HD2 LYS 52 HD2 LYS 52 -17.086 -16.421 6.847 248 HD3 LYS 52 HD3 LYS 52 -16.799 -17.531 8.187 249 HE2 LYS 52 HE2 LYS 52 -14.959 -15.281 7.291 250 HE3 LYS 52 HE3 LYS 52 -15.978 -15.287 8.732 251 HZ1 LYS 52 HZ1 LYS 52 -14.689 -17.117 9.606 252 HZ2 LYS 52 HZ2 LYS 52 -13.676 -15.817 9.244 253 HZ3 LYS 52 HZ3 LYS 52 -13.727 -17.156 8.217 254 H ASP 53 H ASP 53 -14.604 -14.375 4.301 255 HA ASP 53 HA ASP 53 -16.591 -12.933 5.792 256 HB2 ASP 53 HB2 ASP 53 -14.125 -12.452 5.963 257 HB3 ASP 53 HB3 ASP 53 -14.162 -11.823 4.320 258 H PHE 54 H PHE 54 -15.631 -13.146 2.387 259 HA PHE 54 HA PHE 54 -17.005 -11.052 1.202 260 HB2 PHE 54 HB2 PHE 54 -15.449 -12.546 -0.013 261 HB3 PHE 54 HB3 PHE 54 -16.588 -13.873 0.125 262 HD1 PHE 54 HD1 PHE 54 -18.714 -13.847 -1.229 263 HD2 PHE 54 HD2 PHE 54 -15.673 -10.887 -1.747 264 HE1 PHE 54 HE1 PHE 54 -19.699 -13.206 -3.387 265 HE2 PHE 54 HE2 PHE 54 -16.666 -10.263 -3.906 266 HZ PHE 54 HZ PHE 54 -18.675 -11.414 -4.725 267 H GLN 55 H GLN 55 -18.203 -14.340 1.797 268 HA GLN 55 HA GLN 55 -20.806 -13.909 0.760 269 HB2 GLN 55 HB2 GLN 55 -21.346 -16.127 1.660 270 HB3 GLN 55 HB3 GLN 55 -19.812 -16.125 0.796 271 HG2 GLN 55 HG2 GLN 55 -18.648 -15.969 3.021 272 HG3 GLN 55 HG3 GLN 55 -20.216 -16.193 3.793 273 HE21 GLN 55 HE21 GLN 55 -17.704 -17.707 1.895 274 HE22 GLN 55 HE22 GLN 55 -18.217 -19.338 2.146 275 H THR 56 H THR 56 -19.404 -13.470 3.963 276 HA THR 56 HA THR 56 -21.792 -13.243 5.473 277 HB THR 56 HB THR 56 -19.164 -11.776 5.980 278 HG1 THR 56 HG1 THR 56 -19.623 -14.398 5.918 279 HG21 THR 56 HG21 THR 56 -21.007 -10.985 7.433 280 HG22 THR 56 HG22 THR 56 -19.812 -11.884 8.364 281 HG23 THR 56 HG23 THR 56 -21.342 -12.648 7.930 282 H GLN 57 H GLN 57 -19.897 -10.875 3.607 283 HA GLN 57 HA GLN 57 -21.528 -8.590 4.187 284 HB2 GLN 57 HB2 GLN 57 -19.714 -8.921 1.766 285 HB3 GLN 57 HB3 GLN 57 -20.187 -7.427 2.555 286 HG2 GLN 57 HG2 GLN 57 -18.286 -9.532 3.605 287 HG3 GLN 57 HG3 GLN 57 -17.880 -7.912 3.056 288 HE21 GLN 57 HE21 GLN 57 -17.458 -9.328 5.636 289 HE22 GLN 57 HE22 GLN 57 -18.110 -8.269 6.838 290 H SER 58 H SER 58 -21.498 -11.104 1.757 291 HA SER 58 HA SER 58 -23.367 -9.994 -0.077 292 HB2 SER 58 HB2 SER 58 -21.781 -11.764 -0.693 293 HB3 SER 58 HB3 SER 58 -22.562 -12.887 0.420 294 HG SER 58 HG SER 58 -24.028 -11.652 -1.648 295 H LEU 59 H LEU 59 -23.691 -11.771 2.916 296 HA LEU 59 HA LEU 59 -26.536 -12.286 2.664 297 HB2 LEU 59 HB2 LEU 59 -24.656 -12.488 5.043 298 HB3 LEU 59 HB3 LEU 59 -26.339 -12.993 5.079 299 HG LEU 59 HG LEU 59 -24.167 -14.221 3.339 300 HD11 LEU 59 HD11 LEU 59 -24.357 -16.198 4.775 301 HD12 LEU 59 HD12 LEU 59 -25.503 -15.345 5.811 302 HD13 LEU 59 HD13 LEU 59 -23.838 -14.779 5.683 303 HD21 LEU 59 HD21 LEU 59 -27.064 -15.069 3.652 304 HD22 LEU 59 HD22 LEU 59 -25.820 -15.938 2.747 305 HD23 LEU 59 HD23 LEU 59 -26.336 -14.340 2.218 306 H THR 60 H THR 60 -24.658 -9.567 3.493 307 HA THR 60 HA THR 60 -26.613 -8.354 5.313 308 HB THR 60 HB THR 60 -23.974 -7.268 4.239 309 HG1 THR 60 HG1 THR 60 -23.982 -9.217 5.672 310 HG21 THR 60 HG21 THR 60 -25.447 -5.443 4.992 311 HG22 THR 60 HG22 THR 60 -24.103 -5.648 6.115 312 HG23 THR 60 HG23 THR 60 -25.699 -6.264 6.537 313 H GLU 61 H GLU 61 -28.232 -7.112 4.549 314 HA GLU 61 HA GLU 61 -28.630 -6.333 1.854 315 HB2 GLU 61 HB2 GLU 61 -30.494 -6.648 3.474 316 HB3 GLU 61 HB3 GLU 61 -29.934 -5.275 4.416 317 HG2 GLU 61 HG2 GLU 61 -31.904 -4.711 3.067 318 HG3 GLU 61 HG3 GLU 61 -30.509 -3.745 2.588 319 H ASN 62 H ASN 62 -28.518 -4.297 0.890 320 HA ASN 62 HA ASN 62 -27.792 -2.256 0.321 321 HB2 ASN 62 HB2 ASN 62 -27.141 -1.808 3.259 322 HB3 ASN 62 HB3 ASN 62 -27.063 -0.567 2.013 323 HD21 ASN 62 HD21 ASN 62 -28.685 -0.659 4.435 324 HD22 ASN 62 HD22 ASN 62 -30.327 -0.521 3.919 325 H SER 63 H SER 63 -25.791 -4.647 1.446 326 HA SER 63 HA SER 63 -23.247 -3.386 0.867 327 HB2 SER 63 HB2 SER 63 -23.994 -6.330 1.204 328 HB3 SER 63 HB3 SER 63 -22.348 -5.709 1.102 329 HG SER 63 HG SER 63 -24.174 -4.801 3.065 330 H ILE 64 H ILE 64 -22.000 -3.833 -0.994 331 HA ILE 64 HA ILE 64 -23.333 -3.768 -3.468 332 HB ILE 64 HB ILE 64 -21.067 -4.002 -4.486 333 HG12 ILE 64 HG12 ILE 64 -20.014 -4.293 -1.634 334 HG13 ILE 64 HG13 ILE 64 -20.206 -5.649 -2.734 335 HG21 ILE 64 HG21 ILE 64 -21.827 -1.787 -3.774 336 HG22 ILE 64 HG22 ILE 64 -20.083 -1.946 -3.564 337 HG23 ILE 64 HG23 ILE 64 -21.153 -2.055 -2.163 338 HD11 ILE 64 HD11 ILE 64 -18.374 -3.297 -3.121 339 HD12 ILE 64 HD12 ILE 64 -18.578 -4.641 -4.249 340 HD13 ILE 64 HD13 ILE 64 -17.925 -4.932 -2.640 341 H LEU 65 H LEU 65 -22.371 -6.466 -1.549 342 HA LEU 65 HA LEU 65 -22.274 -8.369 -3.779 343 HB2 LEU 65 HB2 LEU 65 -21.819 -8.843 -0.813 344 HB3 LEU 65 HB3 LEU 65 -21.449 -9.961 -2.121 345 HG LEU 65 HG LEU 65 -20.064 -7.312 -1.575 346 HD11 LEU 65 HD11 LEU 65 -19.492 -9.045 0.042 347 HD12 LEU 65 HD12 LEU 65 -18.118 -8.667 -0.990 348 HD13 LEU 65 HD13 LEU 65 -19.044 -10.150 -1.258 349 HD21 LEU 65 HD21 LEU 65 -20.144 -7.702 -3.984 350 HD22 LEU 65 HD22 LEU 65 -19.501 -9.332 -3.775 351 HD23 LEU 65 HD23 LEU 65 -18.502 -7.931 -3.386 352 H ALA 66 H ALA 66 -24.606 -7.103 -1.691 353 HA ALA 66 HA ALA 66 -26.168 -9.410 -1.050 354 HB1 ALA 66 HB1 ALA 66 -27.917 -7.806 -0.421 355 HB2 ALA 66 HB2 ALA 66 -27.034 -6.505 -1.226 356 HB3 ALA 66 HB3 ALA 66 -26.346 -7.288 0.195 357 H GLN 67 H GLN 67 -25.979 -7.347 -3.856 358 HA GLN 67 HA GLN 67 -28.300 -8.348 -5.232 359 HB2 GLN 67 HB2 GLN 67 -27.356 -7.157 -7.199 360 HB3 GLN 67 HB3 GLN 67 -27.372 -6.140 -5.760 361 HG2 GLN 67 HG2 GLN 67 -24.933 -6.745 -5.424 362 HG3 GLN 67 HG3 GLN 67 -24.977 -7.514 -7.007 363 HE21 GLN 67 HE21 GLN 67 -25.122 -4.482 -5.286 364 HE22 GLN 67 HE22 GLN 67 -24.822 -3.457 -6.641 365 H PHE 68 H PHE 68 -25.084 -9.498 -4.736 366 HA PHE 68 HA PHE 68 -25.243 -11.549 -6.860 367 HB2 PHE 68 HB2 PHE 68 -22.911 -10.737 -5.057 368 HB3 PHE 68 HB3 PHE 68 -22.829 -11.923 -6.351 369 HD1 PHE 68 HD1 PHE 68 -23.787 -10.879 -8.723 370 HD2 PHE 68 HD2 PHE 68 -21.922 -8.676 -5.564 371 HE1 PHE 68 HE1 PHE 68 -23.119 -9.130 -10.322 372 HE2 PHE 68 HE2 PHE 68 -21.267 -6.930 -7.176 373 HZ PHE 68 HZ PHE 68 -21.870 -7.153 -9.555 374 H ALA 69 H ALA 69 -26.574 -11.389 -3.999 375 HA ALA 69 HA ALA 69 -25.373 -13.406 -2.378 376 HB1 ALA 69 HB1 ALA 69 -28.174 -12.261 -2.242 377 HB2 ALA 69 HB2 ALA 69 -26.745 -11.587 -1.463 378 HB3 ALA 69 HB3 ALA 69 -27.354 -13.164 -0.960 379 H GLY 70 H GLY 70 -27.757 -13.518 -4.946 380 HA2 GLY 70 HA2 GLY 70 -28.677 -16.227 -4.387 381 HA3 GLY 70 HA3 GLY 70 -29.047 -15.247 -5.803 382 H GLU 71 H GLU 71 -25.817 -15.005 -5.612 383 HA GLU 71 HA GLU 71 -25.307 -17.268 -7.448 384 HB2 GLU 71 HB2 GLU 71 -25.067 -14.961 -8.387 385 HB3 GLU 71 HB3 GLU 71 -23.859 -14.584 -7.163 386 HG2 GLU 71 HG2 GLU 71 -22.835 -15.069 -9.336 387 HG3 GLU 71 HG3 GLU 71 -22.331 -16.228 -8.108 388 H ASP 72 H ASP 72 -23.416 -18.497 -7.192 389 HA ASP 72 HA ASP 72 -22.417 -19.106 -4.662 390 HB2 ASP 72 HB2 ASP 72 -21.343 -19.561 -7.471 391 HB3 ASP 72 HB3 ASP 72 -20.460 -20.133 -6.066 392 HA PRO 73 HA PRO 73 -20.084 -15.422 -3.638 393 HB2 PRO 73 HB2 PRO 73 -18.403 -17.361 -2.050 394 HB3 PRO 73 HB3 PRO 73 -19.117 -15.821 -1.544 395 HG2 PRO 73 HG2 PRO 73 -20.256 -18.096 -0.799 396 HG3 PRO 73 HG3 PRO 73 -21.276 -16.748 -1.349 397 HD2 PRO 73 HD2 PRO 73 -20.488 -19.255 -2.818 398 HD3 PRO 73 HD3 PRO 73 -22.043 -18.392 -2.810 399 H VAL 74 H VAL 74 -18.243 -18.284 -4.659 400 HA VAL 74 HA VAL 74 -15.758 -16.946 -5.157 401 HB VAL 74 HB VAL 74 -16.711 -19.623 -6.293 402 HG11 VAL 74 HG11 VAL 74 -13.881 -18.531 -5.968 403 HG12 VAL 74 HG12 VAL 74 -14.739 -18.742 -7.496 404 HG13 VAL 74 HG13 VAL 74 -14.296 -20.151 -6.532 405 HG21 VAL 74 HG21 VAL 74 -15.151 -19.066 -3.734 406 HG22 VAL 74 HG22 VAL 74 -15.519 -20.667 -4.382 407 HG23 VAL 74 HG23 VAL 74 -16.825 -19.619 -3.828 408 H VAL 75 H VAL 75 -18.556 -17.805 -7.145 409 HA VAL 75 HA VAL 75 -17.525 -16.891 -9.678 410 HB VAL 75 HB VAL 75 -20.437 -17.361 -8.868 411 HG11 VAL 75 HG11 VAL 75 -20.871 -17.658 -11.283 412 HG12 VAL 75 HG12 VAL 75 -19.188 -17.266 -11.641 413 HG13 VAL 75 HG13 VAL 75 -20.247 -16.044 -10.936 414 HG21 VAL 75 HG21 VAL 75 -18.482 -19.326 -10.126 415 HG22 VAL 75 HG22 VAL 75 -20.202 -19.623 -9.859 416 HG23 VAL 75 HG23 VAL 75 -19.121 -19.399 -8.483 417 H ALA 76 H ALA 76 -19.567 -15.597 -7.157 418 HA ALA 76 HA ALA 76 -20.419 -13.178 -8.329 419 HB1 ALA 76 HB1 ALA 76 -21.583 -14.212 -6.422 420 HB2 ALA 76 HB2 ALA 76 -21.088 -12.563 -6.028 421 HB3 ALA 76 HB3 ALA 76 -20.172 -13.934 -5.398 422 H LEU 77 H LEU 77 -17.569 -14.131 -6.541 423 HA LEU 77 HA LEU 77 -16.404 -11.623 -6.001 424 HB2 LEU 77 HB2 LEU 77 -15.667 -13.749 -4.976 425 HB3 LEU 77 HB3 LEU 77 -15.119 -14.322 -6.542 426 HG LEU 77 HG LEU 77 -13.428 -12.414 -6.545 427 HD11 LEU 77 HD11 LEU 77 -14.480 -10.940 -4.917 428 HD12 LEU 77 HD12 LEU 77 -12.837 -11.359 -4.438 429 HD13 LEU 77 HD13 LEU 77 -14.210 -12.132 -3.641 430 HD21 LEU 77 HD21 LEU 77 -12.887 -14.787 -5.948 431 HD22 LEU 77 HD22 LEU 77 -13.111 -14.369 -4.255 432 HD23 LEU 77 HD23 LEU 77 -11.837 -13.597 -5.198 433 H GLU 78 H GLU 78 -16.220 -13.790 -8.805 434 HA GLU 78 HA GLU 78 -14.300 -12.355 -10.337 435 HB2 GLU 78 HB2 GLU 78 -16.495 -14.239 -11.309 436 HB3 GLU 78 HB3 GLU 78 -15.066 -13.754 -12.227 437 HG2 GLU 78 HG2 GLU 78 -13.616 -14.868 -10.589 438 HG3 GLU 78 HG3 GLU 78 -15.028 -15.318 -9.629 439 H ALA 79 H ALA 79 -17.838 -12.306 -10.258 440 HA ALA 79 HA ALA 79 -18.298 -10.375 -12.291 441 HB1 ALA 79 HB1 ALA 79 -20.059 -11.896 -11.475 442 HB2 ALA 79 HB2 ALA 79 -20.568 -10.213 -11.320 443 HB3 ALA 79 HB3 ALA 79 -20.023 -11.106 -9.898 444 H ALA 80 H ALA 80 -17.552 -10.162 -8.870 445 HA ALA 80 HA ALA 80 -18.048 -7.352 -8.558 446 HB1 ALA 80 HB1 ALA 80 -18.173 -8.923 -6.669 447 HB2 ALA 80 HB2 ALA 80 -17.006 -7.638 -6.357 448 HB3 ALA 80 HB3 ALA 80 -16.445 -9.249 -6.815 449 H LEU 81 H LEU 81 -15.208 -9.325 -9.347 450 HA LEU 81 HA LEU 81 -13.253 -7.250 -9.304 451 HB2 LEU 81 HB2 LEU 81 -13.329 -9.871 -10.855 452 HB3 LEU 81 HB3 LEU 81 -11.925 -8.814 -10.797 453 HG LEU 81 HG LEU 81 -13.142 -10.242 -8.394 454 HD11 LEU 81 HD11 LEU 81 -11.132 -11.656 -8.418 455 HD12 LEU 81 HD12 LEU 81 -10.592 -10.876 -9.908 456 HD13 LEU 81 HD13 LEU 81 -12.072 -11.838 -9.899 457 HD21 LEU 81 HD21 LEU 81 -11.151 -9.497 -7.169 458 HD22 LEU 81 HD22 LEU 81 -12.098 -8.129 -7.741 459 HD23 LEU 81 HD23 LEU 81 -10.610 -8.580 -8.577 460 H GLN 82 H GLN 82 -15.438 -8.532 -11.735 461 HA GLN 82 HA GLN 82 -14.453 -7.187 -14.017 462 HB2 GLN 82 HB2 GLN 82 -15.841 -9.232 -14.120 463 HB3 GLN 82 HB3 GLN 82 -17.208 -8.352 -13.443 464 HG2 GLN 82 HG2 GLN 82 -17.304 -6.936 -15.456 465 HG3 GLN 82 HG3 GLN 82 -15.920 -7.796 -16.133 466 HE21 GLN 82 HE21 GLN 82 -18.604 -7.514 -17.227 467 HE22 GLN 82 HE22 GLN 82 -19.214 -9.117 -17.440 468 H PHE 83 H PHE 83 -16.982 -6.345 -11.655 469 HA PHE 83 HA PHE 83 -17.791 -3.986 -13.179 470 HB2 PHE 83 HB2 PHE 83 -19.472 -5.466 -12.099 471 HB3 PHE 83 HB3 PHE 83 -18.819 -5.051 -10.522 472 HD1 PHE 83 HD1 PHE 83 -19.444 -2.698 -13.379 473 HD2 PHE 83 HD2 PHE 83 -20.729 -4.041 -9.525 474 HE1 PHE 83 HE1 PHE 83 -21.052 -0.840 -13.258 475 HE2 PHE 83 HE2 PHE 83 -22.335 -2.181 -9.419 476 HZ PHE 83 HZ PHE 83 -22.500 -0.580 -11.283 477 H GLU 84 H GLU 84 -17.190 -1.962 -12.769 478 HA GLU 84 HA GLU 84 -14.762 -1.461 -11.461 479 HB2 GLU 84 HB2 GLU 84 -15.126 0.905 -12.130 480 HB3 GLU 84 HB3 GLU 84 -15.397 -0.238 -13.441 481 HG2 GLU 84 HG2 GLU 84 -17.844 -0.056 -13.100 482 HG3 GLU 84 HG3 GLU 84 -17.571 1.105 -11.799 483 H ASP 85 H ASP 85 -18.055 -0.874 -10.415 484 HA ASP 85 HA ASP 85 -17.476 0.807 -8.192 485 HB2 ASP 85 HB2 ASP 85 -19.748 0.717 -9.106 486 HB3 ASP 85 HB3 ASP 85 -19.859 -1.006 -8.767 487 H THR 86 H THR 86 -17.996 -2.687 -8.552 488 HA THR 86 HA THR 86 -17.939 -3.185 -5.718 489 HB THR 86 HB THR 86 -18.242 -5.607 -6.501 490 HG1 THR 86 HG1 THR 86 -17.283 -4.937 -8.674 491 HG21 THR 86 HG21 THR 86 -20.194 -4.228 -5.920 492 HG22 THR 86 HG22 THR 86 -20.573 -5.269 -7.286 493 HG23 THR 86 HG23 THR 86 -20.234 -3.556 -7.547 494 H ARG 87 H ARG 87 -15.490 -3.051 -8.146 495 HA ARG 87 HA ARG 87 -13.801 -5.139 -7.096 496 HB2 ARG 87 HB2 ARG 87 -12.075 -4.351 -8.678 497 HB3 ARG 87 HB3 ARG 87 -13.622 -4.637 -9.464 498 HG2 ARG 87 HG2 ARG 87 -14.054 -2.270 -9.641 499 HG3 ARG 87 HG3 ARG 87 -12.654 -1.877 -8.642 500 HD2 ARG 87 HD2 ARG 87 -11.121 -2.537 -10.356 501 HD3 ARG 87 HD3 ARG 87 -12.381 -3.352 -11.280 502 HE ARG 87 HE ARG 87 -12.936 -1.372 -12.260 503 HH11 ARG 87 HH11 ARG 87 -10.997 -0.529 -9.431 504 HH12 ARG 87 HH12 ARG 87 -10.814 1.121 -9.919 505 HH21 ARG 87 HH21 ARG 87 -12.647 0.790 -12.870 506 HH22 ARG 87 HH22 ARG 87 -11.746 1.866 -11.853 507 H GLU 88 H GLU 88 -14.468 -2.042 -6.070 508 HA GLU 88 HA GLU 88 -11.921 -1.237 -5.027 509 HB2 GLU 88 HB2 GLU 88 -14.725 -0.230 -4.375 510 HB3 GLU 88 HB3 GLU 88 -13.210 0.609 -4.020 511 HG2 GLU 88 HG2 GLU 88 -14.233 -0.073 -6.804 512 HG3 GLU 88 HG3 GLU 88 -14.376 1.499 -6.032 513 H SER 89 H SER 89 -14.801 -2.830 -3.674 514 HA SER 89 HA SER 89 -13.744 -3.037 -0.997 515 HB2 SER 89 HB2 SER 89 -16.192 -2.990 -1.493 516 HB3 SER 89 HB3 SER 89 -16.045 -4.558 -2.280 517 HG SER 89 HG SER 89 -15.032 -5.041 0.003 518 H MET 90 H MET 90 -13.366 -4.843 -3.944 519 HA MET 90 HA MET 90 -12.676 -7.392 -2.885 520 HB2 MET 90 HB2 MET 90 -11.738 -6.090 -5.473 521 HB3 MET 90 HB3 MET 90 -11.552 -7.795 -5.069 522 HG2 MET 90 HG2 MET 90 -14.156 -6.324 -5.518 523 HG3 MET 90 HG3 MET 90 -13.404 -7.493 -6.597 524 HE1 MET 90 HE1 MET 90 -16.318 -7.136 -4.477 525 HE2 MET 90 HE2 MET 90 -15.216 -7.019 -3.102 526 HE3 MET 90 HE3 MET 90 -16.283 -8.414 -3.264 527 H HIS 91 H HIS 91 -10.930 -4.381 -3.120 528 HA HIS 91 HA HIS 91 -8.284 -5.259 -2.610 529 HB2 HIS 91 HB2 HIS 91 -9.686 -2.617 -2.043 530 HB3 HIS 91 HB3 HIS 91 -7.982 -2.867 -1.671 531 HD1 HIS 91 HD1 HIS 91 -6.332 -2.988 -3.640 532 HD2 HIS 91 HD2 HIS 91 -10.274 -2.336 -4.792 533 HE1 HIS 91 HE1 HIS 91 -6.226 -2.305 -6.059 534 HE2 HIS 91 HE2 HIS 91 -8.632 -2.099 -6.771 535 H ALA 92 H ALA 92 -11.047 -4.869 -0.530 536 HA ALA 92 HA ALA 92 -9.631 -5.045 1.983 537 HB1 ALA 92 HB1 ALA 92 -11.805 -3.887 1.825 538 HB2 ALA 92 HB2 ALA 92 -11.874 -5.212 2.986 539 HB3 ALA 92 HB3 ALA 92 -12.591 -5.403 1.383 540 H PHE 93 H PHE 93 -11.224 -7.315 -0.247 541 HA PHE 93 HA PHE 93 -11.111 -9.540 1.635 542 HB2 PHE 93 HB2 PHE 93 -11.962 -9.488 -1.298 543 HB3 PHE 93 HB3 PHE 93 -12.135 -10.866 -0.211 544 HD1 PHE 93 HD1 PHE 93 -13.433 -10.298 2.079 545 HD2 PHE 93 HD2 PHE 93 -13.850 -8.119 -1.574 546 HE1 PHE 93 HE1 PHE 93 -15.613 -9.438 2.823 547 HE2 PHE 93 HE2 PHE 93 -16.027 -7.261 -0.810 548 HZ PHE 93 HZ PHE 93 -16.907 -7.920 1.389 549 H CYS 94 H CYS 94 -9.107 -8.252 -0.932 550 HA CYS 94 HA CYS 94 -7.704 -10.677 -1.548 551 HB2 CYS 94 HB2 CYS 94 -6.120 -9.243 -2.781 552 HB3 CYS 94 HB3 CYS 94 -7.783 -8.825 -3.168 553 HG CYS 94 HG CYS 94 -6.817 -6.926 -0.697 554 H VAL 95 H VAL 95 -6.791 -11.659 0.125 555 HA VAL 95 HA VAL 95 -5.510 -10.429 2.347 556 HB VAL 95 HB VAL 95 -5.212 -13.311 1.381 557 HG11 VAL 95 HG11 VAL 95 -4.795 -12.133 4.158 558 HG12 VAL 95 HG12 VAL 95 -3.530 -12.716 3.077 559 HG13 VAL 95 HG13 VAL 95 -4.704 -13.847 3.745 560 HG21 VAL 95 HG21 VAL 95 -7.598 -12.759 1.628 561 HG22 VAL 95 HG22 VAL 95 -7.313 -12.163 3.265 562 HG23 VAL 95 HG23 VAL 95 -7.089 -13.874 2.898 563 H GLY 96 H GLY 96 -4.368 -11.826 -0.702 564 HA2 GLY 96 HA2 GLY 96 -2.109 -10.172 -0.946 565 HA3 GLY 96 HA3 GLY 96 -1.581 -11.712 -0.270 566 H GLN 97 H GLN 97 -0.358 -11.497 -2.390 567 HA GLN 97 HA GLN 97 -1.784 -12.398 -4.775 568 HB2 GLN 97 HB2 GLN 97 0.046 -10.733 -5.002 569 HB3 GLN 97 HB3 GLN 97 1.184 -11.877 -4.294 570 HG2 GLN 97 HG2 GLN 97 0.837 -13.396 -6.227 571 HG3 GLN 97 HG3 GLN 97 -0.277 -12.224 -6.933 572 HE21 GLN 97 HE21 GLN 97 3.063 -12.951 -6.216 573 HE22 GLN 97 HE22 GLN 97 3.753 -11.723 -7.215 574 H TYR 98 H TYR 98 -1.815 -14.492 -5.466 575 HA TYR 98 HA TYR 98 -0.633 -16.589 -3.834 576 HB2 TYR 98 HB2 TYR 98 -2.934 -16.782 -4.858 577 HB3 TYR 98 HB3 TYR 98 -2.185 -16.859 -6.445 578 HD1 TYR 98 HD1 TYR 98 -2.237 -18.587 -3.118 579 HD2 TYR 98 HD2 TYR 98 -1.517 -18.993 -7.311 580 HE1 TYR 98 HE1 TYR 98 -2.053 -21.020 -2.853 581 HE2 TYR 98 HE2 TYR 98 -1.335 -21.429 -7.039 582 HH TYR 98 HH TYR 98 -0.828 -23.050 -5.275 583 H LEU 99 H LEU 99 1.180 -17.706 -4.334 584 HA LEU 99 HA LEU 99 2.253 -17.669 -7.064 585 HB2 LEU 99 HB2 LEU 99 3.386 -15.940 -5.392 586 HB3 LEU 99 HB3 LEU 99 4.188 -17.360 -4.753 587 HG LEU 99 HG LEU 99 4.374 -16.403 -7.649 588 HD11 LEU 99 HD11 LEU 99 5.461 -14.815 -6.142 589 HD12 LEU 99 HD12 LEU 99 6.644 -15.662 -7.134 590 HD13 LEU 99 HD13 LEU 99 6.427 -16.116 -5.440 591 HD21 LEU 99 HD21 LEU 99 5.960 -18.584 -6.253 592 HD22 LEU 99 HD22 LEU 99 6.220 -18.004 -7.902 593 HD23 LEU 99 HD23 LEU 99 4.720 -18.825 -7.485 594 H GLU 100 H GLU 100 2.585 -19.683 -7.670 595 HA GLU 100 HA GLU 100 2.019 -21.900 -5.982 596 HB2 GLU 100 HB2 GLU 100 3.026 -21.672 -8.844 597 HB3 GLU 100 HB3 GLU 100 2.615 -23.205 -8.100 598 HG2 GLU 100 HG2 GLU 100 0.286 -22.386 -7.757 599 HG3 GLU 100 HG3 GLU 100 0.726 -20.878 -8.563 600 HA PRO 101 HA PRO 101 6.092 -23.175 -4.411 601 HB2 PRO 101 HB2 PRO 101 5.690 -25.970 -4.833 602 HB3 PRO 101 HB3 PRO 101 5.310 -25.067 -3.365 603 HG2 PRO 101 HG2 PRO 101 3.508 -25.819 -5.651 604 HG3 PRO 101 HG3 PRO 101 3.166 -25.805 -3.906 605 HD2 PRO 101 HD2 PRO 101 2.237 -23.849 -5.440 606 HD3 PRO 101 HD3 PRO 101 2.918 -23.458 -3.847 607 H ASP 102 H ASP 102 4.873 -24.832 -7.323 608 HA ASP 102 HA ASP 102 7.376 -25.612 -8.408 609 HB2 ASP 102 HB2 ASP 102 5.255 -26.753 -8.956 610 HB3 ASP 102 HB3 ASP 102 4.653 -25.297 -9.733 611 H GLN 103 H GLN 103 5.388 -22.737 -8.815 612 HA GLN 103 HA GLN 103 6.215 -21.908 -11.361 613 HB2 GLN 103 HB2 GLN 103 4.146 -21.135 -10.273 614 HB3 GLN 103 HB3 GLN 103 5.081 -20.238 -9.088 615 HG2 GLN 103 HG2 GLN 103 4.108 -18.787 -10.823 616 HG3 GLN 103 HG3 GLN 103 5.869 -18.702 -10.807 617 HE21 GLN 103 HE21 GLN 103 7.022 -19.485 -12.597 618 HE22 GLN 103 HE22 GLN 103 6.252 -19.892 -14.089 619 H GLU 104 H GLU 104 7.438 -20.879 -8.148 620 HA GLU 104 HA GLU 104 9.479 -19.191 -9.403 621 HB2 GLU 104 HB2 GLU 104 10.067 -18.511 -7.116 622 HB3 GLU 104 HB3 GLU 104 8.355 -18.283 -7.452 623 HG2 GLU 104 HG2 GLU 104 7.790 -20.276 -6.156 624 HG3 GLU 104 HG3 GLU 104 9.504 -20.615 -5.884 625 H GLY 105 H GLY 105 9.200 -22.423 -8.555 626 HA2 GLY 105 HA2 GLY 105 12.055 -22.806 -7.863 627 HA3 GLY 105 HA3 GLY 105 10.757 -23.968 -7.635 628 H VAL 106 H VAL 106 10.962 -22.240 -10.632 629 HA VAL 106 HA VAL 106 12.296 -24.495 -11.995 630 HB VAL 106 HB VAL 106 9.878 -24.893 -12.276 631 HG11 VAL 106 HG11 VAL 106 8.393 -23.310 -13.452 632 HG12 VAL 106 HG12 VAL 106 9.690 -22.117 -13.499 633 HG13 VAL 106 HG13 VAL 106 9.011 -22.619 -11.949 634 HG21 VAL 106 HG21 VAL 106 9.751 -25.006 -14.742 635 HG22 VAL 106 HG22 VAL 106 11.353 -25.479 -14.173 636 HG23 VAL 106 HG23 VAL 106 11.106 -23.878 -14.872 637 H THR 107 H THR 107 13.723 -23.867 -13.540 638 HA THR 107 HA THR 107 13.912 -21.063 -14.360 639 HB THR 107 HB THR 107 16.033 -22.184 -13.861 640 HG1 THR 107 HG1 THR 107 16.029 -20.590 -15.502 641 HG21 THR 107 HG21 THR 107 16.972 -23.980 -15.268 642 HG22 THR 107 HG22 THR 107 15.452 -24.089 -16.156 643 HG23 THR 107 HG23 THR 107 15.504 -24.523 -14.447 644 H ILE 108 H ILE 108 12.837 -20.366 -16.077 645 HA ILE 108 HA ILE 108 11.679 -22.285 -18.007 646 HB ILE 108 HB ILE 108 10.825 -19.398 -17.487 647 HG12 ILE 108 HG12 ILE 108 9.481 -21.944 -16.445 648 HG13 ILE 108 HG13 ILE 108 10.466 -20.862 -15.468 649 HG21 ILE 108 HG21 ILE 108 9.423 -21.612 -19.039 650 HG22 ILE 108 HG22 ILE 108 10.222 -20.202 -19.736 651 HG23 ILE 108 HG23 ILE 108 8.779 -19.994 -18.745 652 HD11 ILE 108 HD11 ILE 108 7.850 -20.138 -16.796 653 HD12 ILE 108 HD12 ILE 108 8.836 -19.065 -15.798 654 HD13 ILE 108 HD13 ILE 108 8.098 -20.500 -15.089 655 HA PRO 109 HA PRO 109 14.653 -20.316 -20.968 656 HB2 PRO 109 HB2 PRO 109 13.617 -22.535 -22.689 657 HB3 PRO 109 HB3 PRO 109 15.290 -22.093 -22.327 658 HG2 PRO 109 HG2 PRO 109 14.185 -24.298 -21.261 659 HG3 PRO 109 HG3 PRO 109 15.308 -23.291 -20.319 660 HD2 PRO 109 HD2 PRO 109 12.287 -23.362 -20.215 661 HD3 PRO 109 HD3 PRO 109 13.457 -23.323 -18.875 662 H ASP 110 H ASP 110 14.174 -19.074 -22.837 663 HA ASP 110 HA ASP 110 11.443 -18.191 -23.027 664 HB2 ASP 110 HB2 ASP 110 12.321 -16.514 -24.663 665 HB3 ASP 110 HB3 ASP 110 13.152 -16.491 -23.116 666 H LEU 111 H LEU 111 10.410 -20.032 -23.727 667 HA LEU 111 HA LEU 111 10.523 -20.585 -26.630 668 HB2 LEU 111 HB2 LEU 111 11.609 -22.447 -25.361 669 HB3 LEU 111 HB3 LEU 111 10.147 -22.644 -24.413 670 HG LEU 111 HG LEU 111 8.910 -23.360 -26.450 671 HD11 LEU 111 HD11 LEU 111 11.570 -23.143 -27.890 672 HD12 LEU 111 HD12 LEU 111 10.145 -22.136 -28.161 673 HD13 LEU 111 HD13 LEU 111 10.092 -23.854 -28.545 674 HD21 LEU 111 HD21 LEU 111 9.936 -25.070 -25.027 675 HD22 LEU 111 HD22 LEU 111 11.432 -24.978 -25.961 676 HD23 LEU 111 HD23 LEU 111 9.950 -25.567 -26.718 677 H GLY 112 H GLY 112 8.659 -19.976 -23.755 678 HA2 GLY 112 HA2 GLY 112 6.068 -20.641 -24.858 679 HA3 GLY 112 HA3 GLY 112 6.396 -19.767 -23.367 Start of MODEL 2 1 H GLU 21 H GLU 21 5.354 -2.963 -1.322 2 HA GLU 21 HA GLU 21 7.359 -2.874 -2.582 3 HB2 GLU 21 HB2 GLU 21 9.580 -2.876 -1.385 4 HB3 GLU 21 HB3 GLU 21 8.702 -1.352 -1.274 5 HG2 GLU 21 HG2 GLU 21 8.049 -1.806 1.010 6 HG3 GLU 21 HG3 GLU 21 8.691 -3.447 0.923 7 H LYS 22 H LYS 22 7.024 -4.443 0.597 8 HA LYS 22 HA LYS 22 7.601 -7.081 -0.609 9 HB2 LYS 22 HB2 LYS 22 7.636 -6.228 2.322 10 HB3 LYS 22 HB3 LYS 22 7.974 -7.851 1.729 11 HG2 LYS 22 HG2 LYS 22 9.628 -5.387 1.092 12 HG3 LYS 22 HG3 LYS 22 10.029 -6.584 2.328 13 HD2 LYS 22 HD2 LYS 22 9.766 -7.169 -0.656 14 HD3 LYS 22 HD3 LYS 22 11.296 -6.896 0.183 15 HE2 LYS 22 HE2 LYS 22 9.350 -9.179 0.705 16 HE3 LYS 22 HE3 LYS 22 10.890 -9.303 -0.144 17 HZ1 LYS 22 HZ1 LYS 22 10.484 -8.645 2.724 18 HZ2 LYS 22 HZ2 LYS 22 11.978 -8.564 1.940 19 HZ3 LYS 22 HZ3 LYS 22 11.180 -10.045 2.085 20 H VAL 23 H VAL 23 5.573 -7.409 -1.503 21 HA VAL 23 HA VAL 23 3.118 -7.178 -0.009 22 HB VAL 23 HB VAL 23 3.144 -6.838 -2.450 23 HG11 VAL 23 HG11 VAL 23 3.414 -8.716 -4.050 24 HG12 VAL 23 HG12 VAL 23 3.843 -9.786 -2.714 25 HG13 VAL 23 HG13 VAL 23 4.885 -8.423 -3.118 26 HG21 VAL 23 HG21 VAL 23 1.013 -7.527 -1.431 27 HG22 VAL 23 HG22 VAL 23 1.418 -9.227 -1.665 28 HG23 VAL 23 HG23 VAL 23 1.141 -8.186 -3.065 29 H THR 24 H THR 24 1.885 -8.829 0.923 30 HA THR 24 HA THR 24 3.185 -11.138 1.931 31 HB THR 24 HB THR 24 0.166 -10.658 1.750 32 HG1 THR 24 HG1 THR 24 1.918 -9.964 3.887 33 HG21 THR 24 HG21 THR 24 0.043 -12.103 3.752 34 HG22 THR 24 HG22 THR 24 1.787 -12.349 3.712 35 HG23 THR 24 HG23 THR 24 0.777 -12.987 2.411 36 H LEU 25 H LEU 25 3.841 -12.734 0.635 37 HA LEU 25 HA LEU 25 2.353 -13.573 -1.743 38 HB2 LEU 25 HB2 LEU 25 5.084 -14.383 -0.683 39 HB3 LEU 25 HB3 LEU 25 4.380 -14.973 -2.185 40 HG LEU 25 HG LEU 25 5.179 -12.093 -1.573 41 HD11 LEU 25 HD11 LEU 25 6.395 -14.079 -3.523 42 HD12 LEU 25 HD12 LEU 25 7.108 -13.529 -2.003 43 HD13 LEU 25 HD13 LEU 25 6.870 -12.388 -3.323 44 HD21 LEU 25 HD21 LEU 25 3.911 -13.198 -4.116 45 HD22 LEU 25 HD22 LEU 25 4.569 -11.572 -3.920 46 HD23 LEU 25 HD23 LEU 25 3.171 -12.069 -2.975 47 H VAL 26 H VAL 26 0.752 -14.896 -1.293 48 HA VAL 26 HA VAL 26 0.836 -16.861 0.869 49 HB VAL 26 HB VAL 26 -1.466 -16.121 -1.000 50 HG11 VAL 26 HG11 VAL 26 -1.805 -18.296 0.058 51 HG12 VAL 26 HG12 VAL 26 -2.946 -17.115 0.705 52 HG13 VAL 26 HG13 VAL 26 -1.536 -17.591 1.655 53 HG21 VAL 26 HG21 VAL 26 -0.902 -14.964 1.759 54 HG22 VAL 26 HG22 VAL 26 -2.350 -14.666 0.792 55 HG23 VAL 26 HG23 VAL 26 -0.777 -14.107 0.220 56 H ARG 27 H ARG 27 1.266 -18.974 0.417 57 HA ARG 27 HA ARG 27 1.432 -19.885 -2.376 58 HB2 ARG 27 HB2 ARG 27 2.404 -21.169 0.221 59 HB3 ARG 27 HB3 ARG 27 2.590 -21.898 -1.376 60 HG2 ARG 27 HG2 ARG 27 4.026 -20.109 -2.110 61 HG3 ARG 27 HG3 ARG 27 3.743 -19.189 -0.629 62 HD2 ARG 27 HD2 ARG 27 4.896 -20.919 0.682 63 HD3 ARG 27 HD3 ARG 27 5.125 -21.897 -0.773 64 HE ARG 27 HE ARG 27 6.404 -19.859 -1.617 65 HH11 ARG 27 HH11 ARG 27 6.424 -20.739 1.795 66 HH12 ARG 27 HH12 ARG 27 8.014 -20.092 2.051 67 HH21 ARG 27 HH21 ARG 27 8.470 -19.054 -1.259 68 HH22 ARG 27 HH22 ARG 27 9.167 -19.144 0.333 69 H ILE 28 H ILE 28 0.775 -22.199 -2.743 70 HA ILE 28 HA ILE 28 -1.977 -22.547 -2.536 71 HB ILE 28 HB ILE 28 -0.782 -23.590 -4.330 72 HG12 ILE 28 HG12 ILE 28 -1.928 -25.796 -2.536 73 HG13 ILE 28 HG13 ILE 28 -2.858 -24.780 -3.631 74 HG21 ILE 28 HG21 ILE 28 1.389 -23.961 -3.258 75 HG22 ILE 28 HG22 ILE 28 0.841 -25.443 -4.045 76 HG23 ILE 28 HG23 ILE 28 0.718 -25.282 -2.293 77 HD11 ILE 28 HD11 ILE 28 -0.781 -26.822 -4.416 78 HD12 ILE 28 HD12 ILE 28 -1.681 -25.795 -5.535 79 HD13 ILE 28 HD13 ILE 28 -2.531 -26.985 -4.550 80 H ALA 29 H ALA 29 0.583 -23.825 -0.476 81 HA ALA 29 HA ALA 29 -0.904 -25.697 1.033 82 HB1 ALA 29 HB1 ALA 29 0.968 -25.607 2.633 83 HB2 ALA 29 HB2 ALA 29 1.586 -24.152 1.845 84 HB3 ALA 29 HB3 ALA 29 1.557 -25.686 0.972 85 H ASP 30 H ASP 30 -0.293 -22.232 1.486 86 HA ASP 30 HA ASP 30 -1.343 -21.864 4.081 87 HB2 ASP 30 HB2 ASP 30 -1.165 -19.893 1.764 88 HB3 ASP 30 HB3 ASP 30 -1.524 -19.441 3.432 89 H LEU 31 H LEU 31 -2.875 -21.867 0.908 90 HA LEU 31 HA LEU 31 -5.427 -20.855 1.528 91 HB2 LEU 31 HB2 LEU 31 -4.806 -23.096 -0.441 92 HB3 LEU 31 HB3 LEU 31 -6.212 -22.035 -0.473 93 HG LEU 31 HG LEU 31 -3.331 -21.184 -1.007 94 HD11 LEU 31 HD11 LEU 31 -5.630 -21.543 -2.964 95 HD12 LEU 31 HD12 LEU 31 -4.234 -22.610 -2.795 96 HD13 LEU 31 HD13 LEU 31 -4.009 -20.954 -3.353 97 HD21 LEU 31 HD21 LEU 31 -4.273 -19.023 -1.709 98 HD22 LEU 31 HD22 LEU 31 -4.617 -19.347 -0.013 99 HD23 LEU 31 HD23 LEU 31 -5.887 -19.550 -1.223 100 H GLU 32 H GLU 32 -4.111 -24.128 1.632 101 HA GLU 32 HA GLU 32 -6.524 -25.502 2.303 102 HB2 GLU 32 HB2 GLU 32 -3.672 -26.517 2.669 103 HB3 GLU 32 HB3 GLU 32 -5.131 -27.482 2.416 104 HG2 GLU 32 HG2 GLU 32 -5.297 -26.534 0.112 105 HG3 GLU 32 HG3 GLU 32 -3.801 -25.644 0.397 106 H ASN 33 H ASN 33 -3.720 -24.348 4.083 107 HA ASN 33 HA ASN 33 -4.236 -25.435 6.631 108 HB2 ASN 33 HB2 ASN 33 -2.697 -22.937 5.785 109 HB3 ASN 33 HB3 ASN 33 -2.712 -23.549 7.436 110 HD21 ASN 33 HD21 ASN 33 -0.546 -23.278 5.336 111 HD22 ASN 33 HD22 ASN 33 0.213 -24.829 5.304 112 H HIS 34 H HIS 34 -5.084 -22.282 5.181 113 HA HIS 34 HA HIS 34 -6.475 -21.222 7.429 114 HB2 HIS 34 HB2 HIS 34 -5.574 -19.740 5.692 115 HB3 HIS 34 HB3 HIS 34 -6.632 -20.461 4.484 116 HD1 HIS 34 HD1 HIS 34 -6.644 -18.102 7.396 117 HD2 HIS 34 HD2 HIS 34 -9.281 -19.501 4.509 118 HE1 HIS 34 HE1 HIS 34 -8.668 -16.637 7.560 119 HE2 HIS 34 HE2 HIS 34 -10.152 -17.379 5.676 120 H ASN 35 H ASN 35 -7.445 -23.106 4.613 121 HA ASN 35 HA ASN 35 -10.239 -22.930 4.833 122 HB2 ASN 35 HB2 ASN 35 -9.072 -23.879 2.852 123 HB3 ASN 35 HB3 ASN 35 -8.594 -25.282 3.798 124 HD21 ASN 35 HD21 ASN 35 -9.685 -26.762 2.510 125 HD22 ASN 35 HD22 ASN 35 -11.405 -26.855 2.407 126 H ASN 36 H ASN 36 -7.909 -25.155 6.277 127 HA ASN 36 HA ASN 36 -9.852 -26.710 7.728 128 HB2 ASN 36 HB2 ASN 36 -7.524 -27.462 6.830 129 HB3 ASN 36 HB3 ASN 36 -6.843 -26.646 8.233 130 HD21 ASN 36 HD21 ASN 36 -8.757 -29.333 7.110 131 HD22 ASN 36 HD22 ASN 36 -8.705 -30.251 8.575 132 H ASP 37 H ASP 37 -8.097 -23.774 8.276 133 HA ASP 37 HA ASP 37 -7.970 -23.780 11.144 134 HB2 ASP 37 HB2 ASP 37 -6.364 -22.490 9.872 135 HB3 ASP 37 HB3 ASP 37 -7.637 -21.621 9.027 136 H GLY 38 H GLY 38 -10.294 -22.462 8.774 137 HA2 GLY 38 HA2 GLY 38 -12.663 -22.574 9.850 138 HA3 GLY 38 HA3 GLY 38 -12.002 -21.367 10.945 139 H GLY 39 H GLY 39 -11.274 -21.565 7.496 140 HA2 GLY 39 HA2 GLY 39 -13.138 -19.418 6.785 141 HA3 GLY 39 HA3 GLY 39 -11.420 -19.047 6.641 142 H PHE 40 H PHE 40 -12.577 -18.813 4.316 143 HA PHE 40 HA PHE 40 -11.685 -21.208 2.844 144 HB2 PHE 40 HB2 PHE 40 -14.274 -21.030 2.987 145 HB3 PHE 40 HB3 PHE 40 -14.134 -19.618 1.947 146 HD1 PHE 40 HD1 PHE 40 -13.189 -19.910 -0.411 147 HD2 PHE 40 HD2 PHE 40 -14.106 -23.262 2.088 148 HE1 PHE 40 HE1 PHE 40 -13.156 -21.389 -2.373 149 HE2 PHE 40 HE2 PHE 40 -14.072 -24.734 0.114 150 HZ PHE 40 HZ PHE 40 -13.596 -23.802 -2.117 151 H TRP 41 H TRP 41 -9.859 -20.459 1.868 152 HA TRP 41 HA TRP 41 -9.824 -17.795 0.617 153 HB2 TRP 41 HB2 TRP 41 -7.641 -19.749 1.401 154 HB3 TRP 41 HB3 TRP 41 -7.309 -18.533 0.173 155 HD1 TRP 41 HD1 TRP 41 -9.429 -16.605 2.285 156 HE1 TRP 41 HE1 TRP 41 -8.134 -15.315 4.089 157 HE3 TRP 41 HE3 TRP 41 -4.968 -19.122 2.071 158 HZ2 TRP 41 HZ2 TRP 41 -5.582 -15.341 5.260 159 HZ3 TRP 41 HZ3 TRP 41 -3.146 -18.413 3.568 160 HH2 TRP 41 HH2 TRP 41 -3.448 -16.558 5.129 161 H THR 42 H THR 42 -9.509 -17.486 -1.528 162 HA THR 42 HA THR 42 -9.354 -19.762 -3.386 163 HB THR 42 HB THR 42 -11.761 -19.117 -3.219 164 HG1 THR 42 HG1 THR 42 -12.049 -19.238 -5.349 165 HG21 THR 42 HG21 THR 42 -10.880 -16.385 -4.234 166 HG22 THR 42 HG22 THR 42 -11.548 -16.729 -2.636 167 HG23 THR 42 HG23 THR 42 -12.549 -16.932 -4.076 168 H VAL 43 H VAL 43 -8.127 -19.332 -5.190 169 HA VAL 43 HA VAL 43 -6.702 -16.754 -5.306 170 HB VAL 43 HB VAL 43 -6.150 -19.400 -6.728 171 HG11 VAL 43 HG11 VAL 43 -4.006 -18.368 -7.450 172 HG12 VAL 43 HG12 VAL 43 -4.515 -16.826 -6.755 173 HG13 VAL 43 HG13 VAL 43 -5.395 -17.510 -8.122 174 HG21 VAL 43 HG21 VAL 43 -5.719 -19.504 -4.316 175 HG22 VAL 43 HG22 VAL 43 -4.718 -18.052 -4.405 176 HG23 VAL 43 HG23 VAL 43 -4.199 -19.533 -5.211 177 H ILE 44 H ILE 44 -7.746 -15.281 -6.471 178 HA ILE 44 HA ILE 44 -8.670 -15.922 -9.213 179 HB ILE 44 HB ILE 44 -10.028 -14.004 -7.256 180 HG12 ILE 44 HG12 ILE 44 -11.123 -16.607 -8.433 181 HG13 ILE 44 HG13 ILE 44 -10.513 -16.433 -6.792 182 HG21 ILE 44 HG21 ILE 44 -10.119 -13.118 -9.553 183 HG22 ILE 44 HG22 ILE 44 -11.724 -13.623 -9.028 184 HG23 ILE 44 HG23 ILE 44 -10.802 -14.640 -10.138 185 HD11 ILE 44 HD11 ILE 44 -12.928 -15.044 -7.946 186 HD12 ILE 44 HD12 ILE 44 -12.312 -14.852 -6.301 187 HD13 ILE 44 HD13 ILE 44 -12.919 -16.416 -6.840 188 H ASP 45 H ASP 45 -7.705 -14.658 -10.678 189 HA ASP 45 HA ASP 45 -6.539 -13.056 -11.750 190 HB2 ASP 45 HB2 ASP 45 -8.505 -11.685 -10.873 191 HB3 ASP 45 HB3 ASP 45 -7.493 -11.189 -9.520 192 H GLY 46 H GLY 46 -5.152 -14.688 -9.772 193 HA2 GLY 46 HA2 GLY 46 -2.988 -14.940 -9.006 194 HA3 GLY 46 HA3 GLY 46 -2.611 -13.351 -9.647 195 H LYS 47 H LYS 47 -5.277 -13.341 -7.556 196 HA LYS 47 HA LYS 47 -3.700 -12.477 -5.199 197 HB2 LYS 47 HB2 LYS 47 -6.448 -11.532 -6.145 198 HB3 LYS 47 HB3 LYS 47 -5.667 -11.024 -4.648 199 HG2 LYS 47 HG2 LYS 47 -4.568 -10.491 -7.429 200 HG3 LYS 47 HG3 LYS 47 -5.567 -9.352 -6.512 201 HD2 LYS 47 HD2 LYS 47 -3.812 -9.393 -4.694 202 HD3 LYS 47 HD3 LYS 47 -2.798 -10.382 -5.757 203 HE2 LYS 47 HE2 LYS 47 -2.159 -8.004 -5.853 204 HE3 LYS 47 HE3 LYS 47 -2.767 -8.551 -7.419 205 HZ1 LYS 47 HZ1 LYS 47 -4.330 -7.040 -5.389 206 HZ2 LYS 47 HZ2 LYS 47 -4.898 -7.546 -6.900 207 HZ3 LYS 47 HZ3 LYS 47 -3.665 -6.400 -6.804 208 H VAL 48 H VAL 48 -4.769 -12.930 -3.134 209 HA VAL 48 HA VAL 48 -6.548 -15.295 -3.202 210 HB VAL 48 HB VAL 48 -4.631 -14.446 -0.983 211 HG11 VAL 48 HG11 VAL 48 -5.162 -16.639 0.055 212 HG12 VAL 48 HG12 VAL 48 -6.367 -16.939 -1.201 213 HG13 VAL 48 HG13 VAL 48 -6.591 -15.608 -0.065 214 HG21 VAL 48 HG21 VAL 48 -4.396 -16.733 -2.977 215 HG22 VAL 48 HG22 VAL 48 -3.307 -16.441 -1.620 216 HG23 VAL 48 HG23 VAL 48 -3.402 -15.275 -2.939 217 H TYR 49 H TYR 49 -8.570 -14.815 -2.723 218 HA TYR 49 HA TYR 49 -9.241 -12.637 -0.819 219 HB2 TYR 49 HB2 TYR 49 -11.083 -13.862 -2.922 220 HB3 TYR 49 HB3 TYR 49 -11.388 -12.432 -1.942 221 HD1 TYR 49 HD1 TYR 49 -10.062 -10.306 -2.406 222 HD2 TYR 49 HD2 TYR 49 -9.880 -13.695 -5.008 223 HE1 TYR 49 HE1 TYR 49 -9.106 -8.902 -4.181 224 HE2 TYR 49 HE2 TYR 49 -8.936 -12.269 -6.777 225 HH TYR 49 HH TYR 49 -8.769 -9.967 -7.420 226 H ASP 50 H ASP 50 -10.927 -13.090 0.735 227 HA ASP 50 HA ASP 50 -11.200 -15.958 1.390 228 HB2 ASP 50 HB2 ASP 50 -10.217 -14.456 3.130 229 HB3 ASP 50 HB3 ASP 50 -11.725 -13.538 3.166 230 H ILE 51 H ILE 51 -12.918 -16.794 0.444 231 HA ILE 51 HA ILE 51 -15.355 -15.596 -0.290 232 HB ILE 51 HB ILE 51 -14.602 -18.506 0.223 233 HG12 ILE 51 HG12 ILE 51 -13.525 -17.428 -1.724 234 HG13 ILE 51 HG13 ILE 51 -14.632 -18.697 -2.247 235 HG21 ILE 51 HG21 ILE 51 -17.013 -18.432 0.617 236 HG22 ILE 51 HG22 ILE 51 -16.687 -19.243 -0.913 237 HG23 ILE 51 HG23 ILE 51 -17.271 -17.578 -0.908 238 HD11 ILE 51 HD11 ILE 51 -16.306 -17.004 -2.812 239 HD12 ILE 51 HD12 ILE 51 -14.789 -16.747 -3.666 240 HD13 ILE 51 HD13 ILE 51 -15.199 -15.730 -2.286 241 H LYS 52 H LYS 52 -14.351 -17.135 2.711 242 HA LYS 52 HA LYS 52 -16.849 -17.567 3.920 243 HB2 LYS 52 HB2 LYS 52 -14.416 -18.330 4.617 244 HB3 LYS 52 HB3 LYS 52 -14.350 -16.820 5.501 245 HG2 LYS 52 HG2 LYS 52 -16.365 -19.059 5.959 246 HG3 LYS 52 HG3 LYS 52 -14.918 -18.776 6.929 247 HD2 LYS 52 HD2 LYS 52 -17.291 -16.893 6.661 248 HD3 LYS 52 HD3 LYS 52 -16.972 -17.952 8.037 249 HE2 LYS 52 HE2 LYS 52 -14.997 -16.670 8.642 250 HE3 LYS 52 HE3 LYS 52 -15.072 -15.738 7.145 251 HZ1 LYS 52 HZ1 LYS 52 -17.099 -15.669 9.309 252 HZ2 LYS 52 HZ2 LYS 52 -17.145 -14.758 7.889 253 HZ3 LYS 52 HZ3 LYS 52 -15.926 -14.489 9.032 254 H ASP 53 H ASP 53 -14.649 -14.741 4.039 255 HA ASP 53 HA ASP 53 -16.377 -13.164 5.710 256 HB2 ASP 53 HB2 ASP 53 -13.889 -12.828 5.678 257 HB3 ASP 53 HB3 ASP 53 -14.017 -12.210 4.033 258 H PHE 54 H PHE 54 -15.802 -13.464 2.236 259 HA PHE 54 HA PHE 54 -17.110 -11.251 1.188 260 HB2 PHE 54 HB2 PHE 54 -15.828 -12.794 -0.216 261 HB3 PHE 54 HB3 PHE 54 -16.960 -14.099 0.107 262 HD1 PHE 54 HD1 PHE 54 -16.421 -10.977 -1.787 263 HD2 PHE 54 HD2 PHE 54 -19.115 -14.223 -1.083 264 HE1 PHE 54 HE1 PHE 54 -17.725 -10.341 -3.772 265 HE2 PHE 54 HE2 PHE 54 -20.412 -13.567 -3.068 266 HZ PHE 54 HZ PHE 54 -19.722 -11.621 -4.409 267 H GLN 55 H GLN 55 -18.543 -14.456 1.820 268 HA GLN 55 HA GLN 55 -21.228 -13.702 1.240 269 HB2 GLN 55 HB2 GLN 55 -21.841 -15.911 2.154 270 HB3 GLN 55 HB3 GLN 55 -20.503 -16.011 1.014 271 HG2 GLN 55 HG2 GLN 55 -18.928 -16.102 2.972 272 HG3 GLN 55 HG3 GLN 55 -20.331 -16.185 4.040 273 HE21 GLN 55 HE21 GLN 55 -21.562 -18.102 4.079 274 HE22 GLN 55 HE22 GLN 55 -20.971 -19.582 3.415 275 H THR 56 H THR 56 -19.291 -13.604 4.168 276 HA THR 56 HA THR 56 -21.362 -13.168 6.082 277 HB THR 56 HB THR 56 -18.410 -12.398 6.129 278 HG1 THR 56 HG1 THR 56 -19.277 -14.731 6.137 279 HG21 THR 56 HG21 THR 56 -20.371 -12.415 8.454 280 HG22 THR 56 HG22 THR 56 -19.595 -10.989 7.757 281 HG23 THR 56 HG23 THR 56 -18.628 -12.206 8.592 282 H GLN 57 H GLN 57 -19.475 -10.964 3.992 283 HA GLN 57 HA GLN 57 -20.595 -8.519 5.052 284 HB2 GLN 57 HB2 GLN 57 -19.052 -8.991 2.465 285 HB3 GLN 57 HB3 GLN 57 -19.416 -7.427 3.177 286 HG2 GLN 57 HG2 GLN 57 -17.538 -9.543 4.250 287 HG3 GLN 57 HG3 GLN 57 -17.118 -7.956 3.619 288 HE21 GLN 57 HE21 GLN 57 -18.230 -9.742 6.355 289 HE22 GLN 57 HE22 GLN 57 -18.199 -8.445 7.492 290 H SER 58 H SER 58 -21.362 -10.796 2.520 291 HA SER 58 HA SER 58 -23.247 -9.185 1.072 292 HB2 SER 58 HB2 SER 58 -21.993 -11.127 0.074 293 HB3 SER 58 HB3 SER 58 -22.951 -12.220 1.071 294 HG SER 58 HG SER 58 -24.608 -11.947 -0.217 295 H LEU 59 H LEU 59 -23.408 -10.571 4.125 296 HA LEU 59 HA LEU 59 -26.104 -11.374 4.406 297 HB2 LEU 59 HB2 LEU 59 -24.269 -11.804 6.027 298 HB3 LEU 59 HB3 LEU 59 -24.201 -10.103 6.427 299 HG LEU 59 HG LEU 59 -26.757 -11.667 6.936 300 HD11 LEU 59 HD11 LEU 59 -24.380 -11.618 8.825 301 HD12 LEU 59 HD12 LEU 59 -24.980 -13.022 7.939 302 HD13 LEU 59 HD13 LEU 59 -25.984 -12.277 9.179 303 HD21 LEU 59 HD21 LEU 59 -25.530 -9.289 8.398 304 HD22 LEU 59 HD22 LEU 59 -27.065 -10.065 8.800 305 HD23 LEU 59 HD23 LEU 59 -26.882 -9.222 7.264 306 H THR 60 H THR 60 -24.527 -8.213 4.469 307 HA THR 60 HA THR 60 -26.812 -6.723 5.397 308 HB THR 60 HB THR 60 -24.276 -5.662 4.071 309 HG1 THR 60 HG1 THR 60 -23.290 -6.209 5.843 310 HG21 THR 60 HG21 THR 60 -24.719 -3.613 5.399 311 HG22 THR 60 HG22 THR 60 -26.198 -4.331 6.037 312 HG23 THR 60 HG23 THR 60 -26.080 -3.948 4.318 313 H GLU 61 H GLU 61 -28.297 -5.614 4.224 314 HA GLU 61 HA GLU 61 -28.766 -6.315 1.476 315 HB2 GLU 61 HB2 GLU 61 -30.596 -6.026 3.166 316 HB3 GLU 61 HB3 GLU 61 -30.221 -4.307 3.267 317 HG2 GLU 61 HG2 GLU 61 -30.839 -4.066 0.863 318 HG3 GLU 61 HG3 GLU 61 -31.269 -5.772 0.816 319 H ASN 62 H ASN 62 -27.627 -3.438 3.203 320 HA ASN 62 HA ASN 62 -27.370 -1.827 0.766 321 HB2 ASN 62 HB2 ASN 62 -26.457 -1.170 3.602 322 HB3 ASN 62 HB3 ASN 62 -26.564 -0.044 2.253 323 HD21 ASN 62 HD21 ASN 62 -27.783 0.301 4.777 324 HD22 ASN 62 HD22 ASN 62 -29.496 0.346 4.536 325 H SER 63 H SER 63 -25.992 -3.828 0.097 326 HA SER 63 HA SER 63 -23.135 -3.163 0.472 327 HB2 SER 63 HB2 SER 63 -23.615 -5.182 1.853 328 HB3 SER 63 HB3 SER 63 -24.307 -5.994 0.449 329 HG SER 63 HG SER 63 -21.767 -5.906 1.219 330 H ILE 64 H ILE 64 -21.826 -3.663 -1.328 331 HA ILE 64 HA ILE 64 -23.054 -3.578 -3.938 332 HB ILE 64 HB ILE 64 -20.729 -3.662 -4.834 333 HG12 ILE 64 HG12 ILE 64 -19.887 -3.963 -1.904 334 HG13 ILE 64 HG13 ILE 64 -19.701 -5.180 -3.160 335 HG21 ILE 64 HG21 ILE 64 -19.949 -1.500 -3.930 336 HG22 ILE 64 HG22 ILE 64 -21.061 -1.658 -2.568 337 HG23 ILE 64 HG23 ILE 64 -21.693 -1.488 -4.206 338 HD11 ILE 64 HD11 ILE 64 -18.275 -2.540 -2.973 339 HD12 ILE 64 HD12 ILE 64 -18.140 -3.660 -4.329 340 HD13 ILE 64 HD13 ILE 64 -17.610 -4.151 -2.727 341 H LEU 65 H LEU 65 -22.333 -6.071 -1.773 342 HA LEU 65 HA LEU 65 -22.057 -8.194 -3.782 343 HB2 LEU 65 HB2 LEU 65 -22.255 -8.505 -0.762 344 HB3 LEU 65 HB3 LEU 65 -21.631 -9.669 -1.927 345 HG LEU 65 HG LEU 65 -20.319 -7.086 -1.013 346 HD11 LEU 65 HD11 LEU 65 -20.096 -8.942 0.555 347 HD12 LEU 65 HD12 LEU 65 -18.542 -8.558 -0.178 348 HD13 LEU 65 HD13 LEU 65 -19.443 -9.980 -0.718 349 HD21 LEU 65 HD21 LEU 65 -19.901 -7.271 -3.401 350 HD22 LEU 65 HD22 LEU 65 -19.375 -8.945 -3.225 351 HD23 LEU 65 HD23 LEU 65 -18.425 -7.638 -2.514 352 H ALA 66 H ALA 66 -24.540 -6.496 -2.248 353 HA ALA 66 HA ALA 66 -26.471 -8.547 -1.739 354 HB1 ALA 66 HB1 ALA 66 -28.087 -6.703 -1.538 355 HB2 ALA 66 HB2 ALA 66 -26.912 -5.585 -2.238 356 HB3 ALA 66 HB3 ALA 66 -26.594 -6.327 -0.672 357 H GLN 67 H GLN 67 -25.545 -6.764 -4.593 358 HA GLN 67 HA GLN 67 -27.751 -7.543 -6.279 359 HB2 GLN 67 HB2 GLN 67 -26.368 -6.649 -8.127 360 HB3 GLN 67 HB3 GLN 67 -26.401 -5.534 -6.764 361 HG2 GLN 67 HG2 GLN 67 -24.164 -6.455 -6.058 362 HG3 GLN 67 HG3 GLN 67 -24.136 -7.377 -7.563 363 HE21 GLN 67 HE21 GLN 67 -23.880 -4.201 -6.131 364 HE22 GLN 67 HE22 GLN 67 -23.266 -3.401 -7.530 365 H PHE 68 H PHE 68 -25.028 -9.183 -5.061 366 HA PHE 68 HA PHE 68 -25.240 -11.400 -7.017 367 HB2 PHE 68 HB2 PHE 68 -22.926 -10.571 -5.204 368 HB3 PHE 68 HB3 PHE 68 -22.947 -12.036 -6.169 369 HD1 PHE 68 HD1 PHE 68 -23.424 -11.644 -8.777 370 HD2 PHE 68 HD2 PHE 68 -21.799 -8.707 -6.122 371 HE1 PHE 68 HE1 PHE 68 -22.405 -10.470 -10.686 372 HE2 PHE 68 HE2 PHE 68 -20.787 -7.541 -8.048 373 HZ PHE 68 HZ PHE 68 -21.089 -8.421 -10.327 374 H ALA 69 H ALA 69 -26.685 -10.643 -4.297 375 HA ALA 69 HA ALA 69 -25.926 -12.537 -2.318 376 HB1 ALA 69 HB1 ALA 69 -28.014 -11.907 -1.184 377 HB2 ALA 69 HB2 ALA 69 -28.577 -11.108 -2.654 378 HB3 ALA 69 HB3 ALA 69 -27.174 -10.476 -1.792 379 H GLY 70 H GLY 70 -28.091 -12.745 -5.069 380 HA2 GLY 70 HA2 GLY 70 -29.178 -15.370 -4.285 381 HA3 GLY 70 HA3 GLY 70 -29.689 -14.386 -5.649 382 H GLU 71 H GLU 71 -26.301 -14.988 -5.028 383 HA GLU 71 HA GLU 71 -26.119 -16.955 -7.234 384 HB2 GLU 71 HB2 GLU 71 -25.605 -14.676 -8.125 385 HB3 GLU 71 HB3 GLU 71 -24.390 -14.443 -6.882 386 HG2 GLU 71 HG2 GLU 71 -23.376 -14.950 -9.054 387 HG3 GLU 71 HG3 GLU 71 -22.996 -16.197 -7.862 388 H ASP 72 H ASP 72 -24.281 -18.325 -7.107 389 HA ASP 72 HA ASP 72 -23.294 -19.237 -4.675 390 HB2 ASP 72 HB2 ASP 72 -23.151 -20.548 -6.766 391 HB3 ASP 72 HB3 ASP 72 -22.036 -19.382 -7.461 392 HA PRO 73 HA PRO 73 -20.788 -15.788 -3.323 393 HB2 PRO 73 HB2 PRO 73 -19.079 -17.857 -1.936 394 HB3 PRO 73 HB3 PRO 73 -19.855 -16.413 -1.267 395 HG2 PRO 73 HG2 PRO 73 -20.890 -18.821 -0.804 396 HG3 PRO 73 HG3 PRO 73 -21.964 -17.448 -1.155 397 HD2 PRO 73 HD2 PRO 73 -21.091 -19.692 -2.974 398 HD3 PRO 73 HD3 PRO 73 -22.694 -18.942 -2.800 399 H VAL 74 H VAL 74 -19.041 -18.590 -4.645 400 HA VAL 74 HA VAL 74 -16.541 -17.197 -4.991 401 HB VAL 74 HB VAL 74 -17.370 -19.838 -6.285 402 HG11 VAL 74 HG11 VAL 74 -14.614 -18.637 -5.756 403 HG12 VAL 74 HG12 VAL 74 -15.386 -18.820 -7.332 404 HG13 VAL 74 HG13 VAL 74 -14.912 -20.249 -6.412 405 HG21 VAL 74 HG21 VAL 74 -17.628 -19.994 -3.837 406 HG22 VAL 74 HG22 VAL 74 -15.995 -19.372 -3.599 407 HG23 VAL 74 HG23 VAL 74 -16.236 -20.946 -4.360 408 H VAL 75 H VAL 75 -19.110 -18.323 -7.178 409 HA VAL 75 HA VAL 75 -18.093 -17.262 -9.606 410 HB VAL 75 HB VAL 75 -20.997 -17.840 -8.837 411 HG11 VAL 75 HG11 VAL 75 -20.896 -16.407 -10.846 412 HG12 VAL 75 HG12 VAL 75 -21.443 -18.029 -11.269 413 HG13 VAL 75 HG13 VAL 75 -19.784 -17.539 -11.620 414 HG21 VAL 75 HG21 VAL 75 -19.563 -19.817 -8.563 415 HG22 VAL 75 HG22 VAL 75 -18.940 -19.624 -10.204 416 HG23 VAL 75 HG23 VAL 75 -20.638 -20.034 -9.948 417 H ALA 76 H ALA 76 -20.064 -15.925 -7.073 418 HA ALA 76 HA ALA 76 -20.896 -13.479 -8.209 419 HB1 ALA 76 HB1 ALA 76 -21.319 -12.810 -5.849 420 HB2 ALA 76 HB2 ALA 76 -20.460 -14.249 -5.299 421 HB3 ALA 76 HB3 ALA 76 -21.963 -14.414 -6.211 422 H LEU 77 H LEU 77 -18.095 -14.407 -6.236 423 HA LEU 77 HA LEU 77 -16.900 -11.850 -6.002 424 HB2 LEU 77 HB2 LEU 77 -16.405 -13.685 -4.451 425 HB3 LEU 77 HB3 LEU 77 -15.698 -14.630 -5.752 426 HG LEU 77 HG LEU 77 -13.848 -12.976 -5.958 427 HD11 LEU 77 HD11 LEU 77 -14.980 -10.944 -5.201 428 HD12 LEU 77 HD12 LEU 77 -13.508 -11.232 -4.280 429 HD13 LEU 77 HD13 LEU 77 -15.078 -11.588 -3.558 430 HD21 LEU 77 HD21 LEU 77 -14.187 -14.019 -3.132 431 HD22 LEU 77 HD22 LEU 77 -12.672 -13.560 -3.913 432 HD23 LEU 77 HD23 LEU 77 -13.578 -14.943 -4.510 433 H GLU 78 H GLU 78 -16.386 -14.544 -8.283 434 HA GLU 78 HA GLU 78 -14.171 -13.543 -9.708 435 HB2 GLU 78 HB2 GLU 78 -16.425 -15.384 -10.632 436 HB3 GLU 78 HB3 GLU 78 -14.961 -15.079 -11.572 437 HG2 GLU 78 HG2 GLU 78 -13.589 -16.056 -9.791 438 HG3 GLU 78 HG3 GLU 78 -15.019 -16.312 -8.796 439 H ALA 79 H ALA 79 -17.655 -13.322 -10.465 440 HA ALA 79 HA ALA 79 -17.492 -11.632 -12.723 441 HB1 ALA 79 HB1 ALA 79 -19.787 -11.944 -10.757 442 HB2 ALA 79 HB2 ALA 79 -19.493 -12.958 -12.170 443 HB3 ALA 79 HB3 ALA 79 -19.900 -11.255 -12.382 444 H ALA 80 H ALA 80 -17.614 -10.949 -9.277 445 HA ALA 80 HA ALA 80 -18.088 -8.132 -9.441 446 HB1 ALA 80 HB1 ALA 80 -16.966 -9.759 -7.144 447 HB2 ALA 80 HB2 ALA 80 -18.675 -9.458 -7.460 448 HB3 ALA 80 HB3 ALA 80 -17.611 -8.115 -7.045 449 H LEU 81 H LEU 81 -15.169 -10.092 -9.588 450 HA LEU 81 HA LEU 81 -13.319 -7.942 -9.197 451 HB2 LEU 81 HB2 LEU 81 -13.123 -10.790 -10.031 452 HB3 LEU 81 HB3 LEU 81 -11.920 -9.774 -10.786 453 HG LEU 81 HG LEU 81 -10.916 -10.734 -8.842 454 HD11 LEU 81 HD11 LEU 81 -11.620 -7.856 -8.178 455 HD12 LEU 81 HD12 LEU 81 -10.347 -8.384 -9.282 456 HD13 LEU 81 HD13 LEU 81 -10.240 -8.775 -7.569 457 HD21 LEU 81 HD21 LEU 81 -13.245 -9.694 -7.198 458 HD22 LEU 81 HD22 LEU 81 -11.809 -10.514 -6.572 459 HD23 LEU 81 HD23 LEU 81 -12.929 -11.380 -7.620 460 H GLN 82 H GLN 82 -14.862 -9.393 -12.050 461 HA GLN 82 HA GLN 82 -13.530 -7.718 -13.967 462 HB2 GLN 82 HB2 GLN 82 -15.854 -9.662 -14.134 463 HB3 GLN 82 HB3 GLN 82 -15.484 -8.615 -15.492 464 HG2 GLN 82 HG2 GLN 82 -14.472 -10.775 -15.858 465 HG3 GLN 82 HG3 GLN 82 -13.216 -9.563 -15.635 466 HE21 GLN 82 HE21 GLN 82 -14.775 -12.369 -14.257 467 HE22 GLN 82 HE22 GLN 82 -13.574 -12.703 -13.064 468 H PHE 83 H PHE 83 -16.450 -7.421 -12.052 469 HA PHE 83 HA PHE 83 -17.424 -5.113 -13.535 470 HB2 PHE 83 HB2 PHE 83 -19.008 -6.768 -12.501 471 HB3 PHE 83 HB3 PHE 83 -18.462 -6.261 -10.907 472 HD1 PHE 83 HD1 PHE 83 -19.188 -4.109 -13.892 473 HD2 PHE 83 HD2 PHE 83 -20.464 -5.314 -9.993 474 HE1 PHE 83 HE1 PHE 83 -20.914 -2.369 -13.917 475 HE2 PHE 83 HE2 PHE 83 -22.197 -3.567 -10.032 476 HZ PHE 83 HZ PHE 83 -22.429 -2.094 -11.992 477 H GLU 84 H GLU 84 -16.733 -3.103 -13.177 478 HA GLU 84 HA GLU 84 -14.526 -2.641 -11.477 479 HB2 GLU 84 HB2 GLU 84 -14.512 -0.368 -12.396 480 HB3 GLU 84 HB3 GLU 84 -14.695 -1.583 -13.657 481 HG2 GLU 84 HG2 GLU 84 -17.100 -1.096 -13.813 482 HG3 GLU 84 HG3 GLU 84 -16.962 0.094 -12.519 483 H ASP 85 H ASP 85 -17.911 -2.014 -11.062 484 HA ASP 85 HA ASP 85 -17.692 -0.030 -8.997 485 HB2 ASP 85 HB2 ASP 85 -20.032 -1.763 -9.879 486 HB3 ASP 85 HB3 ASP 85 -20.160 -0.443 -8.715 487 H THR 86 H THR 86 -17.531 -3.484 -9.001 488 HA THR 86 HA THR 86 -18.146 -3.640 -6.105 489 HB THR 86 HB THR 86 -18.441 -6.145 -6.626 490 HG1 THR 86 HG1 THR 86 -17.385 -5.767 -8.804 491 HG21 THR 86 HG21 THR 86 -20.332 -4.159 -7.935 492 HG22 THR 86 HG22 THR 86 -20.383 -4.690 -6.253 493 HG23 THR 86 HG23 THR 86 -20.725 -5.835 -7.547 494 H ARG 87 H ARG 87 -15.576 -4.072 -8.420 495 HA ARG 87 HA ARG 87 -13.933 -5.885 -6.944 496 HB2 ARG 87 HB2 ARG 87 -12.097 -5.244 -8.441 497 HB3 ARG 87 HB3 ARG 87 -13.583 -5.498 -9.363 498 HG2 ARG 87 HG2 ARG 87 -13.947 -3.077 -9.484 499 HG3 ARG 87 HG3 ARG 87 -12.508 -2.791 -8.504 500 HD2 ARG 87 HD2 ARG 87 -11.091 -3.735 -10.278 501 HD3 ARG 87 HD3 ARG 87 -12.529 -4.088 -11.250 502 HE ARG 87 HE ARG 87 -12.635 -1.383 -10.653 503 HH11 ARG 87 HH11 ARG 87 -10.440 -3.466 -12.460 504 HH12 ARG 87 HH12 ARG 87 -9.996 -2.203 -13.566 505 HH21 ARG 87 HH21 ARG 87 -12.062 0.208 -12.116 506 HH22 ARG 87 HH22 ARG 87 -10.907 -0.137 -13.365 507 H GLU 88 H GLU 88 -14.671 -2.615 -6.394 508 HA GLU 88 HA GLU 88 -12.415 -1.488 -5.244 509 HB2 GLU 88 HB2 GLU 88 -14.073 -0.077 -3.918 510 HB3 GLU 88 HB3 GLU 88 -14.300 -0.089 -5.662 511 HG2 GLU 88 HG2 GLU 88 -16.242 -1.427 -5.540 512 HG3 GLU 88 HG3 GLU 88 -15.875 -1.972 -3.907 513 H SER 89 H SER 89 -14.932 -3.456 -3.591 514 HA SER 89 HA SER 89 -13.658 -3.252 -1.002 515 HB2 SER 89 HB2 SER 89 -16.137 -3.427 -1.262 516 HB3 SER 89 HB3 SER 89 -15.946 -5.073 -1.861 517 HG SER 89 HG SER 89 -14.902 -5.507 0.227 518 H MET 90 H MET 90 -13.243 -5.261 -3.733 519 HA MET 90 HA MET 90 -12.408 -7.675 -2.452 520 HB2 MET 90 HB2 MET 90 -11.643 -6.737 -5.247 521 HB3 MET 90 HB3 MET 90 -11.611 -8.395 -4.629 522 HG2 MET 90 HG2 MET 90 -14.009 -6.672 -5.251 523 HG3 MET 90 HG3 MET 90 -13.568 -8.233 -5.951 524 HE1 MET 90 HE1 MET 90 -16.311 -8.621 -5.425 525 HE2 MET 90 HE2 MET 90 -16.425 -7.134 -4.482 526 HE3 MET 90 HE3 MET 90 -16.941 -8.666 -3.781 527 H HIS 91 H HIS 91 -10.850 -4.627 -2.960 528 HA HIS 91 HA HIS 91 -8.135 -5.348 -2.589 529 HB2 HIS 91 HB2 HIS 91 -9.656 -2.842 -1.748 530 HB3 HIS 91 HB3 HIS 91 -7.908 -3.000 -1.604 531 HD1 HIS 91 HD1 HIS 91 -6.716 -1.911 -3.478 532 HD2 HIS 91 HD2 HIS 91 -10.436 -3.337 -4.674 533 HE1 HIS 91 HE1 HIS 91 -6.974 -1.213 -5.876 534 HE2 HIS 91 HE2 HIS 91 -9.157 -2.218 -6.616 535 H ALA 92 H ALA 92 -10.794 -4.813 -0.305 536 HA ALA 92 HA ALA 92 -9.268 -5.191 2.107 537 HB1 ALA 92 HB1 ALA 92 -12.278 -5.259 1.674 538 HB2 ALA 92 HB2 ALA 92 -11.325 -3.833 2.091 539 HB3 ALA 92 HB3 ALA 92 -11.464 -5.166 3.239 540 H PHE 93 H PHE 93 -11.319 -7.263 0.056 541 HA PHE 93 HA PHE 93 -11.229 -9.589 1.735 542 HB2 PHE 93 HB2 PHE 93 -11.883 -9.315 -1.231 543 HB3 PHE 93 HB3 PHE 93 -12.058 -10.814 -0.323 544 HD1 PHE 93 HD1 PHE 93 -13.408 -10.329 2.063 545 HD2 PHE 93 HD2 PHE 93 -13.922 -8.225 -1.615 546 HE1 PHE 93 HE1 PHE 93 -15.676 -9.668 2.742 547 HE2 PHE 93 HE2 PHE 93 -16.188 -7.571 -0.927 548 HZ PHE 93 HZ PHE 93 -17.064 -8.291 1.255 549 H CYS 94 H CYS 94 -9.044 -8.223 -0.614 550 HA CYS 94 HA CYS 94 -7.478 -10.569 -1.134 551 HB2 CYS 94 HB2 CYS 94 -7.465 -8.622 -2.687 552 HB3 CYS 94 HB3 CYS 94 -6.713 -7.632 -1.439 553 HG CYS 94 HG CYS 94 -5.152 -10.483 -2.422 554 H VAL 95 H VAL 95 -6.806 -11.543 0.703 555 HA VAL 95 HA VAL 95 -5.671 -10.232 2.981 556 HB VAL 95 HB VAL 95 -5.086 -12.483 3.780 557 HG11 VAL 95 HG11 VAL 95 -7.844 -12.455 2.476 558 HG12 VAL 95 HG12 VAL 95 -7.430 -11.779 4.053 559 HG13 VAL 95 HG13 VAL 95 -7.341 -13.521 3.794 560 HG21 VAL 95 HG21 VAL 95 -4.241 -13.482 1.685 561 HG22 VAL 95 HG22 VAL 95 -5.869 -13.502 1.009 562 HG23 VAL 95 HG23 VAL 95 -5.479 -14.518 2.396 563 H GLY 96 H GLY 96 -4.443 -11.388 -0.044 564 HA2 GLY 96 HA2 GLY 96 -2.057 -9.948 -0.019 565 HA3 GLY 96 HA3 GLY 96 -1.670 -11.591 0.507 566 H GLN 97 H GLN 97 -0.462 -10.859 -1.707 567 HA GLN 97 HA GLN 97 -1.950 -11.624 -4.101 568 HB2 GLN 97 HB2 GLN 97 -0.201 -9.840 -4.192 569 HB3 GLN 97 HB3 GLN 97 1.021 -11.017 -3.719 570 HG2 GLN 97 HG2 GLN 97 0.485 -12.302 -5.818 571 HG3 GLN 97 HG3 GLN 97 -0.574 -10.981 -6.305 572 HE21 GLN 97 HE21 GLN 97 1.309 -8.915 -5.214 573 HE22 GLN 97 HE22 GLN 97 2.613 -8.855 -6.345 574 H TYR 98 H TYR 98 -1.846 -13.635 -5.047 575 HA TYR 98 HA TYR 98 -0.711 -15.840 -3.581 576 HB2 TYR 98 HB2 TYR 98 -2.840 -16.121 -4.794 577 HB3 TYR 98 HB3 TYR 98 -2.039 -15.783 -6.323 578 HD1 TYR 98 HD1 TYR 98 -1.805 -18.152 -3.399 579 HD2 TYR 98 HD2 TYR 98 -1.324 -17.652 -7.620 580 HE1 TYR 98 HE1 TYR 98 -1.318 -20.546 -3.640 581 HE2 TYR 98 HE2 TYR 98 -0.846 -20.051 -7.843 582 HH TYR 98 HH TYR 98 -1.477 -22.288 -5.495 583 H LEU 99 H LEU 99 1.250 -16.731 -3.883 584 HA LEU 99 HA LEU 99 2.588 -16.509 -6.496 585 HB2 LEU 99 HB2 LEU 99 3.546 -15.141 -4.300 586 HB3 LEU 99 HB3 LEU 99 4.382 -16.664 -4.099 587 HG LEU 99 HG LEU 99 5.841 -15.159 -5.277 588 HD11 LEU 99 HD11 LEU 99 4.764 -17.114 -7.323 589 HD12 LEU 99 HD12 LEU 99 5.949 -17.471 -6.068 590 HD13 LEU 99 HD13 LEU 99 6.350 -16.331 -7.350 591 HD21 LEU 99 HD21 LEU 99 3.629 -14.700 -7.301 592 HD22 LEU 99 HD22 LEU 99 5.271 -14.058 -7.395 593 HD23 LEU 99 HD23 LEU 99 4.202 -13.547 -6.089 594 H GLU 100 H GLU 100 2.982 -18.464 -7.285 595 HA GLU 100 HA GLU 100 2.407 -20.879 -5.903 596 HB2 GLU 100 HB2 GLU 100 3.888 -20.449 -8.525 597 HB3 GLU 100 HB3 GLU 100 3.230 -21.978 -7.982 598 HG2 GLU 100 HG2 GLU 100 0.960 -21.076 -8.131 599 HG3 GLU 100 HG3 GLU 100 1.602 -19.502 -8.605 600 HA PRO 101 HA PRO 101 6.450 -21.575 -3.944 601 HB2 PRO 101 HB2 PRO 101 6.283 -24.364 -3.739 602 HB3 PRO 101 HB3 PRO 101 5.574 -23.221 -2.589 603 HG2 PRO 101 HG2 PRO 101 4.269 -24.632 -4.915 604 HG3 PRO 101 HG3 PRO 101 3.656 -24.383 -3.263 605 HD2 PRO 101 HD2 PRO 101 2.793 -22.837 -5.275 606 HD3 PRO 101 HD3 PRO 101 3.096 -22.136 -3.670 607 H ASP 102 H ASP 102 5.402 -23.066 -6.919 608 HA ASP 102 HA ASP 102 8.005 -24.065 -7.766 609 HB2 ASP 102 HB2 ASP 102 6.015 -25.351 -8.352 610 HB3 ASP 102 HB3 ASP 102 5.264 -23.948 -9.095 611 H GLN 103 H GLN 103 5.852 -21.332 -8.460 612 HA GLN 103 HA GLN 103 7.032 -20.328 -10.823 613 HB2 GLN 103 HB2 GLN 103 4.751 -19.737 -9.982 614 HB3 GLN 103 HB3 GLN 103 5.476 -18.812 -8.679 615 HG2 GLN 103 HG2 GLN 103 4.735 -17.274 -10.325 616 HG3 GLN 103 HG3 GLN 103 6.497 -17.299 -10.413 617 HE21 GLN 103 HE21 GLN 103 4.299 -19.736 -11.835 618 HE22 GLN 103 HE22 GLN 103 4.682 -19.367 -13.477 619 H GLU 104 H GLU 104 7.804 -19.854 -7.447 620 HA GLU 104 HA GLU 104 9.510 -17.621 -7.553 621 HB2 GLU 104 HB2 GLU 104 9.490 -20.010 -5.662 622 HB3 GLU 104 HB3 GLU 104 10.465 -18.559 -5.404 623 HG2 GLU 104 HG2 GLU 104 8.468 -17.181 -5.243 624 HG3 GLU 104 HG3 GLU 104 7.444 -18.560 -5.653 625 H GLY 105 H GLY 105 10.153 -21.048 -8.173 626 HA2 GLY 105 HA2 GLY 105 13.029 -20.696 -8.567 627 HA3 GLY 105 HA3 GLY 105 12.094 -22.166 -8.809 628 H VAL 106 H VAL 106 10.817 -22.392 -10.734 629 HA VAL 106 HA VAL 106 11.965 -21.039 -13.057 630 HB VAL 106 HB VAL 106 11.742 -23.437 -13.291 631 HG11 VAL 106 HG11 VAL 106 9.591 -24.650 -13.241 632 HG12 VAL 106 HG12 VAL 106 8.765 -23.168 -12.752 633 HG13 VAL 106 HG13 VAL 106 9.958 -23.906 -11.683 634 HG21 VAL 106 HG21 VAL 106 10.435 -23.609 -15.389 635 HG22 VAL 106 HG22 VAL 106 11.375 -22.118 -15.349 636 HG23 VAL 106 HG23 VAL 106 9.639 -22.073 -15.032 637 H THR 107 H THR 107 11.149 -19.071 -13.447 638 HA THR 107 HA THR 107 8.292 -18.497 -13.039 639 HB THR 107 HB THR 107 9.830 -16.865 -12.074 640 HG1 THR 107 HG1 THR 107 7.806 -16.175 -13.014 641 HG21 THR 107 HG21 THR 107 11.256 -15.392 -13.450 642 HG22 THR 107 HG22 THR 107 10.846 -16.323 -14.891 643 HG23 THR 107 HG23 THR 107 11.771 -17.079 -13.592 644 H ILE 108 H ILE 108 6.892 -18.339 -14.688 645 HA ILE 108 HA ILE 108 7.886 -18.626 -17.456 646 HB ILE 108 HB ILE 108 5.118 -19.224 -16.313 647 HG12 ILE 108 HG12 ILE 108 7.369 -21.126 -17.150 648 HG13 ILE 108 HG13 ILE 108 6.828 -20.835 -15.502 649 HG21 ILE 108 HG21 ILE 108 6.189 -19.756 -19.117 650 HG22 ILE 108 HG22 ILE 108 4.963 -18.562 -18.685 651 HG23 ILE 108 HG23 ILE 108 4.622 -20.281 -18.503 652 HD11 ILE 108 HD11 ILE 108 5.241 -22.180 -17.692 653 HD12 ILE 108 HD12 ILE 108 4.663 -21.869 -16.051 654 HD13 ILE 108 HD13 ILE 108 6.024 -22.956 -16.318 655 HA PRO 109 HA PRO 109 6.375 -14.297 -17.761 656 HB2 PRO 109 HB2 PRO 109 7.783 -13.577 -19.958 657 HB3 PRO 109 HB3 PRO 109 8.574 -13.785 -18.388 658 HG2 PRO 109 HG2 PRO 109 8.476 -15.681 -20.731 659 HG3 PRO 109 HG3 PRO 109 9.854 -15.252 -19.697 660 HD2 PRO 109 HD2 PRO 109 8.329 -17.545 -19.367 661 HD3 PRO 109 HD3 PRO 109 9.247 -16.782 -18.054 662 H ASP 110 H ASP 110 5.280 -13.051 -19.567 663 HA ASP 110 HA ASP 110 3.209 -14.589 -20.810 664 HB2 ASP 110 HB2 ASP 110 3.959 -11.644 -21.067 665 HB3 ASP 110 HB3 ASP 110 2.542 -12.351 -21.836 666 H LEU 111 H LEU 111 4.341 -16.031 -22.082 667 HA LEU 111 HA LEU 111 4.632 -15.492 -24.823 668 HB2 LEU 111 HB2 LEU 111 6.797 -14.416 -23.993 669 HB3 LEU 111 HB3 LEU 111 7.297 -15.984 -23.390 670 HG LEU 111 HG LEU 111 7.248 -16.858 -25.763 671 HD11 LEU 111 HD11 LEU 111 6.757 -13.952 -26.513 672 HD12 LEU 111 HD12 LEU 111 5.637 -15.296 -26.750 673 HD13 LEU 111 HD13 LEU 111 7.157 -15.253 -27.638 674 HD21 LEU 111 HD21 LEU 111 9.364 -16.126 -24.748 675 HD22 LEU 111 HD22 LEU 111 9.076 -14.472 -25.294 676 HD23 LEU 111 HD23 LEU 111 9.341 -15.760 -26.472 677 H GLY 112 H GLY 112 6.139 -17.462 -22.256 678 HA2 GLY 112 HA2 GLY 112 5.968 -19.691 -21.722 679 HA3 GLY 112 HA3 GLY 112 4.780 -19.904 -23.001 Start of MODEL 3 1 H GLU 21 H GLU 21 2.540 -1.902 -0.046 2 HA GLU 21 HA GLU 21 4.916 -1.197 -1.682 3 HB2 GLU 21 HB2 GLU 21 4.596 -1.449 1.340 4 HB3 GLU 21 HB3 GLU 21 6.124 -1.166 0.510 5 HG2 GLU 21 HG2 GLU 21 5.359 1.025 -0.235 6 HG3 GLU 21 HG3 GLU 21 3.760 0.736 0.463 7 H LYS 22 H LYS 22 4.072 -3.318 1.057 8 HA LYS 22 HA LYS 22 5.768 -5.460 0.025 9 HB2 LYS 22 HB2 LYS 22 4.274 -5.192 2.677 10 HB3 LYS 22 HB3 LYS 22 5.418 -6.473 2.275 11 HG2 LYS 22 HG2 LYS 22 6.130 -3.518 2.416 12 HG3 LYS 22 HG3 LYS 22 6.351 -4.658 3.748 13 HD2 LYS 22 HD2 LYS 22 7.655 -4.937 1.007 14 HD3 LYS 22 HD3 LYS 22 8.436 -4.210 2.415 15 HE2 LYS 22 HE2 LYS 22 8.244 -6.353 3.635 16 HE3 LYS 22 HE3 LYS 22 7.435 -7.080 2.243 17 HZ1 LYS 22 HZ1 LYS 22 10.196 -6.000 2.234 18 HZ2 LYS 22 HZ2 LYS 22 9.420 -6.763 0.943 19 HZ3 LYS 22 HZ3 LYS 22 9.791 -7.639 2.342 20 H VAL 23 H VAL 23 4.645 -6.388 -1.620 21 HA VAL 23 HA VAL 23 1.917 -7.175 -1.510 22 HB VAL 23 HB VAL 23 2.969 -6.843 -3.672 23 HG11 VAL 23 HG11 VAL 23 5.290 -7.475 -3.201 24 HG12 VAL 23 HG12 VAL 23 4.698 -8.316 -4.634 25 HG13 VAL 23 HG13 VAL 23 4.831 -9.177 -3.098 26 HG21 VAL 23 HG21 VAL 23 1.102 -8.427 -3.585 27 HG22 VAL 23 HG22 VAL 23 2.215 -9.767 -3.314 28 HG23 VAL 23 HG23 VAL 23 2.241 -8.896 -4.850 29 H THR 24 H THR 24 1.168 -8.611 -0.088 30 HA THR 24 HA THR 24 2.793 -10.525 1.279 31 HB THR 24 HB THR 24 -0.250 -10.252 1.205 32 HG1 THR 24 HG1 THR 24 1.795 -8.928 2.565 33 HG21 THR 24 HG21 THR 24 0.390 -12.483 2.062 34 HG22 THR 24 HG22 THR 24 -0.217 -11.475 3.370 35 HG23 THR 24 HG23 THR 24 1.519 -11.738 3.209 36 H LEU 25 H LEU 25 3.570 -12.218 0.249 37 HA LEU 25 HA LEU 25 2.238 -13.463 -2.013 38 HB2 LEU 25 HB2 LEU 25 4.923 -14.018 -0.690 39 HB3 LEU 25 HB3 LEU 25 4.363 -14.758 -2.187 40 HG LEU 25 HG LEU 25 4.799 -11.758 -1.820 41 HD11 LEU 25 HD11 LEU 25 6.639 -13.759 -3.162 42 HD12 LEU 25 HD12 LEU 25 6.944 -12.892 -1.657 43 HD13 LEU 25 HD13 LEU 25 6.834 -12.003 -3.174 44 HD21 LEU 25 HD21 LEU 25 4.251 -13.355 -4.358 45 HD22 LEU 25 HD22 LEU 25 4.600 -11.627 -4.279 46 HD23 LEU 25 HD23 LEU 25 3.124 -12.255 -3.554 47 H VAL 26 H VAL 26 0.644 -14.788 -1.507 48 HA VAL 26 HA VAL 26 0.775 -16.597 0.818 49 HB VAL 26 HB VAL 26 -1.617 -15.907 -0.949 50 HG11 VAL 26 HG11 VAL 26 -3.003 -16.870 0.856 51 HG12 VAL 26 HG12 VAL 26 -1.546 -17.330 1.739 52 HG13 VAL 26 HG13 VAL 26 -1.899 -18.066 0.173 53 HG21 VAL 26 HG21 VAL 26 -0.906 -14.719 1.762 54 HG22 VAL 26 HG22 VAL 26 -2.391 -14.417 0.857 55 HG23 VAL 26 HG23 VAL 26 -0.843 -13.883 0.207 56 H ARG 27 H ARG 27 1.061 -18.729 0.480 57 HA ARG 27 HA ARG 27 1.046 -19.811 -2.269 58 HB2 ARG 27 HB2 ARG 27 2.352 -20.953 0.246 59 HB3 ARG 27 HB3 ARG 27 2.472 -21.622 -1.382 60 HG2 ARG 27 HG2 ARG 27 3.605 -19.533 -2.134 61 HG3 ARG 27 HG3 ARG 27 3.542 -18.929 -0.477 62 HD2 ARG 27 HD2 ARG 27 4.921 -20.927 0.218 63 HD3 ARG 27 HD3 ARG 27 5.092 -21.338 -1.498 64 HE ARG 27 HE ARG 27 5.837 -18.624 -0.910 65 HH11 ARG 27 HH11 ARG 27 7.105 -21.911 -0.955 66 HH12 ARG 27 HH12 ARG 27 8.757 -21.384 -1.022 67 HH21 ARG 27 HH21 ARG 27 7.975 -17.966 -0.946 68 HH22 ARG 27 HH22 ARG 27 9.245 -19.146 -1.013 69 H ILE 28 H ILE 28 0.483 -22.259 -2.274 70 HA ILE 28 HA ILE 28 -2.303 -22.376 -1.727 71 HB ILE 28 HB ILE 28 -1.386 -23.374 -3.741 72 HG12 ILE 28 HG12 ILE 28 -2.621 -25.586 -2.024 73 HG13 ILE 28 HG13 ILE 28 -3.534 -24.295 -2.799 74 HG21 ILE 28 HG21 ILE 28 0.027 -25.413 -1.992 75 HG22 ILE 28 HG22 ILE 28 0.786 -24.131 -2.939 76 HG23 ILE 28 HG23 ILE 28 -0.052 -25.446 -3.759 77 HD11 ILE 28 HD11 ILE 28 -2.861 -25.117 -4.992 78 HD12 ILE 28 HD12 ILE 28 -3.662 -26.374 -4.051 79 HD13 ILE 28 HD13 ILE 28 -1.908 -26.395 -4.232 80 H ALA 29 H ALA 29 0.507 -23.742 -0.108 81 HA ALA 29 HA ALA 29 -0.697 -25.652 1.568 82 HB1 ALA 29 HB1 ALA 29 1.283 -25.396 3.011 83 HB2 ALA 29 HB2 ALA 29 1.707 -23.894 2.183 84 HB3 ALA 29 HB3 ALA 29 1.744 -25.425 1.308 85 H ASP 30 H ASP 30 -0.430 -22.157 1.873 86 HA ASP 30 HA ASP 30 -1.338 -21.900 4.561 87 HB2 ASP 30 HB2 ASP 30 -0.040 -20.125 3.283 88 HB3 ASP 30 HB3 ASP 30 -1.491 -19.804 2.345 89 H LEU 31 H LEU 31 -2.934 -21.773 1.378 90 HA LEU 31 HA LEU 31 -5.551 -21.064 2.080 91 HB2 LEU 31 HB2 LEU 31 -4.688 -23.016 -0.100 92 HB3 LEU 31 HB3 LEU 31 -6.264 -22.241 -0.004 93 HG LEU 31 HG LEU 31 -3.607 -20.840 -0.520 94 HD11 LEU 31 HD11 LEU 31 -4.503 -20.404 -2.768 95 HD12 LEU 31 HD12 LEU 31 -5.952 -21.341 -2.381 96 HD13 LEU 31 HD13 LEU 31 -4.376 -22.134 -2.445 97 HD21 LEU 31 HD21 LEU 31 -5.074 -19.376 0.771 98 HD22 LEU 31 HD22 LEU 31 -6.397 -19.648 -0.367 99 HD23 LEU 31 HD23 LEU 31 -4.936 -18.800 -0.887 100 H GLU 32 H GLU 32 -3.975 -24.223 2.103 101 HA GLU 32 HA GLU 32 -6.235 -25.843 2.607 102 HB2 GLU 32 HB2 GLU 32 -3.380 -26.514 3.442 103 HB3 GLU 32 HB3 GLU 32 -4.677 -27.642 3.042 104 HG2 GLU 32 HG2 GLU 32 -3.138 -25.837 1.153 105 HG3 GLU 32 HG3 GLU 32 -3.054 -27.593 1.259 106 H ASN 33 H ASN 33 -3.848 -24.306 4.702 107 HA ASN 33 HA ASN 33 -4.557 -25.365 7.206 108 HB2 ASN 33 HB2 ASN 33 -3.430 -22.606 6.547 109 HB3 ASN 33 HB3 ASN 33 -3.430 -23.339 8.149 110 HD21 ASN 33 HD21 ASN 33 -1.257 -22.443 6.317 111 HD22 ASN 33 HD22 ASN 33 -0.185 -23.790 6.211 112 H HIS 34 H HIS 34 -5.606 -22.364 5.589 113 HA HIS 34 HA HIS 34 -7.368 -21.463 7.623 114 HB2 HIS 34 HB2 HIS 34 -7.180 -20.740 4.670 115 HB3 HIS 34 HB3 HIS 34 -8.292 -19.947 5.784 116 HD1 HIS 34 HD1 HIS 34 -7.225 -18.500 7.703 117 HD2 HIS 34 HD2 HIS 34 -4.559 -19.850 4.831 118 HE1 HIS 34 HE1 HIS 34 -5.157 -17.133 8.019 119 HE2 HIS 34 HE2 HIS 34 -3.534 -17.995 6.286 120 H ASN 35 H ASN 35 -7.840 -23.516 4.787 121 HA ASN 35 HA ASN 35 -10.641 -23.764 4.810 122 HB2 ASN 35 HB2 ASN 35 -9.285 -24.634 2.959 123 HB3 ASN 35 HB3 ASN 35 -8.506 -25.796 4.021 124 HD21 ASN 35 HD21 ASN 35 -9.626 -27.702 4.589 125 HD22 ASN 35 HD22 ASN 35 -11.074 -28.199 3.782 126 H ASN 36 H ASN 36 -8.128 -25.414 6.694 127 HA ASN 36 HA ASN 36 -9.861 -27.299 8.001 128 HB2 ASN 36 HB2 ASN 36 -6.997 -26.476 8.656 129 HB3 ASN 36 HB3 ASN 36 -7.830 -27.878 9.319 130 HD21 ASN 36 HD21 ASN 36 -5.379 -27.826 7.772 131 HD22 ASN 36 HD22 ASN 36 -5.654 -28.773 6.358 132 H ASP 37 H ASP 37 -8.901 -24.002 8.659 133 HA ASP 37 HA ASP 37 -9.945 -24.008 11.388 134 HB2 ASP 37 HB2 ASP 37 -8.982 -21.777 9.544 135 HB3 ASP 37 HB3 ASP 37 -9.729 -21.428 11.100 136 H GLY 38 H GLY 38 -11.221 -23.735 8.215 137 HA2 GLY 38 HA2 GLY 38 -13.567 -23.786 7.773 138 HA3 GLY 38 HA3 GLY 38 -13.865 -22.858 9.234 139 H GLY 39 H GLY 39 -11.341 -21.245 8.203 140 HA2 GLY 39 HA2 GLY 39 -12.805 -19.133 6.888 141 HA3 GLY 39 HA3 GLY 39 -11.088 -19.162 7.254 142 H PHE 40 H PHE 40 -13.532 -19.999 4.929 143 HA PHE 40 HA PHE 40 -11.823 -21.488 3.160 144 HB2 PHE 40 HB2 PHE 40 -14.318 -21.833 3.411 145 HB3 PHE 40 HB3 PHE 40 -14.574 -20.288 2.616 146 HD1 PHE 40 HD1 PHE 40 -13.411 -23.782 2.138 147 HD2 PHE 40 HD2 PHE 40 -14.351 -20.104 0.177 148 HE1 PHE 40 HE1 PHE 40 -13.391 -24.925 -0.047 149 HE2 PHE 40 HE2 PHE 40 -14.337 -21.252 -1.997 150 HZ PHE 40 HZ PHE 40 -13.856 -23.665 -2.109 151 H TRP 41 H TRP 41 -10.246 -20.453 2.124 152 HA TRP 41 HA TRP 41 -10.623 -17.774 0.962 153 HB2 TRP 41 HB2 TRP 41 -8.148 -19.456 1.534 154 HB3 TRP 41 HB3 TRP 41 -8.077 -18.031 0.506 155 HD1 TRP 41 HD1 TRP 41 -10.387 -17.421 3.393 156 HE1 TRP 41 HE1 TRP 41 -9.198 -15.970 5.155 157 HE3 TRP 41 HE3 TRP 41 -5.582 -17.755 1.668 158 HZ2 TRP 41 HZ2 TRP 41 -6.608 -15.086 5.743 159 HZ3 TRP 41 HZ3 TRP 41 -3.796 -16.600 2.898 160 HH2 TRP 41 HH2 TRP 41 -4.304 -15.277 4.894 161 H THR 42 H THR 42 -9.238 -17.620 -1.198 162 HA THR 42 HA THR 42 -9.505 -19.844 -3.027 163 HB THR 42 HB THR 42 -11.839 -19.043 -3.043 164 HG1 THR 42 HG1 THR 42 -10.833 -19.722 -5.041 165 HG21 THR 42 HG21 THR 42 -12.445 -16.777 -3.796 166 HG22 THR 42 HG22 THR 42 -10.738 -16.332 -3.884 167 HG23 THR 42 HG23 THR 42 -11.478 -16.706 -2.324 168 H VAL 43 H VAL 43 -8.350 -19.480 -4.971 169 HA VAL 43 HA VAL 43 -6.761 -16.992 -5.141 170 HB VAL 43 HB VAL 43 -5.264 -18.841 -5.112 171 HG11 VAL 43 HG11 VAL 43 -5.368 -20.798 -6.626 172 HG12 VAL 43 HG12 VAL 43 -6.909 -20.218 -7.267 173 HG13 VAL 43 HG13 VAL 43 -6.782 -20.698 -5.573 174 HG21 VAL 43 HG21 VAL 43 -4.705 -17.119 -6.782 175 HG22 VAL 43 HG22 VAL 43 -5.582 -18.014 -8.025 176 HG23 VAL 43 HG23 VAL 43 -4.128 -18.706 -7.304 177 H ILE 44 H ILE 44 -7.633 -15.511 -6.385 178 HA ILE 44 HA ILE 44 -9.077 -16.217 -8.882 179 HB ILE 44 HB ILE 44 -9.766 -14.011 -6.884 180 HG12 ILE 44 HG12 ILE 44 -11.353 -16.464 -7.783 181 HG13 ILE 44 HG13 ILE 44 -10.581 -16.254 -6.216 182 HG21 ILE 44 HG21 ILE 44 -11.057 -14.521 -9.598 183 HG22 ILE 44 HG22 ILE 44 -10.069 -13.124 -9.160 184 HG23 ILE 44 HG23 ILE 44 -11.634 -13.375 -8.388 185 HD11 ILE 44 HD11 ILE 44 -12.905 -14.651 -7.279 186 HD12 ILE 44 HD12 ILE 44 -12.133 -14.434 -5.705 187 HD13 ILE 44 HD13 ILE 44 -12.968 -15.940 -6.079 188 H ASP 45 H ASP 45 -7.926 -15.577 -10.529 189 HA ASP 45 HA ASP 45 -6.578 -14.499 -11.963 190 HB2 ASP 45 HB2 ASP 45 -8.567 -12.912 -11.792 191 HB3 ASP 45 HB3 ASP 45 -7.620 -11.943 -10.670 192 H GLY 46 H GLY 46 -5.027 -15.485 -10.104 193 HA2 GLY 46 HA2 GLY 46 -2.798 -15.426 -9.539 194 HA3 GLY 46 HA3 GLY 46 -2.696 -13.811 -10.209 195 H LYS 47 H LYS 47 -5.160 -13.704 -8.000 196 HA LYS 47 HA LYS 47 -3.413 -12.840 -5.763 197 HB2 LYS 47 HB2 LYS 47 -6.241 -11.939 -6.468 198 HB3 LYS 47 HB3 LYS 47 -5.317 -11.387 -5.071 199 HG2 LYS 47 HG2 LYS 47 -4.604 -10.904 -7.980 200 HG3 LYS 47 HG3 LYS 47 -5.378 -9.736 -6.899 201 HD2 LYS 47 HD2 LYS 47 -3.370 -9.774 -5.445 202 HD3 LYS 47 HD3 LYS 47 -2.599 -10.934 -6.537 203 HE2 LYS 47 HE2 LYS 47 -3.370 -8.067 -7.165 204 HE3 LYS 47 HE3 LYS 47 -1.739 -8.725 -7.019 205 HZ1 LYS 47 HZ1 LYS 47 -2.232 -10.153 -8.936 206 HZ2 LYS 47 HZ2 LYS 47 -2.306 -8.514 -9.321 207 HZ3 LYS 47 HZ3 LYS 47 -3.733 -9.395 -9.117 208 H VAL 48 H VAL 48 -4.450 -13.118 -3.605 209 HA VAL 48 HA VAL 48 -6.301 -15.420 -3.466 210 HB VAL 48 HB VAL 48 -4.276 -14.539 -1.359 211 HG11 VAL 48 HG11 VAL 48 -4.979 -16.561 -0.103 212 HG12 VAL 48 HG12 VAL 48 -6.235 -16.872 -1.306 213 HG13 VAL 48 HG13 VAL 48 -6.315 -15.423 -0.300 214 HG21 VAL 48 HG21 VAL 48 -3.197 -15.659 -3.258 215 HG22 VAL 48 HG22 VAL 48 -4.315 -17.016 -3.123 216 HG23 VAL 48 HG23 VAL 48 -3.157 -16.696 -1.832 217 H TYR 49 H TYR 49 -8.238 -14.893 -2.876 218 HA TYR 49 HA TYR 49 -8.801 -12.577 -1.114 219 HB2 TYR 49 HB2 TYR 49 -10.574 -13.937 -3.203 220 HB3 TYR 49 HB3 TYR 49 -11.085 -12.629 -2.146 221 HD1 TYR 49 HD1 TYR 49 -8.819 -13.477 -4.982 222 HD2 TYR 49 HD2 TYR 49 -10.652 -10.326 -2.748 223 HE1 TYR 49 HE1 TYR 49 -8.082 -11.848 -6.665 224 HE2 TYR 49 HE2 TYR 49 -9.910 -8.705 -4.440 225 HH TYR 49 HH TYR 49 -8.183 -8.492 -6.149 226 H ASP 50 H ASP 50 -10.805 -12.954 0.209 227 HA ASP 50 HA ASP 50 -11.011 -15.722 1.239 228 HB2 ASP 50 HB2 ASP 50 -12.183 -14.702 3.160 229 HB3 ASP 50 HB3 ASP 50 -10.646 -13.884 2.897 230 H ILE 51 H ILE 51 -13.085 -16.639 1.517 231 HA ILE 51 HA ILE 51 -15.378 -15.482 0.041 232 HB ILE 51 HB ILE 51 -14.652 -18.397 0.567 233 HG12 ILE 51 HG12 ILE 51 -13.484 -17.435 -1.366 234 HG13 ILE 51 HG13 ILE 51 -14.679 -18.601 -1.931 235 HG21 ILE 51 HG21 ILE 51 -17.058 -18.219 0.928 236 HG22 ILE 51 HG22 ILE 51 -16.744 -19.074 -0.581 237 HG23 ILE 51 HG23 ILE 51 -17.265 -17.389 -0.617 238 HD11 ILE 51 HD11 ILE 51 -14.950 -15.595 -1.959 239 HD12 ILE 51 HD12 ILE 51 -16.192 -16.736 -2.485 240 HD13 ILE 51 HD13 ILE 51 -14.654 -16.648 -3.339 241 H LYS 52 H LYS 52 -14.124 -16.838 2.976 242 HA LYS 52 HA LYS 52 -16.342 -17.379 4.530 243 HB2 LYS 52 HB2 LYS 52 -14.002 -17.884 5.163 244 HB3 LYS 52 HB3 LYS 52 -13.673 -16.163 5.357 245 HG2 LYS 52 HG2 LYS 52 -15.670 -16.328 7.132 246 HG3 LYS 52 HG3 LYS 52 -15.232 -18.037 7.131 247 HD2 LYS 52 HD2 LYS 52 -14.023 -16.955 8.923 248 HD3 LYS 52 HD3 LYS 52 -12.871 -17.386 7.655 249 HE2 LYS 52 HE2 LYS 52 -12.856 -15.059 6.848 250 HE3 LYS 52 HE3 LYS 52 -14.074 -14.615 8.046 251 HZ1 LYS 52 HZ1 LYS 52 -12.507 -15.110 9.792 252 HZ2 LYS 52 HZ2 LYS 52 -11.833 -13.993 8.717 253 HZ3 LYS 52 HZ3 LYS 52 -11.352 -15.613 8.665 254 H ASP 53 H ASP 53 -14.511 -14.277 4.484 255 HA ASP 53 HA ASP 53 -16.453 -12.886 6.101 256 HB2 ASP 53 HB2 ASP 53 -14.064 -12.280 6.274 257 HB3 ASP 53 HB3 ASP 53 -14.023 -11.851 4.571 258 H PHE 54 H PHE 54 -15.675 -13.130 2.668 259 HA PHE 54 HA PHE 54 -17.096 -11.086 1.484 260 HB2 PHE 54 HB2 PHE 54 -15.608 -12.581 0.234 261 HB3 PHE 54 HB3 PHE 54 -16.671 -13.950 0.526 262 HD1 PHE 54 HD1 PHE 54 -18.767 -14.224 -0.766 263 HD2 PHE 54 HD2 PHE 54 -16.160 -10.908 -1.480 264 HE1 PHE 54 HE1 PHE 54 -19.945 -13.744 -2.872 265 HE2 PHE 54 HE2 PHE 54 -17.353 -10.442 -3.580 266 HZ PHE 54 HZ PHE 54 -19.238 -11.853 -4.280 267 H GLN 55 H GLN 55 -18.333 -14.338 2.232 268 HA GLN 55 HA GLN 55 -20.974 -13.902 1.285 269 HB2 GLN 55 HB2 GLN 55 -21.495 -16.094 2.209 270 HB3 GLN 55 HB3 GLN 55 -19.925 -16.136 1.413 271 HG2 GLN 55 HG2 GLN 55 -18.847 -15.908 3.680 272 HG3 GLN 55 HG3 GLN 55 -20.447 -16.060 4.403 273 HE21 GLN 55 HE21 GLN 55 -17.874 -17.728 2.730 274 HE22 GLN 55 HE22 GLN 55 -18.455 -19.331 2.999 275 H THR 56 H THR 56 -19.409 -13.405 4.367 276 HA THR 56 HA THR 56 -21.723 -12.991 5.979 277 HB THR 56 HB THR 56 -18.943 -11.789 6.376 278 HG1 THR 56 HG1 THR 56 -18.779 -14.021 6.227 279 HG21 THR 56 HG21 THR 56 -20.672 -10.780 7.853 280 HG22 THR 56 HG22 THR 56 -19.514 -11.738 8.773 281 HG23 THR 56 HG23 THR 56 -21.114 -12.393 8.428 282 H GLN 57 H GLN 57 -19.652 -10.821 4.029 283 HA GLN 57 HA GLN 57 -20.979 -8.388 4.672 284 HB2 GLN 57 HB2 GLN 57 -19.318 -9.037 2.199 285 HB3 GLN 57 HB3 GLN 57 -19.726 -7.429 2.783 286 HG2 GLN 57 HG2 GLN 57 -17.934 -9.442 4.166 287 HG3 GLN 57 HG3 GLN 57 -17.413 -7.997 3.312 288 HE21 GLN 57 HE21 GLN 57 -16.960 -8.817 6.071 289 HE22 GLN 57 HE22 GLN 57 -17.555 -7.534 7.058 290 H SER 58 H SER 58 -21.517 -10.922 2.327 291 HA SER 58 HA SER 58 -23.446 -9.575 0.699 292 HB2 SER 58 HB2 SER 58 -22.185 -11.515 -0.139 293 HB3 SER 58 HB3 SER 58 -22.903 -12.548 1.093 294 HG SER 58 HG SER 58 -24.147 -11.347 -1.140 295 H LEU 59 H LEU 59 -23.555 -11.253 3.755 296 HA LEU 59 HA LEU 59 -26.294 -12.005 3.819 297 HB2 LEU 59 HB2 LEU 59 -24.526 -13.026 5.235 298 HB3 LEU 59 HB3 LEU 59 -24.353 -11.515 6.108 299 HG LEU 59 HG LEU 59 -26.672 -11.770 7.000 300 HD11 LEU 59 HD11 LEU 59 -27.877 -13.896 6.758 301 HD12 LEU 59 HD12 LEU 59 -26.676 -14.461 5.597 302 HD13 LEU 59 HD13 LEU 59 -27.698 -13.074 5.211 303 HD21 LEU 59 HD21 LEU 59 -26.182 -13.573 8.591 304 HD22 LEU 59 HD22 LEU 59 -24.756 -12.577 8.316 305 HD23 LEU 59 HD23 LEU 59 -24.881 -14.163 7.550 306 H THR 60 H THR 60 -24.688 -8.955 4.505 307 HA THR 60 HA THR 60 -27.012 -7.845 5.901 308 HB THR 60 HB THR 60 -24.773 -7.225 6.733 309 HG1 THR 60 HG1 THR 60 -25.233 -4.772 6.392 310 HG21 THR 60 HG21 THR 60 -23.496 -7.142 4.620 311 HG22 THR 60 HG22 THR 60 -23.340 -5.631 5.518 312 HG23 THR 60 HG23 THR 60 -24.411 -5.717 4.119 313 H GLU 61 H GLU 61 -28.190 -6.071 5.210 314 HA GLU 61 HA GLU 61 -28.730 -5.833 2.386 315 HB2 GLU 61 HB2 GLU 61 -30.527 -5.834 4.118 316 HB3 GLU 61 HB3 GLU 61 -29.895 -4.336 4.783 317 HG2 GLU 61 HG2 GLU 61 -31.861 -3.894 3.439 318 HG3 GLU 61 HG3 GLU 61 -30.449 -3.163 2.684 319 H ASN 62 H ASN 62 -28.687 -3.803 1.229 320 HA ASN 62 HA ASN 62 -27.827 -1.906 0.397 321 HB2 ASN 62 HB2 ASN 62 -27.034 -1.294 3.275 322 HB3 ASN 62 HB3 ASN 62 -26.725 -0.183 1.947 323 HD21 ASN 62 HD21 ASN 62 -28.004 1.420 2.865 324 HD22 ASN 62 HD22 ASN 62 -29.729 1.332 2.897 325 H SER 63 H SER 63 -26.096 -4.431 1.262 326 HA SER 63 HA SER 63 -23.385 -3.533 0.961 327 HB2 SER 63 HB2 SER 63 -23.870 -5.631 2.166 328 HB3 SER 63 HB3 SER 63 -24.659 -6.306 0.738 329 HG SER 63 HG SER 63 -22.105 -6.440 1.394 330 H ILE 64 H ILE 64 -22.049 -3.880 -0.907 331 HA ILE 64 HA ILE 64 -23.227 -3.654 -3.507 332 HB ILE 64 HB ILE 64 -20.921 -3.993 -4.405 333 HG12 ILE 64 HG12 ILE 64 -20.018 -4.339 -1.494 334 HG13 ILE 64 HG13 ILE 64 -20.145 -5.653 -2.655 335 HG21 ILE 64 HG21 ILE 64 -21.034 -2.004 -2.107 336 HG22 ILE 64 HG22 ILE 64 -21.623 -1.741 -3.749 337 HG23 ILE 64 HG23 ILE 64 -19.896 -1.953 -3.460 338 HD11 ILE 64 HD11 ILE 64 -18.282 -3.292 -2.869 339 HD12 ILE 64 HD12 ILE 64 -18.407 -4.618 -4.029 340 HD13 ILE 64 HD13 ILE 64 -17.855 -4.931 -2.385 341 H LEU 65 H LEU 65 -22.525 -6.295 -1.455 342 HA LEU 65 HA LEU 65 -22.562 -8.355 -3.548 343 HB2 LEU 65 HB2 LEU 65 -22.166 -8.624 -0.542 344 HB3 LEU 65 HB3 LEU 65 -21.897 -9.878 -1.750 345 HG LEU 65 HG LEU 65 -20.291 -7.318 -1.433 346 HD11 LEU 65 HD11 LEU 65 -19.517 -10.194 -0.846 347 HD12 LEU 65 HD12 LEU 65 -19.817 -8.918 0.337 348 HD13 LEU 65 HD13 LEU 65 -18.442 -8.791 -0.757 349 HD21 LEU 65 HD21 LEU 65 -19.925 -9.563 -3.451 350 HD22 LEU 65 HD22 LEU 65 -18.821 -8.212 -3.199 351 HD23 LEU 65 HD23 LEU 65 -20.444 -7.909 -3.798 352 H ALA 66 H ALA 66 -24.839 -6.673 -1.817 353 HA ALA 66 HA ALA 66 -26.670 -8.682 -0.982 354 HB1 ALA 66 HB1 ALA 66 -28.349 -6.886 -0.940 355 HB2 ALA 66 HB2 ALA 66 -27.266 -5.831 -1.854 356 HB3 ALA 66 HB3 ALA 66 -26.831 -6.341 -0.222 357 H GLN 67 H GLN 67 -26.000 -7.225 -4.108 358 HA GLN 67 HA GLN 67 -28.187 -8.522 -5.520 359 HB2 GLN 67 HB2 GLN 67 -27.091 -7.634 -7.570 360 HB3 GLN 67 HB3 GLN 67 -27.347 -6.384 -6.357 361 HG2 GLN 67 HG2 GLN 67 -24.967 -6.541 -5.701 362 HG3 GLN 67 HG3 GLN 67 -24.710 -7.772 -6.935 363 HE21 GLN 67 HE21 GLN 67 -25.450 -4.385 -6.377 364 HE22 GLN 67 HE22 GLN 67 -25.011 -3.827 -7.951 365 H PHE 68 H PHE 68 -24.940 -9.332 -4.626 366 HA PHE 68 HA PHE 68 -24.665 -11.534 -6.539 367 HB2 PHE 68 HB2 PHE 68 -22.790 -10.311 -4.482 368 HB3 PHE 68 HB3 PHE 68 -22.382 -11.756 -5.386 369 HD1 PHE 68 HD1 PHE 68 -22.745 -11.497 -8.056 370 HD2 PHE 68 HD2 PHE 68 -21.963 -8.274 -5.351 371 HE1 PHE 68 HE1 PHE 68 -21.889 -10.131 -9.916 372 HE2 PHE 68 HE2 PHE 68 -21.114 -6.925 -7.227 373 HZ PHE 68 HZ PHE 68 -21.074 -7.844 -9.510 374 H ALA 69 H ALA 69 -26.258 -11.214 -3.691 375 HA ALA 69 HA ALA 69 -25.487 -13.496 -2.176 376 HB1 ALA 69 HB1 ALA 69 -27.630 -13.182 -0.999 377 HB2 ALA 69 HB2 ALA 69 -28.159 -12.062 -2.257 378 HB3 ALA 69 HB3 ALA 69 -26.796 -11.641 -1.220 379 H GLY 70 H GLY 70 -27.610 -13.043 -4.941 380 HA2 GLY 70 HA2 GLY 70 -28.694 -15.770 -4.881 381 HA3 GLY 70 HA3 GLY 70 -29.088 -14.498 -6.027 382 H GLU 71 H GLU 71 -25.754 -15.212 -5.353 383 HA GLU 71 HA GLU 71 -25.426 -17.004 -7.662 384 HB2 GLU 71 HB2 GLU 71 -25.014 -14.670 -8.484 385 HB3 GLU 71 HB3 GLU 71 -23.821 -14.427 -7.218 386 HG2 GLU 71 HG2 GLU 71 -22.739 -14.837 -9.364 387 HG3 GLU 71 HG3 GLU 71 -22.366 -16.130 -8.227 388 H ASP 72 H ASP 72 -23.548 -18.306 -7.490 389 HA ASP 72 HA ASP 72 -22.659 -19.229 -5.028 390 HB2 ASP 72 HB2 ASP 72 -22.344 -20.474 -7.148 391 HB3 ASP 72 HB3 ASP 72 -21.204 -19.266 -7.715 392 HA PRO 73 HA PRO 73 -20.350 -15.722 -3.491 393 HB2 PRO 73 HB2 PRO 73 -18.713 -17.756 -1.982 394 HB3 PRO 73 HB3 PRO 73 -19.566 -16.325 -1.376 395 HG2 PRO 73 HG2 PRO 73 -20.589 -18.753 -0.984 396 HG3 PRO 73 HG3 PRO 73 -21.658 -17.401 -1.425 397 HD2 PRO 73 HD2 PRO 73 -20.600 -19.632 -3.162 398 HD3 PRO 73 HD3 PRO 73 -22.228 -18.915 -3.112 399 H VAL 74 H VAL 74 -18.448 -18.482 -4.700 400 HA VAL 74 HA VAL 74 -15.968 -17.035 -4.928 401 HB VAL 74 HB VAL 74 -16.702 -19.615 -6.389 402 HG11 VAL 74 HG11 VAL 74 -14.253 -20.006 -6.431 403 HG12 VAL 74 HG12 VAL 74 -13.986 -18.451 -5.638 404 HG13 VAL 74 HG13 VAL 74 -14.680 -18.508 -7.261 405 HG21 VAL 74 HG21 VAL 74 -17.079 -19.933 -3.976 406 HG22 VAL 74 HG22 VAL 74 -15.459 -19.330 -3.621 407 HG23 VAL 74 HG23 VAL 74 -15.662 -20.847 -4.502 408 H VAL 75 H VAL 75 -18.471 -18.115 -7.205 409 HA VAL 75 HA VAL 75 -17.431 -16.989 -9.590 410 HB VAL 75 HB VAL 75 -20.329 -17.628 -8.845 411 HG11 VAL 75 HG11 VAL 75 -19.150 -17.133 -11.611 412 HG12 VAL 75 HG12 VAL 75 -20.296 -16.094 -10.766 413 HG13 VAL 75 HG13 VAL 75 -20.790 -17.702 -11.284 414 HG21 VAL 75 HG21 VAL 75 -18.269 -19.298 -10.338 415 HG22 VAL 75 HG22 VAL 75 -19.957 -19.747 -10.079 416 HG23 VAL 75 HG23 VAL 75 -18.866 -19.591 -8.702 417 H ALA 76 H ALA 76 -19.408 -15.705 -7.035 418 HA ALA 76 HA ALA 76 -20.338 -13.309 -8.270 419 HB1 ALA 76 HB1 ALA 76 -21.048 -12.716 -5.965 420 HB2 ALA 76 HB2 ALA 76 -20.190 -14.126 -5.348 421 HB3 ALA 76 HB3 ALA 76 -21.570 -14.334 -6.429 422 H LEU 77 H LEU 77 -17.605 -14.187 -6.228 423 HA LEU 77 HA LEU 77 -16.582 -11.536 -5.870 424 HB2 LEU 77 HB2 LEU 77 -16.143 -13.388 -4.303 425 HB3 LEU 77 HB3 LEU 77 -15.235 -14.236 -5.542 426 HG LEU 77 HG LEU 77 -13.431 -12.622 -5.455 427 HD11 LEU 77 HD11 LEU 77 -13.413 -10.658 -3.992 428 HD12 LEU 77 HD12 LEU 77 -15.088 -10.960 -3.534 429 HD13 LEU 77 HD13 LEU 77 -14.691 -10.532 -5.199 430 HD21 LEU 77 HD21 LEU 77 -14.353 -13.377 -2.664 431 HD22 LEU 77 HD22 LEU 77 -12.728 -12.854 -3.095 432 HD23 LEU 77 HD23 LEU 77 -13.364 -14.356 -3.755 433 H GLU 78 H GLU 78 -15.850 -14.214 -8.112 434 HA GLU 78 HA GLU 78 -13.817 -12.968 -9.646 435 HB2 GLU 78 HB2 GLU 78 -15.904 -15.044 -10.449 436 HB3 GLU 78 HB3 GLU 78 -14.514 -14.603 -11.446 437 HG2 GLU 78 HG2 GLU 78 -12.982 -15.440 -9.724 438 HG3 GLU 78 HG3 GLU 78 -14.339 -15.800 -8.659 439 H ALA 79 H ALA 79 -17.329 -12.838 -9.797 440 HA ALA 79 HA ALA 79 -17.597 -11.243 -12.154 441 HB1 ALA 79 HB1 ALA 79 -19.421 -12.681 -11.335 442 HB2 ALA 79 HB2 ALA 79 -19.949 -11.002 -11.459 443 HB3 ALA 79 HB3 ALA 79 -19.562 -11.691 -9.878 444 H ALA 80 H ALA 80 -17.197 -10.588 -8.728 445 HA ALA 80 HA ALA 80 -17.873 -7.835 -8.697 446 HB1 ALA 80 HB1 ALA 80 -16.767 -7.768 -6.506 447 HB2 ALA 80 HB2 ALA 80 -16.050 -9.355 -6.803 448 HB3 ALA 80 HB3 ALA 80 -17.800 -9.193 -6.648 449 H LEU 81 H LEU 81 -14.737 -9.527 -9.077 450 HA LEU 81 HA LEU 81 -13.181 -7.143 -9.339 451 HB2 LEU 81 HB2 LEU 81 -12.631 -10.055 -9.915 452 HB3 LEU 81 HB3 LEU 81 -11.507 -8.852 -10.509 453 HG LEU 81 HG LEU 81 -10.633 -9.708 -8.445 454 HD11 LEU 81 HD11 LEU 81 -11.791 -6.958 -7.895 455 HD12 LEU 81 HD12 LEU 81 -10.320 -7.304 -8.808 456 HD13 LEU 81 HD13 LEU 81 -10.398 -7.696 -7.094 457 HD21 LEU 81 HD21 LEU 81 -11.831 -9.609 -6.298 458 HD22 LEU 81 HD22 LEU 81 -12.648 -10.645 -7.464 459 HD23 LEU 81 HD23 LEU 81 -13.279 -9.030 -7.129 460 H GLN 82 H GLN 82 -14.977 -9.094 -11.632 461 HA GLN 82 HA GLN 82 -13.947 -7.877 -14.022 462 HB2 GLN 82 HB2 GLN 82 -15.037 -10.131 -13.992 463 HB3 GLN 82 HB3 GLN 82 -16.571 -9.372 -13.571 464 HG2 GLN 82 HG2 GLN 82 -16.537 -8.154 -15.735 465 HG3 GLN 82 HG3 GLN 82 -15.024 -8.947 -16.154 466 HE21 GLN 82 HE21 GLN 82 -15.051 -11.184 -16.644 467 HE22 GLN 82 HE22 GLN 82 -16.514 -11.989 -17.088 468 H PHE 83 H PHE 83 -16.395 -7.032 -11.692 469 HA PHE 83 HA PHE 83 -17.650 -5.015 -13.431 470 HB2 PHE 83 HB2 PHE 83 -19.016 -6.648 -12.066 471 HB3 PHE 83 HB3 PHE 83 -18.405 -5.877 -10.608 472 HD1 PHE 83 HD1 PHE 83 -19.302 -3.862 -13.596 473 HD2 PHE 83 HD2 PHE 83 -20.663 -5.374 -9.830 474 HE1 PHE 83 HE1 PHE 83 -21.240 -2.351 -13.682 475 HE2 PHE 83 HE2 PHE 83 -22.591 -3.857 -9.927 476 HZ PHE 83 HZ PHE 83 -22.887 -2.345 -11.848 477 H GLU 84 H GLU 84 -16.944 -2.976 -13.361 478 HA GLU 84 HA GLU 84 -14.786 -2.035 -11.847 479 HB2 GLU 84 HB2 GLU 84 -15.349 0.196 -12.828 480 HB3 GLU 84 HB3 GLU 84 -15.305 -1.106 -14.014 481 HG2 GLU 84 HG2 GLU 84 -17.820 -1.234 -13.862 482 HG3 GLU 84 HG3 GLU 84 -17.779 0.195 -12.825 483 H ASP 85 H ASP 85 -18.161 -1.973 -11.150 484 HA ASP 85 HA ASP 85 -18.152 0.231 -9.289 485 HB2 ASP 85 HB2 ASP 85 -20.102 -0.210 -10.707 486 HB3 ASP 85 HB3 ASP 85 -20.272 -1.819 -10.025 487 H THR 86 H THR 86 -17.485 -3.164 -9.024 488 HA THR 86 HA THR 86 -17.903 -3.106 -6.072 489 HB THR 86 HB THR 86 -18.435 -5.575 -6.254 490 HG1 THR 86 HG1 THR 86 -19.151 -6.158 -8.486 491 HG21 THR 86 HG21 THR 86 -20.747 -5.264 -7.059 492 HG22 THR 86 HG22 THR 86 -20.299 -3.733 -7.807 493 HG23 THR 86 HG23 THR 86 -20.261 -3.912 -6.051 494 H ARG 87 H ARG 87 -15.629 -3.569 -8.576 495 HA ARG 87 HA ARG 87 -13.868 -5.506 -7.414 496 HB2 ARG 87 HB2 ARG 87 -12.240 -4.803 -9.092 497 HB3 ARG 87 HB3 ARG 87 -13.832 -4.892 -9.844 498 HG2 ARG 87 HG2 ARG 87 -14.059 -2.454 -9.727 499 HG3 ARG 87 HG3 ARG 87 -12.517 -2.332 -8.879 500 HD2 ARG 87 HD2 ARG 87 -11.366 -3.239 -10.881 501 HD3 ARG 87 HD3 ARG 87 -12.923 -3.297 -11.726 502 HE ARG 87 HE ARG 87 -12.347 -0.695 -10.652 503 HH11 ARG 87 HH11 ARG 87 -11.722 -2.759 -13.429 504 HH12 ARG 87 HH12 ARG 87 -11.341 -1.430 -14.475 505 HH21 ARG 87 HH21 ARG 87 -11.861 1.028 -12.017 506 HH22 ARG 87 HH22 ARG 87 -11.425 0.728 -13.671 507 H GLU 88 H GLU 88 -14.398 -2.149 -6.884 508 HA GLU 88 HA GLU 88 -11.870 -1.209 -6.135 509 HB2 GLU 88 HB2 GLU 88 -14.578 -0.224 -5.142 510 HB3 GLU 88 HB3 GLU 88 -13.076 0.705 -5.176 511 HG2 GLU 88 HG2 GLU 88 -13.085 0.670 -7.632 512 HG3 GLU 88 HG3 GLU 88 -14.522 -0.350 -7.637 513 H SER 89 H SER 89 -14.608 -2.255 -4.093 514 HA SER 89 HA SER 89 -13.325 -2.013 -1.589 515 HB2 SER 89 HB2 SER 89 -15.704 -3.749 -2.349 516 HB3 SER 89 HB3 SER 89 -15.269 -3.235 -0.715 517 HG SER 89 HG SER 89 -15.397 -1.008 -1.833 518 H MET 90 H MET 90 -13.065 -4.469 -4.005 519 HA MET 90 HA MET 90 -12.426 -6.686 -2.284 520 HB2 MET 90 HB2 MET 90 -12.004 -6.373 -5.282 521 HB3 MET 90 HB3 MET 90 -11.840 -7.883 -4.377 522 HG2 MET 90 HG2 MET 90 -14.359 -6.258 -4.792 523 HG3 MET 90 HG3 MET 90 -14.002 -7.873 -5.421 524 HE1 MET 90 HE1 MET 90 -16.571 -8.324 -4.294 525 HE2 MET 90 HE2 MET 90 -16.554 -6.725 -3.549 526 HE3 MET 90 HE3 MET 90 -16.855 -8.157 -2.563 527 H HIS 91 H HIS 91 -10.639 -3.963 -3.136 528 HA HIS 91 HA HIS 91 -8.000 -5.026 -2.997 529 HB2 HIS 91 HB2 HIS 91 -7.240 -2.792 -2.742 530 HB3 HIS 91 HB3 HIS 91 -8.673 -2.666 -3.742 531 HD1 HIS 91 HD1 HIS 91 -7.212 -0.555 -1.640 532 HD2 HIS 91 HD2 HIS 91 -10.937 -2.374 -1.318 533 HE1 HIS 91 HE1 HIS 91 -8.580 0.949 -0.170 534 HE2 HIS 91 HE2 HIS 91 -10.760 -0.260 0.145 535 H ALA 92 H ALA 92 -10.461 -4.518 -0.632 536 HA ALA 92 HA ALA 92 -8.712 -4.826 1.687 537 HB1 ALA 92 HB1 ALA 92 -10.648 -3.313 1.833 538 HB2 ALA 92 HB2 ALA 92 -10.781 -4.630 3.000 539 HB3 ALA 92 HB3 ALA 92 -11.741 -4.662 1.516 540 H PHE 93 H PHE 93 -10.812 -6.767 -0.353 541 HA PHE 93 HA PHE 93 -10.991 -9.024 1.467 542 HB2 PHE 93 HB2 PHE 93 -11.903 -8.635 -1.413 543 HB3 PHE 93 HB3 PHE 93 -12.094 -10.157 -0.550 544 HD1 PHE 93 HD1 PHE 93 -13.079 -6.559 -0.495 545 HD2 PHE 93 HD2 PHE 93 -13.930 -10.489 0.955 546 HE1 PHE 93 HE1 PHE 93 -15.192 -5.748 0.468 547 HE2 PHE 93 HE2 PHE 93 -16.037 -9.665 1.921 548 HZ PHE 93 HZ PHE 93 -16.671 -7.300 1.681 549 H CYS 94 H CYS 94 -8.885 -8.026 -1.157 550 HA CYS 94 HA CYS 94 -7.600 -10.580 -1.475 551 HB2 CYS 94 HB2 CYS 94 -5.889 -9.326 -2.761 552 HB3 CYS 94 HB3 CYS 94 -7.517 -8.951 -3.306 553 HG CYS 94 HG CYS 94 -6.477 -6.808 -0.997 554 H VAL 95 H VAL 95 -6.584 -11.447 0.218 555 HA VAL 95 HA VAL 95 -5.300 -9.996 2.324 556 HB VAL 95 HB VAL 95 -4.480 -12.168 3.126 557 HG11 VAL 95 HG11 VAL 95 -6.641 -13.347 3.418 558 HG12 VAL 95 HG12 VAL 95 -7.353 -12.368 2.132 559 HG13 VAL 95 HG13 VAL 95 -6.820 -11.603 3.632 560 HG21 VAL 95 HG21 VAL 95 -4.878 -14.268 1.884 561 HG22 VAL 95 HG22 VAL 95 -3.821 -13.187 0.978 562 HG23 VAL 95 HG23 VAL 95 -5.516 -13.348 0.517 563 H GLY 96 H GLY 96 -4.319 -11.150 -0.796 564 HA2 GLY 96 HA2 GLY 96 -2.155 -9.493 -1.147 565 HA3 GLY 96 HA3 GLY 96 -1.478 -10.975 -0.466 566 H GLN 97 H GLN 97 -0.345 -11.169 -2.486 567 HA GLN 97 HA GLN 97 -1.907 -12.029 -4.835 568 HB2 GLN 97 HB2 GLN 97 -0.216 -10.261 -5.187 569 HB3 GLN 97 HB3 GLN 97 1.035 -11.312 -4.536 570 HG2 GLN 97 HG2 GLN 97 0.779 -12.830 -6.438 571 HG3 GLN 97 HG3 GLN 97 -0.534 -11.836 -7.079 572 HE21 GLN 97 HE21 GLN 97 2.049 -12.543 -8.276 573 HE22 GLN 97 HE22 GLN 97 2.829 -11.055 -8.648 574 H TYR 98 H TYR 98 -1.721 -14.084 -5.611 575 HA TYR 98 HA TYR 98 -0.704 -16.148 -3.884 576 HB2 TYR 98 HB2 TYR 98 -2.843 -16.437 -5.091 577 HB3 TYR 98 HB3 TYR 98 -2.008 -16.325 -6.633 578 HD1 TYR 98 HD1 TYR 98 -2.117 -18.373 -3.487 579 HD2 TYR 98 HD2 TYR 98 -1.198 -18.315 -7.661 580 HE1 TYR 98 HE1 TYR 98 -1.723 -20.797 -3.443 581 HE2 TYR 98 HE2 TYR 98 -0.817 -20.734 -7.604 582 HH TYR 98 HH TYR 98 -1.765 -22.701 -5.096 583 H LEU 99 H LEU 99 1.320 -16.922 -3.970 584 HA LEU 99 HA LEU 99 2.809 -16.939 -6.533 585 HB2 LEU 99 HB2 LEU 99 3.790 -15.503 -4.712 586 HB3 LEU 99 HB3 LEU 99 3.966 -16.925 -3.704 587 HG LEU 99 HG LEU 99 5.325 -16.912 -6.417 588 HD11 LEU 99 HD11 LEU 99 6.508 -15.495 -4.008 589 HD12 LEU 99 HD12 LEU 99 5.922 -14.717 -5.480 590 HD13 LEU 99 HD13 LEU 99 7.314 -15.793 -5.554 591 HD21 LEU 99 HD21 LEU 99 6.211 -18.050 -3.742 592 HD22 LEU 99 HD22 LEU 99 7.034 -18.254 -5.294 593 HD23 LEU 99 HD23 LEU 99 5.439 -18.955 -5.046 594 H GLU 100 H GLU 100 2.955 -18.916 -7.375 595 HA GLU 100 HA GLU 100 2.058 -21.294 -6.098 596 HB2 GLU 100 HB2 GLU 100 3.658 -20.904 -8.655 597 HB3 GLU 100 HB3 GLU 100 2.882 -22.398 -8.206 598 HG2 GLU 100 HG2 GLU 100 0.691 -21.390 -8.428 599 HG3 GLU 100 HG3 GLU 100 1.404 -19.797 -8.686 600 HA PRO 101 HA PRO 101 5.836 -22.688 -3.985 601 HB2 PRO 101 HB2 PRO 101 5.519 -25.460 -4.433 602 HB3 PRO 101 HB3 PRO 101 4.814 -24.544 -3.095 603 HG2 PRO 101 HG2 PRO 101 3.569 -25.323 -5.731 604 HG3 PRO 101 HG3 PRO 101 2.867 -25.366 -4.097 605 HD2 PRO 101 HD2 PRO 101 2.230 -23.391 -5.765 606 HD3 PRO 101 HD3 PRO 101 2.529 -23.030 -4.048 607 H ASP 102 H ASP 102 5.095 -23.832 -7.263 608 HA ASP 102 HA ASP 102 7.834 -24.535 -7.938 609 HB2 ASP 102 HB2 ASP 102 5.931 -25.778 -8.940 610 HB3 ASP 102 HB3 ASP 102 5.345 -24.302 -9.691 611 H GLN 103 H GLN 103 5.765 -21.743 -8.191 612 HA GLN 103 HA GLN 103 7.007 -20.404 -10.369 613 HB2 GLN 103 HB2 GLN 103 4.677 -20.021 -9.506 614 HB3 GLN 103 HB3 GLN 103 5.362 -19.198 -8.111 615 HG2 GLN 103 HG2 GLN 103 6.349 -17.517 -9.682 616 HG3 GLN 103 HG3 GLN 103 5.516 -18.329 -11.007 617 HE21 GLN 103 HE21 GLN 103 3.220 -18.246 -11.080 618 HE22 GLN 103 HE22 GLN 103 2.341 -17.019 -10.237 619 H GLU 104 H GLU 104 7.780 -20.581 -6.959 620 HA GLU 104 HA GLU 104 9.474 -18.335 -6.708 621 HB2 GLU 104 HB2 GLU 104 8.762 -19.646 -4.746 622 HB3 GLU 104 HB3 GLU 104 9.663 -21.047 -5.318 623 HG2 GLU 104 HG2 GLU 104 11.782 -19.804 -5.035 624 HG3 GLU 104 HG3 GLU 104 10.879 -18.387 -4.500 625 H GLY 105 H GLY 105 9.992 -21.536 -8.086 626 HA2 GLY 105 HA2 GLY 105 12.832 -21.239 -8.561 627 HA3 GLY 105 HA3 GLY 105 11.783 -22.521 -9.150 628 H VAL 106 H VAL 106 10.031 -21.598 -10.792 629 HA VAL 106 HA VAL 106 11.658 -20.384 -12.940 630 HB VAL 106 HB VAL 106 10.722 -22.685 -13.317 631 HG11 VAL 106 HG11 VAL 106 8.005 -21.317 -13.363 632 HG12 VAL 106 HG12 VAL 106 8.567 -22.471 -12.151 633 HG13 VAL 106 HG13 VAL 106 8.322 -22.995 -13.818 634 HG21 VAL 106 HG21 VAL 106 9.706 -20.582 -15.277 635 HG22 VAL 106 HG22 VAL 106 9.925 -22.297 -15.631 636 HG23 VAL 106 HG23 VAL 106 11.324 -21.290 -15.261 637 H THR 107 H THR 107 10.941 -18.653 -14.156 638 HA THR 107 HA THR 107 8.390 -17.341 -13.409 639 HB THR 107 HB THR 107 10.297 -15.842 -13.117 640 HG1 THR 107 HG1 THR 107 8.224 -15.169 -14.207 641 HG21 THR 107 HG21 THR 107 11.925 -16.844 -14.692 642 HG22 THR 107 HG22 THR 107 11.750 -15.112 -14.965 643 HG23 THR 107 HG23 THR 107 10.964 -16.251 -16.058 644 H ILE 108 H ILE 108 6.802 -17.240 -14.958 645 HA ILE 108 HA ILE 108 7.100 -18.916 -17.303 646 HB ILE 108 HB ILE 108 4.655 -17.400 -16.289 647 HG12 ILE 108 HG12 ILE 108 5.469 -20.322 -15.862 648 HG13 ILE 108 HG13 ILE 108 5.492 -19.065 -14.631 649 HG21 ILE 108 HG21 ILE 108 3.325 -18.928 -17.711 650 HG22 ILE 108 HG22 ILE 108 4.809 -19.654 -18.331 651 HG23 ILE 108 HG23 ILE 108 4.440 -17.964 -18.681 652 HD11 ILE 108 HD11 ILE 108 3.036 -18.900 -14.784 653 HD12 ILE 108 HD12 ILE 108 3.586 -20.512 -14.343 654 HD13 ILE 108 HD13 ILE 108 3.038 -20.196 -15.986 655 HA PRO 109 HA PRO 109 8.008 -15.286 -19.875 656 HB2 PRO 109 HB2 PRO 109 8.266 -16.568 -22.283 657 HB3 PRO 109 HB3 PRO 109 9.501 -16.654 -21.018 658 HG2 PRO 109 HG2 PRO 109 7.342 -18.648 -21.704 659 HG3 PRO 109 HG3 PRO 109 9.061 -18.936 -21.345 660 HD2 PRO 109 HD2 PRO 109 7.094 -19.281 -19.480 661 HD3 PRO 109 HD3 PRO 109 8.734 -18.774 -19.039 662 H ASP 110 H ASP 110 6.554 -13.851 -20.550 663 HA ASP 110 HA ASP 110 3.864 -14.603 -21.341 664 HB2 ASP 110 HB2 ASP 110 4.260 -12.629 -19.867 665 HB3 ASP 110 HB3 ASP 110 5.156 -11.844 -21.161 666 H LEU 111 H LEU 111 3.699 -15.381 -23.372 667 HA LEU 111 HA LEU 111 5.061 -14.053 -25.623 668 HB2 LEU 111 HB2 LEU 111 4.189 -16.029 -26.956 669 HB3 LEU 111 HB3 LEU 111 5.335 -16.405 -25.687 670 HG LEU 111 HG LEU 111 3.282 -17.082 -24.248 671 HD11 LEU 111 HD11 LEU 111 1.890 -17.154 -26.941 672 HD12 LEU 111 HD12 LEU 111 1.489 -16.096 -25.585 673 HD13 LEU 111 HD13 LEU 111 1.273 -17.838 -25.432 674 HD21 LEU 111 HD21 LEU 111 3.237 -19.357 -25.191 675 HD22 LEU 111 HD22 LEU 111 4.875 -18.712 -25.142 676 HD23 LEU 111 HD23 LEU 111 3.996 -18.764 -26.673 677 H GLY 112 H GLY 112 2.106 -13.944 -23.984 678 HA2 GLY 112 HA2 GLY 112 0.994 -11.953 -25.655 679 HA3 GLY 112 HA3 GLY 112 0.190 -13.487 -25.983 Start of MODEL 4 1 H GLU 21 H GLU 21 6.203 -0.409 -1.644 2 HA GLU 21 HA GLU 21 8.028 -1.202 -0.313 3 HB2 GLU 21 HB2 GLU 21 5.279 -1.447 0.982 4 HB3 GLU 21 HB3 GLU 21 6.768 -1.465 1.910 5 HG2 GLU 21 HG2 GLU 21 5.880 0.730 2.081 6 HG3 GLU 21 HG3 GLU 21 7.284 0.829 1.022 7 H LYS 22 H LYS 22 5.420 -3.455 0.622 8 HA LYS 22 HA LYS 22 7.091 -5.823 0.153 9 HB2 LYS 22 HB2 LYS 22 5.850 -5.116 2.857 10 HB3 LYS 22 HB3 LYS 22 6.569 -6.672 2.461 11 HG2 LYS 22 HG2 LYS 22 8.067 -4.031 2.528 12 HG3 LYS 22 HG3 LYS 22 8.045 -5.218 3.838 13 HD2 LYS 22 HD2 LYS 22 9.110 -5.705 1.023 14 HD3 LYS 22 HD3 LYS 22 10.104 -5.367 2.444 15 HE2 LYS 22 HE2 LYS 22 9.274 -7.448 3.502 16 HE3 LYS 22 HE3 LYS 22 8.289 -7.771 2.074 17 HZ1 LYS 22 HZ1 LYS 22 10.341 -7.846 0.769 18 HZ2 LYS 22 HZ2 LYS 22 10.301 -9.026 1.978 19 HZ3 LYS 22 HZ3 LYS 22 11.244 -7.642 2.183 20 H VAL 23 H VAL 23 5.801 -7.835 0.249 21 HA VAL 23 HA VAL 23 2.892 -7.555 0.172 22 HB VAL 23 HB VAL 23 3.547 -6.996 -2.133 23 HG11 VAL 23 HG11 VAL 23 4.849 -9.740 -2.313 24 HG12 VAL 23 HG12 VAL 23 5.690 -8.189 -2.310 25 HG13 VAL 23 HG13 VAL 23 4.630 -8.613 -3.656 26 HG21 VAL 23 HG21 VAL 23 2.193 -9.712 -1.960 27 HG22 VAL 23 HG22 VAL 23 2.108 -8.609 -3.335 28 HG23 VAL 23 HG23 VAL 23 1.406 -8.140 -1.784 29 H THR 24 H THR 24 1.973 -9.252 1.144 30 HA THR 24 HA THR 24 3.443 -11.534 2.033 31 HB THR 24 HB THR 24 0.443 -10.980 2.112 32 HG1 THR 24 HG1 THR 24 2.547 -9.944 3.484 33 HG21 THR 24 HG21 THR 24 0.372 -12.596 3.985 34 HG22 THR 24 HG22 THR 24 2.079 -12.971 3.741 35 HG23 THR 24 HG23 THR 24 0.898 -13.386 2.496 36 H LEU 25 H LEU 25 3.937 -13.220 0.809 37 HA LEU 25 HA LEU 25 2.377 -13.919 -1.582 38 HB2 LEU 25 HB2 LEU 25 5.114 -14.860 -0.633 39 HB3 LEU 25 HB3 LEU 25 4.349 -15.342 -2.142 40 HG LEU 25 HG LEU 25 5.292 -12.539 -1.407 41 HD11 LEU 25 HD11 LEU 25 6.897 -12.793 -3.236 42 HD12 LEU 25 HD12 LEU 25 6.344 -14.448 -3.514 43 HD13 LEU 25 HD13 LEU 25 7.135 -14.022 -1.993 44 HD21 LEU 25 HD21 LEU 25 3.900 -13.435 -3.955 45 HD22 LEU 25 HD22 LEU 25 4.630 -11.850 -3.680 46 HD23 LEU 25 HD23 LEU 25 3.243 -12.356 -2.722 47 H VAL 26 H VAL 26 0.718 -15.143 -1.032 48 HA VAL 26 HA VAL 26 0.885 -17.351 0.887 49 HB VAL 26 HB VAL 26 -1.512 -16.258 -0.660 50 HG11 VAL 26 HG11 VAL 26 -1.891 -18.576 0.043 51 HG12 VAL 26 HG12 VAL 26 -2.923 -17.477 0.958 52 HG13 VAL 26 HG13 VAL 26 -1.480 -18.160 1.710 53 HG21 VAL 26 HG21 VAL 26 -2.192 -15.116 1.423 54 HG22 VAL 26 HG22 VAL 26 -0.633 -14.527 0.844 55 HG23 VAL 26 HG23 VAL 26 -0.700 -15.645 2.208 56 H ARG 27 H ARG 27 1.354 -19.332 0.129 57 HA ARG 27 HA ARG 27 1.337 -20.022 -2.683 58 HB2 ARG 27 HB2 ARG 27 1.809 -21.836 -0.271 59 HB3 ARG 27 HB3 ARG 27 2.196 -22.205 -1.956 60 HG2 ARG 27 HG2 ARG 27 3.913 -20.463 -1.984 61 HG3 ARG 27 HG3 ARG 27 3.480 -19.970 -0.341 62 HD2 ARG 27 HD2 ARG 27 4.110 -22.278 0.447 63 HD3 ARG 27 HD3 ARG 27 4.673 -22.637 -1.192 64 HE ARG 27 HE ARG 27 5.855 -20.304 0.107 65 HH11 ARG 27 HH11 ARG 27 6.269 -23.708 -0.727 66 HH12 ARG 27 HH12 ARG 27 7.953 -23.721 -0.323 67 HH21 ARG 27 HH21 ARG 27 8.051 -20.354 0.644 68 HH22 ARG 27 HH22 ARG 27 8.962 -21.816 0.458 69 H ILE 28 H ILE 28 0.285 -22.092 -3.392 70 HA ILE 28 HA ILE 28 -2.479 -22.151 -3.093 71 HB ILE 28 HB ILE 28 -1.462 -23.180 -5.027 72 HG12 ILE 28 HG12 ILE 28 -2.914 -25.323 -3.397 73 HG13 ILE 28 HG13 ILE 28 -3.681 -24.076 -4.371 74 HG21 ILE 28 HG21 ILE 28 -0.159 -25.274 -4.978 75 HG22 ILE 28 HG22 ILE 28 -0.224 -25.279 -3.215 76 HG23 ILE 28 HG23 ILE 28 0.638 -23.990 -4.062 77 HD11 ILE 28 HD11 ILE 28 -1.973 -26.342 -5.408 78 HD12 ILE 28 HD12 ILE 28 -2.715 -25.079 -6.394 79 HD13 ILE 28 HD13 ILE 28 -3.729 -26.210 -5.503 80 H ALA 29 H ALA 29 -0.019 -24.123 -1.452 81 HA ALA 29 HA ALA 29 -1.680 -25.863 -0.019 82 HB1 ALA 29 HB1 ALA 29 1.094 -24.871 0.741 83 HB2 ALA 29 HB2 ALA 29 0.740 -26.239 -0.315 84 HB3 ALA 29 HB3 ALA 29 0.292 -26.308 1.389 85 H ASP 30 H ASP 30 -0.528 -22.605 0.760 86 HA ASP 30 HA ASP 30 -1.219 -22.588 3.517 87 HB2 ASP 30 HB2 ASP 30 -0.820 -20.249 1.612 88 HB3 ASP 30 HB3 ASP 30 -0.957 -20.099 3.361 89 H LEU 31 H LEU 31 -2.960 -21.356 0.622 90 HA LEU 31 HA LEU 31 -5.186 -20.401 2.164 91 HB2 LEU 31 HB2 LEU 31 -6.288 -19.985 -0.046 92 HB3 LEU 31 HB3 LEU 31 -4.730 -19.223 0.174 93 HG LEU 31 HG LEU 31 -3.789 -21.229 -1.228 94 HD11 LEU 31 HD11 LEU 31 -5.342 -22.166 -2.883 95 HD12 LEU 31 HD12 LEU 31 -6.697 -21.387 -2.062 96 HD13 LEU 31 HD13 LEU 31 -5.771 -22.645 -1.241 97 HD21 LEU 31 HD21 LEU 31 -5.465 -19.066 -2.550 98 HD22 LEU 31 HD22 LEU 31 -4.182 -19.999 -3.328 99 HD23 LEU 31 HD23 LEU 31 -3.793 -18.907 -2.001 100 H GLU 32 H GLU 32 -4.505 -23.439 0.486 101 HA GLU 32 HA GLU 32 -7.049 -24.679 0.709 102 HB2 GLU 32 HB2 GLU 32 -4.271 -25.933 0.754 103 HB3 GLU 32 HB3 GLU 32 -5.764 -26.859 0.631 104 HG2 GLU 32 HG2 GLU 32 -4.749 -24.847 -1.391 105 HG3 GLU 32 HG3 GLU 32 -4.631 -26.596 -1.532 106 H ASN 33 H ASN 33 -4.249 -24.632 2.878 107 HA ASN 33 HA ASN 33 -5.437 -26.351 4.862 108 HB2 ASN 33 HB2 ASN 33 -2.828 -24.786 4.803 109 HB3 ASN 33 HB3 ASN 33 -3.307 -25.802 6.163 110 HD21 ASN 33 HD21 ASN 33 -1.054 -26.010 4.211 111 HD22 ASN 33 HD22 ASN 33 -1.159 -27.612 3.582 112 H HIS 34 H HIS 34 -5.289 -22.902 4.327 113 HA HIS 34 HA HIS 34 -6.018 -22.147 6.995 114 HB2 HIS 34 HB2 HIS 34 -4.955 -20.538 5.321 115 HB3 HIS 34 HB3 HIS 34 -6.514 -20.463 4.500 116 HD1 HIS 34 HD1 HIS 34 -8.180 -18.810 5.434 117 HD2 HIS 34 HD2 HIS 34 -5.087 -19.580 8.093 118 HE1 HIS 34 HE1 HIS 34 -8.564 -17.273 7.382 119 HE2 HIS 34 HE2 HIS 34 -6.798 -17.905 9.053 120 H ASN 35 H ASN 35 -7.780 -23.170 4.127 121 HA ASN 35 HA ASN 35 -10.417 -22.507 4.859 122 HB2 ASN 35 HB2 ASN 35 -9.837 -23.349 2.611 123 HB3 ASN 35 HB3 ASN 35 -9.414 -24.918 3.285 124 HD21 ASN 35 HD21 ASN 35 -10.926 -25.978 1.961 125 HD22 ASN 35 HD22 ASN 35 -12.630 -25.879 2.243 126 H ASN 36 H ASN 36 -8.496 -25.425 5.550 127 HA ASN 36 HA ASN 36 -10.420 -26.710 7.233 128 HB2 ASN 36 HB2 ASN 36 -8.636 -27.956 6.018 129 HB3 ASN 36 HB3 ASN 36 -7.414 -27.171 7.010 130 HD21 ASN 36 HD21 ASN 36 -10.053 -29.493 7.012 131 HD22 ASN 36 HD22 ASN 36 -9.605 -30.292 8.475 132 H ASP 37 H ASP 37 -7.919 -24.337 7.773 133 HA ASP 37 HA ASP 37 -7.658 -24.483 10.606 134 HB2 ASP 37 HB2 ASP 37 -5.970 -23.373 9.231 135 HB3 ASP 37 HB3 ASP 37 -7.152 -22.226 8.626 136 H GLY 38 H GLY 38 -9.963 -22.921 8.475 137 HA2 GLY 38 HA2 GLY 38 -12.226 -22.612 9.496 138 HA3 GLY 38 HA3 GLY 38 -11.417 -21.735 10.789 139 H GLY 39 H GLY 39 -10.661 -21.522 7.329 140 HA2 GLY 39 HA2 GLY 39 -12.047 -19.024 6.937 141 HA3 GLY 39 HA3 GLY 39 -10.308 -18.830 7.116 142 H PHE 40 H PHE 40 -12.876 -19.712 4.999 143 HA PHE 40 HA PHE 40 -11.302 -21.190 3.097 144 HB2 PHE 40 HB2 PHE 40 -13.769 -21.541 3.337 145 HB3 PHE 40 HB3 PHE 40 -14.053 -19.914 2.730 146 HD1 PHE 40 HD1 PHE 40 -11.593 -22.445 1.432 147 HD2 PHE 40 HD2 PHE 40 -15.239 -20.336 0.707 148 HE1 PHE 40 HE1 PHE 40 -11.654 -23.322 -0.863 149 HE2 PHE 40 HE2 PHE 40 -15.286 -21.221 -1.586 150 HZ PHE 40 HZ PHE 40 -13.494 -22.713 -2.375 151 H TRP 41 H TRP 41 -9.739 -20.197 2.071 152 HA TRP 41 HA TRP 41 -10.078 -17.504 0.911 153 HB2 TRP 41 HB2 TRP 41 -7.614 -19.199 1.473 154 HB3 TRP 41 HB3 TRP 41 -7.557 -17.745 0.489 155 HD1 TRP 41 HD1 TRP 41 -9.843 -16.722 3.072 156 HE1 TRP 41 HE1 TRP 41 -8.620 -15.521 4.991 157 HE3 TRP 41 HE3 TRP 41 -5.065 -18.199 2.050 158 HZ2 TRP 41 HZ2 TRP 41 -5.986 -15.232 5.946 159 HZ3 TRP 41 HZ3 TRP 41 -3.243 -17.424 3.503 160 HH2 TRP 41 HH2 TRP 41 -3.697 -15.965 5.417 161 H THR 42 H THR 42 -9.367 -17.190 -1.269 162 HA THR 42 HA THR 42 -9.217 -19.484 -3.059 163 HB THR 42 HB THR 42 -11.668 -19.038 -2.790 164 HG1 THR 42 HG1 THR 42 -11.184 -19.923 -4.703 165 HG21 THR 42 HG21 THR 42 -11.628 -16.590 -2.421 166 HG22 THR 42 HG22 THR 42 -12.700 -17.026 -3.750 167 HG23 THR 42 HG23 THR 42 -11.110 -16.344 -4.094 168 H VAL 43 H VAL 43 -8.167 -18.997 -5.000 169 HA VAL 43 HA VAL 43 -6.857 -16.359 -5.116 170 HB VAL 43 HB VAL 43 -5.232 -18.119 -5.174 171 HG11 VAL 43 HG11 VAL 43 -6.619 -20.021 -5.883 172 HG12 VAL 43 HG12 VAL 43 -5.156 -19.920 -6.865 173 HG13 VAL 43 HG13 VAL 43 -6.701 -19.375 -7.524 174 HG21 VAL 43 HG21 VAL 43 -4.082 -17.673 -7.325 175 HG22 VAL 43 HG22 VAL 43 -4.771 -16.199 -6.643 176 HG23 VAL 43 HG23 VAL 43 -5.577 -17.008 -7.988 177 H ILE 44 H ILE 44 -7.619 -14.888 -6.409 178 HA ILE 44 HA ILE 44 -8.683 -15.511 -9.087 179 HB ILE 44 HB ILE 44 -9.946 -13.537 -7.116 180 HG12 ILE 44 HG12 ILE 44 -11.140 -16.098 -8.275 181 HG13 ILE 44 HG13 ILE 44 -10.490 -15.944 -6.648 182 HG21 ILE 44 HG21 ILE 44 -11.653 -13.102 -8.852 183 HG22 ILE 44 HG22 ILE 44 -10.785 -14.145 -9.979 184 HG23 ILE 44 HG23 ILE 44 -10.041 -12.650 -9.409 185 HD11 ILE 44 HD11 ILE 44 -12.228 -14.323 -6.110 186 HD12 ILE 44 HD12 ILE 44 -12.891 -15.865 -6.648 187 HD13 ILE 44 HD13 ILE 44 -12.883 -14.485 -7.742 188 H ASP 45 H ASP 45 -7.545 -14.388 -10.545 189 HA ASP 45 HA ASP 45 -6.290 -12.863 -11.635 190 HB2 ASP 45 HB2 ASP 45 -8.239 -11.369 -10.947 191 HB3 ASP 45 HB3 ASP 45 -7.266 -10.819 -9.588 192 H GLY 46 H GLY 46 -5.053 -14.434 -9.574 193 HA2 GLY 46 HA2 GLY 46 -2.937 -14.728 -8.710 194 HA3 GLY 46 HA3 GLY 46 -2.481 -13.187 -9.418 195 H LYS 47 H LYS 47 -5.202 -13.197 -7.330 196 HA LYS 47 HA LYS 47 -3.643 -12.217 -5.004 197 HB2 LYS 47 HB2 LYS 47 -6.369 -11.230 -5.973 198 HB3 LYS 47 HB3 LYS 47 -5.535 -10.671 -4.523 199 HG2 LYS 47 HG2 LYS 47 -4.487 -10.335 -7.348 200 HG3 LYS 47 HG3 LYS 47 -5.426 -9.111 -6.482 201 HD2 LYS 47 HD2 LYS 47 -3.656 -9.013 -4.738 202 HD3 LYS 47 HD3 LYS 47 -2.709 -10.212 -5.634 203 HE2 LYS 47 HE2 LYS 47 -1.907 -7.913 -6.057 204 HE3 LYS 47 HE3 LYS 47 -2.523 -8.657 -7.534 205 HZ1 LYS 47 HZ1 LYS 47 -3.992 -6.721 -5.823 206 HZ2 LYS 47 HZ2 LYS 47 -4.607 -7.455 -7.217 207 HZ3 LYS 47 HZ3 LYS 47 -3.299 -6.396 -7.329 208 H VAL 48 H VAL 48 -4.400 -12.931 -3.006 209 HA VAL 48 HA VAL 48 -6.408 -15.094 -3.045 210 HB VAL 48 HB VAL 48 -4.490 -14.375 -0.778 211 HG11 VAL 48 HG11 VAL 48 -6.126 -16.905 -1.250 212 HG12 VAL 48 HG12 VAL 48 -6.477 -15.664 -0.046 213 HG13 VAL 48 HG13 VAL 48 -5.007 -16.631 0.091 214 HG21 VAL 48 HG21 VAL 48 -4.154 -16.472 -2.953 215 HG22 VAL 48 HG22 VAL 48 -3.111 -16.296 -1.541 216 HG23 VAL 48 HG23 VAL 48 -3.184 -15.009 -2.747 217 H TYR 49 H TYR 49 -8.396 -14.541 -2.476 218 HA TYR 49 HA TYR 49 -8.921 -12.337 -0.553 219 HB2 TYR 49 HB2 TYR 49 -10.865 -13.545 -2.583 220 HB3 TYR 49 HB3 TYR 49 -11.134 -12.123 -1.585 221 HD1 TYR 49 HD1 TYR 49 -9.849 -9.993 -2.093 222 HD2 TYR 49 HD2 TYR 49 -9.734 -13.374 -4.703 223 HE1 TYR 49 HE1 TYR 49 -8.958 -8.581 -3.896 224 HE2 TYR 49 HE2 TYR 49 -8.848 -11.947 -6.497 225 HH TYR 49 HH TYR 49 -8.716 -9.668 -7.148 226 H ASP 50 H ASP 50 -10.820 -12.738 0.892 227 HA ASP 50 HA ASP 50 -11.115 -15.562 1.688 228 HB2 ASP 50 HB2 ASP 50 -12.242 -14.706 3.702 229 HB3 ASP 50 HB3 ASP 50 -10.706 -13.882 3.480 230 H ILE 51 H ILE 51 -13.220 -16.415 2.080 231 HA ILE 51 HA ILE 51 -15.431 -15.328 0.435 232 HB ILE 51 HB ILE 51 -14.658 -18.197 1.090 233 HG12 ILE 51 HG12 ILE 51 -13.508 -17.202 -0.852 234 HG13 ILE 51 HG13 ILE 51 -14.598 -18.483 -1.371 235 HG21 ILE 51 HG21 ILE 51 -17.074 -18.107 1.405 236 HG22 ILE 51 HG22 ILE 51 -16.699 -18.982 -0.079 237 HG23 ILE 51 HG23 ILE 51 -17.284 -17.319 -0.161 238 HD11 ILE 51 HD11 ILE 51 -15.114 -15.513 -1.572 239 HD12 ILE 51 HD12 ILE 51 -16.236 -16.783 -2.073 240 HD13 ILE 51 HD13 ILE 51 -14.683 -16.606 -2.886 241 H LYS 52 H LYS 52 -14.383 -16.539 3.531 242 HA LYS 52 HA LYS 52 -16.783 -17.088 4.825 243 HB2 LYS 52 HB2 LYS 52 -15.469 -16.801 6.929 244 HB3 LYS 52 HB3 LYS 52 -14.628 -17.762 5.723 245 HG2 LYS 52 HG2 LYS 52 -13.244 -15.799 5.130 246 HG3 LYS 52 HG3 LYS 52 -14.067 -14.848 6.365 247 HD2 LYS 52 HD2 LYS 52 -12.326 -17.291 6.848 248 HD3 LYS 52 HD3 LYS 52 -11.855 -15.622 7.115 249 HE2 LYS 52 HE2 LYS 52 -12.368 -16.429 9.266 250 HE3 LYS 52 HE3 LYS 52 -13.805 -15.526 8.805 251 HZ1 LYS 52 HZ1 LYS 52 -14.911 -17.596 8.277 252 HZ2 LYS 52 HZ2 LYS 52 -14.319 -17.652 9.859 253 HZ3 LYS 52 HZ3 LYS 52 -13.510 -18.480 8.625 254 H ASP 53 H ASP 53 -14.974 -13.995 4.836 255 HA ASP 53 HA ASP 53 -16.930 -12.574 6.421 256 HB2 ASP 53 HB2 ASP 53 -14.424 -12.210 6.523 257 HB3 ASP 53 HB3 ASP 53 -14.499 -11.528 4.907 258 H PHE 54 H PHE 54 -16.036 -12.908 3.055 259 HA PHE 54 HA PHE 54 -17.401 -10.904 1.729 260 HB2 PHE 54 HB2 PHE 54 -15.874 -12.494 0.627 261 HB3 PHE 54 HB3 PHE 54 -16.989 -13.818 0.924 262 HD1 PHE 54 HD1 PHE 54 -19.120 -13.989 -0.401 263 HD2 PHE 54 HD2 PHE 54 -16.175 -11.007 -1.264 264 HE1 PHE 54 HE1 PHE 54 -20.138 -13.616 -2.609 265 HE2 PHE 54 HE2 PHE 54 -17.207 -10.653 -3.467 266 HZ PHE 54 HZ PHE 54 -19.183 -11.945 -4.140 267 H GLN 55 H GLN 55 -18.667 -14.175 2.398 268 HA GLN 55 HA GLN 55 -21.251 -13.700 1.348 269 HB2 GLN 55 HB2 GLN 55 -21.847 -15.899 2.334 270 HB3 GLN 55 HB3 GLN 55 -20.352 -15.946 1.406 271 HG2 GLN 55 HG2 GLN 55 -19.048 -15.889 3.495 272 HG3 GLN 55 HG3 GLN 55 -20.538 -15.809 4.428 273 HE21 GLN 55 HE21 GLN 55 -20.197 -17.889 1.589 274 HE22 GLN 55 HE22 GLN 55 -20.201 -19.378 2.457 275 H THR 56 H THR 56 -19.932 -13.303 4.571 276 HA THR 56 HA THR 56 -22.313 -12.989 6.067 277 HB THR 56 HB THR 56 -19.617 -11.618 6.515 278 HG1 THR 56 HG1 THR 56 -18.966 -13.598 6.808 279 HG21 THR 56 HG21 THR 56 -20.251 -11.605 8.913 280 HG22 THR 56 HG22 THR 56 -21.835 -12.265 8.502 281 HG23 THR 56 HG23 THR 56 -21.379 -10.653 7.943 282 H GLN 57 H GLN 57 -20.274 -10.652 4.297 283 HA GLN 57 HA GLN 57 -21.975 -8.385 4.803 284 HB2 GLN 57 HB2 GLN 57 -19.583 -8.770 2.971 285 HB3 GLN 57 HB3 GLN 57 -20.407 -7.226 3.210 286 HG2 GLN 57 HG2 GLN 57 -19.899 -7.382 5.645 287 HG3 GLN 57 HG3 GLN 57 -18.986 -8.853 5.347 288 HE21 GLN 57 HE21 GLN 57 -16.959 -8.702 4.414 289 HE22 GLN 57 HE22 GLN 57 -16.136 -7.197 4.206 290 H SER 58 H SER 58 -22.038 -10.924 2.494 291 HA SER 58 HA SER 58 -23.516 -9.600 0.422 292 HB2 SER 58 HB2 SER 58 -23.479 -12.566 1.117 293 HB3 SER 58 HB3 SER 58 -24.046 -11.857 -0.397 294 HG SER 58 HG SER 58 -21.438 -11.293 0.464 295 H LEU 59 H LEU 59 -24.325 -10.756 3.565 296 HA LEU 59 HA LEU 59 -27.195 -10.929 3.188 297 HB2 LEU 59 HB2 LEU 59 -25.587 -10.833 5.774 298 HB3 LEU 59 HB3 LEU 59 -27.265 -11.336 5.613 299 HG LEU 59 HG LEU 59 -24.854 -12.812 4.474 300 HD11 LEU 59 HD11 LEU 59 -24.932 -12.968 6.908 301 HD12 LEU 59 HD12 LEU 59 -25.305 -14.524 6.174 302 HD13 LEU 59 HD13 LEU 59 -26.605 -13.533 6.846 303 HD21 LEU 59 HD21 LEU 59 -26.433 -14.628 3.914 304 HD22 LEU 59 HD22 LEU 59 -26.813 -13.145 3.045 305 HD23 LEU 59 HD23 LEU 59 -27.787 -13.619 4.438 306 H THR 60 H THR 60 -25.082 -8.351 3.400 307 HA THR 60 HA THR 60 -26.780 -6.538 4.964 308 HB THR 60 HB THR 60 -24.094 -6.092 3.579 309 HG1 THR 60 HG1 THR 60 -24.667 -7.421 5.772 310 HG21 THR 60 HG21 THR 60 -25.289 -3.946 3.869 311 HG22 THR 60 HG22 THR 60 -23.908 -4.055 4.963 312 HG23 THR 60 HG23 THR 60 -25.540 -4.309 5.582 313 H GLU 61 H GLU 61 -28.088 -5.040 4.053 314 HA GLU 61 HA GLU 61 -28.983 -5.251 1.386 315 HB2 GLU 61 HB2 GLU 61 -30.463 -4.478 3.191 316 HB3 GLU 61 HB3 GLU 61 -29.465 -3.057 3.450 317 HG2 GLU 61 HG2 GLU 61 -31.531 -2.477 2.279 318 HG3 GLU 61 HG3 GLU 61 -30.128 -2.151 1.265 319 H ASN 62 H ASN 62 -27.024 -2.691 2.971 320 HA ASN 62 HA ASN 62 -26.649 -1.273 0.445 321 HB2 ASN 62 HB2 ASN 62 -27.065 -0.050 2.625 322 HB3 ASN 62 HB3 ASN 62 -25.495 -0.600 3.194 323 HD21 ASN 62 HD21 ASN 62 -24.706 1.509 3.403 324 HD22 ASN 62 HD22 ASN 62 -24.317 2.510 2.051 325 H SER 63 H SER 63 -25.585 -3.823 0.339 326 HA SER 63 HA SER 63 -22.701 -3.271 -0.048 327 HB2 SER 63 HB2 SER 63 -24.056 -5.923 0.639 328 HB3 SER 63 HB3 SER 63 -22.372 -5.780 0.135 329 HG SER 63 HG SER 63 -22.674 -5.825 2.430 330 H ILE 64 H ILE 64 -21.915 -3.692 -2.041 331 HA ILE 64 HA ILE 64 -23.422 -4.062 -4.372 332 HB ILE 64 HB ILE 64 -21.216 -4.720 -5.444 333 HG12 ILE 64 HG12 ILE 64 -20.049 -4.344 -2.639 334 HG13 ILE 64 HG13 ILE 64 -20.308 -5.911 -3.391 335 HG21 ILE 64 HG21 ILE 64 -20.092 -2.541 -5.128 336 HG22 ILE 64 HG22 ILE 64 -21.091 -2.223 -3.708 337 HG23 ILE 64 HG23 ILE 64 -21.839 -2.345 -5.302 338 HD11 ILE 64 HD11 ILE 64 -18.006 -5.255 -3.529 339 HD12 ILE 64 HD12 ILE 64 -18.440 -3.764 -4.362 340 HD13 ILE 64 HD13 ILE 64 -18.710 -5.326 -5.141 341 H LEU 65 H LEU 65 -22.256 -6.333 -2.033 342 HA LEU 65 HA LEU 65 -22.354 -8.726 -3.621 343 HB2 LEU 65 HB2 LEU 65 -22.320 -8.472 -0.594 344 HB3 LEU 65 HB3 LEU 65 -21.849 -9.878 -1.543 345 HG LEU 65 HG LEU 65 -20.377 -7.230 -1.324 346 HD11 LEU 65 HD11 LEU 65 -18.566 -8.560 -0.336 347 HD12 LEU 65 HD12 LEU 65 -19.558 -10.020 -0.445 348 HD13 LEU 65 HD13 LEU 65 -20.053 -8.687 0.605 349 HD21 LEU 65 HD21 LEU 65 -18.675 -8.170 -2.812 350 HD22 LEU 65 HD22 LEU 65 -20.218 -7.995 -3.630 351 HD23 LEU 65 HD23 LEU 65 -19.682 -9.591 -3.096 352 H ALA 66 H ALA 66 -24.749 -6.823 -2.171 353 HA ALA 66 HA ALA 66 -26.626 -8.865 -1.416 354 HB1 ALA 66 HB1 ALA 66 -28.211 -7.017 -1.130 355 HB2 ALA 66 HB2 ALA 66 -27.097 -5.912 -1.944 356 HB3 ALA 66 HB3 ALA 66 -26.657 -6.624 -0.394 357 H GLN 67 H GLN 67 -25.808 -7.286 -4.453 358 HA GLN 67 HA GLN 67 -28.168 -8.205 -5.864 359 HB2 GLN 67 HB2 GLN 67 -27.181 -7.361 -7.858 360 HB3 GLN 67 HB3 GLN 67 -26.643 -6.252 -6.604 361 HG2 GLN 67 HG2 GLN 67 -24.451 -7.452 -6.546 362 HG3 GLN 67 HG3 GLN 67 -25.001 -8.474 -7.864 363 HE21 GLN 67 HE21 GLN 67 -25.612 -4.990 -7.618 364 HE22 GLN 67 HE22 GLN 67 -24.618 -4.545 -8.955 365 H PHE 68 H PHE 68 -25.033 -9.450 -5.026 366 HA PHE 68 HA PHE 68 -25.197 -11.858 -6.661 367 HB2 PHE 68 HB2 PHE 68 -23.164 -10.948 -4.578 368 HB3 PHE 68 HB3 PHE 68 -23.012 -12.404 -5.549 369 HD1 PHE 68 HD1 PHE 68 -23.276 -11.904 -8.223 370 HD2 PHE 68 HD2 PHE 68 -21.877 -9.116 -5.294 371 HE1 PHE 68 HE1 PHE 68 -22.061 -10.667 -9.970 372 HE2 PHE 68 HE2 PHE 68 -20.671 -7.881 -7.053 373 HZ PHE 68 HZ PHE 68 -20.762 -8.655 -9.391 374 H ALA 69 H ALA 69 -26.727 -10.946 -3.888 375 HA ALA 69 HA ALA 69 -26.382 -13.167 -2.147 376 HB1 ALA 69 HB1 ALA 69 -28.437 -12.364 -1.041 377 HB2 ALA 69 HB2 ALA 69 -28.744 -11.272 -2.394 378 HB3 ALA 69 HB3 ALA 69 -27.332 -11.026 -1.366 379 H GLY 70 H GLY 70 -27.202 -15.181 -2.260 380 HA2 GLY 70 HA2 GLY 70 -28.824 -16.840 -2.813 381 HA3 GLY 70 HA3 GLY 70 -29.383 -15.857 -4.157 382 H GLU 71 H GLU 71 -26.423 -15.342 -4.760 383 HA GLU 71 HA GLU 71 -25.961 -17.657 -6.499 384 HB2 GLU 71 HB2 GLU 71 -25.819 -15.297 -7.391 385 HB3 GLU 71 HB3 GLU 71 -24.451 -14.988 -6.334 386 HG2 GLU 71 HG2 GLU 71 -23.709 -15.411 -8.624 387 HG3 GLU 71 HG3 GLU 71 -23.126 -16.682 -7.545 388 H ASP 72 H ASP 72 -23.840 -18.692 -6.561 389 HA ASP 72 HA ASP 72 -22.669 -19.389 -4.093 390 HB2 ASP 72 HB2 ASP 72 -22.505 -20.824 -6.109 391 HB3 ASP 72 HB3 ASP 72 -21.519 -19.614 -6.916 392 HA PRO 73 HA PRO 73 -20.379 -15.669 -3.241 393 HB2 PRO 73 HB2 PRO 73 -18.526 -16.602 -1.423 394 HB3 PRO 73 HB3 PRO 73 -20.240 -16.377 -1.043 395 HG2 PRO 73 HG2 PRO 73 -18.803 -18.908 -1.871 396 HG3 PRO 73 HG3 PRO 73 -19.939 -18.661 -0.523 397 HD2 PRO 73 HD2 PRO 73 -20.773 -19.753 -2.824 398 HD3 PRO 73 HD3 PRO 73 -21.813 -18.612 -1.942 399 H VAL 74 H VAL 74 -18.482 -18.509 -4.278 400 HA VAL 74 HA VAL 74 -16.048 -17.032 -4.783 401 HB VAL 74 HB VAL 74 -16.818 -19.798 -5.837 402 HG11 VAL 74 HG11 VAL 74 -14.368 -20.150 -6.107 403 HG12 VAL 74 HG12 VAL 74 -14.076 -18.485 -5.598 404 HG13 VAL 74 HG13 VAL 74 -14.943 -18.807 -7.101 405 HG21 VAL 74 HG21 VAL 74 -16.902 -19.731 -3.372 406 HG22 VAL 74 HG22 VAL 74 -15.265 -19.072 -3.321 407 HG23 VAL 74 HG23 VAL 74 -15.537 -20.707 -3.924 408 H VAL 75 H VAL 75 -18.682 -18.362 -6.789 409 HA VAL 75 HA VAL 75 -17.815 -17.471 -9.333 410 HB VAL 75 HB VAL 75 -20.683 -17.916 -8.352 411 HG11 VAL 75 HG11 VAL 75 -19.640 -17.807 -11.215 412 HG12 VAL 75 HG12 VAL 75 -20.686 -16.611 -10.446 413 HG13 VAL 75 HG13 VAL 75 -21.285 -18.243 -10.739 414 HG21 VAL 75 HG21 VAL 75 -18.786 -19.836 -9.757 415 HG22 VAL 75 HG22 VAL 75 -20.467 -20.177 -9.340 416 HG23 VAL 75 HG23 VAL 75 -19.278 -19.917 -8.063 417 H ALA 76 H ALA 76 -19.784 -15.967 -6.851 418 HA ALA 76 HA ALA 76 -20.549 -13.576 -8.144 419 HB1 ALA 76 HB1 ALA 76 -21.647 -14.420 -6.109 420 HB2 ALA 76 HB2 ALA 76 -21.063 -12.774 -5.863 421 HB3 ALA 76 HB3 ALA 76 -20.172 -14.139 -5.181 422 H LEU 77 H LEU 77 -17.745 -14.440 -6.174 423 HA LEU 77 HA LEU 77 -16.609 -11.823 -6.004 424 HB2 LEU 77 HB2 LEU 77 -16.215 -13.599 -4.329 425 HB3 LEU 77 HB3 LEU 77 -15.380 -14.565 -5.531 426 HG LEU 77 HG LEU 77 -13.540 -12.931 -5.621 427 HD11 LEU 77 HD11 LEU 77 -14.765 -10.867 -5.190 428 HD12 LEU 77 HD12 LEU 77 -13.396 -11.039 -4.096 429 HD13 LEU 77 HD13 LEU 77 -15.032 -11.357 -3.513 430 HD21 LEU 77 HD21 LEU 77 -14.198 -13.735 -2.769 431 HD22 LEU 77 HD22 LEU 77 -12.604 -13.308 -3.395 432 HD23 LEU 77 HD23 LEU 77 -13.415 -14.755 -3.980 433 H GLU 78 H GLU 78 -16.100 -14.610 -8.167 434 HA GLU 78 HA GLU 78 -13.900 -13.593 -9.654 435 HB2 GLU 78 HB2 GLU 78 -16.079 -15.583 -10.424 436 HB3 GLU 78 HB3 GLU 78 -14.664 -15.249 -11.428 437 HG2 GLU 78 HG2 GLU 78 -13.189 -16.070 -9.653 438 HG3 GLU 78 HG3 GLU 78 -14.577 -16.352 -8.601 439 H ALA 79 H ALA 79 -17.410 -13.431 -10.162 440 HA ALA 79 HA ALA 79 -17.467 -11.881 -12.527 441 HB1 ALA 79 HB1 ALA 79 -19.408 -13.157 -11.678 442 HB2 ALA 79 HB2 ALA 79 -19.826 -11.465 -11.956 443 HB3 ALA 79 HB3 ALA 79 -19.540 -12.049 -10.311 444 H ALA 80 H ALA 80 -17.188 -11.056 -9.139 445 HA ALA 80 HA ALA 80 -17.735 -8.281 -9.297 446 HB1 ALA 80 HB1 ALA 80 -17.911 -9.556 -7.207 447 HB2 ALA 80 HB2 ALA 80 -16.833 -8.172 -7.023 448 HB3 ALA 80 HB3 ALA 80 -16.162 -9.798 -7.194 449 H LEU 81 H LEU 81 -14.644 -10.125 -9.407 450 HA LEU 81 HA LEU 81 -12.980 -7.806 -9.539 451 HB2 LEU 81 HB2 LEU 81 -12.513 -10.735 -10.013 452 HB3 LEU 81 HB3 LEU 81 -11.316 -9.617 -10.622 453 HG LEU 81 HG LEU 81 -10.537 -10.393 -8.503 454 HD11 LEU 81 HD11 LEU 81 -10.136 -8.020 -8.943 455 HD12 LEU 81 HD12 LEU 81 -10.281 -8.346 -7.220 456 HD13 LEU 81 HD13 LEU 81 -11.622 -7.595 -8.087 457 HD21 LEU 81 HD21 LEU 81 -11.779 -10.188 -6.398 458 HD22 LEU 81 HD22 LEU 81 -12.616 -11.229 -7.548 459 HD23 LEU 81 HD23 LEU 81 -13.187 -9.581 -7.278 460 H GLN 82 H GLN 82 -14.860 -9.442 -11.927 461 HA GLN 82 HA GLN 82 -13.473 -8.362 -14.243 462 HB2 GLN 82 HB2 GLN 82 -16.103 -9.872 -13.971 463 HB3 GLN 82 HB3 GLN 82 -15.383 -9.406 -15.514 464 HG2 GLN 82 HG2 GLN 82 -13.448 -10.824 -15.083 465 HG3 GLN 82 HG3 GLN 82 -14.056 -11.226 -13.479 466 HE21 GLN 82 HE21 GLN 82 -15.823 -12.636 -13.297 467 HE22 GLN 82 HE22 GLN 82 -16.325 -13.657 -14.592 468 H PHE 83 H PHE 83 -15.719 -7.080 -12.026 469 HA PHE 83 HA PHE 83 -16.486 -4.933 -13.929 470 HB2 PHE 83 HB2 PHE 83 -18.425 -6.395 -13.364 471 HB3 PHE 83 HB3 PHE 83 -18.181 -6.060 -11.656 472 HD1 PHE 83 HD1 PHE 83 -18.267 -3.828 -14.700 473 HD2 PHE 83 HD2 PHE 83 -19.999 -4.775 -10.903 474 HE1 PHE 83 HE1 PHE 83 -19.804 -1.922 -14.917 475 HE2 PHE 83 HE2 PHE 83 -21.531 -2.864 -11.132 476 HZ PHE 83 HZ PHE 83 -21.439 -1.438 -13.139 477 H GLU 84 H GLU 84 -15.890 -2.949 -13.300 478 HA GLU 84 HA GLU 84 -13.905 -2.620 -11.379 479 HB2 GLU 84 HB2 GLU 84 -14.042 -0.184 -11.962 480 HB3 GLU 84 HB3 GLU 84 -13.922 -1.261 -13.348 481 HG2 GLU 84 HG2 GLU 84 -16.407 -1.060 -13.647 482 HG3 GLU 84 HG3 GLU 84 -16.429 0.129 -12.346 483 H ASP 85 H ASP 85 -17.312 -1.622 -11.200 484 HA ASP 85 HA ASP 85 -17.225 -0.142 -8.804 485 HB2 ASP 85 HB2 ASP 85 -19.496 -1.739 -10.059 486 HB3 ASP 85 HB3 ASP 85 -19.709 -0.670 -8.671 487 H THR 86 H THR 86 -17.486 -3.571 -9.413 488 HA THR 86 HA THR 86 -17.997 -4.179 -6.593 489 HB THR 86 HB THR 86 -18.426 -6.528 -7.492 490 HG1 THR 86 HG1 THR 86 -17.239 -5.945 -9.554 491 HG21 THR 86 HG21 THR 86 -20.642 -5.991 -8.444 492 HG22 THR 86 HG22 THR 86 -20.157 -4.305 -8.638 493 HG23 THR 86 HG23 THR 86 -20.306 -4.999 -7.022 494 H ARG 87 H ARG 87 -15.243 -3.879 -8.555 495 HA ARG 87 HA ARG 87 -13.808 -6.182 -7.395 496 HB2 ARG 87 HB2 ARG 87 -12.055 -5.807 -8.940 497 HB3 ARG 87 HB3 ARG 87 -13.504 -5.423 -9.860 498 HG2 ARG 87 HG2 ARG 87 -13.099 -3.037 -9.583 499 HG3 ARG 87 HG3 ARG 87 -11.731 -3.354 -8.520 500 HD2 ARG 87 HD2 ARG 87 -10.569 -4.472 -10.434 501 HD3 ARG 87 HD3 ARG 87 -11.916 -3.994 -11.478 502 HE ARG 87 HE ARG 87 -10.269 -2.026 -9.991 503 HH11 ARG 87 HH11 ARG 87 -11.762 -3.046 -13.007 504 HH12 ARG 87 HH12 ARG 87 -11.255 -1.624 -13.864 505 HH21 ARG 87 HH21 ARG 87 -9.640 -0.168 -11.121 506 HH22 ARG 87 HH22 ARG 87 -10.050 -0.003 -12.800 507 H GLU 88 H GLU 88 -14.231 -2.801 -6.896 508 HA GLU 88 HA GLU 88 -11.686 -2.248 -5.694 509 HB2 GLU 88 HB2 GLU 88 -14.247 -0.648 -5.924 510 HB3 GLU 88 HB3 GLU 88 -12.775 -0.020 -5.181 511 HG2 GLU 88 HG2 GLU 88 -13.023 -1.007 -8.039 512 HG3 GLU 88 HG3 GLU 88 -13.027 0.677 -7.543 513 H SER 89 H SER 89 -14.795 -3.255 -4.457 514 HA SER 89 HA SER 89 -14.242 -2.786 -1.688 515 HB2 SER 89 HB2 SER 89 -16.543 -3.161 -2.596 516 HB3 SER 89 HB3 SER 89 -16.113 -4.831 -2.950 517 HG SER 89 HG SER 89 -16.967 -3.760 -0.648 518 H MET 90 H MET 90 -13.252 -5.186 -4.006 519 HA MET 90 HA MET 90 -12.571 -7.281 -2.145 520 HB2 MET 90 HB2 MET 90 -11.644 -6.999 -5.031 521 HB3 MET 90 HB3 MET 90 -11.673 -8.477 -4.057 522 HG2 MET 90 HG2 MET 90 -14.009 -6.912 -5.159 523 HG3 MET 90 HG3 MET 90 -13.574 -8.599 -5.469 524 HE1 MET 90 HE1 MET 90 -16.487 -7.205 -4.337 525 HE2 MET 90 HE2 MET 90 -16.998 -8.585 -3.367 526 HE3 MET 90 HE3 MET 90 -16.314 -8.848 -4.965 527 H HIS 91 H HIS 91 -11.099 -4.375 -3.004 528 HA HIS 91 HA HIS 91 -8.378 -4.981 -2.373 529 HB2 HIS 91 HB2 HIS 91 -9.940 -2.364 -2.317 530 HB3 HIS 91 HB3 HIS 91 -8.211 -2.461 -1.999 531 HD1 HIS 91 HD1 HIS 91 -7.108 -1.490 -4.008 532 HD2 HIS 91 HD2 HIS 91 -10.260 -3.986 -5.049 533 HE1 HIS 91 HE1 HIS 91 -7.130 -1.540 -6.517 534 HE2 HIS 91 HE2 HIS 91 -9.204 -2.825 -7.102 535 H ALA 92 H ALA 92 -11.239 -4.630 -0.486 536 HA ALA 92 HA ALA 92 -9.870 -4.428 2.085 537 HB1 ALA 92 HB1 ALA 92 -12.136 -4.565 3.035 538 HB2 ALA 92 HB2 ALA 92 -12.802 -4.912 1.436 539 HB3 ALA 92 HB3 ALA 92 -12.068 -3.341 1.763 540 H PHE 93 H PHE 93 -11.422 -6.897 0.041 541 HA PHE 93 HA PHE 93 -11.364 -8.982 2.064 542 HB2 PHE 93 HB2 PHE 93 -12.098 -9.074 -0.891 543 HB3 PHE 93 HB3 PHE 93 -12.239 -10.446 0.205 544 HD1 PHE 93 HD1 PHE 93 -13.872 -10.334 2.131 545 HD2 PHE 93 HD2 PHE 93 -13.821 -7.375 -0.944 546 HE1 PHE 93 HE1 PHE 93 -16.120 -9.576 2.798 547 HE2 PHE 93 HE2 PHE 93 -16.065 -6.634 -0.275 548 HZ PHE 93 HZ PHE 93 -17.214 -7.734 1.600 549 H CYS 94 H CYS 94 -9.094 -7.786 -0.209 550 HA CYS 94 HA CYS 94 -7.708 -10.197 -0.834 551 HB2 CYS 94 HB2 CYS 94 -5.894 -8.697 -1.633 552 HB3 CYS 94 HB3 CYS 94 -7.467 -8.221 -2.253 553 HG CYS 94 HG CYS 94 -6.301 -6.666 0.529 554 H VAL 95 H VAL 95 -7.054 -11.426 0.825 555 HA VAL 95 HA VAL 95 -5.889 -10.401 3.262 556 HB VAL 95 HB VAL 95 -5.617 -12.748 3.923 557 HG11 VAL 95 HG11 VAL 95 -7.978 -13.491 3.833 558 HG12 VAL 95 HG12 VAL 95 -8.314 -12.293 2.581 559 HG13 VAL 95 HG13 VAL 95 -7.860 -11.768 4.204 560 HG21 VAL 95 HG21 VAL 95 -6.216 -14.614 2.408 561 HG22 VAL 95 HG22 VAL 95 -4.859 -13.686 1.774 562 HG23 VAL 95 HG23 VAL 95 -6.471 -13.467 1.091 563 H GLY 96 H GLY 96 -4.690 -11.184 0.156 564 HA2 GLY 96 HA2 GLY 96 -2.167 -10.126 0.489 565 HA3 GLY 96 HA3 GLY 96 -1.980 -11.853 0.798 566 H GLN 97 H GLN 97 -0.530 -11.370 -1.155 567 HA GLN 97 HA GLN 97 -1.961 -11.671 -3.718 568 HB2 GLN 97 HB2 GLN 97 -0.092 -9.999 -3.568 569 HB3 GLN 97 HB3 GLN 97 1.020 -11.305 -3.173 570 HG2 GLN 97 HG2 GLN 97 0.573 -12.325 -5.393 571 HG3 GLN 97 HG3 GLN 97 -0.501 -10.981 -5.779 572 HE21 GLN 97 HE21 GLN 97 2.801 -11.997 -5.409 573 HE22 GLN 97 HE22 GLN 97 3.533 -10.579 -6.068 574 H TYR 98 H TYR 98 -1.534 -13.502 -5.038 575 HA TYR 98 HA TYR 98 -0.877 -15.947 -3.601 576 HB2 TYR 98 HB2 TYR 98 -2.858 -15.852 -5.067 577 HB3 TYR 98 HB3 TYR 98 -1.840 -15.475 -6.447 578 HD1 TYR 98 HD1 TYR 98 -2.081 -18.118 -3.769 579 HD2 TYR 98 HD2 TYR 98 -1.388 -17.264 -7.900 580 HE1 TYR 98 HE1 TYR 98 -1.904 -20.523 -4.244 581 HE2 TYR 98 HE2 TYR 98 -1.216 -19.667 -8.370 582 HH TYR 98 HH TYR 98 -0.725 -21.732 -7.223 583 H LEU 99 H LEU 99 0.748 -17.393 -4.209 584 HA LEU 99 HA LEU 99 2.562 -16.766 -6.405 585 HB2 LEU 99 HB2 LEU 99 3.513 -15.683 -4.351 586 HB3 LEU 99 HB3 LEU 99 3.531 -17.236 -3.544 587 HG LEU 99 HG LEU 99 5.746 -16.287 -4.481 588 HD11 LEU 99 HD11 LEU 99 5.623 -18.532 -3.605 589 HD12 LEU 99 HD12 LEU 99 6.679 -18.472 -5.013 590 HD13 LEU 99 HD13 LEU 99 5.050 -19.142 -5.159 591 HD21 LEU 99 HD21 LEU 99 4.964 -15.633 -6.700 592 HD22 LEU 99 HD22 LEU 99 4.657 -17.325 -7.108 593 HD23 LEU 99 HD23 LEU 99 6.305 -16.772 -6.804 594 H GLU 100 H GLU 100 2.637 -18.581 -7.576 595 HA GLU 100 HA GLU 100 1.902 -21.177 -6.646 596 HB2 GLU 100 HB2 GLU 100 3.358 -20.275 -9.160 597 HB3 GLU 100 HB3 GLU 100 2.786 -21.911 -8.896 598 HG2 GLU 100 HG2 GLU 100 0.483 -21.165 -8.897 599 HG3 GLU 100 HG3 GLU 100 0.990 -19.475 -8.946 600 HA PRO 101 HA PRO 101 5.870 -22.276 -4.685 601 HB2 PRO 101 HB2 PRO 101 5.515 -25.072 -4.994 602 HB3 PRO 101 HB3 PRO 101 4.998 -24.105 -3.609 603 HG2 PRO 101 HG2 PRO 101 3.414 -25.002 -6.002 604 HG3 PRO 101 HG3 PRO 101 2.919 -24.904 -4.298 605 HD2 PRO 101 HD2 PRO 101 2.120 -23.049 -6.045 606 HD3 PRO 101 HD3 PRO 101 2.590 -22.579 -4.396 607 H ASP 102 H ASP 102 4.827 -23.604 -7.820 608 HA ASP 102 HA ASP 102 7.451 -24.387 -8.728 609 HB2 ASP 102 HB2 ASP 102 5.437 -25.517 -9.585 610 HB3 ASP 102 HB3 ASP 102 4.853 -24.010 -10.278 611 H GLN 103 H GLN 103 5.456 -21.484 -9.004 612 HA GLN 103 HA GLN 103 6.878 -20.160 -11.066 613 HB2 GLN 103 HB2 GLN 103 4.606 -19.466 -10.300 614 HB3 GLN 103 HB3 GLN 103 5.290 -18.924 -8.772 615 HG2 GLN 103 HG2 GLN 103 4.816 -17.065 -10.335 616 HG3 GLN 103 HG3 GLN 103 6.517 -17.160 -9.876 617 HE21 GLN 103 HE21 GLN 103 7.196 -16.005 -11.710 618 HE22 GLN 103 HE22 GLN 103 7.155 -16.671 -13.303 619 H GLU 104 H GLU 104 7.377 -20.391 -7.570 620 HA GLU 104 HA GLU 104 9.713 -18.727 -7.502 621 HB2 GLU 104 HB2 GLU 104 8.414 -19.320 -5.436 622 HB3 GLU 104 HB3 GLU 104 8.923 -20.992 -5.620 623 HG2 GLU 104 HG2 GLU 104 10.277 -19.925 -3.924 624 HG3 GLU 104 HG3 GLU 104 11.283 -20.316 -5.316 625 H GLY 105 H GLY 105 11.198 -19.270 -9.056 626 HA2 GLY 105 HA2 GLY 105 12.897 -21.516 -8.756 627 HA3 GLY 105 HA3 GLY 105 11.794 -21.764 -10.113 628 H VAL 106 H VAL 106 13.942 -21.808 -11.188 629 HA VAL 106 HA VAL 106 15.430 -19.407 -11.650 630 HB VAL 106 HB VAL 106 16.459 -21.642 -11.834 631 HG11 VAL 106 HG11 VAL 106 14.513 -22.891 -12.679 632 HG12 VAL 106 HG12 VAL 106 15.939 -23.190 -13.680 633 HG13 VAL 106 HG13 VAL 106 14.671 -22.099 -14.250 634 HG21 VAL 106 HG21 VAL 106 16.483 -20.197 -14.514 635 HG22 VAL 106 HG22 VAL 106 17.688 -21.368 -13.967 636 HG23 VAL 106 HG23 VAL 106 17.509 -19.828 -13.124 637 H THR 107 H THR 107 15.390 -18.042 -13.446 638 HA THR 107 HA THR 107 13.156 -18.304 -15.367 639 HB THR 107 HB THR 107 13.169 -16.132 -14.212 640 HG1 THR 107 HG1 THR 107 14.075 -15.360 -16.735 641 HG21 THR 107 HG21 THR 107 14.971 -14.471 -14.528 642 HG22 THR 107 HG22 THR 107 15.938 -15.671 -15.385 643 HG23 THR 107 HG23 THR 107 15.570 -15.895 -13.674 644 H ILE 108 H ILE 108 13.627 -18.891 -17.420 645 HA ILE 108 HA ILE 108 16.399 -19.309 -18.240 646 HB ILE 108 HB ILE 108 13.768 -19.966 -19.644 647 HG12 ILE 108 HG12 ILE 108 15.769 -21.782 -18.210 648 HG13 ILE 108 HG13 ILE 108 14.194 -21.302 -17.586 649 HG21 ILE 108 HG21 ILE 108 15.116 -21.306 -21.245 650 HG22 ILE 108 HG22 ILE 108 16.595 -20.696 -20.502 651 HG23 ILE 108 HG23 ILE 108 15.506 -19.586 -21.332 652 HD11 ILE 108 HD11 ILE 108 14.131 -23.560 -18.432 653 HD12 ILE 108 HD12 ILE 108 14.701 -23.029 -20.013 654 HD13 ILE 108 HD13 ILE 108 13.113 -22.524 -19.431 655 HA PRO 109 HA PRO 109 16.398 -15.285 -20.459 656 HB2 PRO 109 HB2 PRO 109 19.011 -16.362 -21.475 657 HB3 PRO 109 HB3 PRO 109 18.656 -14.803 -20.716 658 HG2 PRO 109 HG2 PRO 109 19.954 -16.698 -19.351 659 HG3 PRO 109 HG3 PRO 109 18.732 -15.687 -18.547 660 HD2 PRO 109 HD2 PRO 109 18.464 -18.517 -19.579 661 HD3 PRO 109 HD3 PRO 109 17.899 -17.820 -18.044 662 H ASP 110 H ASP 110 14.852 -15.527 -21.998 663 HA ASP 110 HA ASP 110 14.907 -17.539 -24.065 664 HB2 ASP 110 HB2 ASP 110 12.773 -16.777 -23.108 665 HB3 ASP 110 HB3 ASP 110 13.088 -15.127 -23.641 666 H LEU 111 H LEU 111 16.845 -17.160 -25.084 667 HA LEU 111 HA LEU 111 17.604 -14.677 -26.306 668 HB2 LEU 111 HB2 LEU 111 19.179 -16.448 -25.472 669 HB3 LEU 111 HB3 LEU 111 18.673 -17.500 -26.775 670 HG LEU 111 HG LEU 111 19.966 -14.812 -27.382 671 HD11 LEU 111 HD11 LEU 111 22.177 -15.902 -27.448 672 HD12 LEU 111 HD12 LEU 111 21.471 -17.384 -26.797 673 HD13 LEU 111 HD13 LEU 111 21.494 -15.913 -25.821 674 HD21 LEU 111 HD21 LEU 111 18.971 -15.995 -29.303 675 HD22 LEU 111 HD22 LEU 111 19.932 -17.429 -28.936 676 HD23 LEU 111 HD23 LEU 111 20.728 -15.937 -29.447 677 H GLY 112 H GLY 112 15.987 -17.599 -27.348 678 HA2 GLY 112 HA2 GLY 112 14.340 -17.529 -29.138 679 HA3 GLY 112 HA3 GLY 112 15.424 -16.472 -30.040 Start of MODEL 5 1 H GLU 21 H GLU 21 -0.704 -1.879 -0.497 2 HA GLU 21 HA GLU 21 0.881 -0.548 -1.676 3 HB2 GLU 21 HB2 GLU 21 2.397 -0.546 0.978 4 HB3 GLU 21 HB3 GLU 21 3.143 -0.117 -0.554 5 HG2 GLU 21 HG2 GLU 21 2.611 1.910 0.587 6 HG3 GLU 21 HG3 GLU 21 1.522 1.762 -0.788 7 H LYS 22 H LYS 22 2.452 -2.637 0.784 8 HA LYS 22 HA LYS 22 3.539 -4.402 -1.213 9 HB2 LYS 22 HB2 LYS 22 4.367 -5.768 0.760 10 HB3 LYS 22 HB3 LYS 22 4.917 -4.108 0.729 11 HG2 LYS 22 HG2 LYS 22 4.456 -4.486 2.982 12 HG3 LYS 22 HG3 LYS 22 3.039 -3.614 2.417 13 HD2 LYS 22 HD2 LYS 22 2.376 -5.411 3.922 14 HD3 LYS 22 HD3 LYS 22 1.783 -5.754 2.300 15 HE2 LYS 22 HE2 LYS 22 3.613 -7.366 1.953 16 HE3 LYS 22 HE3 LYS 22 4.264 -6.986 3.551 17 HZ1 LYS 22 HZ1 LYS 22 1.630 -8.228 2.973 18 HZ2 LYS 22 HZ2 LYS 22 2.177 -7.793 4.511 19 HZ3 LYS 22 HZ3 LYS 22 2.983 -8.993 3.640 20 H VAL 23 H VAL 23 3.031 -6.584 -1.567 21 HA VAL 23 HA VAL 23 0.271 -7.355 -0.832 22 HB VAL 23 HB VAL 23 0.730 -6.993 -3.285 23 HG11 VAL 23 HG11 VAL 23 2.499 -9.455 -3.106 24 HG12 VAL 23 HG12 VAL 23 3.034 -7.811 -3.445 25 HG13 VAL 23 HG13 VAL 23 2.000 -8.652 -4.600 26 HG21 VAL 23 HG21 VAL 23 -1.152 -8.374 -2.564 27 HG22 VAL 23 HG22 VAL 23 -0.122 -9.806 -2.518 28 HG23 VAL 23 HG23 VAL 23 -0.469 -9.018 -4.059 29 H THR 24 H THR 24 -0.029 -9.179 0.318 30 HA THR 24 HA THR 24 2.232 -10.478 1.559 31 HB THR 24 HB THR 24 -0.755 -11.002 1.918 32 HG1 THR 24 HG1 THR 24 -0.733 -9.445 3.402 33 HG21 THR 24 HG21 THR 24 0.626 -12.854 2.795 34 HG22 THR 24 HG22 THR 24 -0.122 -11.947 4.110 35 HG23 THR 24 HG23 THR 24 1.585 -11.704 3.731 36 H LEU 25 H LEU 25 3.211 -12.243 0.687 37 HA LEU 25 HA LEU 25 1.981 -13.731 -1.462 38 HB2 LEU 25 HB2 LEU 25 4.640 -14.088 -0.028 39 HB3 LEU 25 HB3 LEU 25 4.126 -15.058 -1.403 40 HG LEU 25 HG LEU 25 4.642 -12.057 -1.426 41 HD11 LEU 25 HD11 LEU 25 6.533 -12.580 -2.903 42 HD12 LEU 25 HD12 LEU 25 6.212 -14.307 -2.720 43 HD13 LEU 25 HD13 LEU 25 6.710 -13.347 -1.325 44 HD21 LEU 25 HD21 LEU 25 2.799 -12.580 -2.954 45 HD22 LEU 25 HD22 LEU 25 3.756 -13.847 -3.724 46 HD23 LEU 25 HD23 LEU 25 4.247 -12.157 -3.865 47 H VAL 26 H VAL 26 0.288 -14.860 -0.763 48 HA VAL 26 HA VAL 26 0.414 -16.704 1.504 49 HB VAL 26 HB VAL 26 -1.832 -16.063 -0.470 50 HG11 VAL 26 HG11 VAL 26 -2.003 -17.729 2.067 51 HG12 VAL 26 HG12 VAL 26 -2.130 -18.329 0.411 52 HG13 VAL 26 HG13 VAL 26 -3.365 -17.247 1.052 53 HG21 VAL 26 HG21 VAL 26 -2.887 -14.793 1.363 54 HG22 VAL 26 HG22 VAL 26 -1.307 -14.127 0.950 55 HG23 VAL 26 HG23 VAL 26 -1.497 -15.112 2.403 56 H ARG 27 H ARG 27 1.264 -18.613 1.137 57 HA ARG 27 HA ARG 27 1.698 -19.653 -1.544 58 HB2 ARG 27 HB2 ARG 27 2.612 -20.617 1.197 59 HB3 ARG 27 HB3 ARG 27 3.081 -21.373 -0.328 60 HG2 ARG 27 HG2 ARG 27 4.298 -19.429 -1.024 61 HG3 ARG 27 HG3 ARG 27 3.646 -18.458 0.300 62 HD2 ARG 27 HD2 ARG 27 6.005 -19.185 0.658 63 HD3 ARG 27 HD3 ARG 27 4.908 -19.719 1.934 64 HE ARG 27 HE ARG 27 5.958 -21.435 -0.242 65 HH11 ARG 27 HH11 ARG 27 4.766 -21.125 3.055 66 HH12 ARG 27 HH12 ARG 27 5.184 -22.753 3.478 67 HH21 ARG 27 HH21 ARG 27 6.490 -23.561 0.327 68 HH22 ARG 27 HH22 ARG 27 6.164 -24.128 1.934 69 H ILE 28 H ILE 28 1.502 -22.154 -1.708 70 HA ILE 28 HA ILE 28 -1.158 -22.996 -1.590 71 HB ILE 28 HB ILE 28 0.495 -24.031 -3.103 72 HG12 ILE 28 HG12 ILE 28 -0.771 -26.086 -1.229 73 HG13 ILE 28 HG13 ILE 28 -1.580 -25.278 -2.556 74 HG21 ILE 28 HG21 ILE 28 1.719 -25.346 -0.652 75 HG22 ILE 28 HG22 ILE 28 2.461 -24.082 -1.633 76 HG23 ILE 28 HG23 ILE 28 2.164 -25.673 -2.331 77 HD11 ILE 28 HD11 ILE 28 0.720 -27.195 -2.830 78 HD12 ILE 28 HD12 ILE 28 -0.125 -26.384 -4.152 79 HD13 ILE 28 HD13 ILE 28 -0.982 -27.541 -3.136 80 H ALA 29 H ALA 29 1.474 -23.404 0.697 81 HA ALA 29 HA ALA 29 0.272 -25.229 2.492 82 HB1 ALA 29 HB1 ALA 29 2.704 -24.799 2.426 83 HB2 ALA 29 HB2 ALA 29 2.067 -24.532 4.047 84 HB3 ALA 29 HB3 ALA 29 2.444 -23.155 3.010 85 H ASP 30 H ASP 30 0.289 -21.678 2.350 86 HA ASP 30 HA ASP 30 -1.114 -21.257 4.828 87 HB2 ASP 30 HB2 ASP 30 -0.727 -19.347 2.483 88 HB3 ASP 30 HB3 ASP 30 -1.276 -18.892 4.095 89 H LEU 31 H LEU 31 -2.029 -21.452 1.416 90 HA LEU 31 HA LEU 31 -4.693 -20.514 1.684 91 HB2 LEU 31 HB2 LEU 31 -3.442 -20.534 -0.482 92 HB3 LEU 31 HB3 LEU 31 -3.515 -22.286 -0.499 93 HG LEU 31 HG LEU 31 -6.019 -22.168 -0.673 94 HD11 LEU 31 HD11 LEU 31 -5.602 -19.176 -0.916 95 HD12 LEU 31 HD12 LEU 31 -6.400 -20.017 0.418 96 HD13 LEU 31 HD13 LEU 31 -7.119 -20.039 -1.189 97 HD21 LEU 31 HD21 LEU 31 -4.590 -20.614 -2.858 98 HD22 LEU 31 HD22 LEU 31 -6.149 -21.427 -3.009 99 HD23 LEU 31 HD23 LEU 31 -4.689 -22.372 -2.735 100 H GLU 32 H GLU 32 -3.322 -23.802 1.464 101 HA GLU 32 HA GLU 32 -5.756 -25.233 1.542 102 HB2 GLU 32 HB2 GLU 32 -2.933 -26.137 2.222 103 HB3 GLU 32 HB3 GLU 32 -4.307 -27.232 2.087 104 HG2 GLU 32 HG2 GLU 32 -3.202 -25.498 -0.147 105 HG3 GLU 32 HG3 GLU 32 -2.885 -27.216 0.068 106 H ASN 33 H ASN 33 -3.403 -24.461 4.126 107 HA ASN 33 HA ASN 33 -4.720 -25.959 6.159 108 HB2 ASN 33 HB2 ASN 33 -2.469 -23.948 6.180 109 HB3 ASN 33 HB3 ASN 33 -3.245 -24.341 7.705 110 HD21 ASN 33 HD21 ASN 33 -1.215 -25.550 5.138 111 HD22 ASN 33 HD22 ASN 33 -0.722 -26.992 5.939 112 H HIS 34 H HIS 34 -4.733 -22.446 5.404 113 HA HIS 34 HA HIS 34 -6.372 -21.667 7.587 114 HB2 HIS 34 HB2 HIS 34 -4.952 -20.071 6.250 115 HB3 HIS 34 HB3 HIS 34 -6.098 -20.200 4.919 116 HD1 HIS 34 HD1 HIS 34 -8.539 -19.218 5.391 117 HD2 HIS 34 HD2 HIS 34 -5.679 -18.307 8.264 118 HE1 HIS 34 HE1 HIS 34 -9.535 -17.380 6.774 119 HE2 HIS 34 HE2 HIS 34 -7.813 -16.866 8.531 120 H ASN 35 H ASN 35 -7.104 -22.698 4.287 121 HA ASN 35 HA ASN 35 -9.907 -22.246 4.294 122 HB2 ASN 35 HB2 ASN 35 -8.496 -22.670 2.247 123 HB3 ASN 35 HB3 ASN 35 -8.368 -24.358 2.724 124 HD21 ASN 35 HD21 ASN 35 -10.260 -25.675 2.619 125 HD22 ASN 35 HD22 ASN 35 -11.605 -25.220 1.637 126 H ASN 36 H ASN 36 -7.870 -24.954 5.277 127 HA ASN 36 HA ASN 36 -9.921 -26.854 5.782 128 HB2 ASN 36 HB2 ASN 36 -7.586 -27.525 5.361 129 HB3 ASN 36 HB3 ASN 36 -7.063 -26.719 6.837 130 HD21 ASN 36 HD21 ASN 36 -8.948 -29.412 5.555 131 HD22 ASN 36 HD22 ASN 36 -8.859 -30.387 6.978 132 H ASP 37 H ASP 37 -8.467 -24.303 7.750 133 HA ASP 37 HA ASP 37 -9.494 -25.032 10.302 134 HB2 ASP 37 HB2 ASP 37 -8.737 -22.327 9.122 135 HB3 ASP 37 HB3 ASP 37 -9.264 -22.501 10.793 136 H GLY 38 H GLY 38 -11.019 -23.692 7.510 137 HA2 GLY 38 HA2 GLY 38 -13.495 -23.877 7.475 138 HA3 GLY 38 HA3 GLY 38 -13.501 -23.016 9.012 139 H GLY 39 H GLY 39 -11.231 -21.329 8.115 140 HA2 GLY 39 HA2 GLY 39 -12.622 -19.145 6.940 141 HA3 GLY 39 HA3 GLY 39 -10.896 -19.250 7.230 142 H PHE 40 H PHE 40 -13.451 -19.786 4.916 143 HA PHE 40 HA PHE 40 -11.876 -21.254 3.022 144 HB2 PHE 40 HB2 PHE 40 -14.445 -21.354 3.262 145 HB3 PHE 40 HB3 PHE 40 -14.502 -19.803 2.442 146 HD1 PHE 40 HD1 PHE 40 -13.287 -19.722 0.057 147 HD2 PHE 40 HD2 PHE 40 -14.574 -23.327 1.968 148 HE1 PHE 40 HE1 PHE 40 -13.297 -20.873 -2.117 149 HE2 PHE 40 HE2 PHE 40 -14.576 -24.466 -0.217 150 HZ PHE 40 HZ PHE 40 -13.939 -23.247 -2.253 151 H TRP 41 H TRP 41 -10.253 -20.287 2.054 152 HA TRP 41 HA TRP 41 -10.503 -17.578 0.909 153 HB2 TRP 41 HB2 TRP 41 -8.103 -19.316 1.615 154 HB3 TRP 41 HB3 TRP 41 -7.949 -17.968 0.499 155 HD1 TRP 41 HD1 TRP 41 -10.256 -16.625 2.914 156 HE1 TRP 41 HE1 TRP 41 -9.053 -15.262 4.722 157 HE3 TRP 41 HE3 TRP 41 -5.482 -18.338 2.195 158 HZ2 TRP 41 HZ2 TRP 41 -6.441 -14.948 5.730 159 HZ3 TRP 41 HZ3 TRP 41 -3.685 -17.456 3.637 160 HH2 TRP 41 HH2 TRP 41 -4.159 -15.795 5.370 161 H THR 42 H THR 42 -9.886 -17.315 -1.307 162 HA THR 42 HA THR 42 -9.882 -19.744 -3.011 163 HB THR 42 HB THR 42 -12.143 -18.649 -3.081 164 HG1 THR 42 HG1 THR 42 -12.141 -19.330 -5.067 165 HG21 THR 42 HG21 THR 42 -12.439 -16.454 -4.150 166 HG22 THR 42 HG22 THR 42 -10.692 -16.252 -4.277 167 HG23 THR 42 HG23 THR 42 -11.463 -16.293 -2.689 168 H VAL 43 H VAL 43 -8.843 -19.391 -5.112 169 HA VAL 43 HA VAL 43 -7.012 -17.061 -5.197 170 HB VAL 43 HB VAL 43 -5.595 -18.952 -4.924 171 HG11 VAL 43 HG11 VAL 43 -5.665 -21.007 -6.300 172 HG12 VAL 43 HG12 VAL 43 -7.120 -20.415 -7.104 173 HG13 VAL 43 HG13 VAL 43 -7.153 -20.775 -5.376 174 HG21 VAL 43 HG21 VAL 43 -5.641 -18.342 -7.905 175 HG22 VAL 43 HG22 VAL 43 -4.277 -19.009 -7.007 176 HG23 VAL 43 HG23 VAL 43 -4.840 -17.372 -6.668 177 H ILE 44 H ILE 44 -7.855 -15.646 -6.527 178 HA ILE 44 HA ILE 44 -8.752 -16.393 -9.244 179 HB ILE 44 HB ILE 44 -10.081 -14.237 -7.521 180 HG12 ILE 44 HG12 ILE 44 -11.293 -16.934 -8.303 181 HG13 ILE 44 HG13 ILE 44 -10.645 -16.567 -6.710 182 HG21 ILE 44 HG21 ILE 44 -11.754 -14.110 -9.346 183 HG22 ILE 44 HG22 ILE 44 -10.841 -15.307 -10.268 184 HG23 ILE 44 HG23 ILE 44 -10.129 -13.729 -9.921 185 HD11 ILE 44 HD11 ILE 44 -13.006 -15.199 -8.002 186 HD12 ILE 44 HD12 ILE 44 -12.363 -14.857 -6.394 187 HD13 ILE 44 HD13 ILE 44 -13.065 -16.434 -6.749 188 H ASP 45 H ASP 45 -7.784 -15.107 -10.782 189 HA ASP 45 HA ASP 45 -6.483 -13.559 -11.823 190 HB2 ASP 45 HB2 ASP 45 -8.266 -11.997 -10.916 191 HB3 ASP 45 HB3 ASP 45 -7.257 -11.701 -9.511 192 H GLY 46 H GLY 46 -5.324 -15.409 -9.948 193 HA2 GLY 46 HA2 GLY 46 -3.355 -15.976 -8.934 194 HA3 GLY 46 HA3 GLY 46 -2.653 -14.541 -9.658 195 H LYS 47 H LYS 47 -5.389 -14.089 -7.619 196 HA LYS 47 HA LYS 47 -3.727 -13.075 -5.384 197 HB2 LYS 47 HB2 LYS 47 -6.528 -12.146 -6.133 198 HB3 LYS 47 HB3 LYS 47 -5.449 -11.410 -4.952 199 HG2 LYS 47 HG2 LYS 47 -4.997 -11.473 -7.948 200 HG3 LYS 47 HG3 LYS 47 -5.711 -10.121 -7.060 201 HD2 LYS 47 HD2 LYS 47 -3.630 -9.872 -5.781 202 HD3 LYS 47 HD3 LYS 47 -2.903 -11.220 -6.670 203 HE2 LYS 47 HE2 LYS 47 -3.783 -8.542 -7.810 204 HE3 LYS 47 HE3 LYS 47 -2.127 -9.128 -7.631 205 HZ1 LYS 47 HZ1 LYS 47 -4.210 -10.273 -9.431 206 HZ2 LYS 47 HZ2 LYS 47 -2.656 -10.905 -9.219 207 HZ3 LYS 47 HZ3 LYS 47 -2.855 -9.375 -9.902 208 H VAL 48 H VAL 48 -4.540 -13.513 -3.275 209 HA VAL 48 HA VAL 48 -6.576 -15.631 -3.077 210 HB VAL 48 HB VAL 48 -4.576 -14.703 -0.976 211 HG11 VAL 48 HG11 VAL 48 -6.511 -17.052 -0.903 212 HG12 VAL 48 HG12 VAL 48 -6.608 -15.595 0.086 213 HG13 VAL 48 HG13 VAL 48 -5.263 -16.715 0.300 214 HG21 VAL 48 HG21 VAL 48 -3.441 -16.864 -1.401 215 HG22 VAL 48 HG22 VAL 48 -3.467 -15.847 -2.841 216 HG23 VAL 48 HG23 VAL 48 -4.583 -17.206 -2.702 217 H TYR 49 H TYR 49 -8.546 -15.111 -2.450 218 HA TYR 49 HA TYR 49 -9.081 -12.563 -1.023 219 HB2 TYR 49 HB2 TYR 49 -10.884 -14.113 -2.933 220 HB3 TYR 49 HB3 TYR 49 -11.346 -12.653 -2.066 221 HD1 TYR 49 HD1 TYR 49 -10.431 -10.450 -2.733 222 HD2 TYR 49 HD2 TYR 49 -9.424 -13.988 -4.907 223 HE1 TYR 49 HE1 TYR 49 -9.560 -9.078 -4.582 224 HE2 TYR 49 HE2 TYR 49 -8.561 -12.595 -6.738 225 HH TYR 49 HH TYR 49 -8.772 -10.379 -7.632 226 H ASP 50 H ASP 50 -10.793 -12.581 0.536 227 HA ASP 50 HA ASP 50 -11.096 -15.129 1.963 228 HB2 ASP 50 HB2 ASP 50 -10.314 -12.924 3.073 229 HB3 ASP 50 HB3 ASP 50 -11.977 -12.374 2.939 230 H ILE 51 H ILE 51 -12.759 -16.298 1.283 231 HA ILE 51 HA ILE 51 -15.089 -15.223 -0.026 232 HB ILE 51 HB ILE 51 -14.155 -18.013 0.677 233 HG12 ILE 51 HG12 ILE 51 -13.186 -16.934 -1.315 234 HG13 ILE 51 HG13 ILE 51 -14.155 -18.330 -1.774 235 HG21 ILE 51 HG21 ILE 51 -16.549 -18.194 1.073 236 HG22 ILE 51 HG22 ILE 51 -16.140 -19.027 -0.425 237 HG23 ILE 51 HG23 ILE 51 -16.902 -17.436 -0.480 238 HD11 ILE 51 HD11 ILE 51 -15.031 -15.446 -1.968 239 HD12 ILE 51 HD12 ILE 51 -15.974 -16.856 -2.466 240 HD13 ILE 51 HD13 ILE 51 -14.470 -16.461 -3.294 241 H LYS 52 H LYS 52 -14.458 -16.569 3.222 242 HA LYS 52 HA LYS 52 -17.218 -16.886 3.875 243 HB2 LYS 52 HB2 LYS 52 -16.559 -17.305 6.155 244 HB3 LYS 52 HB3 LYS 52 -15.458 -18.143 5.073 245 HG2 LYS 52 HG2 LYS 52 -13.683 -16.617 5.519 246 HG3 LYS 52 HG3 LYS 52 -14.761 -15.474 6.327 247 HD2 LYS 52 HD2 LYS 52 -14.114 -18.271 7.337 248 HD3 LYS 52 HD3 LYS 52 -13.349 -16.790 7.921 249 HE2 LYS 52 HE2 LYS 52 -15.444 -15.998 8.837 250 HE3 LYS 52 HE3 LYS 52 -16.345 -17.307 8.069 251 HZ1 LYS 52 HZ1 LYS 52 -15.964 -17.729 10.411 252 HZ2 LYS 52 HZ2 LYS 52 -14.292 -17.650 10.183 253 HZ3 LYS 52 HZ3 LYS 52 -15.190 -18.884 9.455 254 H ASP 53 H ASP 53 -14.962 -14.198 4.197 255 HA ASP 53 HA ASP 53 -16.692 -12.536 5.773 256 HB2 ASP 53 HB2 ASP 53 -14.092 -12.311 5.432 257 HB3 ASP 53 HB3 ASP 53 -14.503 -11.447 3.961 258 H PHE 54 H PHE 54 -16.044 -13.013 2.347 259 HA PHE 54 HA PHE 54 -17.377 -10.904 1.130 260 HB2 PHE 54 HB2 PHE 54 -15.928 -12.502 -0.080 261 HB3 PHE 54 HB3 PHE 54 -17.092 -13.790 0.179 262 HD1 PHE 54 HD1 PHE 54 -19.259 -13.800 -1.093 263 HD2 PHE 54 HD2 PHE 54 -16.218 -10.898 -1.883 264 HE1 PHE 54 HE1 PHE 54 -20.340 -13.239 -3.229 265 HE2 PHE 54 HE2 PHE 54 -17.310 -10.353 -4.018 266 HZ PHE 54 HZ PHE 54 -19.367 -11.514 -4.692 267 H GLN 55 H GLN 55 -18.694 -14.116 1.927 268 HA GLN 55 HA GLN 55 -21.333 -13.515 1.032 269 HB2 GLN 55 HB2 GLN 55 -21.927 -15.734 2.013 270 HB3 GLN 55 HB3 GLN 55 -20.573 -15.765 0.891 271 HG2 GLN 55 HG2 GLN 55 -19.022 -15.772 2.865 272 HG3 GLN 55 HG3 GLN 55 -20.429 -15.930 3.912 273 HE21 GLN 55 HE21 GLN 55 -21.849 -17.762 2.086 274 HE22 GLN 55 HE22 GLN 55 -21.022 -19.267 2.184 275 H THR 56 H THR 56 -19.765 -13.208 4.174 276 HA THR 56 HA THR 56 -22.161 -12.715 5.688 277 HB THR 56 HB THR 56 -19.351 -11.739 6.361 278 HG1 THR 56 HG1 THR 56 -18.866 -13.760 6.565 279 HG21 THR 56 HG21 THR 56 -21.691 -12.419 8.191 280 HG22 THR 56 HG22 THR 56 -21.135 -10.789 7.807 281 HG23 THR 56 HG23 THR 56 -20.088 -11.889 8.705 282 H GLN 57 H GLN 57 -19.927 -10.680 3.811 283 HA GLN 57 HA GLN 57 -21.120 -8.155 4.423 284 HB2 GLN 57 HB2 GLN 57 -19.490 -9.076 2.025 285 HB3 GLN 57 HB3 GLN 57 -19.972 -7.409 2.297 286 HG2 GLN 57 HG2 GLN 57 -18.195 -9.003 4.164 287 HG3 GLN 57 HG3 GLN 57 -17.607 -7.930 2.900 288 HE21 GLN 57 HE21 GLN 57 -17.080 -7.764 5.718 289 HE22 GLN 57 HE22 GLN 57 -17.673 -6.228 6.247 290 H SER 58 H SER 58 -21.723 -10.708 2.031 291 HA SER 58 HA SER 58 -23.592 -9.343 0.383 292 HB2 SER 58 HB2 SER 58 -23.408 -12.349 0.881 293 HB3 SER 58 HB3 SER 58 -24.183 -11.552 -0.489 294 HG SER 58 HG SER 58 -21.509 -10.934 -0.020 295 H LEU 59 H LEU 59 -23.861 -11.006 3.444 296 HA LEU 59 HA LEU 59 -26.658 -11.266 3.725 297 HB2 LEU 59 HB2 LEU 59 -24.872 -12.294 5.194 298 HB3 LEU 59 HB3 LEU 59 -24.595 -10.719 5.903 299 HG LEU 59 HG LEU 59 -27.277 -12.149 6.132 300 HD11 LEU 59 HD11 LEU 59 -25.555 -13.623 7.062 301 HD12 LEU 59 HD12 LEU 59 -26.585 -12.976 8.335 302 HD13 LEU 59 HD13 LEU 59 -24.964 -12.315 8.091 303 HD21 LEU 59 HD21 LEU 59 -27.376 -9.751 6.683 304 HD22 LEU 59 HD22 LEU 59 -26.062 -9.945 7.844 305 HD23 LEU 59 HD23 LEU 59 -27.617 -10.731 8.129 306 H THR 60 H THR 60 -24.429 -8.624 4.517 307 HA THR 60 HA THR 60 -26.345 -6.788 5.525 308 HB THR 60 HB THR 60 -23.585 -6.298 4.328 309 HG1 THR 60 HG1 THR 60 -23.058 -7.277 6.138 310 HG21 THR 60 HG21 THR 60 -25.271 -4.430 6.056 311 HG22 THR 60 HG22 THR 60 -24.887 -4.186 4.351 312 HG23 THR 60 HG23 THR 60 -23.600 -4.144 5.554 313 H GLU 61 H GLU 61 -27.863 -5.739 4.457 314 HA GLU 61 HA GLU 61 -28.333 -5.926 1.673 315 HB2 GLU 61 HB2 GLU 61 -30.064 -5.657 3.502 316 HB3 GLU 61 HB3 GLU 61 -29.578 -3.976 3.659 317 HG2 GLU 61 HG2 GLU 61 -31.591 -4.084 2.361 318 HG3 GLU 61 HG3 GLU 61 -30.269 -3.583 1.304 319 H ASN 62 H ASN 62 -26.797 -3.510 3.675 320 HA ASN 62 HA ASN 62 -26.813 -1.296 1.891 321 HB2 ASN 62 HB2 ASN 62 -24.966 -1.881 4.248 322 HB3 ASN 62 HB3 ASN 62 -25.135 -0.321 3.452 323 HD21 ASN 62 HD21 ASN 62 -25.743 0.674 5.395 324 HD22 ASN 62 HD22 ASN 62 -27.296 0.427 6.107 325 H SER 63 H SER 63 -24.900 -4.164 1.979 326 HA SER 63 HA SER 63 -22.500 -3.096 0.793 327 HB2 SER 63 HB2 SER 63 -22.439 -5.144 2.201 328 HB3 SER 63 HB3 SER 63 -23.442 -5.994 1.023 329 HG SER 63 HG SER 63 -20.783 -5.055 0.728 330 H ILE 64 H ILE 64 -21.775 -3.392 -1.323 331 HA ILE 64 HA ILE 64 -23.520 -3.360 -3.537 332 HB ILE 64 HB ILE 64 -21.463 -3.847 -4.917 333 HG12 ILE 64 HG12 ILE 64 -20.053 -4.009 -2.203 334 HG13 ILE 64 HG13 ILE 64 -20.346 -5.374 -3.273 335 HG21 ILE 64 HG21 ILE 64 -20.249 -1.764 -4.362 336 HG22 ILE 64 HG22 ILE 64 -21.103 -1.671 -2.820 337 HG23 ILE 64 HG23 ILE 64 -22.000 -1.525 -4.335 338 HD11 ILE 64 HD11 ILE 64 -18.553 -3.023 -3.787 339 HD12 ILE 64 HD12 ILE 64 -18.928 -4.284 -4.963 340 HD13 ILE 64 HD13 ILE 64 -18.094 -4.696 -3.473 341 H LEU 65 H LEU 65 -22.160 -5.967 -1.680 342 HA LEU 65 HA LEU 65 -22.442 -8.069 -3.631 343 HB2 LEU 65 HB2 LEU 65 -22.040 -8.311 -0.631 344 HB3 LEU 65 HB3 LEU 65 -21.739 -9.556 -1.837 345 HG LEU 65 HG LEU 65 -20.150 -6.999 -1.408 346 HD11 LEU 65 HD11 LEU 65 -18.319 -8.494 -0.811 347 HD12 LEU 65 HD12 LEU 65 -19.353 -9.904 -1.070 348 HD13 LEU 65 HD13 LEU 65 -19.718 -8.767 0.226 349 HD21 LEU 65 HD21 LEU 65 -19.726 -9.100 -3.562 350 HD22 LEU 65 HD22 LEU 65 -18.639 -7.759 -3.192 351 HD23 LEU 65 HD23 LEU 65 -20.253 -7.433 -3.812 352 H ALA 66 H ALA 66 -24.745 -6.416 -1.888 353 HA ALA 66 HA ALA 66 -26.608 -8.388 -1.127 354 HB1 ALA 66 HB1 ALA 66 -28.288 -6.592 -1.270 355 HB2 ALA 66 HB2 ALA 66 -27.148 -5.587 -2.172 356 HB3 ALA 66 HB3 ALA 66 -26.812 -6.015 -0.495 357 H GLN 67 H GLN 67 -25.806 -7.025 -4.277 358 HA GLN 67 HA GLN 67 -27.952 -8.229 -5.777 359 HB2 GLN 67 HB2 GLN 67 -26.752 -7.497 -7.757 360 HB3 GLN 67 HB3 GLN 67 -26.635 -6.219 -6.552 361 HG2 GLN 67 HG2 GLN 67 -24.345 -7.038 -5.972 362 HG3 GLN 67 HG3 GLN 67 -24.475 -8.226 -7.263 363 HE21 GLN 67 HE21 GLN 67 -23.991 -4.859 -6.495 364 HE22 GLN 67 HE22 GLN 67 -23.544 -4.361 -8.087 365 H PHE 68 H PHE 68 -24.832 -9.278 -4.643 366 HA PHE 68 HA PHE 68 -24.712 -11.677 -6.323 367 HB2 PHE 68 HB2 PHE 68 -22.770 -10.549 -4.257 368 HB3 PHE 68 HB3 PHE 68 -22.484 -12.004 -5.200 369 HD1 PHE 68 HD1 PHE 68 -23.030 -11.489 -7.908 370 HD2 PHE 68 HD2 PHE 68 -21.500 -8.732 -5.021 371 HE1 PHE 68 HE1 PHE 68 -22.015 -10.151 -9.707 372 HE2 PHE 68 HE2 PHE 68 -20.488 -7.401 -6.828 373 HZ PHE 68 HZ PHE 68 -20.745 -8.112 -9.173 374 H ALA 69 H ALA 69 -26.062 -10.791 -3.355 375 HA ALA 69 HA ALA 69 -25.774 -13.151 -1.811 376 HB1 ALA 69 HB1 ALA 69 -26.606 -11.033 -0.862 377 HB2 ALA 69 HB2 ALA 69 -27.768 -12.330 -0.589 378 HB3 ALA 69 HB3 ALA 69 -28.062 -11.142 -1.859 379 H GLY 70 H GLY 70 -26.221 -15.101 -2.690 380 HA2 GLY 70 HA2 GLY 70 -28.175 -16.636 -3.133 381 HA3 GLY 70 HA3 GLY 70 -28.635 -15.491 -4.393 382 H GLU 71 H GLU 71 -25.912 -14.920 -5.157 383 HA GLU 71 HA GLU 71 -25.363 -17.110 -6.967 384 HB2 GLU 71 HB2 GLU 71 -25.068 -14.717 -7.626 385 HB3 GLU 71 HB3 GLU 71 -23.807 -14.532 -6.417 386 HG2 GLU 71 HG2 GLU 71 -22.808 -14.748 -8.608 387 HG3 GLU 71 HG3 GLU 71 -22.397 -16.159 -7.638 388 H ASP 72 H ASP 72 -23.464 -18.427 -6.957 389 HA ASP 72 HA ASP 72 -22.304 -19.314 -4.569 390 HB2 ASP 72 HB2 ASP 72 -22.158 -20.614 -6.652 391 HB3 ASP 72 HB3 ASP 72 -21.193 -19.360 -7.411 392 HA PRO 73 HA PRO 73 -20.043 -15.673 -3.402 393 HB2 PRO 73 HB2 PRO 73 -18.099 -16.788 -1.739 394 HB3 PRO 73 HB3 PRO 73 -19.776 -16.490 -1.262 395 HG2 PRO 73 HG2 PRO 73 -18.510 -19.039 -2.273 396 HG3 PRO 73 HG3 PRO 73 -19.615 -18.810 -0.899 397 HD2 PRO 73 HD2 PRO 73 -20.527 -19.744 -3.232 398 HD3 PRO 73 HD3 PRO 73 -21.501 -18.581 -2.298 399 H VAL 74 H VAL 74 -18.125 -18.372 -4.730 400 HA VAL 74 HA VAL 74 -15.754 -16.807 -5.268 401 HB VAL 74 HB VAL 74 -16.532 -19.520 -6.442 402 HG11 VAL 74 HG11 VAL 74 -14.095 -19.820 -6.815 403 HG12 VAL 74 HG12 VAL 74 -13.805 -18.184 -6.217 404 HG13 VAL 74 HG13 VAL 74 -14.722 -18.428 -7.704 405 HG21 VAL 74 HG21 VAL 74 -14.910 -18.920 -3.932 406 HG22 VAL 74 HG22 VAL 74 -15.166 -20.522 -4.627 407 HG23 VAL 74 HG23 VAL 74 -16.532 -19.616 -3.977 408 H VAL 75 H VAL 75 -18.368 -18.184 -7.261 409 HA VAL 75 HA VAL 75 -17.687 -17.108 -9.772 410 HB VAL 75 HB VAL 75 -20.430 -17.876 -8.657 411 HG11 VAL 75 HG11 VAL 75 -19.694 -17.364 -11.571 412 HG12 VAL 75 HG12 VAL 75 -20.783 -16.389 -10.582 413 HG13 VAL 75 HG13 VAL 75 -21.226 -18.042 -11.008 414 HG21 VAL 75 HG21 VAL 75 -20.097 -19.992 -9.914 415 HG22 VAL 75 HG22 VAL 75 -18.832 -19.745 -8.709 416 HG23 VAL 75 HG23 VAL 75 -18.494 -19.439 -10.414 417 H ALA 76 H ALA 76 -19.445 -15.761 -7.090 418 HA ALA 76 HA ALA 76 -20.475 -13.404 -8.334 419 HB1 ALA 76 HB1 ALA 76 -21.062 -12.749 -6.031 420 HB2 ALA 76 HB2 ALA 76 -20.108 -14.092 -5.401 421 HB3 ALA 76 HB3 ALA 76 -21.546 -14.408 -6.372 422 H LEU 77 H LEU 77 -17.578 -14.232 -6.507 423 HA LEU 77 HA LEU 77 -16.609 -11.575 -6.125 424 HB2 LEU 77 HB2 LEU 77 -16.070 -13.761 -4.824 425 HB3 LEU 77 HB3 LEU 77 -14.894 -14.078 -6.084 426 HG LEU 77 HG LEU 77 -14.831 -11.509 -4.461 427 HD11 LEU 77 HD11 LEU 77 -14.794 -13.339 -2.849 428 HD12 LEU 77 HD12 LEU 77 -13.239 -12.516 -2.913 429 HD13 LEU 77 HD13 LEU 77 -13.439 -14.087 -3.699 430 HD21 LEU 77 HD21 LEU 77 -12.612 -12.966 -5.937 431 HD22 LEU 77 HD22 LEU 77 -12.448 -11.456 -5.033 432 HD23 LEU 77 HD23 LEU 77 -13.439 -11.506 -6.485 433 H GLU 78 H GLU 78 -16.122 -14.076 -8.576 434 HA GLU 78 HA GLU 78 -14.136 -12.776 -10.147 435 HB2 GLU 78 HB2 GLU 78 -16.276 -14.789 -10.958 436 HB3 GLU 78 HB3 GLU 78 -14.893 -14.335 -11.958 437 HG2 GLU 78 HG2 GLU 78 -13.357 -15.299 -10.323 438 HG3 GLU 78 HG3 GLU 78 -14.693 -15.658 -9.232 439 H ALA 79 H ALA 79 -17.685 -12.770 -10.219 440 HA ALA 79 HA ALA 79 -18.062 -11.035 -12.445 441 HB1 ALA 79 HB1 ALA 79 -19.842 -12.514 -11.592 442 HB2 ALA 79 HB2 ALA 79 -20.381 -10.833 -11.615 443 HB3 ALA 79 HB3 ALA 79 -19.903 -11.588 -10.091 444 H ALA 80 H ALA 80 -17.531 -10.512 -9.007 445 HA ALA 80 HA ALA 80 -18.112 -7.717 -8.934 446 HB1 ALA 80 HB1 ALA 80 -17.054 -7.761 -6.718 447 HB2 ALA 80 HB2 ALA 80 -16.431 -9.383 -7.038 448 HB3 ALA 80 HB3 ALA 80 -18.171 -9.114 -6.918 449 H LEU 81 H LEU 81 -15.102 -9.593 -9.324 450 HA LEU 81 HA LEU 81 -13.308 -7.418 -9.593 451 HB2 LEU 81 HB2 LEU 81 -13.210 -10.296 -10.531 452 HB3 LEU 81 HB3 LEU 81 -11.908 -9.178 -10.910 453 HG LEU 81 HG LEU 81 -12.781 -9.889 -8.080 454 HD11 LEU 81 HD11 LEU 81 -11.814 -11.848 -9.162 455 HD12 LEU 81 HD12 LEU 81 -10.713 -11.217 -7.939 456 HD13 LEU 81 HD13 LEU 81 -10.400 -10.912 -9.650 457 HD21 LEU 81 HD21 LEU 81 -10.673 -8.781 -7.404 458 HD22 LEU 81 HD22 LEU 81 -11.772 -7.663 -8.207 459 HD23 LEU 81 HD23 LEU 81 -10.384 -8.314 -9.082 460 H GLN 82 H GLN 82 -15.378 -9.116 -11.863 461 HA GLN 82 HA GLN 82 -14.364 -8.049 -14.286 462 HB2 GLN 82 HB2 GLN 82 -15.734 -10.093 -14.202 463 HB3 GLN 82 HB3 GLN 82 -17.112 -9.175 -13.609 464 HG2 GLN 82 HG2 GLN 82 -17.221 -7.962 -15.760 465 HG3 GLN 82 HG3 GLN 82 -15.843 -8.893 -16.349 466 HE21 GLN 82 HE21 GLN 82 -17.089 -9.679 -18.085 467 HE22 GLN 82 HE22 GLN 82 -18.291 -10.904 -17.867 468 H PHE 83 H PHE 83 -16.796 -6.887 -11.982 469 HA PHE 83 HA PHE 83 -17.563 -4.659 -13.755 470 HB2 PHE 83 HB2 PHE 83 -19.287 -6.134 -12.551 471 HB3 PHE 83 HB3 PHE 83 -18.786 -5.360 -11.058 472 HD1 PHE 83 HD1 PHE 83 -19.337 -2.963 -10.644 473 HD2 PHE 83 HD2 PHE 83 -20.605 -4.936 -14.223 474 HE1 PHE 83 HE1 PHE 83 -20.924 -1.139 -11.104 475 HE2 PHE 83 HE2 PHE 83 -22.182 -3.103 -14.669 476 HZ PHE 83 HZ PHE 83 -22.346 -1.206 -13.110 477 H GLU 84 H GLU 84 -17.062 -2.568 -13.294 478 HA GLU 84 HA GLU 84 -14.597 -2.152 -11.982 479 HB2 GLU 84 HB2 GLU 84 -14.805 0.162 -12.795 480 HB3 GLU 84 HB3 GLU 84 -15.196 -1.013 -14.046 481 HG2 GLU 84 HG2 GLU 84 -17.649 -0.614 -13.491 482 HG3 GLU 84 HG3 GLU 84 -17.127 0.736 -12.486 483 H ASP 85 H ASP 85 -17.903 -1.310 -11.074 484 HA ASP 85 HA ASP 85 -17.171 0.449 -8.921 485 HB2 ASP 85 HB2 ASP 85 -19.329 0.676 -10.116 486 HB3 ASP 85 HB3 ASP 85 -19.830 -0.902 -9.533 487 H THR 86 H THR 86 -17.774 -2.992 -9.226 488 HA THR 86 HA THR 86 -18.131 -3.349 -6.339 489 HB THR 86 HB THR 86 -18.681 -5.740 -6.999 490 HG1 THR 86 HG1 THR 86 -17.513 -5.294 -9.160 491 HG21 THR 86 HG21 THR 86 -20.896 -5.209 -7.964 492 HG22 THR 86 HG22 THR 86 -20.349 -3.571 -8.336 493 HG23 THR 86 HG23 THR 86 -20.497 -4.095 -6.655 494 H ARG 87 H ARG 87 -15.492 -3.428 -8.497 495 HA ARG 87 HA ARG 87 -14.100 -5.721 -7.375 496 HB2 ARG 87 HB2 ARG 87 -12.225 -5.107 -8.849 497 HB3 ARG 87 HB3 ARG 87 -13.754 -5.145 -9.726 498 HG2 ARG 87 HG2 ARG 87 -13.869 -2.676 -9.615 499 HG3 ARG 87 HG3 ARG 87 -12.323 -2.647 -8.763 500 HD2 ARG 87 HD2 ARG 87 -11.197 -3.612 -10.719 501 HD3 ARG 87 HD3 ARG 87 -12.745 -3.760 -11.562 502 HE ARG 87 HE ARG 87 -12.360 -1.069 -10.811 503 HH11 ARG 87 HH11 ARG 87 -11.014 -3.379 -13.103 504 HH12 ARG 87 HH12 ARG 87 -10.577 -2.153 -14.249 505 HH21 ARG 87 HH21 ARG 87 -11.774 0.519 -12.339 506 HH22 ARG 87 HH22 ARG 87 -11.009 0.041 -13.822 507 H GLU 88 H GLU 88 -14.426 -2.501 -6.368 508 HA GLU 88 HA GLU 88 -11.823 -2.169 -5.153 509 HB2 GLU 88 HB2 GLU 88 -13.003 -0.115 -4.079 510 HB3 GLU 88 HB3 GLU 88 -12.774 -0.139 -5.818 511 HG2 GLU 88 HG2 GLU 88 -14.943 0.712 -5.481 512 HG3 GLU 88 HG3 GLU 88 -15.163 -0.926 -6.050 513 H SER 89 H SER 89 -14.948 -3.406 -4.048 514 HA SER 89 HA SER 89 -14.208 -3.633 -1.281 515 HB2 SER 89 HB2 SER 89 -16.574 -3.694 -2.016 516 HB3 SER 89 HB3 SER 89 -16.282 -5.216 -2.856 517 HG SER 89 HG SER 89 -15.543 -5.240 -0.194 518 H MET 90 H MET 90 -13.670 -5.580 -4.151 519 HA MET 90 HA MET 90 -12.865 -8.006 -2.917 520 HB2 MET 90 HB2 MET 90 -11.930 -6.911 -5.595 521 HB3 MET 90 HB3 MET 90 -11.842 -8.586 -5.063 522 HG2 MET 90 HG2 MET 90 -14.325 -7.003 -5.754 523 HG3 MET 90 HG3 MET 90 -13.635 -8.364 -6.633 524 HE1 MET 90 HE1 MET 90 -16.553 -7.448 -4.628 525 HE2 MET 90 HE2 MET 90 -15.435 -7.286 -3.271 526 HE3 MET 90 HE3 MET 90 -16.646 -8.567 -3.268 527 H HIS 91 H HIS 91 -11.255 -4.964 -3.484 528 HA HIS 91 HA HIS 91 -8.557 -5.623 -3.071 529 HB2 HIS 91 HB2 HIS 91 -9.475 -3.401 -3.843 530 HB3 HIS 91 HB3 HIS 91 -9.977 -3.069 -2.192 531 HD1 HIS 91 HD1 HIS 91 -8.034 -2.615 -0.444 532 HD2 HIS 91 HD2 HIS 91 -6.815 -2.912 -4.407 533 HE1 HIS 91 HE1 HIS 91 -5.703 -1.690 -0.498 534 HE2 HIS 91 HE2 HIS 91 -5.058 -1.721 -2.931 535 H ALA 92 H ALA 92 -11.198 -5.036 -0.798 536 HA ALA 92 HA ALA 92 -9.613 -5.134 1.600 537 HB1 ALA 92 HB1 ALA 92 -11.761 -5.101 2.783 538 HB2 ALA 92 HB2 ALA 92 -12.617 -5.399 1.266 539 HB3 ALA 92 HB3 ALA 92 -11.738 -3.888 1.502 540 H PHE 93 H PHE 93 -11.469 -7.522 -0.284 541 HA PHE 93 HA PHE 93 -11.190 -9.635 1.678 542 HB2 PHE 93 HB2 PHE 93 -11.976 -9.809 -1.265 543 HB3 PHE 93 HB3 PHE 93 -12.106 -11.126 -0.097 544 HD1 PHE 93 HD1 PHE 93 -13.383 -10.310 2.190 545 HD2 PHE 93 HD2 PHE 93 -13.990 -8.723 -1.729 546 HE1 PHE 93 HE1 PHE 93 -15.602 -9.493 2.850 547 HE2 PHE 93 HE2 PHE 93 -16.205 -7.905 -1.049 548 HZ PHE 93 HZ PHE 93 -17.009 -8.288 1.234 549 H CYS 94 H CYS 94 -9.260 -8.376 -0.918 550 HA CYS 94 HA CYS 94 -7.651 -10.689 -1.412 551 HB2 CYS 94 HB2 CYS 94 -7.884 -8.791 -3.049 552 HB3 CYS 94 HB3 CYS 94 -6.950 -7.772 -1.958 553 HG CYS 94 HG CYS 94 -5.528 -10.694 -2.891 554 H VAL 95 H VAL 95 -6.912 -11.490 0.499 555 HA VAL 95 HA VAL 95 -5.556 -9.986 2.512 556 HB VAL 95 HB VAL 95 -4.945 -12.170 3.502 557 HG11 VAL 95 HG11 VAL 95 -7.833 -12.134 2.520 558 HG12 VAL 95 HG12 VAL 95 -7.212 -11.314 3.954 559 HG13 VAL 95 HG13 VAL 95 -7.225 -13.077 3.887 560 HG21 VAL 95 HG21 VAL 95 -4.401 -13.432 1.454 561 HG22 VAL 95 HG22 VAL 95 -6.100 -13.433 0.978 562 HG23 VAL 95 HG23 VAL 95 -5.589 -14.314 2.420 563 H GLY 96 H GLY 96 -4.610 -11.434 -0.491 564 HA2 GLY 96 HA2 GLY 96 -2.302 -9.954 -0.821 565 HA3 GLY 96 HA3 GLY 96 -1.780 -11.478 -0.112 566 H GLN 97 H GLN 97 -0.586 -11.696 -2.103 567 HA GLN 97 HA GLN 97 -2.067 -12.551 -4.502 568 HB2 GLN 97 HB2 GLN 97 -0.131 -11.025 -4.820 569 HB3 GLN 97 HB3 GLN 97 0.922 -12.172 -4.005 570 HG2 GLN 97 HG2 GLN 97 0.491 -13.807 -5.840 571 HG3 GLN 97 HG3 GLN 97 -0.474 -12.582 -6.663 572 HE21 GLN 97 HE21 GLN 97 2.746 -13.601 -5.811 573 HE22 GLN 97 HE22 GLN 97 3.583 -12.484 -6.825 574 H TYR 98 H TYR 98 -1.957 -14.708 -5.231 575 HA TYR 98 HA TYR 98 -1.136 -16.736 -3.352 576 HB2 TYR 98 HB2 TYR 98 -3.168 -17.071 -4.741 577 HB3 TYR 98 HB3 TYR 98 -2.170 -17.077 -6.193 578 HD1 TYR 98 HD1 TYR 98 -2.314 -18.808 -2.845 579 HD2 TYR 98 HD2 TYR 98 -1.558 -19.207 -7.036 580 HE1 TYR 98 HE1 TYR 98 -1.911 -21.210 -2.553 581 HE2 TYR 98 HE2 TYR 98 -1.164 -21.613 -6.729 582 HH TYR 98 HH TYR 98 -1.981 -23.260 -3.874 583 H LEU 99 H LEU 99 0.964 -17.040 -3.132 584 HA LEU 99 HA LEU 99 2.797 -17.081 -5.414 585 HB2 LEU 99 HB2 LEU 99 3.332 -15.922 -3.219 586 HB3 LEU 99 HB3 LEU 99 3.384 -17.494 -2.452 587 HG LEU 99 HG LEU 99 5.625 -16.389 -3.062 588 HD11 LEU 99 HD11 LEU 99 6.748 -18.456 -3.639 589 HD12 LEU 99 HD12 LEU 99 5.210 -19.194 -4.086 590 HD13 LEU 99 HD13 LEU 99 5.513 -18.729 -2.413 591 HD21 LEU 99 HD21 LEU 99 4.897 -17.245 -5.870 592 HD22 LEU 99 HD22 LEU 99 6.460 -16.619 -5.337 593 HD23 LEU 99 HD23 LEU 99 5.036 -15.583 -5.290 594 H GLU 100 H GLU 100 2.860 -18.932 -6.517 595 HA GLU 100 HA GLU 100 2.232 -21.524 -5.377 596 HB2 GLU 100 HB2 GLU 100 1.724 -20.843 -7.791 597 HB3 GLU 100 HB3 GLU 100 3.454 -20.895 -8.108 598 HG2 GLU 100 HG2 GLU 100 3.417 -23.324 -7.406 599 HG3 GLU 100 HG3 GLU 100 1.660 -23.215 -7.334 600 HA PRO 101 HA PRO 101 6.256 -22.632 -3.604 601 HB2 PRO 101 HB2 PRO 101 6.412 -25.180 -5.027 602 HB3 PRO 101 HB3 PRO 101 6.030 -24.882 -3.330 603 HG2 PRO 101 HG2 PRO 101 4.191 -25.288 -5.639 604 HG3 PRO 101 HG3 PRO 101 3.912 -25.589 -3.911 605 HD2 PRO 101 HD2 PRO 101 2.727 -23.533 -5.147 606 HD3 PRO 101 HD3 PRO 101 3.327 -23.359 -3.484 607 H ASP 102 H ASP 102 6.021 -23.540 -7.077 608 HA ASP 102 HA ASP 102 8.880 -22.875 -7.455 609 HB2 ASP 102 HB2 ASP 102 8.025 -25.205 -8.014 610 HB3 ASP 102 HB3 ASP 102 7.062 -24.494 -9.308 611 H GLN 103 H GLN 103 6.510 -20.933 -7.451 612 HA GLN 103 HA GLN 103 6.519 -19.786 -10.126 613 HB2 GLN 103 HB2 GLN 103 4.510 -19.593 -8.672 614 HB3 GLN 103 HB3 GLN 103 5.433 -18.655 -7.505 615 HG2 GLN 103 HG2 GLN 103 3.985 -17.226 -8.875 616 HG3 GLN 103 HG3 GLN 103 5.686 -16.839 -9.121 617 HE21 GLN 103 HE21 GLN 103 3.948 -19.579 -10.622 618 HE22 GLN 103 HE22 GLN 103 4.072 -18.979 -12.237 619 H GLU 104 H GLU 104 8.269 -19.438 -7.153 620 HA GLU 104 HA GLU 104 9.551 -16.937 -7.641 621 HB2 GLU 104 HB2 GLU 104 10.469 -19.248 -5.873 622 HB3 GLU 104 HB3 GLU 104 11.032 -17.576 -5.786 623 HG2 GLU 104 HG2 GLU 104 8.803 -16.828 -5.104 624 HG3 GLU 104 HG3 GLU 104 8.175 -18.468 -5.282 625 H GLY 105 H GLY 105 10.522 -16.819 -9.586 626 HA2 GLY 105 HA2 GLY 105 12.686 -17.100 -10.709 627 HA3 GLY 105 HA3 GLY 105 12.579 -18.823 -10.361 628 H VAL 106 H VAL 106 9.990 -16.662 -11.487 629 HA VAL 106 HA VAL 106 9.011 -18.412 -13.461 630 HB VAL 106 HB VAL 106 7.582 -16.705 -12.462 631 HG11 VAL 106 HG11 VAL 106 7.745 -14.303 -12.982 632 HG12 VAL 106 HG12 VAL 106 9.214 -14.592 -13.915 633 HG13 VAL 106 HG13 VAL 106 9.208 -14.874 -12.173 634 HG21 VAL 106 HG21 VAL 106 6.418 -15.861 -14.476 635 HG22 VAL 106 HG22 VAL 106 6.912 -17.542 -14.682 636 HG23 VAL 106 HG23 VAL 106 7.829 -16.251 -15.463 637 H THR 107 H THR 107 9.692 -18.848 -15.502 638 HA THR 107 HA THR 107 12.012 -17.482 -16.540 639 HB THR 107 HB THR 107 11.872 -19.910 -16.821 640 HG1 THR 107 HG1 THR 107 12.989 -18.563 -18.398 641 HG21 THR 107 HG21 THR 107 10.353 -20.976 -18.446 642 HG22 THR 107 HG22 THR 107 9.544 -19.432 -18.719 643 HG23 THR 107 HG23 THR 107 9.435 -20.212 -17.142 644 H ILE 108 H ILE 108 12.029 -15.814 -17.850 645 HA ILE 108 HA ILE 108 9.646 -15.044 -19.436 646 HB ILE 108 HB ILE 108 11.958 -13.297 -18.446 647 HG12 ILE 108 HG12 ILE 108 9.063 -13.365 -17.468 648 HG13 ILE 108 HG13 ILE 108 10.433 -14.052 -16.605 649 HG21 ILE 108 HG21 ILE 108 10.637 -11.364 -19.243 650 HG22 ILE 108 HG22 ILE 108 9.424 -12.459 -19.906 651 HG23 ILE 108 HG23 ILE 108 11.059 -12.447 -20.571 652 HD11 ILE 108 HD11 ILE 108 9.760 -11.932 -15.653 653 HD12 ILE 108 HD12 ILE 108 10.007 -11.119 -17.197 654 HD13 ILE 108 HD13 ILE 108 11.382 -11.809 -16.329 655 HA PRO 109 HA PRO 109 12.806 -16.398 -22.538 656 HB2 PRO 109 HB2 PRO 109 11.085 -17.458 -24.371 657 HB3 PRO 109 HB3 PRO 109 11.573 -18.327 -22.911 658 HG2 PRO 109 HG2 PRO 109 9.019 -16.854 -23.480 659 HG3 PRO 109 HG3 PRO 109 9.268 -18.372 -22.595 660 HD2 PRO 109 HD2 PRO 109 8.906 -15.879 -21.396 661 HD3 PRO 109 HD3 PRO 109 9.673 -17.271 -20.606 662 H ASP 110 H ASP 110 13.272 -14.170 -22.789 663 HA ASP 110 HA ASP 110 11.766 -12.520 -24.631 664 HB2 ASP 110 HB2 ASP 110 12.870 -11.471 -22.729 665 HB3 ASP 110 HB3 ASP 110 14.434 -12.099 -23.233 666 H LEU 111 H LEU 111 11.773 -13.646 -26.581 667 HA LEU 111 HA LEU 111 14.217 -14.283 -27.997 668 HB2 LEU 111 HB2 LEU 111 11.314 -14.151 -28.897 669 HB3 LEU 111 HB3 LEU 111 12.623 -14.464 -30.020 670 HG LEU 111 HG LEU 111 13.214 -16.511 -28.622 671 HD11 LEU 111 HD11 LEU 111 10.508 -16.048 -27.340 672 HD12 LEU 111 HD12 LEU 111 12.072 -15.937 -26.529 673 HD13 LEU 111 HD13 LEU 111 11.516 -17.486 -27.159 674 HD21 LEU 111 HD21 LEU 111 11.482 -17.928 -29.625 675 HD22 LEU 111 HD22 LEU 111 12.033 -16.705 -30.768 676 HD23 LEU 111 HD23 LEU 111 10.482 -16.510 -29.946 677 H GLY 112 H GLY 112 12.372 -11.461 -27.445 678 HA2 GLY 112 HA2 GLY 112 13.146 -9.299 -27.681 679 HA3 GLY 112 HA3 GLY 112 14.349 -9.846 -28.832 Start of MODEL 6 1 H GLU 21 H GLU 21 -0.354 -0.341 0.052 2 HA GLU 21 HA GLU 21 0.851 -1.097 -1.876 3 HB2 GLU 21 HB2 GLU 21 1.626 0.947 -0.772 4 HB3 GLU 21 HB3 GLU 21 2.597 0.012 0.358 5 HG2 GLU 21 HG2 GLU 21 3.957 1.066 -1.417 6 HG3 GLU 21 HG3 GLU 21 4.097 -0.691 -1.411 7 H LYS 22 H LYS 22 2.598 -2.176 1.097 8 HA LYS 22 HA LYS 22 3.951 -4.312 -0.232 9 HB2 LYS 22 HB2 LYS 22 4.925 -4.849 1.822 10 HB3 LYS 22 HB3 LYS 22 4.579 -3.143 2.041 11 HG2 LYS 22 HG2 LYS 22 2.934 -5.449 3.134 12 HG3 LYS 22 HG3 LYS 22 4.083 -4.476 4.052 13 HD2 LYS 22 HD2 LYS 22 2.677 -2.519 3.891 14 HD3 LYS 22 HD3 LYS 22 1.615 -3.302 2.715 15 HE2 LYS 22 HE2 LYS 22 0.958 -4.955 4.443 16 HE3 LYS 22 HE3 LYS 22 1.965 -4.102 5.618 17 HZ1 LYS 22 HZ1 LYS 22 -0.313 -3.432 5.849 18 HZ2 LYS 22 HZ2 LYS 22 -0.415 -3.025 4.217 19 HZ3 LYS 22 HZ3 LYS 22 0.575 -2.127 5.248 20 H VAL 23 H VAL 23 3.550 -6.631 0.134 21 HA VAL 23 HA VAL 23 0.693 -7.268 0.502 22 HB VAL 23 HB VAL 23 1.282 -6.914 -1.947 23 HG11 VAL 23 HG11 VAL 23 2.884 -9.484 -1.660 24 HG12 VAL 23 HG12 VAL 23 3.544 -7.883 -1.988 25 HG13 VAL 23 HG13 VAL 23 2.506 -8.666 -3.180 26 HG21 VAL 23 HG21 VAL 23 0.012 -8.868 -2.750 27 HG22 VAL 23 HG22 VAL 23 -0.704 -8.187 -1.289 28 HG23 VAL 23 HG23 VAL 23 0.251 -9.668 -1.194 29 H THR 24 H THR 24 0.235 -9.367 1.151 30 HA THR 24 HA THR 24 2.383 -10.929 2.379 31 HB THR 24 HB THR 24 -0.652 -11.293 2.412 32 HG1 THR 24 HG1 THR 24 1.148 -10.082 4.269 33 HG21 THR 24 HG21 THR 24 -0.262 -12.762 4.368 34 HG22 THR 24 HG22 THR 24 1.480 -12.607 4.145 35 HG23 THR 24 HG23 THR 24 0.507 -13.419 2.917 36 H LEU 25 H LEU 25 3.392 -12.389 1.089 37 HA LEU 25 HA LEU 25 2.142 -13.480 -1.284 38 HB2 LEU 25 HB2 LEU 25 4.828 -14.051 0.016 39 HB3 LEU 25 HB3 LEU 25 4.288 -14.775 -1.494 40 HG LEU 25 HG LEU 25 4.859 -11.828 -0.987 41 HD11 LEU 25 HD11 LEU 25 6.225 -13.815 -2.822 42 HD12 LEU 25 HD12 LEU 25 6.863 -13.179 -1.303 43 HD13 LEU 25 HD13 LEU 25 6.614 -12.098 -2.672 44 HD21 LEU 25 HD21 LEU 25 3.742 -13.087 -3.521 45 HD22 LEU 25 HD22 LEU 25 4.300 -11.420 -3.358 46 HD23 LEU 25 HD23 LEU 25 2.899 -11.969 -2.446 47 H VAL 26 H VAL 26 0.698 -14.996 -1.114 48 HA VAL 26 HA VAL 26 0.534 -16.802 1.171 49 HB VAL 26 HB VAL 26 -1.382 -16.367 -1.170 50 HG11 VAL 26 HG11 VAL 26 -3.071 -17.546 0.204 51 HG12 VAL 26 HG12 VAL 26 -1.843 -17.884 1.426 52 HG13 VAL 26 HG13 VAL 26 -1.701 -18.589 -0.187 53 HG21 VAL 26 HG21 VAL 26 -1.552 -15.225 1.649 54 HG22 VAL 26 HG22 VAL 26 -2.771 -15.040 0.387 55 HG23 VAL 26 HG23 VAL 26 -1.174 -14.318 0.182 56 H ARG 27 H ARG 27 1.434 -18.739 1.028 57 HA ARG 27 HA ARG 27 2.372 -19.832 -1.484 58 HB2 ARG 27 HB2 ARG 27 3.471 -21.532 -0.125 59 HB3 ARG 27 HB3 ARG 27 3.764 -19.943 0.568 60 HG2 ARG 27 HG2 ARG 27 1.960 -20.419 2.253 61 HG3 ARG 27 HG3 ARG 27 1.836 -22.052 1.593 62 HD2 ARG 27 HD2 ARG 27 4.247 -20.810 2.965 63 HD3 ARG 27 HD3 ARG 27 3.213 -22.097 3.592 64 HE ARG 27 HE ARG 27 4.964 -22.403 1.212 65 HH11 ARG 27 HH11 ARG 27 3.564 -23.782 4.119 66 HH12 ARG 27 HH12 ARG 27 4.452 -25.265 3.974 67 HH21 ARG 27 HH21 ARG 27 6.119 -24.345 1.041 68 HH22 ARG 27 HH22 ARG 27 5.893 -25.585 2.236 69 H ILE 28 H ILE 28 1.955 -22.113 -2.044 70 HA ILE 28 HA ILE 28 -0.766 -22.570 -2.548 71 HB ILE 28 HB ILE 28 0.930 -23.394 -4.059 72 HG12 ILE 28 HG12 ILE 28 -0.557 -25.786 -2.873 73 HG13 ILE 28 HG13 ILE 28 -1.227 -24.644 -4.031 74 HG21 ILE 28 HG21 ILE 28 1.863 -25.271 -1.864 75 HG22 ILE 28 HG22 ILE 28 2.734 -23.866 -2.487 76 HG23 ILE 28 HG23 ILE 28 2.457 -25.261 -3.530 77 HD11 ILE 28 HD11 ILE 28 1.066 -26.544 -4.535 78 HD12 ILE 28 HD12 ILE 28 0.413 -25.387 -5.699 79 HD13 ILE 28 HD13 ILE 28 -0.592 -26.711 -5.113 80 H ALA 29 H ALA 29 1.343 -23.896 -0.039 81 HA ALA 29 HA ALA 29 -0.485 -25.852 0.981 82 HB1 ALA 29 HB1 ALA 29 1.945 -26.061 1.281 83 HB2 ALA 29 HB2 ALA 29 1.112 -26.077 2.836 84 HB3 ALA 29 HB3 ALA 29 1.959 -24.622 2.301 85 H ASP 30 H ASP 30 0.072 -22.436 1.650 86 HA ASP 30 HA ASP 30 -0.990 -22.206 4.248 87 HB2 ASP 30 HB2 ASP 30 0.314 -20.393 3.081 88 HB3 ASP 30 HB3 ASP 30 -1.069 -20.086 2.049 89 H LEU 31 H LEU 31 -2.500 -21.912 1.081 90 HA LEU 31 HA LEU 31 -5.116 -21.218 1.648 91 HB2 LEU 31 HB2 LEU 31 -4.100 -23.180 -0.447 92 HB3 LEU 31 HB3 LEU 31 -5.686 -22.417 -0.477 93 HG LEU 31 HG LEU 31 -3.058 -20.881 -0.657 94 HD11 LEU 31 HD11 LEU 31 -4.927 -21.694 -2.905 95 HD12 LEU 31 HD12 LEU 31 -3.308 -22.335 -2.608 96 HD13 LEU 31 HD13 LEU 31 -3.514 -20.643 -3.056 97 HD21 LEU 31 HD21 LEU 31 -4.472 -18.998 -1.385 98 HD22 LEU 31 HD22 LEU 31 -4.912 -19.535 0.235 99 HD23 LEU 31 HD23 LEU 31 -5.922 -19.976 -1.146 100 H GLU 32 H GLU 32 -3.616 -24.425 1.710 101 HA GLU 32 HA GLU 32 -6.024 -25.911 2.101 102 HB2 GLU 32 HB2 GLU 32 -3.161 -26.828 2.605 103 HB3 GLU 32 HB3 GLU 32 -4.563 -27.857 2.314 104 HG2 GLU 32 HG2 GLU 32 -3.199 -26.007 0.327 105 HG3 GLU 32 HG3 GLU 32 -3.173 -27.767 0.331 106 H ASN 33 H ASN 33 -3.472 -24.698 4.268 107 HA ASN 33 HA ASN 33 -4.385 -25.963 6.663 108 HB2 ASN 33 HB2 ASN 33 -2.597 -23.532 6.259 109 HB3 ASN 33 HB3 ASN 33 -2.965 -24.196 7.846 110 HD21 ASN 33 HD21 ASN 33 -1.087 -24.550 4.975 111 HD22 ASN 33 HD22 ASN 33 -0.186 -25.931 5.479 112 H HIS 34 H HIS 34 -4.992 -22.806 5.183 113 HA HIS 34 HA HIS 34 -6.603 -21.722 7.267 114 HB2 HIS 34 HB2 HIS 34 -6.252 -20.976 4.336 115 HB3 HIS 34 HB3 HIS 34 -7.445 -20.161 5.345 116 HD1 HIS 34 HD1 HIS 34 -6.527 -17.973 6.000 117 HD2 HIS 34 HD2 HIS 34 -3.622 -20.936 6.084 118 HE1 HIS 34 HE1 HIS 34 -4.449 -16.859 6.845 119 HE2 HIS 34 HE2 HIS 34 -2.657 -18.606 6.619 120 H ASN 35 H ASN 35 -7.324 -23.570 4.323 121 HA ASN 35 HA ASN 35 -10.133 -23.554 4.443 122 HB2 ASN 35 HB2 ASN 35 -8.807 -24.372 2.490 123 HB3 ASN 35 HB3 ASN 35 -8.295 -25.768 3.429 124 HD21 ASN 35 HD21 ASN 35 -11.548 -24.297 3.238 125 HD22 ASN 35 HD22 ASN 35 -12.305 -25.680 2.534 126 H ASN 36 H ASN 36 -7.725 -25.651 5.966 127 HA ASN 36 HA ASN 36 -9.512 -27.465 7.246 128 HB2 ASN 36 HB2 ASN 36 -7.148 -28.031 6.776 129 HB3 ASN 36 HB3 ASN 36 -6.613 -26.764 7.879 130 HD21 ASN 36 HD21 ASN 36 -8.284 -29.865 7.676 131 HD22 ASN 36 HD22 ASN 36 -7.995 -30.341 9.310 132 H ASP 37 H ASP 37 -8.150 -24.361 8.153 133 HA ASP 37 HA ASP 37 -8.895 -24.377 10.932 134 HB2 ASP 37 HB2 ASP 37 -7.035 -22.985 10.055 135 HB3 ASP 37 HB3 ASP 37 -8.164 -22.067 9.067 136 H GLY 38 H GLY 38 -10.481 -23.521 7.953 137 HA2 GLY 38 HA2 GLY 38 -12.895 -23.273 7.839 138 HA3 GLY 38 HA3 GLY 38 -12.850 -22.424 9.380 139 H GLY 39 H GLY 39 -10.201 -21.260 8.009 140 HA2 GLY 39 HA2 GLY 39 -11.304 -18.823 6.950 141 HA3 GLY 39 HA3 GLY 39 -9.614 -19.287 6.983 142 H PHE 40 H PHE 40 -12.638 -19.599 5.172 143 HA PHE 40 HA PHE 40 -11.523 -21.305 3.146 144 HB2 PHE 40 HB2 PHE 40 -14.025 -21.129 3.904 145 HB3 PHE 40 HB3 PHE 40 -14.115 -19.732 2.841 146 HD1 PHE 40 HD1 PHE 40 -13.798 -20.038 0.352 147 HD2 PHE 40 HD2 PHE 40 -13.961 -23.373 3.021 148 HE1 PHE 40 HE1 PHE 40 -14.192 -21.548 -1.548 149 HE2 PHE 40 HE2 PHE 40 -14.356 -24.875 1.114 150 HZ PHE 40 HZ PHE 40 -14.471 -23.965 -1.168 151 H TRP 41 H TRP 41 -10.015 -20.515 1.852 152 HA TRP 41 HA TRP 41 -10.168 -17.770 0.752 153 HB2 TRP 41 HB2 TRP 41 -7.818 -19.531 1.528 154 HB3 TRP 41 HB3 TRP 41 -7.603 -18.259 0.332 155 HD1 TRP 41 HD1 TRP 41 -9.958 -17.165 3.037 156 HE1 TRP 41 HE1 TRP 41 -8.747 -15.553 4.626 157 HE3 TRP 41 HE3 TRP 41 -5.146 -17.969 1.512 158 HZ2 TRP 41 HZ2 TRP 41 -6.123 -14.722 5.166 159 HZ3 TRP 41 HZ3 TRP 41 -3.331 -16.739 2.626 160 HH2 TRP 41 HH2 TRP 41 -3.813 -15.135 4.413 161 H THR 42 H THR 42 -9.275 -17.506 -1.410 162 HA THR 42 HA THR 42 -9.330 -19.777 -3.244 163 HB THR 42 HB THR 42 -11.714 -19.159 -3.092 164 HG1 THR 42 HG1 THR 42 -10.306 -19.251 -5.327 165 HG21 THR 42 HG21 THR 42 -10.879 -16.374 -3.982 166 HG22 THR 42 HG22 THR 42 -11.509 -16.802 -2.390 167 HG23 THR 42 HG23 THR 42 -12.540 -16.947 -3.815 168 H VAL 43 H VAL 43 -8.184 -19.337 -5.143 169 HA VAL 43 HA VAL 43 -6.800 -16.714 -5.307 170 HB VAL 43 HB VAL 43 -5.865 -19.440 -6.314 171 HG11 VAL 43 HG11 VAL 43 -4.485 -16.729 -6.516 172 HG12 VAL 43 HG12 VAL 43 -5.135 -17.667 -7.862 173 HG13 VAL 43 HG13 VAL 43 -3.760 -18.280 -6.948 174 HG21 VAL 43 HG21 VAL 43 -5.671 -19.211 -3.867 175 HG22 VAL 43 HG22 VAL 43 -4.795 -17.692 -4.063 176 HG23 VAL 43 HG23 VAL 43 -4.073 -19.202 -4.618 177 H ILE 44 H ILE 44 -7.485 -15.474 -6.883 178 HA ILE 44 HA ILE 44 -8.381 -16.606 -9.467 179 HB ILE 44 HB ILE 44 -9.558 -14.161 -8.052 180 HG12 ILE 44 HG12 ILE 44 -10.895 -16.866 -8.541 181 HG13 ILE 44 HG13 ILE 44 -10.203 -16.376 -7.001 182 HG21 ILE 44 HG21 ILE 44 -9.613 -13.899 -10.495 183 HG22 ILE 44 HG22 ILE 44 -11.244 -14.153 -9.875 184 HG23 ILE 44 HG23 ILE 44 -10.390 -15.477 -10.669 185 HD11 ILE 44 HD11 ILE 44 -12.619 -16.152 -7.041 186 HD12 ILE 44 HD12 ILE 44 -12.513 -15.021 -8.388 187 HD13 ILE 44 HD13 ILE 44 -11.836 -14.590 -6.816 188 H ASP 45 H ASP 45 -6.719 -16.162 -10.767 189 HA ASP 45 HA ASP 45 -5.065 -15.176 -11.917 190 HB2 ASP 45 HB2 ASP 45 -6.933 -13.915 -12.853 191 HB3 ASP 45 HB3 ASP 45 -6.868 -12.759 -11.532 192 H GLY 46 H GLY 46 -4.130 -15.688 -9.573 193 HA2 GLY 46 HA2 GLY 46 -2.278 -15.321 -8.277 194 HA3 GLY 46 HA3 GLY 46 -1.947 -13.888 -9.228 195 H LYS 47 H LYS 47 -5.039 -13.808 -7.836 196 HA LYS 47 HA LYS 47 -4.128 -12.098 -5.584 197 HB2 LYS 47 HB2 LYS 47 -6.541 -11.850 -7.431 198 HB3 LYS 47 HB3 LYS 47 -6.405 -10.956 -5.920 199 HG2 LYS 47 HG2 LYS 47 -4.390 -10.742 -8.177 200 HG3 LYS 47 HG3 LYS 47 -5.792 -9.680 -8.006 201 HD2 LYS 47 HD2 LYS 47 -4.952 -8.975 -5.768 202 HD3 LYS 47 HD3 LYS 47 -3.526 -9.992 -5.997 203 HE2 LYS 47 HE2 LYS 47 -2.815 -8.627 -7.893 204 HE3 LYS 47 HE3 LYS 47 -4.298 -7.672 -7.804 205 HZ1 LYS 47 HZ1 LYS 47 -3.630 -6.830 -5.680 206 HZ2 LYS 47 HZ2 LYS 47 -2.368 -6.586 -6.779 207 HZ3 LYS 47 HZ3 LYS 47 -2.270 -7.835 -5.646 208 H VAL 48 H VAL 48 -4.707 -12.847 -3.618 209 HA VAL 48 HA VAL 48 -6.600 -15.098 -3.440 210 HB VAL 48 HB VAL 48 -4.799 -14.081 -1.205 211 HG11 VAL 48 HG11 VAL 48 -5.111 -16.353 -0.257 212 HG12 VAL 48 HG12 VAL 48 -6.179 -16.768 -1.601 213 HG13 VAL 48 HG13 VAL 48 -6.656 -15.519 -0.450 214 HG21 VAL 48 HG21 VAL 48 -3.214 -15.882 -1.819 215 HG22 VAL 48 HG22 VAL 48 -3.371 -14.671 -3.092 216 HG23 VAL 48 HG23 VAL 48 -4.181 -16.229 -3.252 217 H TYR 49 H TYR 49 -8.555 -14.821 -2.650 218 HA TYR 49 HA TYR 49 -9.214 -12.570 -0.843 219 HB2 TYR 49 HB2 TYR 49 -11.023 -13.719 -3.025 220 HB3 TYR 49 HB3 TYR 49 -11.437 -12.411 -1.922 221 HD1 TYR 49 HD1 TYR 49 -10.417 -10.162 -2.212 222 HD2 TYR 49 HD2 TYR 49 -9.621 -13.303 -4.995 223 HE1 TYR 49 HE1 TYR 49 -9.464 -8.535 -3.776 224 HE2 TYR 49 HE2 TYR 49 -8.669 -11.662 -6.555 225 HH TYR 49 HH TYR 49 -8.781 -9.248 -7.008 226 H ASP 50 H ASP 50 -11.081 -13.054 0.553 227 HA ASP 50 HA ASP 50 -11.361 -15.907 1.243 228 HB2 ASP 50 HB2 ASP 50 -12.614 -15.058 3.245 229 HB3 ASP 50 HB3 ASP 50 -10.985 -14.417 3.143 230 H ILE 51 H ILE 51 -13.437 -16.805 1.551 231 HA ILE 51 HA ILE 51 -15.636 -15.691 -0.089 232 HB ILE 51 HB ILE 51 -14.864 -18.566 0.563 233 HG12 ILE 51 HG12 ILE 51 -13.628 -17.615 -1.323 234 HG13 ILE 51 HG13 ILE 51 -14.757 -18.821 -1.929 235 HG21 ILE 51 HG21 ILE 51 -17.441 -17.697 -0.784 236 HG22 ILE 51 HG22 ILE 51 -17.289 -18.485 0.787 237 HG23 ILE 51 HG23 ILE 51 -16.853 -19.358 -0.682 238 HD11 ILE 51 HD11 ILE 51 -15.089 -15.823 -2.046 239 HD12 ILE 51 HD12 ILE 51 -16.288 -16.998 -2.600 240 HD13 ILE 51 HD13 ILE 51 -14.711 -16.910 -3.382 241 H LYS 52 H LYS 52 -14.609 -16.776 3.058 242 HA LYS 52 HA LYS 52 -17.176 -17.381 4.149 243 HB2 LYS 52 HB2 LYS 52 -16.026 -17.554 6.314 244 HB3 LYS 52 HB3 LYS 52 -15.156 -18.416 5.052 245 HG2 LYS 52 HG2 LYS 52 -13.489 -16.650 4.917 246 HG3 LYS 52 HG3 LYS 52 -14.385 -15.660 6.074 247 HD2 LYS 52 HD2 LYS 52 -13.063 -18.342 6.629 248 HD3 LYS 52 HD3 LYS 52 -12.488 -16.764 7.168 249 HE2 LYS 52 HE2 LYS 52 -14.514 -16.508 8.565 250 HE3 LYS 52 HE3 LYS 52 -15.099 -18.077 8.015 251 HZ1 LYS 52 HZ1 LYS 52 -12.599 -17.619 9.543 252 HZ2 LYS 52 HZ2 LYS 52 -13.199 -19.122 9.044 253 HZ3 LYS 52 HZ3 LYS 52 -14.051 -18.203 10.184 254 H ASP 53 H ASP 53 -15.031 -14.512 4.525 255 HA ASP 53 HA ASP 53 -16.932 -13.057 6.145 256 HB2 ASP 53 HB2 ASP 53 -14.497 -12.627 6.393 257 HB3 ASP 53 HB3 ASP 53 -14.405 -12.107 4.722 258 H PHE 54 H PHE 54 -15.938 -13.168 2.776 259 HA PHE 54 HA PHE 54 -17.260 -11.106 1.548 260 HB2 PHE 54 HB2 PHE 54 -15.719 -12.693 0.437 261 HB3 PHE 54 HB3 PHE 54 -16.915 -13.973 0.571 262 HD1 PHE 54 HD1 PHE 54 -15.966 -10.908 -1.233 263 HD2 PHE 54 HD2 PHE 54 -18.857 -14.047 -0.945 264 HE1 PHE 54 HE1 PHE 54 -16.881 -10.289 -3.426 265 HE2 PHE 54 HE2 PHE 54 -19.762 -13.405 -3.138 266 HZ PHE 54 HZ PHE 54 -18.778 -11.526 -4.375 267 H GLN 55 H GLN 55 -18.630 -14.368 2.102 268 HA GLN 55 HA GLN 55 -21.224 -13.736 1.102 269 HB2 GLN 55 HB2 GLN 55 -21.898 -15.956 1.884 270 HB3 GLN 55 HB3 GLN 55 -20.337 -16.042 1.073 271 HG2 GLN 55 HG2 GLN 55 -19.256 -16.029 3.356 272 HG3 GLN 55 HG3 GLN 55 -20.864 -16.177 4.060 273 HE21 GLN 55 HE21 GLN 55 -19.743 -17.788 1.109 274 HE22 GLN 55 HE22 GLN 55 -19.797 -19.390 1.746 275 H THR 56 H THR 56 -19.760 -13.512 4.282 276 HA THR 56 HA THR 56 -22.111 -12.980 5.800 277 HB THR 56 HB THR 56 -19.274 -12.012 6.363 278 HG1 THR 56 HG1 THR 56 -18.876 -14.060 6.638 279 HG21 THR 56 HG21 THR 56 -20.981 -10.917 7.797 280 HG22 THR 56 HG22 THR 56 -19.946 -11.998 8.729 281 HG23 THR 56 HG23 THR 56 -21.579 -12.504 8.291 282 H GLN 57 H GLN 57 -20.030 -10.930 3.759 283 HA GLN 57 HA GLN 57 -21.196 -8.431 4.604 284 HB2 GLN 57 HB2 GLN 57 -19.568 -9.011 2.096 285 HB3 GLN 57 HB3 GLN 57 -19.919 -7.429 2.771 286 HG2 GLN 57 HG2 GLN 57 -18.059 -9.550 3.832 287 HG3 GLN 57 HG3 GLN 57 -17.677 -7.900 3.353 288 HE21 GLN 57 HE21 GLN 57 -18.835 -9.955 5.874 289 HE22 GLN 57 HE22 GLN 57 -18.883 -8.769 7.125 290 H SER 58 H SER 58 -22.008 -10.882 2.255 291 HA SER 58 HA SER 58 -23.864 -9.399 0.682 292 HB2 SER 58 HB2 SER 58 -23.907 -12.379 1.288 293 HB3 SER 58 HB3 SER 58 -24.683 -11.572 -0.078 294 HG SER 58 HG SER 58 -22.852 -11.647 -1.096 295 H LEU 59 H LEU 59 -23.980 -10.623 3.909 296 HA LEU 59 HA LEU 59 -26.808 -10.716 4.334 297 HB2 LEU 59 HB2 LEU 59 -25.167 -11.807 5.846 298 HB3 LEU 59 HB3 LEU 59 -24.527 -10.238 6.291 299 HG LEU 59 HG LEU 59 -26.834 -9.698 7.272 300 HD11 LEU 59 HD11 LEU 59 -28.148 -11.389 6.109 301 HD12 LEU 59 HD12 LEU 59 -28.298 -11.566 7.855 302 HD13 LEU 59 HD13 LEU 59 -27.272 -12.676 6.943 303 HD21 LEU 59 HD21 LEU 59 -24.918 -10.227 8.701 304 HD22 LEU 59 HD22 LEU 59 -25.253 -11.953 8.552 305 HD23 LEU 59 HD23 LEU 59 -26.402 -10.899 9.377 306 H THR 60 H THR 60 -24.477 -8.104 4.139 307 HA THR 60 HA THR 60 -26.221 -6.140 5.428 308 HB THR 60 HB THR 60 -23.551 -5.737 3.993 309 HG1 THR 60 HG1 THR 60 -22.635 -5.894 6.014 310 HG21 THR 60 HG21 THR 60 -25.017 -3.914 5.952 311 HG22 THR 60 HG22 THR 60 -24.851 -3.628 4.217 312 HG23 THR 60 HG23 THR 60 -23.424 -3.614 5.254 313 H GLU 61 H GLU 61 -27.825 -5.238 4.290 314 HA GLU 61 HA GLU 61 -28.251 -5.693 1.515 315 HB2 GLU 61 HB2 GLU 61 -30.048 -5.428 3.262 316 HB3 GLU 61 HB3 GLU 61 -29.683 -3.708 3.331 317 HG2 GLU 61 HG2 GLU 61 -30.374 -3.443 0.995 318 HG3 GLU 61 HG3 GLU 61 -30.661 -5.175 0.857 319 H ASN 62 H ASN 62 -26.838 -2.998 3.305 320 HA ASN 62 HA ASN 62 -26.559 -1.342 0.909 321 HB2 ASN 62 HB2 ASN 62 -26.993 -0.319 3.203 322 HB3 ASN 62 HB3 ASN 62 -25.381 -0.834 3.680 323 HD21 ASN 62 HD21 ASN 62 -24.472 1.223 3.926 324 HD22 ASN 62 HD22 ASN 62 -24.288 2.351 2.628 325 H SER 63 H SER 63 -25.489 -3.392 0.070 326 HA SER 63 HA SER 63 -22.586 -3.023 0.000 327 HB2 SER 63 HB2 SER 63 -23.896 -5.738 0.579 328 HB3 SER 63 HB3 SER 63 -22.187 -5.510 0.233 329 HG SER 63 HG SER 63 -23.673 -4.691 2.455 330 H ILE 64 H ILE 64 -21.720 -3.725 -1.976 331 HA ILE 64 HA ILE 64 -23.283 -3.892 -4.312 332 HB ILE 64 HB ILE 64 -21.187 -4.789 -5.412 333 HG12 ILE 64 HG12 ILE 64 -19.876 -4.545 -2.659 334 HG13 ILE 64 HG13 ILE 64 -20.426 -6.078 -3.314 335 HG21 ILE 64 HG21 ILE 64 -20.754 -2.349 -3.647 336 HG22 ILE 64 HG22 ILE 64 -21.532 -2.363 -5.231 337 HG23 ILE 64 HG23 ILE 64 -19.819 -2.756 -5.090 338 HD11 ILE 64 HD11 ILE 64 -18.295 -4.318 -4.496 339 HD12 ILE 64 HD12 ILE 64 -18.847 -5.856 -5.162 340 HD13 ILE 64 HD13 ILE 64 -18.053 -5.808 -3.589 341 H LEU 65 H LEU 65 -22.424 -6.285 -1.962 342 HA LEU 65 HA LEU 65 -22.797 -8.623 -3.640 343 HB2 LEU 65 HB2 LEU 65 -22.366 -8.426 -0.639 344 HB3 LEU 65 HB3 LEU 65 -22.194 -9.875 -1.624 345 HG LEU 65 HG LEU 65 -20.425 -7.405 -1.712 346 HD11 LEU 65 HD11 LEU 65 -19.780 -10.220 -0.793 347 HD12 LEU 65 HD12 LEU 65 -20.017 -8.810 0.241 348 HD13 LEU 65 HD13 LEU 65 -18.655 -8.859 -0.875 349 HD21 LEU 65 HD21 LEU 65 -20.261 -9.903 -3.432 350 HD22 LEU 65 HD22 LEU 65 -19.044 -8.625 -3.359 351 HD23 LEU 65 HD23 LEU 65 -20.653 -8.267 -3.971 352 H ALA 66 H ALA 66 -24.954 -6.560 -2.219 353 HA ALA 66 HA ALA 66 -26.895 -8.412 -1.170 354 HB1 ALA 66 HB1 ALA 66 -28.398 -6.461 -1.096 355 HB2 ALA 66 HB2 ALA 66 -27.233 -5.517 -2.027 356 HB3 ALA 66 HB3 ALA 66 -26.820 -6.074 -0.406 357 H GLN 67 H GLN 67 -26.235 -6.964 -4.337 358 HA GLN 67 HA GLN 67 -28.560 -8.187 -5.621 359 HB2 GLN 67 HB2 GLN 67 -27.734 -7.185 -7.681 360 HB3 GLN 67 HB3 GLN 67 -27.641 -5.990 -6.391 361 HG2 GLN 67 HG2 GLN 67 -25.198 -6.541 -6.158 362 HG3 GLN 67 HG3 GLN 67 -25.342 -7.571 -7.579 363 HE21 GLN 67 HE21 GLN 67 -25.332 -4.291 -6.388 364 HE22 GLN 67 HE22 GLN 67 -25.128 -3.523 -7.922 365 H PHE 68 H PHE 68 -25.549 -9.257 -4.607 366 HA PHE 68 HA PHE 68 -25.506 -11.556 -6.476 367 HB2 PHE 68 HB2 PHE 68 -23.328 -10.465 -4.622 368 HB3 PHE 68 HB3 PHE 68 -23.172 -11.921 -5.597 369 HD1 PHE 68 HD1 PHE 68 -23.707 -11.556 -8.211 370 HD2 PHE 68 HD2 PHE 68 -22.396 -8.490 -5.528 371 HE1 PHE 68 HE1 PHE 68 -22.869 -10.237 -10.112 372 HE2 PHE 68 HE2 PHE 68 -21.565 -7.176 -7.442 373 HZ PHE 68 HZ PHE 68 -21.802 -8.051 -9.735 374 H ALA 69 H ALA 69 -26.960 -10.797 -3.702 375 HA ALA 69 HA ALA 69 -26.299 -12.965 -1.941 376 HB1 ALA 69 HB1 ALA 69 -28.775 -11.198 -2.042 377 HB2 ALA 69 HB2 ALA 69 -27.317 -10.887 -1.098 378 HB3 ALA 69 HB3 ALA 69 -28.338 -12.274 -0.714 379 H GLY 70 H GLY 70 -27.015 -15.053 -2.019 380 HA2 GLY 70 HA2 GLY 70 -28.540 -16.815 -2.513 381 HA3 GLY 70 HA3 GLY 70 -29.275 -15.832 -3.776 382 H GLU 71 H GLU 71 -26.683 -14.981 -4.835 383 HA GLU 71 HA GLU 71 -26.130 -17.145 -6.662 384 HB2 GLU 71 HB2 GLU 71 -26.129 -14.778 -7.413 385 HB3 GLU 71 HB3 GLU 71 -24.806 -14.401 -6.321 386 HG2 GLU 71 HG2 GLU 71 -24.040 -14.583 -8.650 387 HG3 GLU 71 HG3 GLU 71 -23.279 -15.802 -7.628 388 H ASP 72 H ASP 72 -24.109 -18.189 -6.931 389 HA ASP 72 HA ASP 72 -22.751 -19.163 -4.701 390 HB2 ASP 72 HB2 ASP 72 -22.766 -20.259 -6.930 391 HB3 ASP 72 HB3 ASP 72 -21.787 -18.963 -7.594 392 HA PRO 73 HA PRO 73 -20.469 -15.439 -3.659 393 HB2 PRO 73 HB2 PRO 73 -18.759 -16.451 -1.755 394 HB3 PRO 73 HB3 PRO 73 -20.486 -16.188 -1.470 395 HG2 PRO 73 HG2 PRO 73 -19.065 -18.736 -2.249 396 HG3 PRO 73 HG3 PRO 73 -20.278 -18.484 -0.974 397 HD2 PRO 73 HD2 PRO 73 -20.957 -19.520 -3.363 398 HD3 PRO 73 HD3 PRO 73 -22.054 -18.417 -2.503 399 H VAL 74 H VAL 74 -18.722 -18.286 -4.837 400 HA VAL 74 HA VAL 74 -16.198 -16.929 -5.235 401 HB VAL 74 HB VAL 74 -17.170 -19.489 -6.593 402 HG11 VAL 74 HG11 VAL 74 -14.757 -19.968 -6.938 403 HG12 VAL 74 HG12 VAL 74 -14.346 -18.410 -6.218 404 HG13 VAL 74 HG13 VAL 74 -15.239 -18.468 -7.738 405 HG21 VAL 74 HG21 VAL 74 -15.565 -19.200 -4.022 406 HG22 VAL 74 HG22 VAL 74 -15.950 -20.722 -4.827 407 HG23 VAL 74 HG23 VAL 74 -17.242 -19.738 -4.138 408 H VAL 75 H VAL 75 -18.922 -17.902 -7.303 409 HA VAL 75 HA VAL 75 -18.041 -16.725 -9.733 410 HB VAL 75 HB VAL 75 -20.832 -17.488 -8.763 411 HG11 VAL 75 HG11 VAL 75 -21.113 -15.826 -10.541 412 HG12 VAL 75 HG12 VAL 75 -21.559 -17.423 -11.144 413 HG13 VAL 75 HG13 VAL 75 -20.004 -16.717 -11.586 414 HG21 VAL 75 HG21 VAL 75 -18.889 -18.934 -10.605 415 HG22 VAL 75 HG22 VAL 75 -20.507 -19.494 -10.181 416 HG23 VAL 75 HG23 VAL 75 -19.263 -19.375 -8.936 417 H ALA 76 H ALA 76 -19.856 -15.498 -7.011 418 HA ALA 76 HA ALA 76 -20.693 -12.997 -8.113 419 HB1 ALA 76 HB1 ALA 76 -21.257 -12.419 -5.781 420 HB2 ALA 76 HB2 ALA 76 -20.391 -13.849 -5.213 421 HB3 ALA 76 HB3 ALA 76 -21.844 -14.031 -6.198 422 H LEU 77 H LEU 77 -17.913 -14.128 -6.275 423 HA LEU 77 HA LEU 77 -16.617 -11.634 -5.845 424 HB2 LEU 77 HB2 LEU 77 -16.138 -13.657 -4.524 425 HB3 LEU 77 HB3 LEU 77 -15.539 -14.472 -5.958 426 HG LEU 77 HG LEU 77 -13.652 -12.800 -6.052 427 HD11 LEU 77 HD11 LEU 77 -14.662 -10.958 -4.808 428 HD12 LEU 77 HD12 LEU 77 -13.120 -11.447 -4.112 429 HD13 LEU 77 HD13 LEU 77 -14.628 -11.926 -3.330 430 HD21 LEU 77 HD21 LEU 77 -12.357 -13.843 -4.288 431 HD22 LEU 77 HD22 LEU 77 -13.387 -15.045 -5.056 432 HD23 LEU 77 HD23 LEU 77 -13.828 -14.385 -3.477 433 H GLU 78 H GLU 78 -16.364 -14.137 -8.370 434 HA GLU 78 HA GLU 78 -14.243 -12.983 -9.877 435 HB2 GLU 78 HB2 GLU 78 -16.422 -14.964 -10.685 436 HB3 GLU 78 HB3 GLU 78 -15.052 -14.538 -11.715 437 HG2 GLU 78 HG2 GLU 78 -13.489 -15.448 -10.089 438 HG3 GLU 78 HG3 GLU 78 -14.797 -15.763 -8.953 439 H ALA 79 H ALA 79 -17.779 -12.782 -10.134 440 HA ALA 79 HA ALA 79 -17.977 -11.107 -12.405 441 HB1 ALA 79 HB1 ALA 79 -20.282 -10.652 -11.623 442 HB2 ALA 79 HB2 ALA 79 -19.896 -11.377 -10.058 443 HB3 ALA 79 HB3 ALA 79 -19.898 -12.373 -11.514 444 H ALA 80 H ALA 80 -17.598 -10.456 -8.956 445 HA ALA 80 HA ALA 80 -17.848 -7.638 -9.018 446 HB1 ALA 80 HB1 ALA 80 -16.343 -9.366 -7.032 447 HB2 ALA 80 HB2 ALA 80 -18.052 -8.937 -6.941 448 HB3 ALA 80 HB3 ALA 80 -16.822 -7.681 -6.788 449 H LEU 81 H LEU 81 -15.060 -9.797 -9.301 450 HA LEU 81 HA LEU 81 -13.020 -7.822 -9.345 451 HB2 LEU 81 HB2 LEU 81 -13.080 -10.701 -10.309 452 HB3 LEU 81 HB3 LEU 81 -11.619 -9.720 -10.328 453 HG LEU 81 HG LEU 81 -13.195 -10.433 -7.825 454 HD11 LEU 81 HD11 LEU 81 -11.334 -11.910 -7.245 455 HD12 LEU 81 HD12 LEU 81 -10.565 -11.570 -8.799 456 HD13 LEU 81 HD13 LEU 81 -12.114 -12.415 -8.744 457 HD21 LEU 81 HD21 LEU 81 -11.300 -9.491 -6.597 458 HD22 LEU 81 HD22 LEU 81 -12.062 -8.276 -7.617 459 HD23 LEU 81 HD23 LEU 81 -10.533 -9.011 -8.112 460 H GLN 82 H GLN 82 -15.036 -9.256 -11.836 461 HA GLN 82 HA GLN 82 -13.457 -8.153 -14.044 462 HB2 GLN 82 HB2 GLN 82 -16.001 -9.834 -14.016 463 HB3 GLN 82 HB3 GLN 82 -15.140 -9.351 -15.477 464 HG2 GLN 82 HG2 GLN 82 -13.196 -10.657 -14.824 465 HG3 GLN 82 HG3 GLN 82 -13.925 -11.041 -13.266 466 HE21 GLN 82 HE21 GLN 82 -13.838 -13.262 -13.581 467 HE22 GLN 82 HE22 GLN 82 -14.844 -14.084 -14.719 468 H PHE 83 H PHE 83 -15.613 -6.770 -11.989 469 HA PHE 83 HA PHE 83 -16.652 -4.917 -14.054 470 HB2 PHE 83 HB2 PHE 83 -18.436 -6.497 -13.227 471 HB3 PHE 83 HB3 PHE 83 -18.213 -5.853 -11.607 472 HD1 PHE 83 HD1 PHE 83 -18.662 -4.425 -15.062 473 HD2 PHE 83 HD2 PHE 83 -19.917 -4.373 -10.975 474 HE1 PHE 83 HE1 PHE 83 -20.316 -2.689 -15.590 475 HE2 PHE 83 HE2 PHE 83 -21.570 -2.637 -11.513 476 HZ PHE 83 HZ PHE 83 -21.777 -1.795 -13.820 477 H GLU 84 H GLU 84 -16.235 -2.842 -13.657 478 HA GLU 84 HA GLU 84 -14.172 -2.161 -11.904 479 HB2 GLU 84 HB2 GLU 84 -14.511 0.174 -12.716 480 HB3 GLU 84 HB3 GLU 84 -14.469 -1.012 -14.017 481 HG2 GLU 84 HG2 GLU 84 -16.915 -0.945 -14.201 482 HG3 GLU 84 HG3 GLU 84 -17.005 0.186 -12.852 483 H ASP 85 H ASP 85 -17.648 -1.563 -11.561 484 HA ASP 85 HA ASP 85 -17.480 0.273 -9.375 485 HB2 ASP 85 HB2 ASP 85 -19.822 -1.443 -10.308 486 HB3 ASP 85 HB3 ASP 85 -19.942 -0.109 -9.167 487 H THR 86 H THR 86 -17.584 -3.197 -9.619 488 HA THR 86 HA THR 86 -18.212 -3.540 -6.760 489 HB THR 86 HB THR 86 -18.573 -5.972 -7.479 490 HG1 THR 86 HG1 THR 86 -17.347 -5.561 -9.533 491 HG21 THR 86 HG21 THR 86 -20.789 -5.547 -8.491 492 HG22 THR 86 HG22 THR 86 -20.322 -3.877 -8.826 493 HG23 THR 86 HG23 THR 86 -20.484 -4.431 -7.159 494 H ARG 87 H ARG 87 -15.444 -3.499 -8.776 495 HA ARG 87 HA ARG 87 -13.967 -5.473 -7.194 496 HB2 ARG 87 HB2 ARG 87 -12.041 -5.028 -8.676 497 HB3 ARG 87 HB3 ARG 87 -13.490 -5.440 -9.573 498 HG2 ARG 87 HG2 ARG 87 -12.738 -3.722 -10.882 499 HG3 ARG 87 HG3 ARG 87 -13.741 -2.803 -9.767 500 HD2 ARG 87 HD2 ARG 87 -11.631 -2.368 -8.410 501 HD3 ARG 87 HD3 ARG 87 -10.722 -3.083 -9.751 502 HE ARG 87 HE ARG 87 -12.457 -0.686 -9.999 503 HH11 ARG 87 HH11 ARG 87 -9.542 -2.409 -11.003 504 HH12 ARG 87 HH12 ARG 87 -8.916 -1.047 -11.881 505 HH21 ARG 87 HH21 ARG 87 -11.610 1.051 -11.181 506 HH22 ARG 87 HH22 ARG 87 -10.077 0.887 -11.972 507 H GLU 88 H GLU 88 -14.955 -2.474 -6.581 508 HA GLU 88 HA GLU 88 -12.652 -1.166 -5.502 509 HB2 GLU 88 HB2 GLU 88 -15.600 -0.692 -4.869 510 HB3 GLU 88 HB3 GLU 88 -14.276 0.430 -4.572 511 HG2 GLU 88 HG2 GLU 88 -15.247 -0.493 -7.298 512 HG3 GLU 88 HG3 GLU 88 -15.621 1.053 -6.547 513 H SER 89 H SER 89 -15.386 -2.938 -4.044 514 HA SER 89 HA SER 89 -14.450 -2.790 -1.340 515 HB2 SER 89 HB2 SER 89 -16.854 -3.043 -1.942 516 HB3 SER 89 HB3 SER 89 -16.521 -4.650 -2.585 517 HG SER 89 HG SER 89 -15.777 -4.098 0.062 518 H MET 90 H MET 90 -13.682 -4.825 -4.005 519 HA MET 90 HA MET 90 -12.950 -7.231 -2.707 520 HB2 MET 90 HB2 MET 90 -11.922 -6.059 -5.313 521 HB3 MET 90 HB3 MET 90 -11.669 -7.720 -4.781 522 HG2 MET 90 HG2 MET 90 -14.322 -6.435 -5.468 523 HG3 MET 90 HG3 MET 90 -13.444 -7.631 -6.418 524 HE1 MET 90 HE1 MET 90 -16.519 -7.366 -4.597 525 HE2 MET 90 HE2 MET 90 -15.579 -7.033 -3.139 526 HE3 MET 90 HE3 MET 90 -16.503 -8.529 -3.273 527 H HIS 91 H HIS 91 -11.345 -4.163 -2.902 528 HA HIS 91 HA HIS 91 -8.656 -4.871 -2.430 529 HB2 HIS 91 HB2 HIS 91 -10.244 -2.393 -1.653 530 HB3 HIS 91 HB3 HIS 91 -8.511 -2.533 -1.375 531 HD1 HIS 91 HD1 HIS 91 -7.339 -1.195 -3.074 532 HD2 HIS 91 HD2 HIS 91 -10.630 -3.143 -4.701 533 HE1 HIS 91 HE1 HIS 91 -7.385 -0.540 -5.496 534 HE2 HIS 91 HE2 HIS 91 -9.438 -1.643 -6.439 535 H ALA 92 H ALA 92 -11.414 -4.559 -0.247 536 HA ALA 92 HA ALA 92 -10.008 -4.823 2.224 537 HB1 ALA 92 HB1 ALA 92 -12.918 -5.441 1.604 538 HB2 ALA 92 HB2 ALA 92 -12.281 -3.875 2.105 539 HB3 ALA 92 HB3 ALA 92 -12.223 -5.242 3.217 540 H PHE 93 H PHE 93 -11.702 -7.155 0.119 541 HA PHE 93 HA PHE 93 -11.198 -9.459 1.766 542 HB2 PHE 93 HB2 PHE 93 -12.028 -9.369 -1.170 543 HB3 PHE 93 HB3 PHE 93 -12.167 -10.755 -0.089 544 HD1 PHE 93 HD1 PHE 93 -13.636 -10.380 2.071 545 HD2 PHE 93 HD2 PHE 93 -13.898 -7.945 -1.424 546 HE1 PHE 93 HE1 PHE 93 -15.870 -9.621 2.756 547 HE2 PHE 93 HE2 PHE 93 -16.131 -7.183 -0.726 548 HZ PHE 93 HZ PHE 93 -17.118 -8.021 1.364 549 H CYS 94 H CYS 94 -9.316 -7.725 -0.505 550 HA CYS 94 HA CYS 94 -7.610 -9.813 -1.457 551 HB2 CYS 94 HB2 CYS 94 -7.882 -7.622 -2.629 552 HB3 CYS 94 HB3 CYS 94 -7.070 -6.819 -1.290 553 HG CYS 94 HG CYS 94 -5.741 -8.035 -3.967 554 H VAL 95 H VAL 95 -7.006 -10.995 0.324 555 HA VAL 95 HA VAL 95 -5.807 -9.868 2.696 556 HB VAL 95 HB VAL 95 -5.499 -12.247 3.398 557 HG11 VAL 95 HG11 VAL 95 -7.893 -12.854 3.527 558 HG12 VAL 95 HG12 VAL 95 -8.272 -11.668 2.276 559 HG13 VAL 95 HG13 VAL 95 -7.656 -11.131 3.839 560 HG21 VAL 95 HG21 VAL 95 -6.629 -12.944 0.650 561 HG22 VAL 95 HG22 VAL 95 -6.346 -14.095 1.959 562 HG23 VAL 95 HG23 VAL 95 -4.986 -13.261 1.207 563 H GLY 96 H GLY 96 -4.661 -11.108 -0.332 564 HA2 GLY 96 HA2 GLY 96 -2.086 -10.083 -0.176 565 HA3 GLY 96 HA3 GLY 96 -1.981 -11.756 0.374 566 H GLN 97 H GLN 97 -0.526 -11.330 -1.693 567 HA GLN 97 HA GLN 97 -1.959 -12.018 -4.177 568 HB2 GLN 97 HB2 GLN 97 -0.287 -10.207 -4.365 569 HB3 GLN 97 HB3 GLN 97 0.949 -11.243 -3.660 570 HG2 GLN 97 HG2 GLN 97 0.707 -12.765 -5.642 571 HG3 GLN 97 HG3 GLN 97 -0.382 -11.579 -6.364 572 HE21 GLN 97 HE21 GLN 97 0.504 -9.611 -7.128 573 HE22 GLN 97 HE22 GLN 97 2.200 -9.411 -7.372 574 H TYR 98 H TYR 98 -1.876 -14.081 -4.945 575 HA TYR 98 HA TYR 98 -0.607 -16.193 -3.487 576 HB2 TYR 98 HB2 TYR 98 -2.676 -16.629 -4.727 577 HB3 TYR 98 HB3 TYR 98 -1.889 -16.216 -6.246 578 HD1 TYR 98 HD1 TYR 98 -1.334 -18.552 -3.333 579 HD2 TYR 98 HD2 TYR 98 -1.207 -18.046 -7.576 580 HE1 TYR 98 HE1 TYR 98 -0.685 -20.905 -3.599 581 HE2 TYR 98 HE2 TYR 98 -0.558 -20.400 -7.838 582 HH TYR 98 HH TYR 98 0.498 -22.173 -6.536 583 H LEU 99 H LEU 99 1.351 -16.971 -3.736 584 HA LEU 99 HA LEU 99 2.920 -16.428 -6.159 585 HB2 LEU 99 HB2 LEU 99 3.456 -14.815 -4.269 586 HB3 LEU 99 HB3 LEU 99 3.976 -16.181 -3.308 587 HG LEU 99 HG LEU 99 5.787 -14.738 -4.436 588 HD11 LEU 99 HD11 LEU 99 6.320 -16.868 -3.416 589 HD12 LEU 99 HD12 LEU 99 7.281 -16.597 -4.866 590 HD13 LEU 99 HD13 LEU 99 5.914 -17.714 -4.910 591 HD21 LEU 99 HD21 LEU 99 4.965 -16.261 -6.925 592 HD22 LEU 99 HD22 LEU 99 6.368 -15.201 -6.752 593 HD23 LEU 99 HD23 LEU 99 4.743 -14.531 -6.648 594 H GLU 100 H GLU 100 3.770 -18.233 -6.934 595 HA GLU 100 HA GLU 100 3.309 -20.773 -5.638 596 HB2 GLU 100 HB2 GLU 100 4.512 -20.007 -8.327 597 HB3 GLU 100 HB3 GLU 100 4.234 -21.661 -7.827 598 HG2 GLU 100 HG2 GLU 100 1.786 -21.114 -7.608 599 HG3 GLU 100 HG3 GLU 100 2.135 -19.513 -8.253 600 HA PRO 101 HA PRO 101 7.389 -21.213 -3.757 601 HB2 PRO 101 HB2 PRO 101 7.690 -23.985 -3.976 602 HB3 PRO 101 HB3 PRO 101 6.745 -23.178 -2.722 603 HG2 PRO 101 HG2 PRO 101 5.799 -24.396 -5.314 604 HG3 PRO 101 HG3 PRO 101 5.089 -24.537 -3.690 605 HD2 PRO 101 HD2 PRO 101 4.036 -22.858 -5.482 606 HD3 PRO 101 HD3 PRO 101 4.148 -22.383 -3.774 607 H ASP 102 H ASP 102 6.702 -22.854 -6.790 608 HA ASP 102 HA ASP 102 9.355 -23.117 -7.775 609 HB2 ASP 102 HB2 ASP 102 7.479 -24.526 -8.594 610 HB3 ASP 102 HB3 ASP 102 6.688 -23.102 -9.260 611 H GLN 103 H GLN 103 6.820 -20.644 -8.073 612 HA GLN 103 HA GLN 103 8.007 -19.128 -10.155 613 HB2 GLN 103 HB2 GLN 103 5.585 -19.036 -9.589 614 HB3 GLN 103 HB3 GLN 103 5.971 -18.216 -8.083 615 HG2 GLN 103 HG2 GLN 103 5.157 -16.644 -9.777 616 HG3 GLN 103 HG3 GLN 103 6.820 -16.281 -9.317 617 HE21 GLN 103 HE21 GLN 103 7.221 -15.134 -11.242 618 HE22 GLN 103 HE22 GLN 103 7.365 -15.915 -12.776 619 H GLU 104 H GLU 104 8.322 -19.020 -6.648 620 HA GLU 104 HA GLU 104 9.682 -16.535 -6.406 621 HB2 GLU 104 HB2 GLU 104 8.634 -18.203 -4.573 622 HB3 GLU 104 HB3 GLU 104 10.274 -18.815 -4.503 623 HG2 GLU 104 HG2 GLU 104 9.411 -15.953 -3.969 624 HG3 GLU 104 HG3 GLU 104 9.784 -17.152 -2.739 625 H GLY 105 H GLY 105 10.796 -19.895 -6.670 626 HA2 GLY 105 HA2 GLY 105 13.593 -19.371 -6.610 627 HA3 GLY 105 HA3 GLY 105 12.815 -20.862 -7.112 628 H VAL 106 H VAL 106 11.281 -19.712 -9.267 629 HA VAL 106 HA VAL 106 13.213 -18.743 -11.209 630 HB VAL 106 HB VAL 106 13.624 -21.198 -11.233 631 HG11 VAL 106 HG11 VAL 106 11.922 -22.803 -12.022 632 HG12 VAL 106 HG12 VAL 106 10.719 -21.514 -12.069 633 HG13 VAL 106 HG13 VAL 106 11.411 -22.014 -10.526 634 HG21 VAL 106 HG21 VAL 106 13.964 -19.939 -13.323 635 HG22 VAL 106 HG22 VAL 106 12.283 -20.218 -13.785 636 HG23 VAL 106 HG23 VAL 106 13.404 -21.577 -13.671 637 H THR 107 H THR 107 12.256 -17.557 -12.731 638 HA THR 107 HA THR 107 9.330 -17.612 -13.064 639 HB THR 107 HB THR 107 9.973 -15.392 -12.440 640 HG1 THR 107 HG1 THR 107 9.245 -14.242 -14.217 641 HG21 THR 107 HG21 THR 107 12.093 -15.427 -14.614 642 HG22 THR 107 HG22 THR 107 12.390 -15.440 -12.874 643 HG23 THR 107 HG23 THR 107 11.655 -14.027 -13.634 644 H ILE 108 H ILE 108 8.563 -18.408 -14.898 645 HA ILE 108 HA ILE 108 10.277 -19.728 -16.759 646 HB ILE 108 HB ILE 108 7.251 -19.331 -16.804 647 HG12 ILE 108 HG12 ILE 108 8.922 -21.678 -15.775 648 HG13 ILE 108 HG13 ILE 108 8.075 -20.506 -14.769 649 HG21 ILE 108 HG21 ILE 108 7.155 -21.248 -18.361 650 HG22 ILE 108 HG22 ILE 108 8.916 -21.314 -18.404 651 HG23 ILE 108 HG23 ILE 108 8.071 -19.908 -19.055 652 HD11 ILE 108 HD11 ILE 108 6.780 -22.501 -16.638 653 HD12 ILE 108 HD12 ILE 108 5.928 -21.324 -15.635 654 HD13 ILE 108 HD13 ILE 108 6.873 -22.604 -14.880 655 HA PRO 109 HA PRO 109 10.736 -16.223 -19.616 656 HB2 PRO 109 HB2 PRO 109 11.657 -18.317 -21.548 657 HB3 PRO 109 HB3 PRO 109 12.500 -16.871 -20.979 658 HG2 PRO 109 HG2 PRO 109 13.243 -19.308 -20.142 659 HG3 PRO 109 HG3 PRO 109 13.260 -17.918 -19.032 660 HD2 PRO 109 HD2 PRO 109 11.197 -20.112 -19.289 661 HD3 PRO 109 HD3 PRO 109 11.913 -19.408 -17.819 662 H ASP 110 H ASP 110 10.056 -15.693 -21.863 663 HA ASP 110 HA ASP 110 7.370 -16.688 -22.443 664 HB2 ASP 110 HB2 ASP 110 7.263 -14.783 -24.020 665 HB3 ASP 110 HB3 ASP 110 7.767 -14.266 -22.419 666 H LEU 111 H LEU 111 9.864 -18.314 -22.993 667 HA LEU 111 HA LEU 111 10.010 -18.702 -25.849 668 HB2 LEU 111 HB2 LEU 111 11.088 -20.368 -23.532 669 HB3 LEU 111 HB3 LEU 111 11.470 -20.642 -25.227 670 HG LEU 111 HG LEU 111 12.204 -18.136 -23.656 671 HD11 LEU 111 HD11 LEU 111 13.963 -20.453 -24.511 672 HD12 LEU 111 HD12 LEU 111 13.469 -20.059 -22.862 673 HD13 LEU 111 HD13 LEU 111 14.515 -18.957 -23.752 674 HD21 LEU 111 HD21 LEU 111 13.585 -17.544 -25.609 675 HD22 LEU 111 HD22 LEU 111 11.881 -17.645 -26.040 676 HD23 LEU 111 HD23 LEU 111 12.980 -18.956 -26.482 677 H GLY 112 H GLY 112 7.825 -19.067 -26.341 678 HA2 GLY 112 HA2 GLY 112 7.040 -21.751 -26.655 679 HA3 GLY 112 HA3 GLY 112 6.121 -21.059 -25.318 Start of MODEL 7 1 H GLU 21 H GLU 21 5.812 -1.854 -3.167 2 HA GLU 21 HA GLU 21 3.817 -1.815 -0.991 3 HB2 GLU 21 HB2 GLU 21 2.847 -1.308 -3.231 4 HB3 GLU 21 HB3 GLU 21 3.587 -2.768 -3.882 5 HG2 GLU 21 HG2 GLU 21 2.197 -4.138 -2.348 6 HG3 GLU 21 HG3 GLU 21 1.435 -2.669 -1.739 7 H LYS 22 H LYS 22 4.257 -3.469 0.374 8 HA LYS 22 HA LYS 22 5.561 -5.931 -0.531 9 HB2 LYS 22 HB2 LYS 22 4.604 -4.995 2.210 10 HB3 LYS 22 HB3 LYS 22 5.257 -6.603 1.925 11 HG2 LYS 22 HG2 LYS 22 6.755 -4.002 1.494 12 HG3 LYS 22 HG3 LYS 22 6.923 -5.063 2.898 13 HD2 LYS 22 HD2 LYS 22 7.617 -5.760 0.012 14 HD3 LYS 22 HD3 LYS 22 8.768 -5.404 1.302 15 HE2 LYS 22 HE2 LYS 22 6.884 -7.789 1.179 16 HE3 LYS 22 HE3 LYS 22 8.624 -7.827 0.911 17 HZ1 LYS 22 HZ1 LYS 22 8.922 -7.110 3.222 18 HZ2 LYS 22 HZ2 LYS 22 8.101 -8.585 3.115 19 HZ3 LYS 22 HZ3 LYS 22 7.251 -7.163 3.457 20 H VAL 23 H VAL 23 4.076 -6.953 -1.874 21 HA VAL 23 HA VAL 23 1.346 -7.425 -0.974 22 HB VAL 23 HB VAL 23 1.777 -6.998 -3.385 23 HG11 VAL 23 HG11 VAL 23 2.807 -8.675 -4.873 24 HG12 VAL 23 HG12 VAL 23 3.227 -9.668 -3.476 25 HG13 VAL 23 HG13 VAL 23 3.966 -8.080 -3.678 26 HG21 VAL 23 HG21 VAL 23 -0.250 -8.217 -2.726 27 HG22 VAL 23 HG22 VAL 23 0.607 -9.755 -2.839 28 HG23 VAL 23 HG23 VAL 23 0.323 -8.795 -4.294 29 H THR 24 H THR 24 0.742 -9.157 0.199 30 HA THR 24 HA THR 24 2.668 -10.981 1.252 31 HB THR 24 HB THR 24 -0.382 -11.041 1.476 32 HG1 THR 24 HG1 THR 24 0.924 -9.156 2.310 33 HG21 THR 24 HG21 THR 24 0.600 -13.231 2.090 34 HG22 THR 24 HG22 THR 24 -0.021 -12.400 3.517 35 HG23 THR 24 HG23 THR 24 1.714 -12.429 3.203 36 H LEU 25 H LEU 25 3.504 -12.564 0.007 37 HA LEU 25 HA LEU 25 2.014 -13.869 -2.114 38 HB2 LEU 25 HB2 LEU 25 4.791 -14.418 -0.987 39 HB3 LEU 25 HB3 LEU 25 4.107 -15.215 -2.401 40 HG LEU 25 HG LEU 25 4.758 -12.240 -2.154 41 HD11 LEU 25 HD11 LEU 25 6.763 -13.626 -2.386 42 HD12 LEU 25 HD12 LEU 25 6.492 -12.656 -3.832 43 HD13 LEU 25 HD13 LEU 25 6.100 -14.377 -3.840 44 HD21 LEU 25 HD21 LEU 25 2.766 -12.527 -3.566 45 HD22 LEU 25 HD22 LEU 25 3.604 -13.728 -4.553 46 HD23 LEU 25 HD23 LEU 25 4.149 -12.048 -4.547 47 H VAL 26 H VAL 26 0.402 -15.063 -1.367 48 HA VAL 26 HA VAL 26 0.692 -16.867 0.936 49 HB VAL 26 HB VAL 26 -1.776 -16.230 -0.763 50 HG11 VAL 26 HG11 VAL 26 -1.596 -17.675 1.914 51 HG12 VAL 26 HG12 VAL 26 -1.985 -18.406 0.354 52 HG13 VAL 26 HG13 VAL 26 -3.091 -17.239 1.078 53 HG21 VAL 26 HG21 VAL 26 -1.023 -15.058 1.950 54 HG22 VAL 26 HG22 VAL 26 -2.535 -14.773 1.085 55 HG23 VAL 26 HG23 VAL 26 -1.012 -14.198 0.406 56 H ARG 27 H ARG 27 1.357 -18.865 0.511 57 HA ARG 27 HA ARG 27 1.135 -19.992 -2.195 58 HB2 ARG 27 HB2 ARG 27 2.843 -20.822 0.189 59 HB3 ARG 27 HB3 ARG 27 2.784 -21.692 -1.347 60 HG2 ARG 27 HG2 ARG 27 3.571 -19.640 -2.517 61 HG3 ARG 27 HG3 ARG 27 3.718 -18.826 -0.956 62 HD2 ARG 27 HD2 ARG 27 5.213 -21.366 -1.696 63 HD3 ARG 27 HD3 ARG 27 5.866 -19.738 -1.921 64 HE ARG 27 HE ARG 27 4.986 -20.365 0.780 65 HH11 ARG 27 HH11 ARG 27 7.716 -20.378 -1.435 66 HH12 ARG 27 HH12 ARG 27 8.896 -20.340 -0.158 67 HH21 ARG 27 HH21 ARG 27 6.537 -20.337 2.430 68 HH22 ARG 27 HH22 ARG 27 8.226 -20.331 2.028 69 H ILE 28 H ILE 28 0.923 -22.514 -2.129 70 HA ILE 28 HA ILE 28 -1.777 -22.987 -1.544 71 HB ILE 28 HB ILE 28 -0.558 -24.118 -3.390 72 HG12 ILE 28 HG12 ILE 28 -1.855 -26.153 -1.498 73 HG13 ILE 28 HG13 ILE 28 -2.759 -25.012 -2.488 74 HG21 ILE 28 HG21 ILE 28 0.851 -26.112 -2.981 75 HG22 ILE 28 HG22 ILE 28 0.735 -25.843 -1.241 76 HG23 ILE 28 HG23 ILE 28 1.558 -24.662 -2.262 77 HD11 ILE 28 HD11 ILE 28 -1.853 -26.067 -4.508 78 HD12 ILE 28 HD12 ILE 28 -2.735 -27.205 -3.493 79 HD13 ILE 28 HD13 ILE 28 -0.973 -27.220 -3.502 80 H ALA 29 H ALA 29 1.151 -23.856 0.230 81 HA ALA 29 HA ALA 29 0.219 -25.673 2.138 82 HB1 ALA 29 HB1 ALA 29 2.316 -23.494 2.527 83 HB2 ALA 29 HB2 ALA 29 2.610 -25.103 1.872 84 HB3 ALA 29 HB3 ALA 29 2.112 -24.920 3.555 85 H ASP 30 H ASP 30 0.197 -22.134 2.175 86 HA ASP 30 HA ASP 30 -0.799 -21.735 4.791 87 HB2 ASP 30 HB2 ASP 30 0.342 -19.999 3.264 88 HB3 ASP 30 HB3 ASP 30 -1.185 -19.854 2.419 89 H LEU 31 H LEU 31 -2.381 -21.934 1.606 90 HA LEU 31 HA LEU 31 -5.027 -21.341 2.314 91 HB2 LEU 31 HB2 LEU 31 -4.007 -23.133 0.075 92 HB3 LEU 31 HB3 LEU 31 -5.670 -22.579 0.217 93 HG LEU 31 HG LEU 31 -3.227 -20.833 -0.316 94 HD11 LEU 31 HD11 LEU 31 -5.584 -21.544 -2.098 95 HD12 LEU 31 HD12 LEU 31 -3.932 -22.144 -2.260 96 HD13 LEU 31 HD13 LEU 31 -4.271 -20.433 -2.506 97 HD21 LEU 31 HD21 LEU 31 -4.804 -19.602 1.100 98 HD22 LEU 31 HD22 LEU 31 -6.133 -19.987 0.003 99 HD23 LEU 31 HD23 LEU 31 -4.810 -18.949 -0.536 100 H GLU 32 H GLU 32 -3.306 -24.469 2.299 101 HA GLU 32 HA GLU 32 -5.569 -26.147 2.568 102 HB2 GLU 32 HB2 GLU 32 -2.733 -26.791 3.507 103 HB3 GLU 32 HB3 GLU 32 -4.007 -27.955 3.139 104 HG2 GLU 32 HG2 GLU 32 -2.472 -26.199 1.202 105 HG3 GLU 32 HG3 GLU 32 -2.423 -27.951 1.337 106 H ASN 33 H ASN 33 -3.260 -24.943 5.010 107 HA ASN 33 HA ASN 33 -4.561 -26.184 7.244 108 HB2 ASN 33 HB2 ASN 33 -2.457 -23.979 7.167 109 HB3 ASN 33 HB3 ASN 33 -2.998 -24.782 8.638 110 HD21 ASN 33 HD21 ASN 33 -0.997 -25.017 5.837 111 HD22 ASN 33 HD22 ASN 33 -0.268 -26.537 6.208 112 H HIS 34 H HIS 34 -4.798 -23.023 5.721 113 HA HIS 34 HA HIS 34 -6.182 -21.709 7.861 114 HB2 HIS 34 HB2 HIS 34 -4.817 -20.624 5.908 115 HB3 HIS 34 HB3 HIS 34 -6.289 -20.784 4.963 116 HD1 HIS 34 HD1 HIS 34 -4.671 -18.768 7.563 117 HD2 HIS 34 HD2 HIS 34 -8.501 -19.168 6.017 118 HE1 HIS 34 HE1 HIS 34 -5.927 -16.772 8.384 119 HE2 HIS 34 HE2 HIS 34 -8.290 -17.171 7.639 120 H ASN 35 H ASN 35 -7.136 -23.471 4.978 121 HA ASN 35 HA ASN 35 -9.927 -22.942 4.985 122 HB2 ASN 35 HB2 ASN 35 -8.711 -23.840 3.011 123 HB3 ASN 35 HB3 ASN 35 -8.406 -25.342 3.867 124 HD21 ASN 35 HD21 ASN 35 -10.146 -26.814 4.171 125 HD22 ASN 35 HD22 ASN 35 -11.606 -26.691 3.254 126 H ASN 36 H ASN 36 -7.907 -25.429 6.505 127 HA ASN 36 HA ASN 36 -9.915 -27.145 7.500 128 HB2 ASN 36 HB2 ASN 36 -7.622 -27.921 7.400 129 HB3 ASN 36 HB3 ASN 36 -7.070 -26.609 8.435 130 HD21 ASN 36 HD21 ASN 36 -8.983 -29.588 8.393 131 HD22 ASN 36 HD22 ASN 36 -8.807 -29.939 10.075 132 H ASP 37 H ASP 37 -8.546 -24.158 8.793 133 HA ASP 37 HA ASP 37 -9.673 -24.239 11.400 134 HB2 ASP 37 HB2 ASP 37 -7.854 -22.710 10.868 135 HB3 ASP 37 HB3 ASP 37 -8.814 -21.919 9.624 136 H GLY 38 H GLY 38 -10.936 -23.259 8.276 137 HA2 GLY 38 HA2 GLY 38 -13.410 -23.401 8.012 138 HA3 GLY 38 HA3 GLY 38 -13.530 -22.409 9.462 139 H GLY 39 H GLY 39 -11.020 -20.956 8.445 140 HA2 GLY 39 HA2 GLY 39 -12.245 -18.783 7.060 141 HA3 GLY 39 HA3 GLY 39 -10.522 -19.023 7.313 142 H PHE 40 H PHE 40 -13.219 -19.635 5.187 143 HA PHE 40 HA PHE 40 -11.790 -21.265 3.293 144 HB2 PHE 40 HB2 PHE 40 -14.281 -21.441 3.707 145 HB3 PHE 40 HB3 PHE 40 -14.488 -19.865 2.945 146 HD1 PHE 40 HD1 PHE 40 -13.434 -23.392 2.323 147 HD2 PHE 40 HD2 PHE 40 -14.519 -19.674 0.525 148 HE1 PHE 40 HE1 PHE 40 -13.581 -24.487 0.121 149 HE2 PHE 40 HE2 PHE 40 -14.668 -20.775 -1.671 150 HZ PHE 40 HZ PHE 40 -14.198 -23.184 -1.872 151 H TRP 41 H TRP 41 -10.201 -20.340 2.192 152 HA TRP 41 HA TRP 41 -10.526 -17.701 0.900 153 HB2 TRP 41 HB2 TRP 41 -8.057 -19.343 1.614 154 HB3 TRP 41 HB3 TRP 41 -7.978 -17.973 0.514 155 HD1 TRP 41 HD1 TRP 41 -10.360 -16.935 3.097 156 HE1 TRP 41 HE1 TRP 41 -9.215 -15.483 4.874 157 HE3 TRP 41 HE3 TRP 41 -5.475 -18.020 2.034 158 HZ2 TRP 41 HZ2 TRP 41 -6.610 -14.877 5.728 159 HZ3 TRP 41 HZ3 TRP 41 -3.714 -16.975 3.391 160 HH2 TRP 41 HH2 TRP 41 -4.270 -15.429 5.201 161 H THR 42 H THR 42 -9.574 -17.536 -1.280 162 HA THR 42 HA THR 42 -9.533 -19.983 -2.913 163 HB THR 42 HB THR 42 -11.881 -19.065 -3.043 164 HG1 THR 42 HG1 THR 42 -11.976 -19.462 -5.179 165 HG21 THR 42 HG21 THR 42 -10.587 -16.650 -4.385 166 HG22 THR 42 HG22 THR 42 -11.394 -16.640 -2.815 167 HG23 THR 42 HG23 THR 42 -12.319 -16.972 -4.279 168 H VAL 43 H VAL 43 -8.498 -19.639 -4.992 169 HA VAL 43 HA VAL 43 -6.929 -17.142 -5.237 170 HB VAL 43 HB VAL 43 -5.280 -18.814 -4.989 171 HG11 VAL 43 HG11 VAL 43 -6.754 -20.619 -6.940 172 HG12 VAL 43 HG12 VAL 43 -6.668 -20.831 -5.192 173 HG13 VAL 43 HG13 VAL 43 -5.206 -20.980 -6.168 174 HG21 VAL 43 HG21 VAL 43 -5.632 -18.450 -7.996 175 HG22 VAL 43 HG22 VAL 43 -4.134 -18.903 -7.184 176 HG23 VAL 43 HG23 VAL 43 -4.838 -17.312 -6.901 177 H ILE 44 H ILE 44 -7.870 -15.856 -6.632 178 HA ILE 44 HA ILE 44 -8.661 -16.810 -9.319 179 HB ILE 44 HB ILE 44 -10.176 -14.660 -7.745 180 HG12 ILE 44 HG12 ILE 44 -11.040 -17.530 -8.349 181 HG13 ILE 44 HG13 ILE 44 -10.656 -16.878 -6.760 182 HG21 ILE 44 HG21 ILE 44 -10.191 -14.287 -10.190 183 HG22 ILE 44 HG22 ILE 44 -11.801 -14.710 -9.612 184 HG23 ILE 44 HG23 ILE 44 -10.823 -15.917 -10.451 185 HD11 ILE 44 HD11 ILE 44 -12.976 -17.002 -6.891 186 HD12 ILE 44 HD12 ILE 44 -13.021 -16.291 -8.496 187 HD13 ILE 44 HD13 ILE 44 -12.603 -15.295 -7.105 188 H ASP 45 H ASP 45 -7.881 -15.500 -10.931 189 HA ASP 45 HA ASP 45 -6.634 -13.973 -12.058 190 HB2 ASP 45 HB2 ASP 45 -8.424 -12.422 -11.209 191 HB3 ASP 45 HB3 ASP 45 -7.455 -12.093 -9.782 192 H GLY 46 H GLY 46 -5.384 -15.731 -10.133 193 HA2 GLY 46 HA2 GLY 46 -3.362 -16.218 -9.174 194 HA3 GLY 46 HA3 GLY 46 -2.724 -14.796 -9.981 195 H LYS 47 H LYS 47 -5.400 -14.488 -7.780 196 HA LYS 47 HA LYS 47 -3.709 -13.216 -5.694 197 HB2 LYS 47 HB2 LYS 47 -6.523 -12.337 -6.490 198 HB3 LYS 47 HB3 LYS 47 -5.419 -11.507 -5.395 199 HG2 LYS 47 HG2 LYS 47 -4.881 -11.865 -8.350 200 HG3 LYS 47 HG3 LYS 47 -5.780 -10.488 -7.698 201 HD2 LYS 47 HD2 LYS 47 -3.852 -9.768 -6.418 202 HD3 LYS 47 HD3 LYS 47 -2.934 -11.209 -6.886 203 HE2 LYS 47 HE2 LYS 47 -2.353 -9.116 -8.187 204 HE3 LYS 47 HE3 LYS 47 -2.832 -10.490 -9.187 205 HZ1 LYS 47 HZ1 LYS 47 -4.983 -9.556 -9.491 206 HZ2 LYS 47 HZ2 LYS 47 -3.856 -8.346 -9.839 207 HZ3 LYS 47 HZ3 LYS 47 -4.692 -8.321 -8.371 208 H VAL 48 H VAL 48 -4.546 -13.444 -3.550 209 HA VAL 48 HA VAL 48 -6.518 -15.604 -3.172 210 HB VAL 48 HB VAL 48 -4.441 -14.522 -1.221 211 HG11 VAL 48 HG11 VAL 48 -6.404 -16.823 -0.845 212 HG12 VAL 48 HG12 VAL 48 -6.445 -15.279 0.009 213 HG13 VAL 48 HG13 VAL 48 -5.103 -16.394 0.271 214 HG21 VAL 48 HG21 VAL 48 -3.356 -16.742 -1.515 215 HG22 VAL 48 HG22 VAL 48 -3.431 -15.847 -3.033 216 HG23 VAL 48 HG23 VAL 48 -4.564 -17.167 -2.730 217 H TYR 49 H TYR 49 -8.436 -15.206 -2.231 218 HA TYR 49 HA TYR 49 -8.961 -12.587 -0.931 219 HB2 TYR 49 HB2 TYR 49 -10.908 -14.088 -2.746 220 HB3 TYR 49 HB3 TYR 49 -11.204 -12.553 -1.938 221 HD1 TYR 49 HD1 TYR 49 -9.416 -14.207 -4.725 222 HD2 TYR 49 HD2 TYR 49 -10.303 -10.450 -2.874 223 HE1 TYR 49 HE1 TYR 49 -8.586 -13.021 -6.705 224 HE2 TYR 49 HE2 TYR 49 -9.465 -9.279 -4.869 225 HH TYR 49 HH TYR 49 -8.804 -10.908 -7.811 226 H ASP 50 H ASP 50 -10.568 -12.624 0.720 227 HA ASP 50 HA ASP 50 -10.947 -15.234 2.022 228 HB2 ASP 50 HB2 ASP 50 -10.137 -13.078 3.228 229 HB3 ASP 50 HB3 ASP 50 -11.804 -12.523 3.139 230 H ILE 51 H ILE 51 -12.644 -16.327 1.217 231 HA ILE 51 HA ILE 51 -15.051 -15.031 0.217 232 HB ILE 51 HB ILE 51 -14.190 -17.947 0.353 233 HG12 ILE 51 HG12 ILE 51 -13.011 -16.567 -1.328 234 HG13 ILE 51 HG13 ILE 51 -14.048 -17.750 -2.120 235 HG21 ILE 51 HG21 ILE 51 -16.632 -17.954 0.571 236 HG22 ILE 51 HG22 ILE 51 -16.171 -18.542 -1.025 237 HG23 ILE 51 HG23 ILE 51 -16.792 -16.900 -0.836 238 HD11 ILE 51 HD11 ILE 51 -14.664 -14.817 -1.752 239 HD12 ILE 51 HD12 ILE 51 -15.724 -16.003 -2.523 240 HD13 ILE 51 HD13 ILE 51 -14.162 -15.618 -3.240 241 H LYS 52 H LYS 52 -14.045 -16.752 3.103 242 HA LYS 52 HA LYS 52 -16.551 -17.388 4.231 243 HB2 LYS 52 HB2 LYS 52 -14.076 -17.983 4.974 244 HB3 LYS 52 HB3 LYS 52 -14.165 -16.504 5.909 245 HG2 LYS 52 HG2 LYS 52 -15.980 -18.926 6.239 246 HG3 LYS 52 HG3 LYS 52 -14.574 -18.569 7.230 247 HD2 LYS 52 HD2 LYS 52 -16.118 -17.647 8.658 248 HD3 LYS 52 HD3 LYS 52 -15.989 -16.254 7.585 249 HE2 LYS 52 HE2 LYS 52 -17.959 -17.151 6.285 250 HE3 LYS 52 HE3 LYS 52 -18.138 -18.408 7.514 251 HZ1 LYS 52 HZ1 LYS 52 -18.505 -16.697 9.152 252 HZ2 LYS 52 HZ2 LYS 52 -19.601 -16.516 7.880 253 HZ3 LYS 52 HZ3 LYS 52 -18.268 -15.481 8.000 254 H ASP 53 H ASP 53 -14.504 -14.476 4.509 255 HA ASP 53 HA ASP 53 -16.316 -12.911 6.062 256 HB2 ASP 53 HB2 ASP 53 -13.849 -12.459 5.957 257 HB3 ASP 53 HB3 ASP 53 -14.022 -11.987 4.270 258 H PHE 54 H PHE 54 -15.662 -13.247 2.596 259 HA PHE 54 HA PHE 54 -17.001 -11.089 1.495 260 HB2 PHE 54 HB2 PHE 54 -15.518 -12.637 0.248 261 HB3 PHE 54 HB3 PHE 54 -16.731 -13.901 0.355 262 HD1 PHE 54 HD1 PHE 54 -18.899 -13.655 -0.942 263 HD2 PHE 54 HD2 PHE 54 -15.618 -10.968 -1.481 264 HE1 PHE 54 HE1 PHE 54 -19.850 -12.917 -3.084 265 HE2 PHE 54 HE2 PHE 54 -16.582 -10.250 -3.622 266 HZ PHE 54 HZ PHE 54 -18.695 -11.213 -4.419 267 H GLN 55 H GLN 55 -18.317 -14.344 2.010 268 HA GLN 55 HA GLN 55 -20.923 -13.791 1.039 269 HB2 GLN 55 HB2 GLN 55 -21.520 -16.009 1.922 270 HB3 GLN 55 HB3 GLN 55 -20.009 -16.040 1.019 271 HG2 GLN 55 HG2 GLN 55 -18.773 -15.954 3.215 272 HG3 GLN 55 HG3 GLN 55 -20.331 -16.131 4.031 273 HE21 GLN 55 HE21 GLN 55 -17.909 -17.713 2.086 274 HE22 GLN 55 HE22 GLN 55 -18.491 -19.326 2.309 275 H THR 56 H THR 56 -19.470 -13.500 4.220 276 HA THR 56 HA THR 56 -21.834 -13.104 5.763 277 HB THR 56 HB THR 56 -19.021 -12.016 6.251 278 HG1 THR 56 HG1 THR 56 -19.567 -14.466 6.073 279 HG21 THR 56 HG21 THR 56 -21.294 -12.450 8.237 280 HG22 THR 56 HG22 THR 56 -20.676 -10.887 7.701 281 HG23 THR 56 HG23 THR 56 -19.649 -11.960 8.650 282 H GLN 57 H GLN 57 -19.746 -10.937 3.843 283 HA GLN 57 HA GLN 57 -21.175 -8.513 4.472 284 HB2 GLN 57 HB2 GLN 57 -19.330 -8.959 2.087 285 HB3 GLN 57 HB3 GLN 57 -19.745 -7.433 2.853 286 HG2 GLN 57 HG2 GLN 57 -17.944 -9.613 3.921 287 HG3 GLN 57 HG3 GLN 57 -17.487 -7.988 3.439 288 HE21 GLN 57 HE21 GLN 57 -17.048 -9.412 5.940 289 HE22 GLN 57 HE22 GLN 57 -17.723 -8.428 7.188 290 H SER 58 H SER 58 -21.498 -11.086 2.141 291 HA SER 58 HA SER 58 -23.233 -9.719 0.286 292 HB2 SER 58 HB2 SER 58 -22.843 -12.723 0.630 293 HB3 SER 58 HB3 SER 58 -23.514 -11.893 -0.777 294 HG SER 58 HG SER 58 -20.956 -11.159 0.067 295 H LEU 59 H LEU 59 -23.638 -11.288 3.323 296 HA LEU 59 HA LEU 59 -26.421 -11.943 3.106 297 HB2 LEU 59 HB2 LEU 59 -24.784 -13.062 4.639 298 HB3 LEU 59 HB3 LEU 59 -24.700 -11.603 5.599 299 HG LEU 59 HG LEU 59 -27.414 -12.894 5.238 300 HD11 LEU 59 HD11 LEU 59 -27.056 -14.454 7.094 301 HD12 LEU 59 HD12 LEU 59 -25.353 -13.993 7.177 302 HD13 LEU 59 HD13 LEU 59 -25.979 -14.815 5.745 303 HD21 LEU 59 HD21 LEU 59 -27.257 -10.775 6.497 304 HD22 LEU 59 HD22 LEU 59 -26.146 -11.530 7.641 305 HD23 LEU 59 HD23 LEU 59 -27.816 -12.094 7.526 306 H THR 60 H THR 60 -24.610 -9.074 3.806 307 HA THR 60 HA THR 60 -26.333 -7.571 5.411 308 HB THR 60 HB THR 60 -24.442 -6.528 3.254 309 HG1 THR 60 HG1 THR 60 -23.032 -7.512 4.502 310 HG21 THR 60 HG21 THR 60 -24.255 -4.521 4.703 311 HG22 THR 60 HG22 THR 60 -25.463 -5.192 5.799 312 HG23 THR 60 HG23 THR 60 -25.917 -4.754 4.151 313 H GLU 61 H GLU 61 -28.069 -6.252 5.039 314 HA GLU 61 HA GLU 61 -29.886 -6.635 2.975 315 HB2 GLU 61 HB2 GLU 61 -31.038 -4.577 3.893 316 HB3 GLU 61 HB3 GLU 61 -30.610 -5.769 5.117 317 HG2 GLU 61 HG2 GLU 61 -28.676 -4.438 5.806 318 HG3 GLU 61 HG3 GLU 61 -28.979 -3.274 4.516 319 H ASN 62 H ASN 62 -27.553 -3.978 3.376 320 HA ASN 62 HA ASN 62 -27.927 -3.117 0.570 321 HB2 ASN 62 HB2 ASN 62 -27.075 -1.428 2.973 322 HB3 ASN 62 HB3 ASN 62 -27.137 -0.853 1.309 323 HD21 ASN 62 HD21 ASN 62 -28.534 0.207 3.578 324 HD22 ASN 62 HD22 ASN 62 -30.221 0.080 3.234 325 H SER 63 H SER 63 -26.296 -3.864 -0.544 326 HA SER 63 HA SER 63 -23.558 -3.319 0.049 327 HB2 SER 63 HB2 SER 63 -23.832 -5.399 1.436 328 HB3 SER 63 HB3 SER 63 -24.419 -6.277 0.029 329 HG SER 63 HG SER 63 -21.965 -6.128 0.791 330 H ILE 64 H ILE 64 -22.243 -3.738 -1.839 331 HA ILE 64 HA ILE 64 -23.474 -3.894 -4.404 332 HB ILE 64 HB ILE 64 -21.158 -4.417 -5.274 333 HG12 ILE 64 HG12 ILE 64 -20.277 -4.201 -2.348 334 HG13 ILE 64 HG13 ILE 64 -20.406 -5.719 -3.226 335 HG21 ILE 64 HG21 ILE 64 -21.876 -2.084 -5.054 336 HG22 ILE 64 HG22 ILE 64 -20.152 -2.226 -4.706 337 HG23 ILE 64 HG23 ILE 64 -21.307 -2.039 -3.382 338 HD11 ILE 64 HD11 ILE 64 -18.138 -5.006 -3.110 339 HD12 ILE 64 HD12 ILE 64 -18.537 -3.451 -3.841 340 HD13 ILE 64 HD13 ILE 64 -18.685 -4.939 -4.783 341 H LEU 65 H LEU 65 -22.513 -6.234 -2.056 342 HA LEU 65 HA LEU 65 -22.657 -8.559 -3.812 343 HB2 LEU 65 HB2 LEU 65 -22.184 -8.388 -0.811 344 HB3 LEU 65 HB3 LEU 65 -21.922 -9.796 -1.836 345 HG LEU 65 HG LEU 65 -20.325 -7.210 -1.845 346 HD11 LEU 65 HD11 LEU 65 -19.785 -8.647 0.044 347 HD12 LEU 65 HD12 LEU 65 -18.447 -8.634 -1.103 348 HD13 LEU 65 HD13 LEU 65 -19.529 -10.030 -1.028 349 HD21 LEU 65 HD21 LEU 65 -18.899 -8.279 -3.571 350 HD22 LEU 65 HD22 LEU 65 -20.534 -7.977 -4.141 351 HD23 LEU 65 HD23 LEU 65 -20.049 -9.613 -3.688 352 H ALA 66 H ALA 66 -24.888 -6.664 -2.191 353 HA ALA 66 HA ALA 66 -26.696 -8.641 -1.169 354 HB1 ALA 66 HB1 ALA 66 -26.772 -6.305 -0.383 355 HB2 ALA 66 HB2 ALA 66 -28.332 -6.804 -1.039 356 HB3 ALA 66 HB3 ALA 66 -27.263 -5.770 -1.992 357 H GLN 67 H GLN 67 -26.229 -7.060 -4.299 358 HA GLN 67 HA GLN 67 -28.469 -8.328 -5.609 359 HB2 GLN 67 HB2 GLN 67 -27.568 -7.421 -7.681 360 HB3 GLN 67 HB3 GLN 67 -27.461 -6.192 -6.425 361 HG2 GLN 67 HG2 GLN 67 -25.032 -6.877 -6.127 362 HG3 GLN 67 HG3 GLN 67 -25.207 -7.857 -7.579 363 HE21 GLN 67 HE21 GLN 67 -25.021 -4.631 -6.297 364 HE22 GLN 67 HE22 GLN 67 -24.786 -3.821 -7.804 365 H PHE 68 H PHE 68 -25.234 -9.257 -4.802 366 HA PHE 68 HA PHE 68 -25.147 -11.545 -6.639 367 HB2 PHE 68 HB2 PHE 68 -23.071 -10.386 -4.731 368 HB3 PHE 68 HB3 PHE 68 -22.807 -11.800 -5.734 369 HD1 PHE 68 HD1 PHE 68 -23.807 -11.123 -8.353 370 HD2 PHE 68 HD2 PHE 68 -21.744 -8.624 -5.560 371 HE1 PHE 68 HE1 PHE 68 -22.968 -9.732 -10.200 372 HE2 PHE 68 HE2 PHE 68 -20.914 -7.235 -7.419 373 HZ PHE 68 HZ PHE 68 -21.528 -7.790 -9.742 374 H ALA 69 H ALA 69 -26.662 -11.074 -3.834 375 HA ALA 69 HA ALA 69 -25.678 -13.087 -2.067 376 HB1 ALA 69 HB1 ALA 69 -26.973 -11.145 -1.295 377 HB2 ALA 69 HB2 ALA 69 -27.726 -12.655 -0.776 378 HB3 ALA 69 HB3 ALA 69 -28.400 -11.751 -2.137 379 H GLY 70 H GLY 70 -27.802 -13.208 -4.840 380 HA2 GLY 70 HA2 GLY 70 -28.913 -15.851 -4.181 381 HA3 GLY 70 HA3 GLY 70 -29.281 -14.870 -5.592 382 H GLU 71 H GLU 71 -25.938 -15.072 -5.018 383 HA GLU 71 HA GLU 71 -25.553 -17.262 -6.982 384 HB2 GLU 71 HB2 GLU 71 -25.261 -14.996 -8.034 385 HB3 GLU 71 HB3 GLU 71 -24.037 -14.595 -6.845 386 HG2 GLU 71 HG2 GLU 71 -23.057 -15.172 -9.030 387 HG3 GLU 71 HG3 GLU 71 -22.526 -16.276 -7.758 388 H ASP 72 H ASP 72 -23.560 -18.404 -6.782 389 HA ASP 72 HA ASP 72 -22.471 -19.007 -4.292 390 HB2 ASP 72 HB2 ASP 72 -22.211 -20.445 -6.297 391 HB3 ASP 72 HB3 ASP 72 -21.200 -19.231 -7.064 392 HA PRO 73 HA PRO 73 -20.319 -15.174 -3.406 393 HB2 PRO 73 HB2 PRO 73 -18.494 -16.083 -1.499 394 HB3 PRO 73 HB3 PRO 73 -20.201 -15.747 -1.171 395 HG2 PRO 73 HG2 PRO 73 -18.868 -18.383 -1.803 396 HG3 PRO 73 HG3 PRO 73 -20.057 -18.007 -0.532 397 HD2 PRO 73 HD2 PRO 73 -20.825 -19.204 -2.797 398 HD3 PRO 73 HD3 PRO 73 -21.852 -17.955 -2.058 399 H VAL 74 H VAL 74 -18.389 -18.008 -4.340 400 HA VAL 74 HA VAL 74 -15.945 -16.534 -4.799 401 HB VAL 74 HB VAL 74 -16.667 -19.305 -5.853 402 HG11 VAL 74 HG11 VAL 74 -13.960 -18.027 -5.317 403 HG12 VAL 74 HG12 VAL 74 -14.668 -18.348 -6.902 404 HG13 VAL 74 HG13 VAL 74 -14.221 -19.691 -5.850 405 HG21 VAL 74 HG21 VAL 74 -15.607 -20.239 -3.818 406 HG22 VAL 74 HG22 VAL 74 -17.015 -19.257 -3.413 407 HG23 VAL 74 HG23 VAL 74 -15.392 -18.609 -3.175 408 H VAL 75 H VAL 75 -18.620 -17.739 -6.807 409 HA VAL 75 HA VAL 75 -17.615 -16.855 -9.348 410 HB VAL 75 HB VAL 75 -20.507 -17.391 -8.510 411 HG11 VAL 75 HG11 VAL 75 -20.972 -17.727 -10.931 412 HG12 VAL 75 HG12 VAL 75 -19.316 -17.243 -11.314 413 HG13 VAL 75 HG13 VAL 75 -20.431 -16.080 -10.594 414 HG21 VAL 75 HG21 VAL 75 -18.491 -19.276 -9.800 415 HG22 VAL 75 HG22 VAL 75 -20.189 -19.647 -9.488 416 HG23 VAL 75 HG23 VAL 75 -19.087 -19.364 -8.139 417 H ALA 76 H ALA 76 -19.692 -15.477 -6.908 418 HA ALA 76 HA ALA 76 -20.554 -13.100 -8.136 419 HB1 ALA 76 HB1 ALA 76 -21.671 -14.012 -6.170 420 HB2 ALA 76 HB2 ALA 76 -21.085 -12.385 -5.811 421 HB3 ALA 76 HB3 ALA 76 -20.211 -13.789 -5.202 422 H LEU 77 H LEU 77 -17.715 -13.938 -6.249 423 HA LEU 77 HA LEU 77 -16.545 -11.430 -5.851 424 HB2 LEU 77 HB2 LEU 77 -15.802 -13.441 -4.679 425 HB3 LEU 77 HB3 LEU 77 -15.296 -14.171 -6.192 426 HG LEU 77 HG LEU 77 -13.529 -12.384 -6.412 427 HD11 LEU 77 HD11 LEU 77 -14.292 -11.625 -3.579 428 HD12 LEU 77 HD12 LEU 77 -14.511 -10.628 -5.020 429 HD13 LEU 77 HD13 LEU 77 -12.888 -11.044 -4.478 430 HD21 LEU 77 HD21 LEU 77 -11.999 -13.407 -4.857 431 HD22 LEU 77 HD22 LEU 77 -13.062 -14.646 -5.500 432 HD23 LEU 77 HD23 LEU 77 -13.326 -14.024 -3.876 433 H GLU 78 H GLU 78 -16.260 -13.743 -8.545 434 HA GLU 78 HA GLU 78 -14.256 -12.403 -10.052 435 HB2 GLU 78 HB2 GLU 78 -16.417 -14.320 -11.035 436 HB3 GLU 78 HB3 GLU 78 -14.946 -13.884 -11.915 437 HG2 GLU 78 HG2 GLU 78 -13.577 -14.928 -10.177 438 HG3 GLU 78 HG3 GLU 78 -15.022 -15.315 -9.241 439 H ALA 79 H ALA 79 -17.800 -12.309 -10.186 440 HA ALA 79 HA ALA 79 -18.144 -10.526 -12.358 441 HB1 ALA 79 HB1 ALA 79 -20.412 -10.177 -11.440 442 HB2 ALA 79 HB2 ALA 79 -19.923 -10.965 -9.937 443 HB3 ALA 79 HB3 ALA 79 -19.976 -11.891 -11.435 444 H ALA 80 H ALA 80 -17.650 -10.037 -8.912 445 HA ALA 80 HA ALA 80 -17.978 -7.184 -8.903 446 HB1 ALA 80 HB1 ALA 80 -16.791 -9.034 -6.812 447 HB2 ALA 80 HB2 ALA 80 -18.490 -8.569 -6.941 448 HB3 ALA 80 HB3 ALA 80 -17.269 -7.353 -6.560 449 H LEU 81 H LEU 81 -15.267 -9.373 -9.378 450 HA LEU 81 HA LEU 81 -13.148 -7.452 -9.114 451 HB2 LEU 81 HB2 LEU 81 -13.293 -10.166 -10.484 452 HB3 LEU 81 HB3 LEU 81 -11.826 -9.196 -10.487 453 HG LEU 81 HG LEU 81 -13.189 -10.259 -7.973 454 HD11 LEU 81 HD11 LEU 81 -11.329 -11.853 -7.797 455 HD12 LEU 81 HD12 LEU 81 -10.682 -11.294 -9.343 456 HD13 LEU 81 HD13 LEU 81 -12.246 -12.110 -9.282 457 HD21 LEU 81 HD21 LEU 81 -11.154 -9.531 -6.811 458 HD22 LEU 81 HD22 LEU 81 -11.967 -8.171 -7.575 459 HD23 LEU 81 HD23 LEU 81 -10.515 -8.854 -8.312 460 H GLN 82 H GLN 82 -15.151 -8.660 -11.731 461 HA GLN 82 HA GLN 82 -13.779 -7.479 -13.909 462 HB2 GLN 82 HB2 GLN 82 -15.303 -9.432 -14.146 463 HB3 GLN 82 HB3 GLN 82 -16.670 -8.416 -13.700 464 HG2 GLN 82 HG2 GLN 82 -16.342 -7.061 -15.739 465 HG3 GLN 82 HG3 GLN 82 -14.955 -8.057 -16.183 466 HE21 GLN 82 HE21 GLN 82 -17.452 -7.562 -17.631 467 HE22 GLN 82 HE22 GLN 82 -18.153 -9.113 -17.919 468 H PHE 83 H PHE 83 -16.617 -6.449 -11.983 469 HA PHE 83 HA PHE 83 -16.959 -4.044 -13.587 470 HB2 PHE 83 HB2 PHE 83 -18.893 -5.424 -12.621 471 HB3 PHE 83 HB3 PHE 83 -18.470 -4.760 -11.044 472 HD1 PHE 83 HD1 PHE 83 -19.075 -3.543 -14.552 473 HD2 PHE 83 HD2 PHE 83 -19.700 -2.849 -10.377 474 HE1 PHE 83 HE1 PHE 83 -20.414 -1.552 -15.080 475 HE2 PHE 83 HE2 PHE 83 -21.040 -0.857 -10.924 476 HZ PHE 83 HZ PHE 83 -21.400 -0.211 -13.269 477 H GLU 84 H GLU 84 -16.340 -2.035 -13.046 478 HA GLU 84 HA GLU 84 -14.086 -1.748 -11.360 479 HB2 GLU 84 HB2 GLU 84 -14.123 0.631 -12.115 480 HB3 GLU 84 HB3 GLU 84 -14.234 -0.537 -13.435 481 HG2 GLU 84 HG2 GLU 84 -16.751 -0.160 -13.416 482 HG3 GLU 84 HG3 GLU 84 -16.475 1.166 -12.291 483 H ASP 85 H ASP 85 -17.446 -0.657 -10.983 484 HA ASP 85 HA ASP 85 -17.005 1.052 -8.748 485 HB2 ASP 85 HB2 ASP 85 -18.956 1.326 -10.214 486 HB3 ASP 85 HB3 ASP 85 -19.555 -0.259 -9.760 487 H THR 86 H THR 86 -17.492 -2.373 -9.063 488 HA THR 86 HA THR 86 -18.168 -2.763 -6.241 489 HB THR 86 HB THR 86 -18.309 -5.215 -6.960 490 HG1 THR 86 HG1 THR 86 -16.948 -4.849 -8.873 491 HG21 THR 86 HG21 THR 86 -20.348 -3.804 -6.850 492 HG22 THR 86 HG22 THR 86 -20.444 -4.963 -8.177 493 HG23 THR 86 HG23 THR 86 -20.069 -3.270 -8.510 494 H ARG 87 H ARG 87 -15.369 -3.151 -8.398 495 HA ARG 87 HA ARG 87 -13.972 -5.121 -6.875 496 HB2 ARG 87 HB2 ARG 87 -12.080 -4.766 -8.344 497 HB3 ARG 87 HB3 ARG 87 -13.561 -4.727 -9.301 498 HG2 ARG 87 HG2 ARG 87 -13.471 -2.258 -9.332 499 HG3 ARG 87 HG3 ARG 87 -11.988 -2.296 -8.377 500 HD2 ARG 87 HD2 ARG 87 -10.825 -3.456 -10.209 501 HD3 ARG 87 HD3 ARG 87 -12.320 -3.475 -11.158 502 HE ARG 87 HE ARG 87 -11.696 -0.823 -10.390 503 HH11 ARG 87 HH11 ARG 87 -10.656 -3.264 -12.691 504 HH12 ARG 87 HH12 ARG 87 -9.976 -2.104 -13.785 505 HH21 ARG 87 HH21 ARG 87 -10.818 0.682 -11.832 506 HH22 ARG 87 HH22 ARG 87 -10.083 0.130 -13.303 507 H GLU 88 H GLU 88 -14.300 -1.747 -6.379 508 HA GLU 88 HA GLU 88 -11.989 -1.063 -4.947 509 HB2 GLU 88 HB2 GLU 88 -13.492 0.583 -3.740 510 HB3 GLU 88 HB3 GLU 88 -13.594 0.655 -5.499 511 HG2 GLU 88 HG2 GLU 88 -15.709 -0.451 -5.531 512 HG3 GLU 88 HG3 GLU 88 -15.575 -0.933 -3.844 513 H SER 89 H SER 89 -14.872 -2.847 -3.917 514 HA SER 89 HA SER 89 -14.113 -3.085 -1.145 515 HB2 SER 89 HB2 SER 89 -16.476 -3.120 -1.836 516 HB3 SER 89 HB3 SER 89 -16.200 -4.581 -2.782 517 HG SER 89 HG SER 89 -17.104 -4.765 -0.556 518 H MET 90 H MET 90 -13.833 -5.077 -4.066 519 HA MET 90 HA MET 90 -12.715 -7.418 -2.871 520 HB2 MET 90 HB2 MET 90 -12.552 -6.361 -5.715 521 HB3 MET 90 HB3 MET 90 -11.941 -7.941 -5.231 522 HG2 MET 90 HG2 MET 90 -14.140 -8.125 -6.270 523 HG3 MET 90 HG3 MET 90 -14.188 -8.637 -4.584 524 HE1 MET 90 HE1 MET 90 -17.293 -6.908 -3.523 525 HE2 MET 90 HE2 MET 90 -15.862 -7.721 -2.887 526 HE3 MET 90 HE3 MET 90 -16.758 -8.435 -4.229 527 H HIS 91 H HIS 91 -11.420 -4.352 -3.728 528 HA HIS 91 HA HIS 91 -8.637 -4.916 -3.697 529 HB2 HIS 91 HB2 HIS 91 -9.731 -2.826 -4.608 530 HB3 HIS 91 HB3 HIS 91 -10.062 -2.321 -2.957 531 HD1 HIS 91 HD1 HIS 91 -8.050 -1.440 -1.564 532 HD2 HIS 91 HD2 HIS 91 -7.096 -2.485 -5.468 533 HE1 HIS 91 HE1 HIS 91 -5.763 -0.499 -1.964 534 HE2 HIS 91 HE2 HIS 91 -5.254 -1.049 -4.360 535 H ALA 92 H ALA 92 -11.047 -4.591 -1.199 536 HA ALA 92 HA ALA 92 -9.096 -4.587 0.991 537 HB1 ALA 92 HB1 ALA 92 -11.053 -4.479 2.472 538 HB2 ALA 92 HB2 ALA 92 -12.135 -4.674 1.087 539 HB3 ALA 92 HB3 ALA 92 -11.139 -3.226 1.234 540 H PHE 93 H PHE 93 -11.196 -6.846 -0.761 541 HA PHE 93 HA PHE 93 -11.082 -8.983 1.184 542 HB2 PHE 93 HB2 PHE 93 -12.038 -8.889 -1.706 543 HB3 PHE 93 HB3 PHE 93 -11.985 -10.398 -0.803 544 HD1 PHE 93 HD1 PHE 93 -13.193 -10.330 1.562 545 HD2 PHE 93 HD2 PHE 93 -14.069 -7.669 -1.660 546 HE1 PHE 93 HE1 PHE 93 -15.401 -9.862 2.530 547 HE2 PHE 93 HE2 PHE 93 -16.275 -7.211 -0.679 548 HZ PHE 93 HZ PHE 93 -16.942 -8.305 1.417 549 H CYS 94 H CYS 94 -9.017 -7.914 -1.408 550 HA CYS 94 HA CYS 94 -7.678 -10.379 -1.922 551 HB2 CYS 94 HB2 CYS 94 -6.002 -8.969 -3.101 552 HB3 CYS 94 HB3 CYS 94 -7.645 -8.579 -3.580 553 HG CYS 94 HG CYS 94 -5.617 -6.738 -1.541 554 H VAL 95 H VAL 95 -6.880 -11.366 -0.171 555 HA VAL 95 HA VAL 95 -5.529 -10.188 2.030 556 HB VAL 95 HB VAL 95 -5.408 -13.079 1.042 557 HG11 VAL 95 HG11 VAL 95 -4.772 -11.949 3.801 558 HG12 VAL 95 HG12 VAL 95 -3.609 -12.614 2.654 559 HG13 VAL 95 HG13 VAL 95 -4.818 -13.664 3.384 560 HG21 VAL 95 HG21 VAL 95 -7.342 -11.822 3.041 561 HG22 VAL 95 HG22 VAL 95 -7.250 -13.540 2.644 562 HG23 VAL 95 HG23 VAL 95 -7.745 -12.377 1.412 563 H GLY 96 H GLY 96 -4.481 -11.444 -1.079 564 HA2 GLY 96 HA2 GLY 96 -2.196 -9.887 -1.282 565 HA3 GLY 96 HA3 GLY 96 -1.675 -11.442 -0.626 566 H GLN 97 H GLN 97 -0.458 -11.580 -2.608 567 HA GLN 97 HA GLN 97 -1.980 -12.423 -4.991 568 HB2 GLN 97 HB2 GLN 97 -0.188 -10.715 -5.302 569 HB3 GLN 97 HB3 GLN 97 0.990 -11.836 -4.634 570 HG2 GLN 97 HG2 GLN 97 0.542 -13.377 -6.549 571 HG3 GLN 97 HG3 GLN 97 -0.559 -12.176 -7.227 572 HE21 GLN 97 HE21 GLN 97 1.861 -13.292 -8.387 573 HE22 GLN 97 HE22 GLN 97 2.918 -11.961 -8.697 574 H TYR 98 H TYR 98 -2.009 -14.559 -5.524 575 HA TYR 98 HA TYR 98 -0.933 -16.530 -3.742 576 HB2 TYR 98 HB2 TYR 98 -3.097 -16.910 -4.837 577 HB3 TYR 98 HB3 TYR 98 -2.339 -16.848 -6.422 578 HD1 TYR 98 HD1 TYR 98 -2.182 -18.778 -3.192 579 HD2 TYR 98 HD2 TYR 98 -1.645 -18.908 -7.433 580 HE1 TYR 98 HE1 TYR 98 -1.777 -21.196 -3.074 581 HE2 TYR 98 HE2 TYR 98 -1.253 -21.331 -7.301 582 HH TYR 98 HH TYR 98 -1.948 -23.170 -4.571 583 H LEU 99 H LEU 99 0.944 -17.552 -3.893 584 HA LEU 99 HA LEU 99 2.456 -17.631 -6.441 585 HB2 LEU 99 HB2 LEU 99 3.583 -16.199 -4.771 586 HB3 LEU 99 HB3 LEU 99 3.496 -17.486 -3.580 587 HG LEU 99 HG LEU 99 5.038 -18.873 -4.991 588 HD11 LEU 99 HD11 LEU 99 5.309 -16.394 -6.730 589 HD12 LEU 99 HD12 LEU 99 4.561 -17.922 -7.205 590 HD13 LEU 99 HD13 LEU 99 6.284 -17.863 -6.847 591 HD21 LEU 99 HD21 LEU 99 6.153 -16.159 -4.221 592 HD22 LEU 99 HD22 LEU 99 7.085 -17.639 -4.463 593 HD23 LEU 99 HD23 LEU 99 5.929 -17.537 -3.138 594 H GLU 100 H GLU 100 2.898 -19.676 -7.144 595 HA GLU 100 HA GLU 100 2.202 -21.994 -5.537 596 HB2 GLU 100 HB2 GLU 100 3.461 -21.805 -8.290 597 HB3 GLU 100 HB3 GLU 100 2.844 -23.269 -7.560 598 HG2 GLU 100 HG2 GLU 100 0.584 -22.481 -7.691 599 HG3 GLU 100 HG3 GLU 100 1.110 -20.859 -8.133 600 HA PRO 101 HA PRO 101 6.393 -22.499 -3.836 601 HB2 PRO 101 HB2 PRO 101 6.281 -25.242 -3.363 602 HB3 PRO 101 HB3 PRO 101 5.570 -24.016 -2.301 603 HG2 PRO 101 HG2 PRO 101 4.235 -25.634 -4.485 604 HG3 PRO 101 HG3 PRO 101 3.681 -25.331 -2.821 605 HD2 PRO 101 HD2 PRO 101 2.662 -23.918 -4.837 606 HD3 PRO 101 HD3 PRO 101 3.058 -23.103 -3.301 607 H ASP 102 H ASP 102 5.155 -24.289 -6.559 608 HA ASP 102 HA ASP 102 7.718 -25.279 -7.510 609 HB2 ASP 102 HB2 ASP 102 5.746 -26.659 -7.885 610 HB3 ASP 102 HB3 ASP 102 4.888 -25.315 -8.632 611 H GLN 103 H GLN 103 5.491 -22.607 -8.165 612 HA GLN 103 HA GLN 103 6.391 -21.831 -10.737 613 HB2 GLN 103 HB2 GLN 103 4.190 -21.151 -9.789 614 HB3 GLN 103 HB3 GLN 103 5.002 -20.137 -8.607 615 HG2 GLN 103 HG2 GLN 103 4.100 -18.783 -10.400 616 HG3 GLN 103 HG3 GLN 103 5.863 -18.707 -10.425 617 HE21 GLN 103 HE21 GLN 103 3.798 -21.331 -11.701 618 HE22 GLN 103 HE22 GLN 103 4.268 -21.123 -13.352 619 H GLU 104 H GLU 104 7.256 -20.721 -7.481 620 HA GLU 104 HA GLU 104 9.015 -18.622 -8.168 621 HB2 GLU 104 HB2 GLU 104 9.887 -18.887 -5.840 622 HB3 GLU 104 HB3 GLU 104 8.126 -18.838 -5.916 623 HG2 GLU 104 HG2 GLU 104 8.088 -21.335 -5.755 624 HG3 GLU 104 HG3 GLU 104 9.842 -21.319 -5.559 625 H GLY 105 H GLY 105 9.547 -22.115 -7.854 626 HA2 GLY 105 HA2 GLY 105 12.439 -21.892 -8.295 627 HA3 GLY 105 HA3 GLY 105 11.534 -23.354 -7.923 628 H VAL 106 H VAL 106 12.098 -20.951 -10.479 629 HA VAL 106 HA VAL 106 12.147 -23.097 -12.469 630 HB VAL 106 HB VAL 106 9.797 -22.226 -12.555 631 HG11 VAL 106 HG11 VAL 106 11.019 -19.553 -13.346 632 HG12 VAL 106 HG12 VAL 106 10.162 -19.899 -11.844 633 HG13 VAL 106 HG13 VAL 106 9.296 -19.943 -13.381 634 HG21 VAL 106 HG21 VAL 106 10.782 -23.166 -14.614 635 HG22 VAL 106 HG22 VAL 106 11.424 -21.582 -15.055 636 HG23 VAL 106 HG23 VAL 106 9.680 -21.845 -15.017 637 H THR 107 H THR 107 13.702 -22.813 -13.958 638 HA THR 107 HA THR 107 14.898 -20.141 -14.391 639 HB THR 107 HB THR 107 16.527 -21.469 -13.127 640 HG1 THR 107 HG1 THR 107 17.038 -20.190 -15.221 641 HG21 THR 107 HG21 THR 107 17.545 -23.536 -14.027 642 HG22 THR 107 HG22 THR 107 16.381 -23.539 -15.351 643 HG23 THR 107 HG23 THR 107 15.825 -23.767 -13.693 644 H ILE 108 H ILE 108 14.959 -19.541 -16.490 645 HA ILE 108 HA ILE 108 13.967 -21.387 -18.552 646 HB ILE 108 HB ILE 108 14.432 -18.367 -18.674 647 HG12 ILE 108 HG12 ILE 108 11.807 -19.907 -18.326 648 HG13 ILE 108 HG13 ILE 108 12.627 -19.007 -17.054 649 HG21 ILE 108 HG21 ILE 108 13.075 -18.432 -20.752 650 HG22 ILE 108 HG22 ILE 108 12.993 -20.192 -20.646 651 HG23 ILE 108 HG23 ILE 108 14.546 -19.394 -20.914 652 HD11 ILE 108 HD11 ILE 108 10.734 -17.775 -17.940 653 HD12 ILE 108 HD12 ILE 108 11.419 -17.830 -19.564 654 HD13 ILE 108 HD13 ILE 108 12.237 -16.922 -18.289 655 HA PRO 109 HA PRO 109 18.349 -21.851 -19.971 656 HB2 PRO 109 HB2 PRO 109 16.947 -23.384 -22.142 657 HB3 PRO 109 HB3 PRO 109 18.325 -23.866 -21.144 658 HG2 PRO 109 HG2 PRO 109 15.907 -24.914 -20.697 659 HG3 PRO 109 HG3 PRO 109 16.966 -24.487 -19.335 660 HD2 PRO 109 HD2 PRO 109 14.603 -22.967 -20.446 661 HD3 PRO 109 HD3 PRO 109 15.045 -23.273 -18.749 662 H ASP 110 H ASP 110 19.481 -21.063 -21.849 663 HA ASP 110 HA ASP 110 18.502 -18.579 -22.752 664 HB2 ASP 110 HB2 ASP 110 20.581 -18.431 -24.101 665 HB3 ASP 110 HB3 ASP 110 20.902 -18.943 -22.453 666 H LEU 111 H LEU 111 16.951 -18.288 -24.180 667 HA LEU 111 HA LEU 111 17.133 -19.061 -26.893 668 HB2 LEU 111 HB2 LEU 111 16.091 -21.166 -25.632 669 HB3 LEU 111 HB3 LEU 111 14.627 -20.210 -25.593 670 HG LEU 111 HG LEU 111 14.664 -21.879 -27.444 671 HD11 LEU 111 HD11 LEU 111 14.617 -19.035 -28.483 672 HD12 LEU 111 HD12 LEU 111 13.274 -19.910 -27.746 673 HD13 LEU 111 HD13 LEU 111 13.930 -20.453 -29.288 674 HD21 LEU 111 HD21 LEU 111 17.075 -21.902 -27.880 675 HD22 LEU 111 HD22 LEU 111 16.977 -20.287 -28.585 676 HD23 LEU 111 HD23 LEU 111 16.159 -21.644 -29.363 677 H GLY 112 H GLY 112 16.839 -16.986 -27.456 678 HA2 GLY 112 HA2 GLY 112 14.592 -15.370 -26.485 679 HA3 GLY 112 HA3 GLY 112 15.899 -14.848 -27.540 Start of MODEL 8 1 H GLU 21 H GLU 21 2.258 -1.800 -4.227 2 HA GLU 21 HA GLU 21 4.904 -1.101 -3.098 3 HB2 GLU 21 HB2 GLU 21 2.253 -1.564 -1.647 4 HB3 GLU 21 HB3 GLU 21 3.766 -1.013 -0.932 5 HG2 GLU 21 HG2 GLU 21 1.919 0.530 -2.787 6 HG3 GLU 21 HG3 GLU 21 2.266 0.863 -1.090 7 H LYS 22 H LYS 22 4.954 -2.784 -0.979 8 HA LYS 22 HA LYS 22 5.356 -5.396 -2.032 9 HB2 LYS 22 HB2 LYS 22 5.405 -4.244 0.777 10 HB3 LYS 22 HB3 LYS 22 5.569 -5.980 0.524 11 HG2 LYS 22 HG2 LYS 22 7.402 -3.848 -0.634 12 HG3 LYS 22 HG3 LYS 22 7.755 -4.873 0.767 13 HD2 LYS 22 HD2 LYS 22 7.665 -6.883 -0.647 14 HD3 LYS 22 HD3 LYS 22 7.225 -5.909 -2.055 15 HE2 LYS 22 HE2 LYS 22 9.395 -4.767 -1.937 16 HE3 LYS 22 HE3 LYS 22 9.835 -5.727 -0.524 17 HZ1 LYS 22 HZ1 LYS 22 10.801 -6.617 -2.540 18 HZ2 LYS 22 HZ2 LYS 22 9.273 -6.794 -3.239 19 HZ3 LYS 22 HZ3 LYS 22 9.694 -7.712 -1.884 20 H VAL 23 H VAL 23 4.153 -7.185 -1.942 21 HA VAL 23 HA VAL 23 1.411 -7.049 -0.798 22 HB VAL 23 HB VAL 23 1.345 -6.994 -3.288 23 HG11 VAL 23 HG11 VAL 23 2.711 -9.713 -3.228 24 HG12 VAL 23 HG12 VAL 23 3.408 -8.211 -3.833 25 HG13 VAL 23 HG13 VAL 23 2.031 -8.936 -4.664 26 HG21 VAL 23 HG21 VAL 23 -0.287 -8.830 -3.624 27 HG22 VAL 23 HG22 VAL 23 -0.536 -8.018 -2.078 28 HG23 VAL 23 HG23 VAL 23 0.262 -9.591 -2.127 29 H THR 24 H THR 24 0.736 -8.806 0.386 30 HA THR 24 HA THR 24 2.694 -10.593 1.459 31 HB THR 24 HB THR 24 0.621 -11.613 2.624 32 HG1 THR 24 HG1 THR 24 -1.296 -10.939 2.033 33 HG21 THR 24 HG21 THR 24 0.296 -9.694 4.131 34 HG22 THR 24 HG22 THR 24 1.047 -8.618 2.951 35 HG23 THR 24 HG23 THR 24 2.005 -9.881 3.731 36 H LEU 25 H LEU 25 3.489 -12.149 0.199 37 HA LEU 25 HA LEU 25 1.941 -13.545 -1.810 38 HB2 LEU 25 HB2 LEU 25 4.809 -13.893 -0.847 39 HB3 LEU 25 HB3 LEU 25 4.090 -14.860 -2.130 40 HG LEU 25 HG LEU 25 4.600 -11.856 -2.198 41 HD11 LEU 25 HD11 LEU 25 6.179 -12.360 -4.005 42 HD12 LEU 25 HD12 LEU 25 5.869 -14.088 -3.814 43 HD13 LEU 25 HD13 LEU 25 6.633 -13.177 -2.510 44 HD21 LEU 25 HD21 LEU 25 3.290 -13.582 -4.335 45 HD22 LEU 25 HD22 LEU 25 3.775 -11.894 -4.526 46 HD23 LEU 25 HD23 LEU 25 2.510 -12.316 -3.380 47 H VAL 26 H VAL 26 0.709 -15.212 -1.344 48 HA VAL 26 HA VAL 26 0.813 -16.504 1.268 49 HB VAL 26 HB VAL 26 -1.279 -16.676 -0.959 50 HG11 VAL 26 HG11 VAL 26 -1.433 -17.729 1.893 51 HG12 VAL 26 HG12 VAL 26 -1.343 -18.701 0.422 52 HG13 VAL 26 HG13 VAL 26 -2.767 -17.709 0.735 53 HG21 VAL 26 HG21 VAL 26 -2.678 -15.204 0.463 54 HG22 VAL 26 HG22 VAL 26 -1.177 -14.405 -0.011 55 HG23 VAL 26 HG23 VAL 26 -1.354 -15.054 1.623 56 H ARG 27 H ARG 27 1.688 -18.425 1.506 57 HA ARG 27 HA ARG 27 2.888 -19.957 -0.589 58 HB2 ARG 27 HB2 ARG 27 2.221 -20.859 2.256 59 HB3 ARG 27 HB3 ARG 27 3.434 -21.562 1.190 60 HG2 ARG 27 HG2 ARG 27 4.855 -19.622 1.399 61 HG3 ARG 27 HG3 ARG 27 3.587 -18.711 2.226 62 HD2 ARG 27 HD2 ARG 27 5.023 -21.166 3.310 63 HD3 ARG 27 HD3 ARG 27 5.282 -19.496 3.820 64 HE ARG 27 HE ARG 27 2.705 -19.698 4.351 65 HH11 ARG 27 HH11 ARG 27 5.261 -21.993 5.118 66 HH12 ARG 27 HH12 ARG 27 4.386 -22.691 6.442 67 HH21 ARG 27 HH21 ARG 27 1.577 -20.621 6.098 68 HH22 ARG 27 HH22 ARG 27 2.305 -21.915 7.000 69 H ILE 28 H ILE 28 2.205 -22.094 -1.333 70 HA ILE 28 HA ILE 28 -0.543 -22.389 -1.849 71 HB ILE 28 HB ILE 28 1.153 -23.411 -3.302 72 HG12 ILE 28 HG12 ILE 28 -0.709 -25.561 -2.171 73 HG13 ILE 28 HG13 ILE 28 -1.206 -24.302 -3.296 74 HG21 ILE 28 HG21 ILE 28 1.670 -25.413 -1.071 75 HG22 ILE 28 HG22 ILE 28 2.786 -24.169 -1.638 76 HG23 ILE 28 HG23 ILE 28 2.334 -25.495 -2.707 77 HD11 ILE 28 HD11 ILE 28 -0.857 -26.406 -4.433 78 HD12 ILE 28 HD12 ILE 28 0.807 -26.476 -3.858 79 HD13 ILE 28 HD13 ILE 28 0.315 -25.208 -4.983 80 H ALA 29 H ALA 29 1.536 -23.970 0.564 81 HA ALA 29 HA ALA 29 -0.452 -25.696 1.674 82 HB1 ALA 29 HB1 ALA 29 1.184 -26.085 3.475 83 HB2 ALA 29 HB2 ALA 29 2.160 -24.733 2.891 84 HB3 ALA 29 HB3 ALA 29 1.959 -26.171 1.889 85 H ASP 30 H ASP 30 0.614 -22.410 2.306 86 HA ASP 30 HA ASP 30 -0.757 -21.994 4.777 87 HB2 ASP 30 HB2 ASP 30 1.122 -20.534 3.901 88 HB3 ASP 30 HB3 ASP 30 0.006 -19.885 2.710 89 H LEU 31 H LEU 31 -1.603 -21.562 1.371 90 HA LEU 31 HA LEU 31 -4.154 -20.392 1.677 91 HB2 LEU 31 HB2 LEU 31 -2.958 -20.342 -0.462 92 HB3 LEU 31 HB3 LEU 31 -2.970 -22.094 -0.547 93 HG LEU 31 HG LEU 31 -5.484 -22.023 -0.778 94 HD11 LEU 31 HD11 LEU 31 -5.922 -19.865 0.276 95 HD12 LEU 31 HD12 LEU 31 -6.584 -19.919 -1.356 96 HD13 LEU 31 HD13 LEU 31 -5.090 -19.031 -1.041 97 HD21 LEU 31 HD21 LEU 31 -4.078 -22.273 -2.766 98 HD22 LEU 31 HD22 LEU 31 -3.944 -20.519 -2.918 99 HD23 LEU 31 HD23 LEU 31 -5.510 -21.307 -3.126 100 H GLU 32 H GLU 32 -3.106 -23.765 1.268 101 HA GLU 32 HA GLU 32 -5.660 -24.926 1.013 102 HB2 GLU 32 HB2 GLU 32 -2.996 -26.200 1.773 103 HB3 GLU 32 HB3 GLU 32 -4.460 -27.113 1.400 104 HG2 GLU 32 HG2 GLU 32 -2.872 -25.347 -0.477 105 HG3 GLU 32 HG3 GLU 32 -3.026 -27.099 -0.533 106 H ASN 33 H ASN 33 -3.423 -24.875 3.824 107 HA ASN 33 HA ASN 33 -5.225 -26.394 5.477 108 HB2 ASN 33 HB2 ASN 33 -2.592 -25.017 6.154 109 HB3 ASN 33 HB3 ASN 33 -3.532 -25.933 7.328 110 HD21 ASN 33 HD21 ASN 33 -1.287 -26.133 4.734 111 HD22 ASN 33 HD22 ASN 33 -1.165 -27.851 4.672 112 H HIS 34 H HIS 34 -4.599 -22.943 5.067 113 HA HIS 34 HA HIS 34 -6.040 -22.090 7.416 114 HB2 HIS 34 HB2 HIS 34 -4.335 -20.682 6.181 115 HB3 HIS 34 HB3 HIS 34 -5.499 -20.475 4.883 116 HD1 HIS 34 HD1 HIS 34 -4.361 -18.984 7.971 117 HD2 HIS 34 HD2 HIS 34 -7.908 -18.991 5.826 118 HE1 HIS 34 HE1 HIS 34 -5.639 -16.976 8.766 119 HE2 HIS 34 HE2 HIS 34 -7.729 -16.946 7.376 120 H ASN 35 H ASN 35 -6.828 -22.621 4.019 121 HA ASN 35 HA ASN 35 -9.553 -21.855 4.001 122 HB2 ASN 35 HB2 ASN 35 -8.091 -22.362 1.977 123 HB3 ASN 35 HB3 ASN 35 -8.221 -24.070 2.364 124 HD21 ASN 35 HD21 ASN 35 -9.271 -24.659 0.472 125 HD22 ASN 35 HD22 ASN 35 -10.867 -24.139 0.069 126 H ASN 36 H ASN 36 -7.899 -24.886 4.687 127 HA ASN 36 HA ASN 36 -10.117 -26.580 5.198 128 HB2 ASN 36 HB2 ASN 36 -7.896 -27.426 4.551 129 HB3 ASN 36 HB3 ASN 36 -7.184 -26.748 6.005 130 HD21 ASN 36 HD21 ASN 36 -6.342 -28.739 6.612 131 HD22 ASN 36 HD22 ASN 36 -7.322 -30.019 7.232 132 H ASP 37 H ASP 37 -8.353 -24.297 7.164 133 HA ASP 37 HA ASP 37 -9.015 -25.217 9.766 134 HB2 ASP 37 HB2 ASP 37 -7.183 -23.683 9.524 135 HB3 ASP 37 HB3 ASP 37 -8.167 -22.522 8.648 136 H GLY 38 H GLY 38 -10.712 -23.179 7.450 137 HA2 GLY 38 HA2 GLY 38 -13.214 -23.115 7.791 138 HA3 GLY 38 HA3 GLY 38 -12.857 -22.551 9.422 139 H GLY 39 H GLY 39 -10.530 -20.960 8.498 140 HA2 GLY 39 HA2 GLY 39 -11.723 -18.536 7.522 141 HA3 GLY 39 HA3 GLY 39 -9.998 -18.877 7.645 142 H PHE 40 H PHE 40 -12.845 -19.213 5.601 143 HA PHE 40 HA PHE 40 -11.595 -20.984 3.723 144 HB2 PHE 40 HB2 PHE 40 -14.098 -20.932 4.291 145 HB3 PHE 40 HB3 PHE 40 -14.220 -19.466 3.327 146 HD1 PHE 40 HD1 PHE 40 -13.711 -19.591 0.822 147 HD2 PHE 40 HD2 PHE 40 -14.029 -23.103 3.242 148 HE1 PHE 40 HE1 PHE 40 -13.954 -20.966 -1.202 149 HE2 PHE 40 HE2 PHE 40 -14.272 -24.471 1.204 150 HZ PHE 40 HZ PHE 40 -14.229 -23.404 -1.013 151 H TRP 41 H TRP 41 -10.142 -20.324 2.353 152 HA TRP 41 HA TRP 41 -10.225 -17.645 1.119 153 HB2 TRP 41 HB2 TRP 41 -7.949 -19.583 1.671 154 HB3 TRP 41 HB3 TRP 41 -7.776 -18.295 0.489 155 HD1 TRP 41 HD1 TRP 41 -9.670 -16.569 3.015 156 HE1 TRP 41 HE1 TRP 41 -8.130 -15.326 4.662 157 HE3 TRP 41 HE3 TRP 41 -5.255 -18.943 1.989 158 HZ2 TRP 41 HZ2 TRP 41 -5.429 -15.336 5.418 159 HZ3 TRP 41 HZ3 TRP 41 -3.238 -18.272 3.226 160 HH2 TRP 41 HH2 TRP 41 -3.324 -16.501 4.910 161 H THR 42 H THR 42 -9.197 -17.664 -1.112 162 HA THR 42 HA THR 42 -9.634 -19.948 -2.819 163 HB THR 42 HB THR 42 -11.954 -19.123 -2.629 164 HG1 THR 42 HG1 THR 42 -11.501 -19.945 -4.619 165 HG21 THR 42 HG21 THR 42 -11.536 -16.758 -2.070 166 HG22 THR 42 HG22 THR 42 -12.635 -16.904 -3.441 167 HG23 THR 42 HG23 THR 42 -10.948 -16.464 -3.714 168 H VAL 43 H VAL 43 -8.471 -19.737 -4.734 169 HA VAL 43 HA VAL 43 -6.915 -17.250 -5.108 170 HB VAL 43 HB VAL 43 -5.412 -19.098 -4.804 171 HG11 VAL 43 HG11 VAL 43 -5.391 -21.149 -6.198 172 HG12 VAL 43 HG12 VAL 43 -6.878 -20.618 -6.989 173 HG13 VAL 43 HG13 VAL 43 -6.885 -20.998 -5.266 174 HG21 VAL 43 HG21 VAL 43 -4.760 -17.458 -6.530 175 HG22 VAL 43 HG22 VAL 43 -5.527 -18.447 -7.776 176 HG23 VAL 43 HG23 VAL 43 -4.118 -19.060 -6.907 177 H ILE 44 H ILE 44 -7.826 -15.926 -6.550 178 HA ILE 44 HA ILE 44 -8.823 -16.984 -9.137 179 HB ILE 44 HB ILE 44 -9.947 -14.537 -7.676 180 HG12 ILE 44 HG12 ILE 44 -11.247 -17.278 -8.064 181 HG13 ILE 44 HG13 ILE 44 -10.601 -16.672 -6.546 182 HG21 ILE 44 HG21 ILE 44 -11.680 -14.522 -9.454 183 HG22 ILE 44 HG22 ILE 44 -10.874 -15.868 -10.261 184 HG23 ILE 44 HG23 ILE 44 -10.063 -14.305 -10.128 185 HD11 ILE 44 HD11 ILE 44 -12.946 -15.511 -8.044 186 HD12 ILE 44 HD12 ILE 44 -12.308 -14.936 -6.503 187 HD13 ILE 44 HD13 ILE 44 -13.014 -16.546 -6.621 188 H ASP 45 H ASP 45 -7.546 -16.322 -10.716 189 HA ASP 45 HA ASP 45 -6.172 -15.194 -12.087 190 HB2 ASP 45 HB2 ASP 45 -8.061 -13.522 -12.006 191 HB3 ASP 45 HB3 ASP 45 -7.225 -12.677 -10.712 192 H GLY 46 H GLY 46 -5.040 -16.292 -9.841 193 HA2 GLY 46 HA2 GLY 46 -2.975 -16.474 -8.864 194 HA3 GLY 46 HA3 GLY 46 -2.466 -15.065 -9.782 195 H LYS 47 H LYS 47 -5.257 -14.584 -7.844 196 HA LYS 47 HA LYS 47 -3.702 -13.253 -5.686 197 HB2 LYS 47 HB2 LYS 47 -6.442 -12.490 -6.811 198 HB3 LYS 47 HB3 LYS 47 -5.619 -11.675 -5.480 199 HG2 LYS 47 HG2 LYS 47 -4.631 -11.810 -8.341 200 HG3 LYS 47 HG3 LYS 47 -5.497 -10.441 -7.625 201 HD2 LYS 47 HD2 LYS 47 -3.640 -10.183 -5.973 202 HD3 LYS 47 HD3 LYS 47 -2.772 -11.507 -6.765 203 HE2 LYS 47 HE2 LYS 47 -1.914 -9.343 -7.515 204 HE3 LYS 47 HE3 LYS 47 -2.699 -10.178 -8.860 205 HZ1 LYS 47 HZ1 LYS 47 -3.937 -8.039 -7.206 206 HZ2 LYS 47 HZ2 LYS 47 -4.656 -8.816 -8.525 207 HZ3 LYS 47 HZ3 LYS 47 -3.299 -7.838 -8.760 208 H VAL 48 H VAL 48 -4.518 -13.506 -3.554 209 HA VAL 48 HA VAL 48 -6.482 -15.687 -3.203 210 HB VAL 48 HB VAL 48 -4.409 -14.691 -1.201 211 HG11 VAL 48 HG11 VAL 48 -5.038 -16.664 0.156 212 HG12 VAL 48 HG12 VAL 48 -6.290 -17.085 -1.015 213 HG13 VAL 48 HG13 VAL 48 -6.422 -15.597 -0.078 214 HG21 VAL 48 HG21 VAL 48 -4.444 -17.229 -2.874 215 HG22 VAL 48 HG22 VAL 48 -3.253 -16.839 -1.629 216 HG23 VAL 48 HG23 VAL 48 -3.357 -15.854 -3.089 217 H TYR 49 H TYR 49 -8.404 -15.078 -2.645 218 HA TYR 49 HA TYR 49 -8.902 -12.745 -0.889 219 HB2 TYR 49 HB2 TYR 49 -10.816 -14.029 -2.902 220 HB3 TYR 49 HB3 TYR 49 -11.153 -12.621 -1.899 221 HD1 TYR 49 HD1 TYR 49 -10.210 -10.421 -2.468 222 HD2 TYR 49 HD2 TYR 49 -9.363 -13.847 -4.883 223 HE1 TYR 49 HE1 TYR 49 -9.314 -8.963 -4.224 224 HE2 TYR 49 HE2 TYR 49 -8.466 -12.377 -6.635 225 HH TYR 49 HH TYR 49 -8.701 -10.029 -7.361 226 H ASP 50 H ASP 50 -10.929 -13.084 0.446 227 HA ASP 50 HA ASP 50 -11.220 -15.899 1.334 228 HB2 ASP 50 HB2 ASP 50 -12.287 -14.971 3.348 229 HB3 ASP 50 HB3 ASP 50 -10.703 -14.252 3.104 230 H ILE 51 H ILE 51 -13.311 -16.746 1.627 231 HA ILE 51 HA ILE 51 -15.585 -15.431 0.274 232 HB ILE 51 HB ILE 51 -15.036 -18.398 0.750 233 HG12 ILE 51 HG12 ILE 51 -13.790 -17.464 -1.165 234 HG13 ILE 51 HG13 ILE 51 -15.030 -18.575 -1.740 235 HG21 ILE 51 HG21 ILE 51 -17.431 -18.047 1.088 236 HG22 ILE 51 HG22 ILE 51 -17.156 -18.912 -0.425 237 HG23 ILE 51 HG23 ILE 51 -17.556 -17.192 -0.453 238 HD11 ILE 51 HD11 ILE 51 -14.910 -16.625 -3.146 239 HD12 ILE 51 HD12 ILE 51 -15.168 -15.560 -1.767 240 HD13 ILE 51 HD13 ILE 51 -16.458 -16.645 -2.303 241 H LYS 52 H LYS 52 -14.270 -16.541 3.278 242 HA LYS 52 HA LYS 52 -16.684 -17.131 4.673 243 HB2 LYS 52 HB2 LYS 52 -14.508 -18.037 5.377 244 HB3 LYS 52 HB3 LYS 52 -13.929 -16.423 5.748 245 HG2 LYS 52 HG2 LYS 52 -14.479 -17.614 7.793 246 HG3 LYS 52 HG3 LYS 52 -15.555 -16.236 7.594 247 HD2 LYS 52 HD2 LYS 52 -16.524 -18.930 6.622 248 HD3 LYS 52 HD3 LYS 52 -16.441 -18.672 8.363 249 HE2 LYS 52 HE2 LYS 52 -17.933 -16.722 8.160 250 HE3 LYS 52 HE3 LYS 52 -17.984 -16.926 6.412 251 HZ1 LYS 52 HZ1 LYS 52 -19.019 -18.832 8.424 252 HZ2 LYS 52 HZ2 LYS 52 -19.037 -19.077 6.755 253 HZ3 LYS 52 HZ3 LYS 52 -19.943 -17.823 7.434 254 H ASP 53 H ASP 53 -14.521 -14.234 4.942 255 HA ASP 53 HA ASP 53 -16.378 -12.724 6.512 256 HB2 ASP 53 HB2 ASP 53 -13.914 -12.251 6.464 257 HB3 ASP 53 HB3 ASP 53 -14.057 -11.720 4.795 258 H PHE 54 H PHE 54 -15.684 -13.009 3.086 259 HA PHE 54 HA PHE 54 -17.127 -10.996 1.878 260 HB2 PHE 54 HB2 PHE 54 -15.567 -12.461 0.693 261 HB3 PHE 54 HB3 PHE 54 -16.603 -13.850 0.971 262 HD1 PHE 54 HD1 PHE 54 -16.167 -10.771 -1.003 263 HD2 PHE 54 HD2 PHE 54 -18.575 -14.260 -0.432 264 HE1 PHE 54 HE1 PHE 54 -17.293 -10.359 -3.148 265 HE2 PHE 54 HE2 PHE 54 -19.697 -13.828 -2.579 266 HZ PHE 54 HZ PHE 54 -19.060 -11.876 -3.934 267 H GLN 55 H GLN 55 -18.319 -14.263 2.676 268 HA GLN 55 HA GLN 55 -20.936 -13.836 1.609 269 HB2 GLN 55 HB2 GLN 55 -21.521 -16.029 2.544 270 HB3 GLN 55 HB3 GLN 55 -19.974 -16.091 1.704 271 HG2 GLN 55 HG2 GLN 55 -18.817 -15.942 3.913 272 HG3 GLN 55 HG3 GLN 55 -20.389 -15.998 4.706 273 HE21 GLN 55 HE21 GLN 55 -18.035 -17.813 2.855 274 HE22 GLN 55 HE22 GLN 55 -18.660 -19.383 3.221 275 H THR 56 H THR 56 -19.485 -13.340 4.765 276 HA THR 56 HA THR 56 -21.903 -12.922 6.242 277 HB THR 56 HB THR 56 -19.161 -11.718 6.855 278 HG1 THR 56 HG1 THR 56 -18.553 -13.721 7.079 279 HG21 THR 56 HG21 THR 56 -21.016 -10.846 8.275 280 HG22 THR 56 HG22 THR 56 -19.890 -11.829 9.211 281 HG23 THR 56 HG23 THR 56 -21.443 -12.502 8.720 282 H GLN 57 H GLN 57 -19.828 -10.879 4.234 283 HA GLN 57 HA GLN 57 -20.995 -8.350 4.894 284 HB2 GLN 57 HB2 GLN 57 -19.279 -9.230 2.539 285 HB3 GLN 57 HB3 GLN 57 -19.739 -7.562 2.845 286 HG2 GLN 57 HG2 GLN 57 -18.073 -9.279 4.712 287 HG3 GLN 57 HG3 GLN 57 -17.438 -8.088 3.581 288 HE21 GLN 57 HE21 GLN 57 -19.052 -8.589 6.597 289 HE22 GLN 57 HE22 GLN 57 -18.966 -6.956 7.151 290 H SER 58 H SER 58 -21.874 -10.884 2.611 291 HA SER 58 HA SER 58 -23.638 -9.215 1.040 292 HB2 SER 58 HB2 SER 58 -24.415 -11.413 0.049 293 HB3 SER 58 HB3 SER 58 -22.684 -11.118 -0.080 294 HG SER 58 HG SER 58 -23.805 -12.649 2.025 295 H LEU 59 H LEU 59 -23.920 -10.542 4.157 296 HA LEU 59 HA LEU 59 -26.814 -10.616 4.225 297 HB2 LEU 59 HB2 LEU 59 -24.680 -10.737 6.364 298 HB3 LEU 59 HB3 LEU 59 -26.336 -10.428 6.828 299 HG LEU 59 HG LEU 59 -25.951 -12.752 7.161 300 HD11 LEU 59 HD11 LEU 59 -27.610 -13.820 5.741 301 HD12 LEU 59 HD12 LEU 59 -27.527 -12.484 4.590 302 HD13 LEU 59 HD13 LEU 59 -28.141 -12.209 6.222 303 HD21 LEU 59 HD21 LEU 59 -23.969 -13.073 5.806 304 HD22 LEU 59 HD22 LEU 59 -24.914 -12.938 4.323 305 HD23 LEU 59 HD23 LEU 59 -25.171 -14.302 5.417 306 H THR 60 H THR 60 -24.632 -8.063 3.925 307 HA THR 60 HA THR 60 -26.245 -6.064 5.247 308 HB THR 60 HB THR 60 -24.261 -5.645 2.967 309 HG1 THR 60 HG1 THR 60 -22.846 -6.310 4.379 310 HG21 THR 60 HG21 THR 60 -24.016 -3.371 3.907 311 HG22 THR 60 HG22 THR 60 -25.218 -3.739 5.144 312 HG23 THR 60 HG23 THR 60 -25.693 -3.675 3.445 313 H GLU 61 H GLU 61 -28.181 -5.431 4.514 314 HA GLU 61 HA GLU 61 -29.413 -6.414 2.181 315 HB2 GLU 61 HB2 GLU 61 -31.258 -4.791 2.755 316 HB3 GLU 61 HB3 GLU 61 -30.779 -5.866 4.062 317 HG2 GLU 61 HG2 GLU 61 -29.480 -4.069 5.106 318 HG3 GLU 61 HG3 GLU 61 -29.882 -2.983 3.781 319 H ASN 62 H ASN 62 -27.817 -3.309 2.816 320 HA ASN 62 HA ASN 62 -28.081 -2.585 -0.053 321 HB2 ASN 62 HB2 ASN 62 -27.544 -0.758 2.339 322 HB3 ASN 62 HB3 ASN 62 -27.598 -0.234 0.654 323 HD21 ASN 62 HD21 ASN 62 -29.458 -1.365 3.364 324 HD22 ASN 62 HD22 ASN 62 -31.016 -0.945 2.755 325 H SER 63 H SER 63 -26.390 -3.898 -0.696 326 HA SER 63 HA SER 63 -23.680 -2.870 -0.241 327 HB2 SER 63 HB2 SER 63 -22.749 -5.134 0.209 328 HB3 SER 63 HB3 SER 63 -23.929 -4.717 1.445 329 HG SER 63 HG SER 63 -25.377 -6.090 0.498 330 H ILE 64 H ILE 64 -22.151 -3.737 -1.875 331 HA ILE 64 HA ILE 64 -23.223 -4.045 -4.502 332 HB ILE 64 HB ILE 64 -20.921 -4.572 -5.237 333 HG12 ILE 64 HG12 ILE 64 -19.999 -4.362 -2.335 334 HG13 ILE 64 HG13 ILE 64 -20.351 -5.910 -3.086 335 HG21 ILE 64 HG21 ILE 64 -19.828 -2.452 -4.584 336 HG22 ILE 64 HG22 ILE 64 -21.015 -2.238 -3.295 337 HG23 ILE 64 HG23 ILE 64 -21.532 -2.213 -4.983 338 HD11 ILE 64 HD11 ILE 64 -18.269 -3.955 -4.019 339 HD12 ILE 64 HD12 ILE 64 -18.609 -5.538 -4.727 340 HD13 ILE 64 HD13 ILE 64 -17.987 -5.419 -3.081 341 H LEU 65 H LEU 65 -22.750 -6.265 -1.937 342 HA LEU 65 HA LEU 65 -22.585 -8.655 -3.640 343 HB2 LEU 65 HB2 LEU 65 -22.452 -8.396 -0.610 344 HB3 LEU 65 HB3 LEU 65 -22.125 -9.853 -1.542 345 HG LEU 65 HG LEU 65 -20.456 -7.315 -1.456 346 HD11 LEU 65 HD11 LEU 65 -18.707 -8.756 -0.510 347 HD12 LEU 65 HD12 LEU 65 -19.804 -10.142 -0.552 348 HD13 LEU 65 HD13 LEU 65 -20.160 -8.761 0.489 349 HD21 LEU 65 HD21 LEU 65 -20.463 -8.116 -3.755 350 HD22 LEU 65 HD22 LEU 65 -20.044 -9.749 -3.231 351 HD23 LEU 65 HD23 LEU 65 -18.892 -8.428 -3.019 352 H ALA 66 H ALA 66 -24.947 -6.742 -2.129 353 HA ALA 66 HA ALA 66 -26.881 -8.701 -1.367 354 HB1 ALA 66 HB1 ALA 66 -26.976 -6.374 -0.556 355 HB2 ALA 66 HB2 ALA 66 -28.486 -6.828 -1.350 356 HB3 ALA 66 HB3 ALA 66 -27.316 -5.806 -2.193 357 H GLN 67 H GLN 67 -26.127 -7.075 -4.393 358 HA GLN 67 HA GLN 67 -28.332 -8.125 -5.934 359 HB2 GLN 67 HB2 GLN 67 -27.129 -7.193 -7.885 360 HB3 GLN 67 HB3 GLN 67 -27.204 -6.020 -6.571 361 HG2 GLN 67 HG2 GLN 67 -24.876 -6.658 -5.928 362 HG3 GLN 67 HG3 GLN 67 -24.815 -7.724 -7.329 363 HE21 GLN 67 HE21 GLN 67 -24.867 -4.411 -6.243 364 HE22 GLN 67 HE22 GLN 67 -24.340 -3.707 -7.729 365 H PHE 68 H PHE 68 -25.281 -9.344 -4.909 366 HA PHE 68 HA PHE 68 -25.239 -11.532 -6.906 367 HB2 PHE 68 HB2 PHE 68 -23.042 -10.463 -5.070 368 HB3 PHE 68 HB3 PHE 68 -22.859 -11.851 -6.129 369 HD1 PHE 68 HD1 PHE 68 -24.048 -10.966 -8.659 370 HD2 PHE 68 HD2 PHE 68 -21.593 -8.805 -5.900 371 HE1 PHE 68 HE1 PHE 68 -23.264 -9.511 -10.483 372 HE2 PHE 68 HE2 PHE 68 -20.808 -7.357 -7.737 373 HZ PHE 68 HZ PHE 68 -21.646 -7.712 -10.029 374 H ALA 69 H ALA 69 -26.628 -11.053 -4.056 375 HA ALA 69 HA ALA 69 -25.582 -12.989 -2.272 376 HB1 ALA 69 HB1 ALA 69 -26.984 -11.108 -1.539 377 HB2 ALA 69 HB2 ALA 69 -27.660 -12.646 -0.997 378 HB3 ALA 69 HB3 ALA 69 -28.374 -11.802 -2.375 379 H GLY 70 H GLY 70 -28.119 -13.145 -4.742 380 HA2 GLY 70 HA2 GLY 70 -28.972 -15.841 -4.146 381 HA3 GLY 70 HA3 GLY 70 -29.464 -14.856 -5.511 382 H GLU 71 H GLU 71 -26.292 -14.589 -5.812 383 HA GLU 71 HA GLU 71 -25.970 -16.944 -7.557 384 HB2 GLU 71 HB2 GLU 71 -25.494 -14.657 -8.479 385 HB3 GLU 71 HB3 GLU 71 -24.236 -14.435 -7.274 386 HG2 GLU 71 HG2 GLU 71 -23.313 -14.996 -9.488 387 HG3 GLU 71 HG3 GLU 71 -22.890 -16.194 -8.267 388 H ASP 72 H ASP 72 -24.097 -18.275 -7.393 389 HA ASP 72 HA ASP 72 -23.133 -19.213 -4.984 390 HB2 ASP 72 HB2 ASP 72 -22.819 -20.314 -7.199 391 HB3 ASP 72 HB3 ASP 72 -21.668 -19.076 -7.662 392 HA PRO 73 HA PRO 73 -20.824 -15.714 -3.418 393 HB2 PRO 73 HB2 PRO 73 -19.160 -16.952 -1.577 394 HB3 PRO 73 HB3 PRO 73 -20.883 -16.651 -1.305 395 HG2 PRO 73 HG2 PRO 73 -19.529 -19.169 -2.286 396 HG3 PRO 73 HG3 PRO 73 -20.773 -18.992 -1.027 397 HD2 PRO 73 HD2 PRO 73 -21.436 -19.786 -3.502 398 HD3 PRO 73 HD3 PRO 73 -22.499 -18.675 -2.604 399 H VAL 74 H VAL 74 -18.906 -18.493 -4.588 400 HA VAL 74 HA VAL 74 -16.417 -17.031 -4.742 401 HB VAL 74 HB VAL 74 -17.085 -19.656 -6.150 402 HG11 VAL 74 HG11 VAL 74 -14.635 -20.066 -6.026 403 HG12 VAL 74 HG12 VAL 74 -14.411 -18.478 -5.287 404 HG13 VAL 74 HG13 VAL 74 -15.007 -18.602 -6.943 405 HG21 VAL 74 HG21 VAL 74 -17.611 -19.885 -3.750 406 HG22 VAL 74 HG22 VAL 74 -16.008 -19.284 -3.321 407 HG23 VAL 74 HG23 VAL 74 -16.176 -20.829 -4.158 408 H VAL 75 H VAL 75 -18.953 -18.009 -7.020 409 HA VAL 75 HA VAL 75 -17.836 -16.832 -9.385 410 HB VAL 75 HB VAL 75 -20.737 -17.545 -8.726 411 HG11 VAL 75 HG11 VAL 75 -20.681 -15.952 -10.606 412 HG12 VAL 75 HG12 VAL 75 -21.159 -17.553 -11.168 413 HG13 VAL 75 HG13 VAL 75 -19.517 -16.969 -11.460 414 HG21 VAL 75 HG21 VAL 75 -18.622 -19.140 -10.228 415 HG22 VAL 75 HG22 VAL 75 -20.307 -19.624 -10.003 416 HG23 VAL 75 HG23 VAL 75 -19.235 -19.486 -8.608 417 H ALA 76 H ALA 76 -19.831 -15.659 -6.781 418 HA ALA 76 HA ALA 76 -20.728 -13.183 -7.871 419 HB1 ALA 76 HB1 ALA 76 -20.434 -14.078 -4.980 420 HB2 ALA 76 HB2 ALA 76 -21.880 -14.237 -5.982 421 HB3 ALA 76 HB3 ALA 76 -21.303 -12.636 -5.517 422 H LEU 77 H LEU 77 -17.969 -14.209 -5.945 423 HA LEU 77 HA LEU 77 -16.752 -11.710 -5.477 424 HB2 LEU 77 HB2 LEU 77 -16.183 -13.775 -4.241 425 HB3 LEU 77 HB3 LEU 77 -15.523 -14.481 -5.705 426 HG LEU 77 HG LEU 77 -13.735 -12.705 -5.707 427 HD11 LEU 77 HD11 LEU 77 -14.864 -10.958 -4.424 428 HD12 LEU 77 HD12 LEU 77 -13.310 -11.379 -3.714 429 HD13 LEU 77 HD13 LEU 77 -14.803 -11.963 -2.974 430 HD21 LEU 77 HD21 LEU 77 -13.349 -14.957 -4.760 431 HD22 LEU 77 HD22 LEU 77 -13.836 -14.362 -3.171 432 HD23 LEU 77 HD23 LEU 77 -12.398 -13.713 -3.960 433 H GLU 78 H GLU 78 -16.400 -14.104 -8.112 434 HA GLU 78 HA GLU 78 -14.371 -12.807 -9.610 435 HB2 GLU 78 HB2 GLU 78 -16.579 -14.658 -10.599 436 HB3 GLU 78 HB3 GLU 78 -15.141 -14.209 -11.523 437 HG2 GLU 78 HG2 GLU 78 -13.735 -15.276 -9.774 438 HG3 GLU 78 HG3 GLU 78 -15.198 -15.783 -8.934 439 H ALA 79 H ALA 79 -17.897 -12.580 -9.738 440 HA ALA 79 HA ALA 79 -18.136 -10.845 -11.976 441 HB1 ALA 79 HB1 ALA 79 -20.452 -10.493 -11.181 442 HB2 ALA 79 HB2 ALA 79 -20.045 -11.272 -9.648 443 HB3 ALA 79 HB3 ALA 79 -20.018 -12.204 -11.146 444 H ALA 80 H ALA 80 -17.689 -10.351 -8.535 445 HA ALA 80 HA ALA 80 -17.954 -7.484 -8.576 446 HB1 ALA 80 HB1 ALA 80 -18.506 -8.803 -6.584 447 HB2 ALA 80 HB2 ALA 80 -17.242 -7.624 -6.230 448 HB3 ALA 80 HB3 ALA 80 -16.827 -9.328 -6.449 449 H LEU 81 H LEU 81 -15.301 -9.763 -8.982 450 HA LEU 81 HA LEU 81 -13.174 -7.819 -8.878 451 HB2 LEU 81 HB2 LEU 81 -13.320 -10.636 -10.012 452 HB3 LEU 81 HB3 LEU 81 -11.844 -9.675 -10.047 453 HG LEU 81 HG LEU 81 -13.306 -10.493 -7.500 454 HD11 LEU 81 HD11 LEU 81 -11.487 -12.084 -7.116 455 HD12 LEU 81 HD12 LEU 81 -10.781 -11.686 -8.685 456 HD13 LEU 81 HD13 LEU 81 -12.363 -12.466 -8.598 457 HD21 LEU 81 HD21 LEU 81 -10.596 -9.172 -7.874 458 HD22 LEU 81 HD22 LEU 81 -11.302 -9.691 -6.342 459 HD23 LEU 81 HD23 LEU 81 -12.060 -8.396 -7.258 460 H GLN 82 H GLN 82 -15.373 -9.014 -11.282 461 HA GLN 82 HA GLN 82 -13.927 -8.167 -13.609 462 HB2 GLN 82 HB2 GLN 82 -15.571 -10.088 -13.567 463 HB3 GLN 82 HB3 GLN 82 -16.876 -8.928 -13.364 464 HG2 GLN 82 HG2 GLN 82 -16.739 -9.642 -15.686 465 HG3 GLN 82 HG3 GLN 82 -16.337 -7.926 -15.556 466 HE21 GLN 82 HE21 GLN 82 -14.119 -10.597 -14.757 467 HE22 GLN 82 HE22 GLN 82 -13.007 -10.288 -16.042 468 H PHE 83 H PHE 83 -16.698 -6.886 -11.752 469 HA PHE 83 HA PHE 83 -17.097 -4.679 -13.595 470 HB2 PHE 83 HB2 PHE 83 -18.966 -5.920 -12.402 471 HB3 PHE 83 HB3 PHE 83 -18.458 -5.144 -10.909 472 HD1 PHE 83 HD1 PHE 83 -19.447 -4.282 -14.428 473 HD2 PHE 83 HD2 PHE 83 -19.531 -3.117 -10.315 474 HE1 PHE 83 HE1 PHE 83 -20.878 -2.367 -14.997 475 HE2 PHE 83 HE2 PHE 83 -20.966 -1.203 -10.899 476 HZ PHE 83 HZ PHE 83 -21.639 -0.825 -13.236 477 H GLU 84 H GLU 84 -16.657 -2.523 -13.225 478 HA GLU 84 HA GLU 84 -14.186 -2.020 -11.942 479 HB2 GLU 84 HB2 GLU 84 -14.482 0.297 -12.805 480 HB3 GLU 84 HB3 GLU 84 -14.749 -0.948 -14.023 481 HG2 GLU 84 HG2 GLU 84 -17.234 -0.695 -13.643 482 HG3 GLU 84 HG3 GLU 84 -16.881 0.665 -12.575 483 H ASP 85 H ASP 85 -17.484 -1.128 -11.067 484 HA ASP 85 HA ASP 85 -16.895 0.690 -8.967 485 HB2 ASP 85 HB2 ASP 85 -19.106 0.670 -9.964 486 HB3 ASP 85 HB3 ASP 85 -19.330 -1.025 -9.590 487 H THR 86 H THR 86 -17.399 -2.785 -9.085 488 HA THR 86 HA THR 86 -17.594 -3.123 -6.224 489 HB THR 86 HB THR 86 -17.839 -5.576 -6.924 490 HG1 THR 86 HG1 THR 86 -16.687 -5.160 -8.984 491 HG21 THR 86 HG21 THR 86 -20.082 -5.299 -7.891 492 HG22 THR 86 HG22 THR 86 -19.724 -3.613 -8.279 493 HG23 THR 86 HG23 THR 86 -19.827 -4.129 -6.597 494 H ARG 87 H ARG 87 -15.069 -3.461 -8.651 495 HA ARG 87 HA ARG 87 -13.497 -5.462 -7.392 496 HB2 ARG 87 HB2 ARG 87 -11.717 -4.864 -8.971 497 HB3 ARG 87 HB3 ARG 87 -13.274 -4.940 -9.793 498 HG2 ARG 87 HG2 ARG 87 -13.419 -2.472 -9.733 499 HG3 ARG 87 HG3 ARG 87 -11.856 -2.396 -8.918 500 HD2 ARG 87 HD2 ARG 87 -10.772 -3.388 -10.896 501 HD3 ARG 87 HD3 ARG 87 -12.341 -3.512 -11.705 502 HE ARG 87 HE ARG 87 -11.813 -0.831 -10.887 503 HH11 ARG 87 HH11 ARG 87 -11.023 -3.138 -13.421 504 HH12 ARG 87 HH12 ARG 87 -10.597 -1.905 -14.564 505 HH21 ARG 87 HH21 ARG 87 -11.253 0.763 -12.396 506 HH22 ARG 87 HH22 ARG 87 -10.727 0.296 -13.986 507 H GLU 88 H GLU 88 -13.728 -2.042 -6.871 508 HA GLU 88 HA GLU 88 -11.194 -1.731 -5.496 509 HB2 GLU 88 HB2 GLU 88 -13.542 0.211 -5.531 510 HB3 GLU 88 HB3 GLU 88 -11.840 0.578 -5.229 511 HG2 GLU 88 HG2 GLU 88 -11.379 -0.196 -7.617 512 HG3 GLU 88 HG3 GLU 88 -13.122 -0.257 -7.856 513 H SER 89 H SER 89 -14.472 -2.524 -4.634 514 HA SER 89 HA SER 89 -14.109 -2.331 -1.766 515 HB2 SER 89 HB2 SER 89 -16.332 -2.078 -2.740 516 HB3 SER 89 HB3 SER 89 -16.239 -3.676 -3.474 517 HG SER 89 HG SER 89 -17.452 -3.483 -1.451 518 H MET 90 H MET 90 -13.661 -4.748 -4.284 519 HA MET 90 HA MET 90 -13.361 -7.092 -2.711 520 HB2 MET 90 HB2 MET 90 -12.144 -6.389 -5.395 521 HB3 MET 90 HB3 MET 90 -12.130 -8.001 -4.687 522 HG2 MET 90 HG2 MET 90 -14.641 -6.479 -5.420 523 HG3 MET 90 HG3 MET 90 -13.851 -7.671 -6.446 524 HE1 MET 90 HE1 MET 90 -16.733 -7.202 -4.129 525 HE2 MET 90 HE2 MET 90 -15.520 -7.196 -2.847 526 HE3 MET 90 HE3 MET 90 -16.667 -8.532 -2.977 527 H HIS 91 H HIS 91 -11.340 -4.379 -3.116 528 HA HIS 91 HA HIS 91 -8.762 -5.282 -2.568 529 HB2 HIS 91 HB2 HIS 91 -9.338 -2.993 -3.296 530 HB3 HIS 91 HB3 HIS 91 -10.138 -2.684 -1.762 531 HD1 HIS 91 HD1 HIS 91 -8.554 -2.429 0.355 532 HD2 HIS 91 HD2 HIS 91 -6.638 -2.532 -3.331 533 HE1 HIS 91 HE1 HIS 91 -6.236 -1.572 0.781 534 HE2 HIS 91 HE2 HIS 91 -5.187 -1.430 -1.497 535 H ALA 92 H ALA 92 -11.483 -4.676 -0.394 536 HA ALA 92 HA ALA 92 -10.145 -4.933 2.104 537 HB1 ALA 92 HB1 ALA 92 -12.382 -3.915 1.897 538 HB2 ALA 92 HB2 ALA 92 -12.405 -5.246 3.054 539 HB3 ALA 92 HB3 ALA 92 -13.060 -5.477 1.428 540 H PHE 93 H PHE 93 -11.613 -7.268 -0.102 541 HA PHE 93 HA PHE 93 -11.331 -9.529 1.720 542 HB2 PHE 93 HB2 PHE 93 -12.274 -9.485 -1.184 543 HB3 PHE 93 HB3 PHE 93 -12.456 -10.821 -0.043 544 HD1 PHE 93 HD1 PHE 93 -13.849 -10.387 2.098 545 HD2 PHE 93 HD2 PHE 93 -13.968 -7.811 -1.297 546 HE1 PHE 93 HE1 PHE 93 -15.960 -9.413 2.890 547 HE2 PHE 93 HE2 PHE 93 -16.075 -6.829 -0.491 548 HZ PHE 93 HZ PHE 93 -17.074 -7.636 1.607 549 H CYS 94 H CYS 94 -9.396 -7.947 -0.594 550 HA CYS 94 HA CYS 94 -7.810 -10.153 -1.507 551 HB2 CYS 94 HB2 CYS 94 -7.929 -7.990 -2.744 552 HB3 CYS 94 HB3 CYS 94 -7.102 -7.187 -1.410 553 HG CYS 94 HG CYS 94 -5.802 -9.530 -3.533 554 H VAL 95 H VAL 95 -7.162 -11.371 0.233 555 HA VAL 95 HA VAL 95 -5.822 -10.193 2.537 556 HB VAL 95 HB VAL 95 -5.705 -12.473 3.451 557 HG11 VAL 95 HG11 VAL 95 -8.125 -12.978 3.625 558 HG12 VAL 95 HG12 VAL 95 -8.453 -11.919 2.251 559 HG13 VAL 95 HG13 VAL 95 -7.823 -11.242 3.753 560 HG21 VAL 95 HG21 VAL 95 -6.622 -14.431 2.222 561 HG22 VAL 95 HG22 VAL 95 -5.212 -13.748 1.414 562 HG23 VAL 95 HG23 VAL 95 -6.828 -13.424 0.783 563 H GLY 96 H GLY 96 -4.912 -11.337 -0.548 564 HA2 GLY 96 HA2 GLY 96 -2.364 -10.321 -0.482 565 HA3 GLY 96 HA3 GLY 96 -2.168 -12.003 0.006 566 H GLN 97 H GLN 97 -0.816 -11.800 -2.005 567 HA GLN 97 HA GLN 97 -2.348 -12.560 -4.428 568 HB2 GLN 97 HB2 GLN 97 -0.731 -10.689 -4.739 569 HB3 GLN 97 HB3 GLN 97 0.572 -11.704 -4.136 570 HG2 GLN 97 HG2 GLN 97 0.296 -13.211 -6.077 571 HG3 GLN 97 HG3 GLN 97 -1.022 -12.200 -6.672 572 HE21 GLN 97 HE21 GLN 97 2.428 -12.499 -6.316 573 HE22 GLN 97 HE22 GLN 97 2.852 -11.146 -7.301 574 H TYR 98 H TYR 98 -2.046 -14.630 -5.247 575 HA TYR 98 HA TYR 98 -1.002 -16.656 -3.520 576 HB2 TYR 98 HB2 TYR 98 -2.923 -17.112 -4.996 577 HB3 TYR 98 HB3 TYR 98 -1.928 -16.843 -6.421 578 HD1 TYR 98 HD1 TYR 98 -2.069 -19.036 -3.351 579 HD2 TYR 98 HD2 TYR 98 -0.963 -18.765 -7.481 580 HE1 TYR 98 HE1 TYR 98 -1.504 -21.426 -3.377 581 HE2 TYR 98 HE2 TYR 98 -0.407 -21.152 -7.490 582 HH TYR 98 HH TYR 98 -1.334 -23.256 -5.014 583 H LEU 99 H LEU 99 0.915 -17.635 -3.530 584 HA LEU 99 HA LEU 99 2.789 -17.210 -5.771 585 HB2 LEU 99 HB2 LEU 99 3.552 -16.141 -3.669 586 HB3 LEU 99 HB3 LEU 99 3.432 -17.671 -2.825 587 HG LEU 99 HG LEU 99 5.792 -16.829 -3.556 588 HD11 LEU 99 HD11 LEU 99 5.036 -19.669 -4.235 589 HD12 LEU 99 HD12 LEU 99 5.445 -19.046 -2.638 590 HD13 LEU 99 HD13 LEU 99 6.662 -19.060 -3.910 591 HD21 LEU 99 HD21 LEU 99 6.549 -17.389 -5.790 592 HD22 LEU 99 HD22 LEU 99 5.237 -16.214 -5.863 593 HD23 LEU 99 HD23 LEU 99 4.927 -17.913 -6.247 594 H GLU 100 H GLU 100 3.033 -18.939 -6.931 595 HA GLU 100 HA GLU 100 2.215 -21.581 -6.228 596 HB2 GLU 100 HB2 GLU 100 2.145 -20.694 -8.545 597 HB3 GLU 100 HB3 GLU 100 3.893 -20.510 -8.537 598 HG2 GLU 100 HG2 GLU 100 4.052 -23.028 -8.247 599 HG3 GLU 100 HG3 GLU 100 2.306 -23.084 -8.516 600 HA PRO 101 HA PRO 101 5.849 -22.593 -3.813 601 HB2 PRO 101 HB2 PRO 101 5.793 -25.333 -3.838 602 HB3 PRO 101 HB3 PRO 101 4.580 -24.364 -2.983 603 HG2 PRO 101 HG2 PRO 101 4.420 -25.547 -5.770 604 HG3 PRO 101 HG3 PRO 101 3.254 -25.695 -4.434 605 HD2 PRO 101 HD2 PRO 101 2.856 -23.890 -6.365 606 HD3 PRO 101 HD3 PRO 101 2.501 -23.471 -4.673 607 H ASP 102 H ASP 102 5.699 -23.493 -7.139 608 HA ASP 102 HA ASP 102 8.510 -24.411 -7.190 609 HB2 ASP 102 HB2 ASP 102 6.576 -25.810 -8.213 610 HB3 ASP 102 HB3 ASP 102 6.501 -24.584 -9.475 611 H GLN 103 H GLN 103 6.542 -21.712 -7.838 612 HA GLN 103 HA GLN 103 7.607 -20.734 -10.267 613 HB2 GLN 103 HB2 GLN 103 5.364 -20.138 -9.253 614 HB3 GLN 103 HB3 GLN 103 6.203 -19.107 -8.096 615 HG2 GLN 103 HG2 GLN 103 5.261 -17.819 -9.963 616 HG3 GLN 103 HG3 GLN 103 7.021 -17.690 -9.919 617 HE21 GLN 103 HE21 GLN 103 5.218 -20.484 -11.218 618 HE22 GLN 103 HE22 GLN 103 5.704 -20.248 -12.854 619 H GLU 104 H GLU 104 8.688 -20.360 -6.947 620 HA GLU 104 HA GLU 104 10.344 -18.045 -7.425 621 HB2 GLU 104 HB2 GLU 104 10.210 -19.944 -5.050 622 HB3 GLU 104 HB3 GLU 104 11.266 -18.532 -5.114 623 HG2 GLU 104 HG2 GLU 104 9.186 -17.119 -5.463 624 HG3 GLU 104 HG3 GLU 104 8.231 -18.562 -5.127 625 H GLY 105 H GLY 105 10.745 -21.222 -8.386 626 HA2 GLY 105 HA2 GLY 105 13.467 -20.774 -9.218 627 HA3 GLY 105 HA3 GLY 105 13.358 -21.975 -7.932 628 H VAL 106 H VAL 106 11.384 -21.228 -10.818 629 HA VAL 106 HA VAL 106 11.158 -24.083 -11.426 630 HB VAL 106 HB VAL 106 9.049 -22.919 -11.471 631 HG11 VAL 106 HG11 VAL 106 10.180 -20.990 -13.522 632 HG12 VAL 106 HG12 VAL 106 9.792 -20.618 -11.843 633 HG13 VAL 106 HG13 VAL 106 8.501 -21.039 -12.971 634 HG21 VAL 106 HG21 VAL 106 9.304 -24.704 -13.161 635 HG22 VAL 106 HG22 VAL 106 9.870 -23.524 -14.347 636 HG23 VAL 106 HG23 VAL 106 8.214 -23.443 -13.742 637 H THR 107 H THR 107 12.787 -24.930 -12.578 638 HA THR 107 HA THR 107 13.791 -23.574 -15.010 639 HB THR 107 HB THR 107 15.507 -24.652 -13.531 640 HG1 THR 107 HG1 THR 107 16.503 -24.857 -15.373 641 HG21 THR 107 HG21 THR 107 14.162 -27.278 -14.273 642 HG22 THR 107 HG22 THR 107 14.213 -26.561 -12.661 643 HG23 THR 107 HG23 THR 107 15.701 -27.118 -13.430 644 H ILE 108 H ILE 108 13.600 -24.697 -17.086 645 HA ILE 108 HA ILE 108 11.269 -26.537 -17.242 646 HB ILE 108 HB ILE 108 11.956 -24.244 -19.147 647 HG12 ILE 108 HG12 ILE 108 9.581 -24.536 -17.231 648 HG13 ILE 108 HG13 ILE 108 10.964 -23.476 -16.977 649 HG21 ILE 108 HG21 ILE 108 9.631 -26.203 -19.284 650 HG22 ILE 108 HG22 ILE 108 11.003 -26.141 -20.391 651 HG23 ILE 108 HG23 ILE 108 9.850 -24.806 -20.342 652 HD11 ILE 108 HD11 ILE 108 8.917 -23.231 -19.187 653 HD12 ILE 108 HD12 ILE 108 10.311 -22.172 -18.953 654 HD13 ILE 108 HD13 ILE 108 9.035 -22.233 -17.739 655 HA PRO 109 HA PRO 109 14.267 -29.127 -19.554 656 HB2 PRO 109 HB2 PRO 109 11.824 -30.719 -20.259 657 HB3 PRO 109 HB3 PRO 109 13.315 -31.247 -19.465 658 HG2 PRO 109 HG2 PRO 109 11.035 -30.990 -18.072 659 HG3 PRO 109 HG3 PRO 109 12.595 -30.538 -17.348 660 HD2 PRO 109 HD2 PRO 109 10.482 -28.748 -18.567 661 HD3 PRO 109 HD3 PRO 109 11.391 -28.544 -17.051 662 H ASP 110 H ASP 110 14.898 -29.057 -21.675 663 HA ASP 110 HA ASP 110 15.080 -28.427 -23.828 664 HB2 ASP 110 HB2 ASP 110 12.133 -29.209 -23.882 665 HB3 ASP 110 HB3 ASP 110 13.015 -28.741 -25.331 666 H LEU 111 H LEU 111 14.464 -26.411 -21.811 667 HA LEU 111 HA LEU 111 12.810 -24.352 -22.857 668 HB2 LEU 111 HB2 LEU 111 13.564 -24.516 -20.477 669 HB3 LEU 111 HB3 LEU 111 15.201 -24.134 -20.982 670 HG LEU 111 HG LEU 111 14.433 -21.872 -21.720 671 HD11 LEU 111 HD11 LEU 111 12.203 -21.046 -21.125 672 HD12 LEU 111 HD12 LEU 111 11.734 -22.654 -20.570 673 HD13 LEU 111 HD13 LEU 111 12.103 -22.377 -22.274 674 HD21 LEU 111 HD21 LEU 111 14.124 -20.928 -19.468 675 HD22 LEU 111 HD22 LEU 111 15.372 -22.171 -19.478 676 HD23 LEU 111 HD23 LEU 111 13.770 -22.538 -18.832 677 H GLY 112 H GLY 112 16.268 -25.049 -23.084 678 HA2 GLY 112 HA2 GLY 112 16.495 -23.730 -25.666 679 HA3 GLY 112 HA3 GLY 112 17.442 -22.993 -24.371 Start of MODEL 9 1 H GLU 21 H GLU 21 3.011 -2.086 -4.475 2 HA GLU 21 HA GLU 21 5.094 -3.199 -4.920 3 HB2 GLU 21 HB2 GLU 21 5.054 -0.850 -4.141 4 HB3 GLU 21 HB3 GLU 21 5.150 -1.391 -2.468 5 HG2 GLU 21 HG2 GLU 21 7.385 -2.305 -2.868 6 HG3 GLU 21 HG3 GLU 21 7.281 -1.873 -4.574 7 H LYS 22 H LYS 22 4.500 -3.212 -1.354 8 HA LYS 22 HA LYS 22 5.956 -5.710 -1.037 9 HB2 LYS 22 HB2 LYS 22 5.534 -5.499 1.347 10 HB3 LYS 22 HB3 LYS 22 6.081 -3.958 0.727 11 HG2 LYS 22 HG2 LYS 22 4.408 -3.216 2.120 12 HG3 LYS 22 HG3 LYS 22 3.483 -3.413 0.634 13 HD2 LYS 22 HD2 LYS 22 2.237 -4.321 2.539 14 HD3 LYS 22 HD3 LYS 22 2.669 -5.621 1.427 15 HE2 LYS 22 HE2 LYS 22 3.005 -6.346 3.735 16 HE3 LYS 22 HE3 LYS 22 4.565 -6.233 2.919 17 HZ1 LYS 22 HZ1 LYS 22 3.422 -4.197 4.763 18 HZ2 LYS 22 HZ2 LYS 22 4.920 -4.088 3.986 19 HZ3 LYS 22 HZ3 LYS 22 4.654 -5.291 5.138 20 H VAL 23 H VAL 23 4.959 -7.724 -0.354 21 HA VAL 23 HA VAL 23 2.077 -7.970 -0.782 22 HB VAL 23 HB VAL 23 2.910 -8.028 -3.069 23 HG11 VAL 23 HG11 VAL 23 4.489 -9.743 -3.904 24 HG12 VAL 23 HG12 VAL 23 4.726 -10.322 -2.253 25 HG13 VAL 23 HG13 VAL 23 5.239 -8.694 -2.694 26 HG21 VAL 23 HG21 VAL 23 1.999 -10.199 -3.814 27 HG22 VAL 23 HG22 VAL 23 1.013 -9.497 -2.529 28 HG23 VAL 23 HG23 VAL 23 2.122 -10.819 -2.164 29 H THR 24 H THR 24 1.195 -9.546 0.392 30 HA THR 24 HA THR 24 2.732 -11.532 1.843 31 HB THR 24 HB THR 24 -0.290 -11.221 1.511 32 HG1 THR 24 HG1 THR 24 -0.230 -9.805 3.109 33 HG21 THR 24 HG21 THR 24 0.313 -13.475 2.324 34 HG22 THR 24 HG22 THR 24 -0.464 -12.533 3.598 35 HG23 THR 24 HG23 THR 24 1.285 -12.755 3.616 36 H LEU 25 H LEU 25 3.527 -13.191 0.633 37 HA LEU 25 HA LEU 25 2.114 -14.175 -1.744 38 HB2 LEU 25 HB2 LEU 25 4.902 -14.709 -0.639 39 HB3 LEU 25 HB3 LEU 25 4.264 -15.483 -2.086 40 HG LEU 25 HG LEU 25 4.554 -12.459 -1.790 41 HD11 LEU 25 HD11 LEU 25 6.781 -13.468 -1.696 42 HD12 LEU 25 HD12 LEU 25 6.546 -12.585 -3.200 43 HD13 LEU 25 HD13 LEU 25 6.468 -14.348 -3.194 44 HD21 LEU 25 HD21 LEU 25 2.853 -13.140 -3.437 45 HD22 LEU 25 HD22 LEU 25 4.041 -14.152 -4.267 46 HD23 LEU 25 HD23 LEU 25 4.245 -12.399 -4.227 47 H VAL 26 H VAL 26 0.525 -15.510 -1.178 48 HA VAL 26 HA VAL 26 0.779 -17.499 0.955 49 HB VAL 26 HB VAL 26 -1.589 -16.691 -0.804 50 HG11 VAL 26 HG11 VAL 26 -1.585 -18.648 1.526 51 HG12 VAL 26 HG12 VAL 26 -1.840 -19.050 -0.173 52 HG13 VAL 26 HG13 VAL 26 -3.023 -18.061 0.684 53 HG21 VAL 26 HG21 VAL 26 -1.071 -16.080 2.135 54 HG22 VAL 26 HG22 VAL 26 -2.515 -15.629 1.224 55 HG23 VAL 26 HG23 VAL 26 -0.951 -14.928 0.799 56 H ARG 27 H ARG 27 1.607 -19.386 0.417 57 HA ARG 27 HA ARG 27 1.680 -20.427 -2.304 58 HB2 ARG 27 HB2 ARG 27 3.627 -20.517 -0.689 59 HB3 ARG 27 HB3 ARG 27 2.716 -21.656 0.295 60 HG2 ARG 27 HG2 ARG 27 2.775 -23.308 -1.510 61 HG3 ARG 27 HG3 ARG 27 3.562 -22.147 -2.586 62 HD2 ARG 27 HD2 ARG 27 5.533 -22.092 -1.127 63 HD3 ARG 27 HD3 ARG 27 4.744 -23.189 0.012 64 HE ARG 27 HE ARG 27 4.742 -24.861 -1.834 65 HH11 ARG 27 HH11 ARG 27 7.122 -22.291 -1.968 66 HH12 ARG 27 HH12 ARG 27 8.296 -23.257 -2.791 67 HH21 ARG 27 HH21 ARG 27 6.272 -26.114 -2.904 68 HH22 ARG 27 HH22 ARG 27 7.812 -25.444 -3.322 69 H ILE 28 H ILE 28 1.030 -22.784 -2.625 70 HA ILE 28 HA ILE 28 -1.686 -23.078 -2.360 71 HB ILE 28 HB ILE 28 -0.467 -24.311 -4.057 72 HG12 ILE 28 HG12 ILE 28 -1.932 -26.283 -2.237 73 HG13 ILE 28 HG13 ILE 28 -2.715 -25.161 -3.340 74 HG21 ILE 28 HG21 ILE 28 0.872 -26.324 -3.604 75 HG22 ILE 28 HG22 ILE 28 0.676 -26.076 -1.868 76 HG23 ILE 28 HG23 ILE 28 1.573 -24.897 -2.831 77 HD11 ILE 28 HD11 ILE 28 -2.656 -27.398 -4.259 78 HD12 ILE 28 HD12 ILE 28 -0.898 -27.434 -4.134 79 HD13 ILE 28 HD13 ILE 28 -1.682 -26.303 -5.238 80 H ALA 29 H ALA 29 0.807 -24.501 -0.259 81 HA ALA 29 HA ALA 29 -0.825 -26.183 1.294 82 HB1 ALA 29 HB1 ALA 29 1.630 -26.350 1.293 83 HB2 ALA 29 HB2 ALA 29 1.014 -26.182 2.937 84 HB3 ALA 29 HB3 ALA 29 1.755 -24.799 2.123 85 H ASP 30 H ASP 30 0.113 -22.778 1.806 86 HA ASP 30 HA ASP 30 -1.184 -22.441 4.325 87 HB2 ASP 30 HB2 ASP 30 0.654 -20.944 3.545 88 HB3 ASP 30 HB3 ASP 30 -0.406 -20.304 2.292 89 H LEU 31 H LEU 31 -2.197 -21.987 0.973 90 HA LEU 31 HA LEU 31 -4.697 -20.737 1.402 91 HB2 LEU 31 HB2 LEU 31 -3.517 -20.978 -0.835 92 HB3 LEU 31 HB3 LEU 31 -3.965 -22.675 -0.837 93 HG LEU 31 HG LEU 31 -6.421 -21.909 -0.746 94 HD11 LEU 31 HD11 LEU 31 -6.941 -19.642 -1.500 95 HD12 LEU 31 HD12 LEU 31 -5.228 -19.216 -1.457 96 HD13 LEU 31 HD13 LEU 31 -6.078 -19.627 0.038 97 HD21 LEU 31 HD21 LEU 31 -5.417 -22.779 -2.812 98 HD22 LEU 31 HD22 LEU 31 -4.857 -21.160 -3.236 99 HD23 LEU 31 HD23 LEU 31 -6.586 -21.502 -3.151 100 H GLU 32 H GLU 32 -3.713 -24.163 1.321 101 HA GLU 32 HA GLU 32 -6.318 -25.315 1.330 102 HB2 GLU 32 HB2 GLU 32 -3.715 -26.640 2.227 103 HB3 GLU 32 HB3 GLU 32 -5.209 -27.472 1.806 104 HG2 GLU 32 HG2 GLU 32 -3.301 -26.016 -0.029 105 HG3 GLU 32 HG3 GLU 32 -3.689 -27.725 -0.018 106 H ASN 33 H ASN 33 -3.894 -24.962 3.947 107 HA ASN 33 HA ASN 33 -5.544 -26.223 5.918 108 HB2 ASN 33 HB2 ASN 33 -2.994 -24.599 6.297 109 HB3 ASN 33 HB3 ASN 33 -3.797 -25.517 7.567 110 HD21 ASN 33 HD21 ASN 33 -1.598 -25.659 4.962 111 HD22 ASN 33 HD22 ASN 33 -1.312 -27.361 4.988 112 H HIS 34 H HIS 34 -4.911 -22.824 5.072 113 HA HIS 34 HA HIS 34 -6.209 -21.686 7.361 114 HB2 HIS 34 HB2 HIS 34 -4.545 -20.474 5.837 115 HB3 HIS 34 HB3 HIS 34 -5.848 -20.291 4.673 116 HD1 HIS 34 HD1 HIS 34 -4.242 -18.534 7.312 117 HD2 HIS 34 HD2 HIS 34 -8.176 -18.828 6.005 118 HE1 HIS 34 HE1 HIS 34 -5.407 -16.497 8.207 119 HE2 HIS 34 HE2 HIS 34 -7.770 -16.681 7.376 120 H ASN 35 H ASN 35 -7.286 -22.600 4.112 121 HA ASN 35 HA ASN 35 -9.898 -21.588 4.105 122 HB2 ASN 35 HB2 ASN 35 -8.783 -22.673 2.131 123 HB3 ASN 35 HB3 ASN 35 -8.958 -24.237 2.920 124 HD21 ASN 35 HD21 ASN 35 -10.302 -25.164 1.389 125 HD22 ASN 35 HD22 ASN 35 -11.897 -24.606 1.046 126 H ASN 36 H ASN 36 -8.577 -24.558 5.509 127 HA ASN 36 HA ASN 36 -11.128 -25.532 6.511 128 HB2 ASN 36 HB2 ASN 36 -8.290 -26.621 6.806 129 HB3 ASN 36 HB3 ASN 36 -9.753 -27.459 7.311 130 HD21 ASN 36 HD21 ASN 36 -7.736 -28.303 5.383 131 HD22 ASN 36 HD22 ASN 36 -8.561 -28.548 3.885 132 H ASP 37 H ASP 37 -8.582 -23.514 7.652 133 HA ASP 37 HA ASP 37 -8.715 -23.983 10.462 134 HB2 ASP 37 HB2 ASP 37 -6.828 -22.788 9.329 135 HB3 ASP 37 HB3 ASP 37 -7.894 -21.442 8.968 136 H GLY 38 H GLY 38 -10.585 -22.042 8.234 137 HA2 GLY 38 HA2 GLY 38 -12.986 -21.830 9.212 138 HA3 GLY 38 HA3 GLY 38 -12.181 -20.782 10.380 139 H GLY 39 H GLY 39 -10.257 -19.805 8.366 140 HA2 GLY 39 HA2 GLY 39 -11.859 -17.731 7.093 141 HA3 GLY 39 HA3 GLY 39 -10.106 -17.886 7.057 142 H PHE 40 H PHE 40 -13.046 -18.587 5.400 143 HA PHE 40 HA PHE 40 -12.082 -20.743 3.771 144 HB2 PHE 40 HB2 PHE 40 -14.572 -20.177 4.363 145 HB3 PHE 40 HB3 PHE 40 -14.479 -18.975 3.087 146 HD1 PHE 40 HD1 PHE 40 -13.862 -19.828 0.685 147 HD2 PHE 40 HD2 PHE 40 -15.079 -22.438 3.849 148 HE1 PHE 40 HE1 PHE 40 -14.436 -21.564 -0.968 149 HE2 PHE 40 HE2 PHE 40 -15.647 -24.170 2.192 150 HZ PHE 40 HZ PHE 40 -15.328 -23.736 -0.210 151 H TRP 41 H TRP 41 -10.783 -20.510 2.034 152 HA TRP 41 HA TRP 41 -10.291 -17.804 0.939 153 HB2 TRP 41 HB2 TRP 41 -8.385 -19.890 1.995 154 HB3 TRP 41 HB3 TRP 41 -7.850 -18.903 0.646 155 HD1 TRP 41 HD1 TRP 41 -9.965 -16.849 2.950 156 HE1 TRP 41 HE1 TRP 41 -8.451 -15.321 4.359 157 HE3 TRP 41 HE3 TRP 41 -5.449 -19.051 1.982 158 HZ2 TRP 41 HZ2 TRP 41 -5.718 -15.068 4.966 159 HZ3 TRP 41 HZ3 TRP 41 -3.430 -18.103 3.021 160 HH2 TRP 41 HH2 TRP 41 -3.561 -16.150 4.485 161 H THR 42 H THR 42 -9.550 -17.650 -1.160 162 HA THR 42 HA THR 42 -9.471 -19.952 -2.941 163 HB THR 42 HB THR 42 -11.876 -19.308 -2.992 164 HG1 THR 42 HG1 THR 42 -11.313 -18.396 -5.474 165 HG21 THR 42 HG21 THR 42 -12.604 -17.146 -3.928 166 HG22 THR 42 HG22 THR 42 -10.932 -16.591 -4.005 167 HG23 THR 42 HG23 THR 42 -11.688 -16.893 -2.438 168 H VAL 43 H VAL 43 -8.318 -19.516 -4.862 169 HA VAL 43 HA VAL 43 -6.942 -16.918 -5.037 170 HB VAL 43 HB VAL 43 -5.314 -18.628 -5.201 171 HG11 VAL 43 HG11 VAL 43 -5.415 -20.571 -6.731 172 HG12 VAL 43 HG12 VAL 43 -7.035 -20.082 -7.234 173 HG13 VAL 43 HG13 VAL 43 -6.741 -20.570 -5.564 174 HG21 VAL 43 HG21 VAL 43 -5.917 -17.791 -8.073 175 HG22 VAL 43 HG22 VAL 43 -4.361 -18.364 -7.467 176 HG23 VAL 43 HG23 VAL 43 -5.023 -16.835 -6.884 177 H ILE 44 H ILE 44 -7.839 -15.436 -6.255 178 HA ILE 44 HA ILE 44 -9.019 -16.076 -8.891 179 HB ILE 44 HB ILE 44 -10.275 -14.143 -6.869 180 HG12 ILE 44 HG12 ILE 44 -11.435 -16.754 -7.950 181 HG13 ILE 44 HG13 ILE 44 -10.803 -16.516 -6.325 182 HG21 ILE 44 HG21 ILE 44 -10.445 -13.291 -9.167 183 HG22 ILE 44 HG22 ILE 44 -12.030 -13.743 -8.547 184 HG23 ILE 44 HG23 ILE 44 -11.200 -14.800 -9.690 185 HD11 ILE 44 HD11 ILE 44 -13.221 -15.157 -7.508 186 HD12 ILE 44 HD12 ILE 44 -12.579 -14.880 -5.886 187 HD13 ILE 44 HD13 ILE 44 -13.209 -16.464 -6.328 188 H ASP 45 H ASP 45 -8.189 -14.699 -10.435 189 HA ASP 45 HA ASP 45 -6.982 -13.060 -11.473 190 HB2 ASP 45 HB2 ASP 45 -8.775 -11.606 -10.597 191 HB3 ASP 45 HB3 ASP 45 -7.937 -11.431 -9.068 192 H GLY 46 H GLY 46 -5.677 -14.910 -9.669 193 HA2 GLY 46 HA2 GLY 46 -3.568 -15.394 -8.910 194 HA3 GLY 46 HA3 GLY 46 -3.044 -13.816 -9.462 195 H LYS 47 H LYS 47 -5.632 -13.328 -7.435 196 HA LYS 47 HA LYS 47 -3.939 -12.614 -5.131 197 HB2 LYS 47 HB2 LYS 47 -6.889 -11.976 -5.564 198 HB3 LYS 47 HB3 LYS 47 -5.779 -11.202 -4.437 199 HG2 LYS 47 HG2 LYS 47 -5.578 -11.004 -7.459 200 HG3 LYS 47 HG3 LYS 47 -6.422 -9.831 -6.440 201 HD2 LYS 47 HD2 LYS 47 -4.323 -9.284 -5.294 202 HD3 LYS 47 HD3 LYS 47 -3.458 -10.507 -6.238 203 HE2 LYS 47 HE2 LYS 47 -4.819 -8.026 -7.367 204 HE3 LYS 47 HE3 LYS 47 -3.082 -8.243 -7.143 205 HZ1 LYS 47 HZ1 LYS 47 -3.677 -8.675 -9.420 206 HZ2 LYS 47 HZ2 LYS 47 -4.830 -9.822 -8.960 207 HZ3 LYS 47 HZ3 LYS 47 -3.185 -10.123 -8.696 208 H VAL 48 H VAL 48 -5.085 -12.977 -2.970 209 HA VAL 48 HA VAL 48 -6.694 -15.463 -2.860 210 HB VAL 48 HB VAL 48 -4.719 -14.433 -0.752 211 HG11 VAL 48 HG11 VAL 48 -6.667 -15.505 0.319 212 HG12 VAL 48 HG12 VAL 48 -5.238 -16.526 0.483 213 HG13 VAL 48 HG13 VAL 48 -6.473 -16.926 -0.712 214 HG21 VAL 48 HG21 VAL 48 -3.557 -15.436 -2.657 215 HG22 VAL 48 HG22 VAL 48 -4.574 -16.876 -2.549 216 HG23 VAL 48 HG23 VAL 48 -3.442 -16.498 -1.251 217 H TYR 49 H TYR 49 -8.722 -15.014 -2.229 218 HA TYR 49 HA TYR 49 -9.288 -12.590 -0.606 219 HB2 TYR 49 HB2 TYR 49 -11.114 -14.087 -2.539 220 HB3 TYR 49 HB3 TYR 49 -11.574 -12.679 -1.591 221 HD1 TYR 49 HD1 TYR 49 -10.628 -10.422 -2.148 222 HD2 TYR 49 HD2 TYR 49 -9.828 -13.839 -4.590 223 HE1 TYR 49 HE1 TYR 49 -9.875 -8.952 -3.965 224 HE2 TYR 49 HE2 TYR 49 -9.080 -12.351 -6.399 225 HH TYR 49 HH TYR 49 -9.302 -10.077 -7.142 226 H ASP 50 H ASP 50 -10.712 -12.766 1.139 227 HA ASP 50 HA ASP 50 -11.144 -15.449 2.233 228 HB2 ASP 50 HB2 ASP 50 -10.183 -13.704 3.719 229 HB3 ASP 50 HB3 ASP 50 -11.642 -12.736 3.517 230 H ILE 51 H ILE 51 -12.774 -16.299 1.132 231 HA ILE 51 HA ILE 51 -15.225 -15.174 0.367 232 HB ILE 51 HB ILE 51 -14.375 -18.043 0.894 233 HG12 ILE 51 HG12 ILE 51 -13.294 -16.923 -1.034 234 HG13 ILE 51 HG13 ILE 51 -14.314 -18.257 -1.558 235 HG21 ILE 51 HG21 ILE 51 -16.408 -18.845 -0.303 236 HG22 ILE 51 HG22 ILE 51 -17.054 -17.204 -0.265 237 HG23 ILE 51 HG23 ILE 51 -16.780 -18.076 1.243 238 HD11 ILE 51 HD11 ILE 51 -15.052 -15.334 -1.676 239 HD12 ILE 51 HD12 ILE 51 -16.043 -16.683 -2.243 240 HD13 ILE 51 HD13 ILE 51 -14.503 -16.331 -3.022 241 H LYS 52 H LYS 52 -14.189 -16.442 3.508 242 HA LYS 52 HA LYS 52 -16.698 -16.904 4.710 243 HB2 LYS 52 HB2 LYS 52 -14.563 -17.581 5.777 244 HB3 LYS 52 HB3 LYS 52 -14.139 -15.886 6.018 245 HG2 LYS 52 HG2 LYS 52 -16.269 -15.699 7.442 246 HG3 LYS 52 HG3 LYS 52 -16.356 -17.460 7.363 247 HD2 LYS 52 HD2 LYS 52 -15.319 -16.804 9.453 248 HD3 LYS 52 HD3 LYS 52 -14.106 -17.587 8.443 249 HE2 LYS 52 HE2 LYS 52 -14.358 -14.575 8.475 250 HE3 LYS 52 HE3 LYS 52 -13.476 -15.413 9.746 251 HZ1 LYS 52 HZ1 LYS 52 -12.066 -14.618 7.928 252 HZ2 LYS 52 HZ2 LYS 52 -12.857 -15.644 6.850 253 HZ3 LYS 52 HZ3 LYS 52 -11.968 -16.291 8.137 254 H ASP 53 H ASP 53 -14.662 -13.955 4.728 255 HA ASP 53 HA ASP 53 -16.535 -12.247 6.034 256 HB2 ASP 53 HB2 ASP 53 -14.134 -11.704 6.042 257 HB3 ASP 53 HB3 ASP 53 -14.128 -11.555 4.287 258 H PHE 54 H PHE 54 -15.752 -12.850 2.626 259 HA PHE 54 HA PHE 54 -17.314 -11.056 1.241 260 HB2 PHE 54 HB2 PHE 54 -15.773 -12.699 0.203 261 HB3 PHE 54 HB3 PHE 54 -16.869 -14.007 0.610 262 HD1 PHE 54 HD1 PHE 54 -19.012 -14.279 -0.641 263 HD2 PHE 54 HD2 PHE 54 -16.161 -11.287 -1.726 264 HE1 PHE 54 HE1 PHE 54 -20.114 -14.015 -2.823 265 HE2 PHE 54 HE2 PHE 54 -17.272 -11.033 -3.903 266 HZ PHE 54 HZ PHE 54 -19.247 -12.386 -4.452 267 H GLN 55 H GLN 55 -18.336 -14.162 2.604 268 HA GLN 55 HA GLN 55 -21.060 -13.959 1.758 269 HB2 GLN 55 HB2 GLN 55 -19.643 -15.790 3.695 270 HB3 GLN 55 HB3 GLN 55 -21.360 -15.938 3.319 271 HG2 GLN 55 HG2 GLN 55 -19.097 -16.133 1.308 272 HG3 GLN 55 HG3 GLN 55 -19.974 -17.488 2.011 273 HE21 GLN 55 HE21 GLN 55 -22.108 -17.879 1.361 274 HE22 GLN 55 HE22 GLN 55 -22.803 -17.156 -0.046 275 H THR 56 H THR 56 -19.372 -13.119 4.725 276 HA THR 56 HA THR 56 -21.602 -12.477 6.336 277 HB THR 56 HB THR 56 -18.923 -11.013 6.360 278 HG1 THR 56 HG1 THR 56 -18.301 -13.070 6.587 279 HG21 THR 56 HG21 THR 56 -20.666 -10.016 7.832 280 HG22 THR 56 HG22 THR 56 -19.347 -10.718 8.767 281 HG23 THR 56 HG23 THR 56 -20.881 -11.579 8.624 282 H GLN 57 H GLN 57 -19.876 -10.632 3.834 283 HA GLN 57 HA GLN 57 -21.381 -8.203 4.187 284 HB2 GLN 57 HB2 GLN 57 -19.581 -8.991 1.868 285 HB3 GLN 57 HB3 GLN 57 -20.128 -7.372 2.264 286 HG2 GLN 57 HG2 GLN 57 -18.184 -9.087 3.820 287 HG3 GLN 57 HG3 GLN 57 -17.820 -7.621 2.922 288 HE21 GLN 57 HE21 GLN 57 -17.281 -8.286 5.698 289 HE22 GLN 57 HE22 GLN 57 -18.062 -7.069 6.652 290 H SER 58 H SER 58 -21.745 -11.110 2.190 291 HA SER 58 HA SER 58 -23.862 -9.921 0.558 292 HB2 SER 58 HB2 SER 58 -24.048 -12.147 -0.492 293 HB3 SER 58 HB3 SER 58 -22.367 -11.617 -0.455 294 HG SER 58 HG SER 58 -22.294 -13.664 0.257 295 H LEU 59 H LEU 59 -23.633 -11.242 3.645 296 HA LEU 59 HA LEU 59 -26.277 -12.344 3.940 297 HB2 LEU 59 HB2 LEU 59 -24.231 -12.925 5.333 298 HB3 LEU 59 HB3 LEU 59 -24.346 -11.353 6.091 299 HG LEU 59 HG LEU 59 -26.608 -13.387 6.292 300 HD11 LEU 59 HD11 LEU 59 -24.257 -13.134 8.199 301 HD12 LEU 59 HD12 LEU 59 -24.584 -14.494 7.121 302 HD13 LEU 59 HD13 LEU 59 -25.691 -14.138 8.445 303 HD21 LEU 59 HD21 LEU 59 -27.210 -12.169 8.350 304 HD22 LEU 59 HD22 LEU 59 -27.222 -11.098 6.951 305 HD23 LEU 59 HD23 LEU 59 -25.873 -11.044 8.090 306 H THR 60 H THR 60 -24.701 -9.207 4.547 307 HA THR 60 HA THR 60 -26.997 -8.012 5.809 308 HB THR 60 HB THR 60 -24.728 -7.320 6.468 309 HG1 THR 60 HG1 THR 60 -26.254 -5.769 6.873 310 HG21 THR 60 HG21 THR 60 -23.589 -7.445 4.283 311 HG22 THR 60 HG22 THR 60 -23.354 -5.869 5.038 312 HG23 THR 60 HG23 THR 60 -24.506 -6.045 3.713 313 H GLU 61 H GLU 61 -27.991 -6.001 5.074 314 HA GLU 61 HA GLU 61 -29.397 -6.546 2.659 315 HB2 GLU 61 HB2 GLU 61 -30.515 -5.578 4.624 316 HB3 GLU 61 HB3 GLU 61 -29.486 -4.152 4.544 317 HG2 GLU 61 HG2 GLU 61 -30.534 -3.733 2.222 318 HG3 GLU 61 HG3 GLU 61 -31.712 -4.972 2.656 319 H ASN 62 H ASN 62 -27.871 -3.441 3.578 320 HA ASN 62 HA ASN 62 -27.515 -2.773 0.764 321 HB2 ASN 62 HB2 ASN 62 -26.789 -0.505 1.675 322 HB3 ASN 62 HB3 ASN 62 -28.457 -0.964 1.967 323 HD21 ASN 62 HD21 ASN 62 -29.083 -1.585 4.099 324 HD22 ASN 62 HD22 ASN 62 -28.169 -1.057 5.468 325 H SER 63 H SER 63 -25.871 -3.757 -0.096 326 HA SER 63 HA SER 63 -23.145 -3.259 0.731 327 HB2 SER 63 HB2 SER 63 -23.692 -5.278 2.075 328 HB3 SER 63 HB3 SER 63 -24.245 -6.115 0.625 329 HG SER 63 HG SER 63 -21.991 -6.477 1.451 330 H ILE 64 H ILE 64 -21.625 -4.057 -0.909 331 HA ILE 64 HA ILE 64 -22.444 -3.728 -3.620 332 HB ILE 64 HB ILE 64 -20.116 -4.434 -4.207 333 HG12 ILE 64 HG12 ILE 64 -19.644 -4.803 -1.211 334 HG13 ILE 64 HG13 ILE 64 -19.898 -6.143 -2.319 335 HG21 ILE 64 HG21 ILE 64 -18.935 -2.562 -3.117 336 HG22 ILE 64 HG22 ILE 64 -20.241 -2.416 -1.939 337 HG23 ILE 64 HG23 ILE 64 -20.551 -2.084 -3.645 338 HD11 ILE 64 HD11 ILE 64 -17.616 -4.188 -2.383 339 HD12 ILE 64 HD12 ILE 64 -17.863 -5.497 -3.539 340 HD13 ILE 64 HD13 ILE 64 -17.561 -5.862 -1.840 341 H LEU 65 H LEU 65 -22.502 -6.439 -1.514 342 HA LEU 65 HA LEU 65 -22.429 -8.440 -3.688 343 HB2 LEU 65 HB2 LEU 65 -22.177 -8.809 -0.686 344 HB3 LEU 65 HB3 LEU 65 -22.032 -10.087 -1.892 345 HG LEU 65 HG LEU 65 -20.144 -7.729 -1.531 346 HD11 LEU 65 HD11 LEU 65 -18.499 -9.389 -0.839 347 HD12 LEU 65 HD12 LEU 65 -19.694 -10.680 -1.008 348 HD13 LEU 65 HD13 LEU 65 -19.915 -9.425 0.208 349 HD21 LEU 65 HD21 LEU 65 -20.330 -8.283 -3.904 350 HD22 LEU 65 HD22 LEU 65 -20.004 -9.983 -3.561 351 HD23 LEU 65 HD23 LEU 65 -18.756 -8.769 -3.281 352 H ALA 66 H ALA 66 -24.729 -6.666 -2.228 353 HA ALA 66 HA ALA 66 -26.758 -8.636 -1.687 354 HB1 ALA 66 HB1 ALA 66 -26.891 -6.397 -0.692 355 HB2 ALA 66 HB2 ALA 66 -28.317 -6.707 -1.690 356 HB3 ALA 66 HB3 ALA 66 -27.022 -5.669 -2.298 357 H GLN 67 H GLN 67 -25.594 -6.952 -4.529 358 HA GLN 67 HA GLN 67 -27.657 -7.873 -6.345 359 HB2 GLN 67 HB2 GLN 67 -26.208 -6.899 -8.109 360 HB3 GLN 67 HB3 GLN 67 -26.467 -5.770 -6.781 361 HG2 GLN 67 HG2 GLN 67 -24.229 -6.390 -5.866 362 HG3 GLN 67 HG3 GLN 67 -23.974 -7.433 -7.262 363 HE21 GLN 67 HE21 GLN 67 -24.201 -4.135 -6.144 364 HE22 GLN 67 HE22 GLN 67 -23.492 -3.398 -7.535 365 H PHE 68 H PHE 68 -25.125 -9.452 -4.826 366 HA PHE 68 HA PHE 68 -24.909 -11.550 -6.920 367 HB2 PHE 68 HB2 PHE 68 -22.913 -10.794 -4.720 368 HB3 PHE 68 HB3 PHE 68 -22.721 -12.138 -5.839 369 HD1 PHE 68 HD1 PHE 68 -22.936 -11.431 -8.434 370 HD2 PHE 68 HD2 PHE 68 -21.745 -8.812 -5.276 371 HE1 PHE 68 HE1 PHE 68 -21.816 -9.962 -10.058 372 HE2 PHE 68 HE2 PHE 68 -20.630 -7.347 -6.910 373 HZ PHE 68 HZ PHE 68 -20.669 -7.921 -9.306 374 H ALA 69 H ALA 69 -26.706 -10.930 -4.372 375 HA ALA 69 HA ALA 69 -26.288 -13.074 -2.523 376 HB1 ALA 69 HB1 ALA 69 -28.461 -12.377 -1.582 377 HB2 ALA 69 HB2 ALA 69 -28.752 -11.345 -2.984 378 HB3 ALA 69 HB3 ALA 69 -27.425 -10.980 -1.879 379 H GLY 70 H GLY 70 -26.409 -15.127 -3.280 380 HA2 GLY 70 HA2 GLY 70 -28.141 -16.918 -3.656 381 HA3 GLY 70 HA3 GLY 70 -28.654 -15.970 -5.051 382 H GLU 71 H GLU 71 -26.040 -15.145 -5.838 383 HA GLU 71 HA GLU 71 -25.213 -17.336 -7.489 384 HB2 GLU 71 HB2 GLU 71 -25.083 -14.987 -8.254 385 HB3 GLU 71 HB3 GLU 71 -23.941 -14.600 -6.978 386 HG2 GLU 71 HG2 GLU 71 -22.814 -14.795 -9.135 387 HG3 GLU 71 HG3 GLU 71 -22.246 -16.039 -8.022 388 H ASP 72 H ASP 72 -23.271 -18.524 -7.422 389 HA ASP 72 HA ASP 72 -22.282 -19.454 -5.000 390 HB2 ASP 72 HB2 ASP 72 -21.965 -20.713 -7.083 391 HB3 ASP 72 HB3 ASP 72 -20.942 -19.448 -7.741 392 HA PRO 73 HA PRO 73 -19.880 -16.083 -3.263 393 HB2 PRO 73 HB2 PRO 73 -18.006 -18.312 -2.439 394 HB3 PRO 73 HB3 PRO 73 -18.676 -16.989 -1.471 395 HG2 PRO 73 HG2 PRO 73 -19.685 -19.455 -1.285 396 HG3 PRO 73 HG3 PRO 73 -20.745 -18.037 -1.233 397 HD2 PRO 73 HD2 PRO 73 -20.335 -20.006 -3.438 398 HD3 PRO 73 HD3 PRO 73 -21.789 -19.079 -2.999 399 H VAL 74 H VAL 74 -17.988 -18.620 -4.909 400 HA VAL 74 HA VAL 74 -15.629 -16.995 -5.211 401 HB VAL 74 HB VAL 74 -16.230 -19.680 -6.532 402 HG11 VAL 74 HG11 VAL 74 -13.570 -18.361 -5.870 403 HG12 VAL 74 HG12 VAL 74 -14.268 -18.526 -7.484 404 HG13 VAL 74 HG13 VAL 74 -13.775 -19.964 -6.584 405 HG21 VAL 74 HG21 VAL 74 -16.563 -19.887 -4.095 406 HG22 VAL 74 HG22 VAL 74 -14.974 -19.177 -3.800 407 HG23 VAL 74 HG23 VAL 74 -15.103 -20.750 -4.590 408 H VAL 75 H VAL 75 -18.180 -18.207 -7.376 409 HA VAL 75 HA VAL 75 -17.233 -17.069 -9.817 410 HB VAL 75 HB VAL 75 -20.082 -17.861 -9.040 411 HG11 VAL 75 HG11 VAL 75 -20.146 -16.361 -10.986 412 HG12 VAL 75 HG12 VAL 75 -20.539 -18.006 -11.485 413 HG13 VAL 75 HG13 VAL 75 -18.938 -17.343 -11.819 414 HG21 VAL 75 HG21 VAL 75 -19.613 -19.982 -10.227 415 HG22 VAL 75 HG22 VAL 75 -18.510 -19.747 -8.870 416 HG23 VAL 75 HG23 VAL 75 -17.951 -19.455 -10.519 417 H ALA 76 H ALA 76 -19.343 -15.894 -7.279 418 HA ALA 76 HA ALA 76 -20.395 -13.568 -8.521 419 HB1 ALA 76 HB1 ALA 76 -21.126 -12.934 -6.244 420 HB2 ALA 76 HB2 ALA 76 -20.120 -14.216 -5.561 421 HB3 ALA 76 HB3 ALA 76 -21.496 -14.627 -6.586 422 H LEU 77 H LEU 77 -17.523 -14.254 -6.654 423 HA LEU 77 HA LEU 77 -16.673 -11.561 -6.238 424 HB2 LEU 77 HB2 LEU 77 -16.042 -13.768 -4.987 425 HB3 LEU 77 HB3 LEU 77 -14.827 -13.959 -6.234 426 HG LEU 77 HG LEU 77 -14.982 -11.487 -4.461 427 HD11 LEU 77 HD11 LEU 77 -13.268 -12.470 -3.031 428 HD12 LEU 77 HD12 LEU 77 -13.333 -13.979 -3.946 429 HD13 LEU 77 HD13 LEU 77 -14.738 -13.441 -3.018 430 HD21 LEU 77 HD21 LEU 77 -12.613 -11.162 -5.051 431 HD22 LEU 77 HD22 LEU 77 -13.632 -11.163 -6.487 432 HD23 LEU 77 HD23 LEU 77 -12.664 -12.587 -6.096 433 H GLU 78 H GLU 78 -16.061 -14.016 -8.742 434 HA GLU 78 HA GLU 78 -14.122 -12.529 -10.233 435 HB2 GLU 78 HB2 GLU 78 -16.017 -14.722 -11.175 436 HB3 GLU 78 HB3 GLU 78 -14.627 -14.110 -12.079 437 HG2 GLU 78 HG2 GLU 78 -13.183 -14.858 -10.122 438 HG3 GLU 78 HG3 GLU 78 -14.609 -15.679 -9.484 439 H ALA 79 H ALA 79 -17.648 -12.811 -10.405 440 HA ALA 79 HA ALA 79 -18.146 -11.077 -12.591 441 HB1 ALA 79 HB1 ALA 79 -19.820 -12.676 -11.741 442 HB2 ALA 79 HB2 ALA 79 -20.471 -11.034 -11.742 443 HB3 ALA 79 HB3 ALA 79 -19.931 -11.772 -10.229 444 H ALA 80 H ALA 80 -17.637 -10.567 -9.157 445 HA ALA 80 HA ALA 80 -18.270 -7.781 -9.063 446 HB1 ALA 80 HB1 ALA 80 -18.302 -9.197 -7.050 447 HB2 ALA 80 HB2 ALA 80 -17.217 -7.822 -6.844 448 HB3 ALA 80 HB3 ALA 80 -16.556 -9.429 -7.169 449 H LEU 81 H LEU 81 -15.279 -9.620 -9.687 450 HA LEU 81 HA LEU 81 -13.564 -7.307 -9.731 451 HB2 LEU 81 HB2 LEU 81 -13.135 -10.148 -10.683 452 HB3 LEU 81 HB3 LEU 81 -11.898 -8.904 -10.826 453 HG LEU 81 HG LEU 81 -13.076 -9.988 -8.230 454 HD11 LEU 81 HD11 LEU 81 -11.516 -11.522 -9.301 455 HD12 LEU 81 HD12 LEU 81 -10.834 -10.863 -7.818 456 HD13 LEU 81 HD13 LEU 81 -10.288 -10.257 -9.386 457 HD21 LEU 81 HD21 LEU 81 -11.429 -8.558 -7.061 458 HD22 LEU 81 HD22 LEU 81 -12.615 -7.608 -7.949 459 HD23 LEU 81 HD23 LEU 81 -10.985 -7.810 -8.600 460 H GLN 82 H GLN 82 -15.584 -8.923 -12.040 461 HA GLN 82 HA GLN 82 -14.562 -7.622 -14.387 462 HB2 GLN 82 HB2 GLN 82 -15.883 -9.763 -14.452 463 HB3 GLN 82 HB3 GLN 82 -17.307 -8.874 -13.931 464 HG2 GLN 82 HG2 GLN 82 -17.390 -9.254 -16.332 465 HG3 GLN 82 HG3 GLN 82 -17.224 -7.528 -16.004 466 HE21 GLN 82 HE21 GLN 82 -15.605 -10.390 -17.210 467 HE22 GLN 82 HE22 GLN 82 -14.284 -9.568 -17.962 468 H PHE 83 H PHE 83 -17.138 -6.981 -12.039 469 HA PHE 83 HA PHE 83 -18.080 -4.599 -13.383 470 HB2 PHE 83 HB2 PHE 83 -19.585 -6.156 -12.095 471 HB3 PHE 83 HB3 PHE 83 -18.791 -5.646 -10.609 472 HD1 PHE 83 HD1 PHE 83 -19.675 -3.376 -13.442 473 HD2 PHE 83 HD2 PHE 83 -20.733 -4.729 -9.527 474 HE1 PHE 83 HE1 PHE 83 -21.318 -1.563 -13.257 475 HE2 PHE 83 HE2 PHE 83 -22.375 -2.910 -9.352 476 HZ PHE 83 HZ PHE 83 -22.672 -1.325 -11.212 477 H GLU 84 H GLU 84 -17.042 -2.735 -13.249 478 HA GLU 84 HA GLU 84 -14.671 -2.302 -11.875 479 HB2 GLU 84 HB2 GLU 84 -14.823 0.024 -12.702 480 HB3 GLU 84 HB3 GLU 84 -15.214 -1.164 -13.943 481 HG2 GLU 84 HG2 GLU 84 -17.635 -0.732 -13.597 482 HG3 GLU 84 HG3 GLU 84 -17.238 0.478 -12.375 483 H ASP 85 H ASP 85 -17.929 -1.489 -10.927 484 HA ASP 85 HA ASP 85 -17.365 0.397 -8.881 485 HB2 ASP 85 HB2 ASP 85 -19.565 0.342 -9.892 486 HB3 ASP 85 HB3 ASP 85 -19.784 -1.350 -9.481 487 H THR 86 H THR 86 -17.721 -3.132 -8.874 488 HA THR 86 HA THR 86 -17.672 -3.260 -5.938 489 HB THR 86 HB THR 86 -18.308 -5.699 -6.348 490 HG1 THR 86 HG1 THR 86 -17.503 -5.284 -8.737 491 HG21 THR 86 HG21 THR 86 -20.177 -3.662 -7.631 492 HG22 THR 86 HG22 THR 86 -20.033 -3.932 -5.898 493 HG23 THR 86 HG23 THR 86 -20.639 -5.221 -6.936 494 H ARG 87 H ARG 87 -15.499 -3.737 -8.590 495 HA ARG 87 HA ARG 87 -13.845 -5.813 -7.475 496 HB2 ARG 87 HB2 ARG 87 -12.276 -5.335 -9.275 497 HB3 ARG 87 HB3 ARG 87 -13.914 -5.319 -9.919 498 HG2 ARG 87 HG2 ARG 87 -13.920 -2.879 -9.944 499 HG3 ARG 87 HG3 ARG 87 -12.327 -2.842 -9.191 500 HD2 ARG 87 HD2 ARG 87 -11.366 -3.939 -11.188 501 HD3 ARG 87 HD3 ARG 87 -12.969 -3.932 -11.946 502 HE ARG 87 HE ARG 87 -12.527 -1.315 -11.228 503 HH11 ARG 87 HH11 ARG 87 -10.790 -3.590 -13.268 504 HH12 ARG 87 HH12 ARG 87 -10.152 -2.357 -14.302 505 HH21 ARG 87 HH21 ARG 87 -11.693 0.291 -12.591 506 HH22 ARG 87 HH22 ARG 87 -10.676 -0.154 -13.927 507 H GLU 88 H GLU 88 -13.855 -2.332 -7.340 508 HA GLU 88 HA GLU 88 -11.202 -1.912 -6.387 509 HB2 GLU 88 HB2 GLU 88 -12.039 0.421 -5.946 510 HB3 GLU 88 HB3 GLU 88 -12.351 -0.153 -7.582 511 HG2 GLU 88 HG2 GLU 88 -14.683 -0.655 -6.974 512 HG3 GLU 88 HG3 GLU 88 -14.384 -0.099 -5.331 513 H SER 89 H SER 89 -14.226 -2.664 -4.847 514 HA SER 89 HA SER 89 -13.416 -1.941 -2.162 515 HB2 SER 89 HB2 SER 89 -15.784 -1.801 -2.880 516 HB3 SER 89 HB3 SER 89 -15.814 -3.541 -3.145 517 HG SER 89 HG SER 89 -16.697 -2.947 -1.118 518 H MET 90 H MET 90 -12.955 -4.655 -4.242 519 HA MET 90 HA MET 90 -12.762 -6.726 -2.266 520 HB2 MET 90 HB2 MET 90 -11.806 -6.621 -5.144 521 HB3 MET 90 HB3 MET 90 -11.688 -8.061 -4.132 522 HG2 MET 90 HG2 MET 90 -14.241 -6.649 -4.952 523 HG3 MET 90 HG3 MET 90 -13.649 -8.206 -5.551 524 HE1 MET 90 HE1 MET 90 -16.263 -8.963 -4.838 525 HE2 MET 90 HE2 MET 90 -16.538 -7.393 -4.079 526 HE3 MET 90 HE3 MET 90 -16.829 -8.877 -3.171 527 H HIS 91 H HIS 91 -10.772 -4.127 -2.732 528 HA HIS 91 HA HIS 91 -8.196 -5.140 -2.241 529 HB2 HIS 91 HB2 HIS 91 -7.573 -2.918 -1.643 530 HB3 HIS 91 HB3 HIS 91 -8.856 -2.721 -2.821 531 HD1 HIS 91 HD1 HIS 91 -7.895 -1.858 0.627 532 HD2 HIS 91 HD2 HIS 91 -11.380 -1.834 -1.647 533 HE1 HIS 91 HE1 HIS 91 -9.522 -0.422 1.896 534 HE2 HIS 91 HE2 HIS 91 -11.530 -0.249 0.390 535 H ALA 92 H ALA 92 -10.940 -4.601 -0.120 536 HA ALA 92 HA ALA 92 -9.519 -4.970 2.378 537 HB1 ALA 92 HB1 ALA 92 -11.760 -4.878 3.404 538 HB2 ALA 92 HB2 ALA 92 -12.510 -4.945 1.804 539 HB3 ALA 92 HB3 ALA 92 -11.531 -3.550 2.263 540 H PHE 93 H PHE 93 -11.040 -7.018 0.028 541 HA PHE 93 HA PHE 93 -11.392 -9.300 1.832 542 HB2 PHE 93 HB2 PHE 93 -11.963 -8.998 -1.156 543 HB3 PHE 93 HB3 PHE 93 -12.358 -10.413 -0.188 544 HD1 PHE 93 HD1 PHE 93 -13.106 -6.763 -0.537 545 HD2 PHE 93 HD2 PHE 93 -14.430 -10.522 1.008 546 HE1 PHE 93 HE1 PHE 93 -15.285 -5.765 0.016 547 HE2 PHE 93 HE2 PHE 93 -16.599 -9.502 1.567 548 HZ PHE 93 HZ PHE 93 -17.031 -7.142 1.074 549 H CYS 94 H CYS 94 -9.095 -8.107 -0.554 550 HA CYS 94 HA CYS 94 -7.799 -10.664 -0.990 551 HB2 CYS 94 HB2 CYS 94 -6.139 -9.388 -2.309 552 HB3 CYS 94 HB3 CYS 94 -7.782 -8.999 -2.799 553 HG CYS 94 HG CYS 94 -6.576 -6.890 -0.511 554 H VAL 95 H VAL 95 -6.814 -11.544 0.676 555 HA VAL 95 HA VAL 95 -5.505 -10.109 2.797 556 HB VAL 95 HB VAL 95 -5.333 -13.095 2.183 557 HG11 VAL 95 HG11 VAL 95 -4.921 -11.594 4.806 558 HG12 VAL 95 HG12 VAL 95 -3.659 -12.350 3.831 559 HG13 VAL 95 HG13 VAL 95 -4.884 -13.349 4.613 560 HG21 VAL 95 HG21 VAL 95 -7.706 -12.430 2.310 561 HG22 VAL 95 HG22 VAL 95 -7.426 -11.669 3.879 562 HG23 VAL 95 HG23 VAL 95 -7.258 -13.418 3.705 563 H GLY 96 H GLY 96 -4.520 -11.639 -0.215 564 HA2 GLY 96 HA2 GLY 96 -2.084 -10.212 -0.388 565 HA3 GLY 96 HA3 GLY 96 -1.748 -11.860 0.141 566 H GLN 97 H GLN 97 -0.530 -11.701 -1.988 567 HA GLN 97 HA GLN 97 -2.180 -12.508 -4.300 568 HB2 GLN 97 HB2 GLN 97 -0.361 -10.915 -4.784 569 HB3 GLN 97 HB3 GLN 97 0.812 -11.988 -4.032 570 HG2 GLN 97 HG2 GLN 97 0.267 -13.688 -5.831 571 HG3 GLN 97 HG3 GLN 97 -0.685 -12.436 -6.627 572 HE21 GLN 97 HE21 GLN 97 1.653 -13.865 -7.589 573 HE22 GLN 97 HE22 GLN 97 2.839 -12.665 -7.961 574 H TYR 98 H TYR 98 -2.243 -14.600 -4.950 575 HA TYR 98 HA TYR 98 -1.108 -16.733 -3.390 576 HB2 TYR 98 HB2 TYR 98 -3.352 -16.892 -4.441 577 HB3 TYR 98 HB3 TYR 98 -2.621 -16.783 -6.034 578 HD1 TYR 98 HD1 TYR 98 -2.676 -18.905 -2.942 579 HD2 TYR 98 HD2 TYR 98 -1.944 -18.780 -7.154 580 HE1 TYR 98 HE1 TYR 98 -2.479 -21.349 -2.990 581 HE2 TYR 98 HE2 TYR 98 -1.748 -21.229 -7.192 582 HH TYR 98 HH TYR 98 -2.779 -23.179 -4.677 583 H LEU 99 H LEU 99 0.968 -17.316 -3.632 584 HA LEU 99 HA LEU 99 2.258 -17.245 -6.275 585 HB2 LEU 99 HB2 LEU 99 3.339 -16.376 -4.010 586 HB3 LEU 99 HB3 LEU 99 3.682 -18.072 -3.728 587 HG LEU 99 HG LEU 99 4.701 -16.387 -6.068 588 HD11 LEU 99 HD11 LEU 99 5.820 -15.853 -3.976 589 HD12 LEU 99 HD12 LEU 99 6.916 -16.672 -5.087 590 HD13 LEU 99 HD13 LEU 99 6.214 -17.555 -3.725 591 HD21 LEU 99 HD21 LEU 99 4.387 -18.692 -6.842 592 HD22 LEU 99 HD22 LEU 99 5.336 -19.299 -5.484 593 HD23 LEU 99 HD23 LEU 99 6.103 -18.300 -6.721 594 H GLU 100 H GLU 100 1.888 -19.034 -7.437 595 HA GLU 100 HA GLU 100 1.341 -21.623 -6.252 596 HB2 GLU 100 HB2 GLU 100 0.192 -20.964 -8.339 597 HB3 GLU 100 HB3 GLU 100 1.740 -20.802 -9.168 598 HG2 GLU 100 HG2 GLU 100 2.134 -23.199 -9.003 599 HG3 GLU 100 HG3 GLU 100 0.686 -23.405 -8.018 600 HA PRO 101 HA PRO 101 5.688 -22.753 -5.685 601 HB2 PRO 101 HB2 PRO 101 5.332 -25.552 -5.964 602 HB3 PRO 101 HB3 PRO 101 5.156 -24.632 -4.469 603 HG2 PRO 101 HG2 PRO 101 3.044 -25.498 -6.430 604 HG3 PRO 101 HG3 PRO 101 3.001 -25.527 -4.653 605 HD2 PRO 101 HD2 PRO 101 1.714 -23.616 -5.961 606 HD3 PRO 101 HD3 PRO 101 2.646 -23.195 -4.503 607 H ASP 102 H ASP 102 3.853 -24.080 -8.410 608 HA ASP 102 HA ASP 102 6.004 -24.991 -10.025 609 HB2 ASP 102 HB2 ASP 102 3.684 -25.746 -10.420 610 HB3 ASP 102 HB3 ASP 102 3.193 -24.104 -10.823 611 H GLN 103 H GLN 103 4.210 -21.923 -9.901 612 HA GLN 103 HA GLN 103 5.363 -20.562 -12.069 613 HB2 GLN 103 HB2 GLN 103 3.308 -19.843 -10.801 614 HB3 GLN 103 HB3 GLN 103 4.335 -19.349 -9.459 615 HG2 GLN 103 HG2 GLN 103 3.641 -17.419 -10.773 616 HG3 GLN 103 HG3 GLN 103 5.387 -17.635 -10.885 617 HE21 GLN 103 HE21 GLN 103 6.295 -18.259 -12.893 618 HE22 GLN 103 HE22 GLN 103 5.402 -18.177 -14.370 619 H GLU 104 H GLU 104 6.443 -20.982 -8.772 620 HA GLU 104 HA GLU 104 8.654 -19.134 -8.902 621 HB2 GLU 104 HB2 GLU 104 7.394 -19.691 -6.796 622 HB3 GLU 104 HB3 GLU 104 8.073 -21.310 -6.852 623 HG2 GLU 104 HG2 GLU 104 9.269 -19.887 -5.256 624 HG3 GLU 104 HG3 GLU 104 10.325 -20.416 -6.566 625 H GLY 105 H GLY 105 8.190 -22.634 -9.173 626 HA2 GLY 105 HA2 GLY 105 10.926 -23.418 -9.076 627 HA3 GLY 105 HA3 GLY 105 9.580 -24.389 -9.647 628 H VAL 106 H VAL 106 8.688 -23.593 -11.845 629 HA VAL 106 HA VAL 106 10.511 -22.332 -13.671 630 HB VAL 106 HB VAL 106 11.497 -24.608 -13.673 631 HG11 VAL 106 HG11 VAL 106 10.266 -26.581 -14.513 632 HG12 VAL 106 HG12 VAL 106 8.785 -25.621 -14.589 633 HG13 VAL 106 HG13 VAL 106 9.548 -25.943 -13.030 634 HG21 VAL 106 HG21 VAL 106 11.602 -23.306 -15.761 635 HG22 VAL 106 HG22 VAL 106 10.057 -23.979 -16.281 636 HG23 VAL 106 HG23 VAL 106 11.465 -25.030 -16.123 637 H THR 107 H THR 107 9.413 -21.374 -15.262 638 HA THR 107 HA THR 107 6.620 -22.167 -15.858 639 HB THR 107 HB THR 107 6.648 -19.939 -14.872 640 HG1 THR 107 HG1 THR 107 5.303 -20.435 -16.782 641 HG21 THR 107 HG21 THR 107 8.556 -19.085 -17.081 642 HG22 THR 107 HG22 THR 107 8.960 -19.236 -15.370 643 HG23 THR 107 HG23 THR 107 7.799 -18.015 -15.898 644 H ILE 108 H ILE 108 6.294 -22.967 -17.858 645 HA ILE 108 HA ILE 108 8.462 -22.914 -19.833 646 HB ILE 108 HB ILE 108 5.851 -24.497 -19.801 647 HG12 ILE 108 HG12 ILE 108 8.743 -25.371 -19.323 648 HG13 ILE 108 HG13 ILE 108 7.486 -25.249 -18.098 649 HG21 ILE 108 HG21 ILE 108 6.743 -25.740 -21.760 650 HG22 ILE 108 HG22 ILE 108 8.127 -24.647 -21.821 651 HG23 ILE 108 HG23 ILE 108 6.504 -24.030 -22.131 652 HD11 ILE 108 HD11 ILE 108 7.537 -27.196 -20.407 653 HD12 ILE 108 HD12 ILE 108 6.259 -27.074 -19.195 654 HD13 ILE 108 HD13 ILE 108 7.886 -27.553 -18.716 655 HA PRO 109 HA PRO 109 5.992 -19.829 -22.138 656 HB2 PRO 109 HB2 PRO 109 8.016 -18.748 -23.582 657 HB3 PRO 109 HB3 PRO 109 7.775 -18.377 -21.869 658 HG2 PRO 109 HG2 PRO 109 9.833 -20.104 -23.158 659 HG3 PRO 109 HG3 PRO 109 9.928 -19.183 -21.647 660 HD2 PRO 109 HD2 PRO 109 9.397 -21.989 -21.936 661 HD3 PRO 109 HD3 PRO 109 9.351 -21.037 -20.439 662 H ASP 110 H ASP 110 4.719 -21.138 -23.396 663 HA ASP 110 HA ASP 110 5.666 -22.824 -25.522 664 HB2 ASP 110 HB2 ASP 110 3.602 -23.431 -24.396 665 HB3 ASP 110 HB3 ASP 110 2.878 -21.868 -24.750 666 H LEU 111 H LEU 111 5.797 -22.429 -27.696 667 HA LEU 111 HA LEU 111 5.469 -19.692 -28.702 668 HB2 LEU 111 HB2 LEU 111 6.636 -22.186 -30.016 669 HB3 LEU 111 HB3 LEU 111 6.540 -20.618 -30.796 670 HG LEU 111 HG LEU 111 8.059 -19.736 -28.912 671 HD11 LEU 111 HD11 LEU 111 8.545 -22.680 -28.388 672 HD12 LEU 111 HD12 LEU 111 7.784 -21.538 -27.278 673 HD13 LEU 111 HD13 LEU 111 9.478 -21.337 -27.719 674 HD21 LEU 111 HD21 LEU 111 8.880 -20.111 -31.197 675 HD22 LEU 111 HD22 LEU 111 9.230 -21.798 -30.809 676 HD23 LEU 111 HD23 LEU 111 10.123 -20.505 -30.007 677 H GLY 112 H GLY 112 4.187 -22.958 -29.163 678 HA2 GLY 112 HA2 GLY 112 1.704 -22.923 -29.695 679 HA3 GLY 112 HA3 GLY 112 2.170 -21.993 -31.114 Start of MODEL 10 1 H GLU 21 H GLU 21 -2.188 -2.801 1.413 2 HA GLU 21 HA GLU 21 -0.386 -0.668 2.390 3 HB2 GLU 21 HB2 GLU 21 -1.447 -3.149 3.825 4 HB3 GLU 21 HB3 GLU 21 -0.276 -2.004 4.490 5 HG2 GLU 21 HG2 GLU 21 -1.989 -0.217 4.385 6 HG3 GLU 21 HG3 GLU 21 -3.154 -1.388 3.762 7 H LYS 22 H LYS 22 -0.641 -4.226 2.150 8 HA LYS 22 HA LYS 22 2.153 -4.379 1.191 9 HB2 LYS 22 HB2 LYS 22 2.758 -6.054 2.734 10 HB3 LYS 22 HB3 LYS 22 1.827 -4.942 3.723 11 HG2 LYS 22 HG2 LYS 22 0.732 -7.534 2.557 12 HG3 LYS 22 HG3 LYS 22 1.395 -7.377 4.186 13 HD2 LYS 22 HD2 LYS 22 -1.029 -5.870 3.121 14 HD3 LYS 22 HD3 LYS 22 -1.096 -7.323 4.125 15 HE2 LYS 22 HE2 LYS 22 0.091 -6.083 5.931 16 HE3 LYS 22 HE3 LYS 22 0.070 -4.633 4.925 17 HZ1 LYS 22 HZ1 LYS 22 -2.310 -6.090 5.926 18 HZ2 LYS 22 HZ2 LYS 22 -2.345 -4.708 4.954 19 HZ3 LYS 22 HZ3 LYS 22 -1.719 -4.623 6.522 20 H VAL 23 H VAL 23 2.610 -6.639 0.398 21 HA VAL 23 HA VAL 23 0.276 -7.971 -0.820 22 HB VAL 23 HB VAL 23 1.392 -6.908 -2.662 23 HG11 VAL 23 HG11 VAL 23 4.054 -8.023 -1.700 24 HG12 VAL 23 HG12 VAL 23 3.547 -6.335 -1.639 25 HG13 VAL 23 HG13 VAL 23 3.799 -7.123 -3.199 26 HG21 VAL 23 HG21 VAL 23 2.074 -8.828 -4.053 27 HG22 VAL 23 HG22 VAL 23 0.674 -9.232 -3.059 28 HG23 VAL 23 HG23 VAL 23 2.276 -9.819 -2.605 29 H THR 24 H THR 24 0.079 -9.411 0.834 30 HA THR 24 HA THR 24 2.226 -10.940 1.944 31 HB THR 24 HB THR 24 -0.792 -11.422 2.051 32 HG1 THR 24 HG1 THR 24 -0.021 -10.589 4.356 33 HG21 THR 24 HG21 THR 24 1.420 -12.605 3.787 34 HG22 THR 24 HG22 THR 24 0.451 -13.497 2.611 35 HG23 THR 24 HG23 THR 24 -0.312 -12.819 4.049 36 H LEU 25 H LEU 25 3.327 -12.334 0.683 37 HA LEU 25 HA LEU 25 2.157 -13.651 -1.607 38 HB2 LEU 25 HB2 LEU 25 4.917 -13.868 -0.339 39 HB3 LEU 25 HB3 LEU 25 4.441 -14.686 -1.826 40 HG LEU 25 HG LEU 25 4.500 -11.655 -1.444 41 HD11 LEU 25 HD11 LEU 25 6.766 -12.564 -1.463 42 HD12 LEU 25 HD12 LEU 25 6.451 -11.648 -2.934 43 HD13 LEU 25 HD13 LEU 25 6.439 -13.412 -2.975 44 HD21 LEU 25 HD21 LEU 25 4.105 -11.520 -3.889 45 HD22 LEU 25 HD22 LEU 25 2.768 -12.313 -3.062 46 HD23 LEU 25 HD23 LEU 25 3.939 -13.278 -3.964 47 H VAL 26 H VAL 26 0.699 -15.117 -1.117 48 HA VAL 26 HA VAL 26 1.022 -17.017 1.095 49 HB VAL 26 HB VAL 26 -1.369 -16.559 -0.758 50 HG11 VAL 26 HG11 VAL 26 -1.403 -18.815 0.221 51 HG12 VAL 26 HG12 VAL 26 -2.690 -17.826 0.913 52 HG13 VAL 26 HG13 VAL 26 -1.222 -18.134 1.842 53 HG21 VAL 26 HG21 VAL 26 -0.938 -15.483 2.061 54 HG22 VAL 26 HG22 VAL 26 -2.422 -15.321 1.118 55 HG23 VAL 26 HG23 VAL 26 -0.941 -14.531 0.570 56 H ARG 27 H ARG 27 1.339 -19.178 0.737 57 HA ARG 27 HA ARG 27 1.838 -20.089 -2.037 58 HB2 ARG 27 HB2 ARG 27 3.757 -19.989 -0.396 59 HB3 ARG 27 HB3 ARG 27 2.930 -21.185 0.587 60 HG2 ARG 27 HG2 ARG 27 3.169 -22.846 -1.211 61 HG3 ARG 27 HG3 ARG 27 3.936 -21.632 -2.244 62 HD2 ARG 27 HD2 ARG 27 5.813 -21.444 -0.711 63 HD3 ARG 27 HD3 ARG 27 5.023 -22.516 0.448 64 HE ARG 27 HE ARG 27 5.177 -24.084 -1.728 65 HH11 ARG 27 HH11 ARG 27 7.633 -22.161 -0.104 66 HH12 ARG 27 HH12 ARG 27 8.920 -23.241 -0.536 67 HH21 ARG 27 HH21 ARG 27 6.876 -25.485 -2.275 68 HH22 ARG 27 HH22 ARG 27 8.492 -25.122 -1.755 69 H ILE 28 H ILE 28 1.476 -22.545 -2.261 70 HA ILE 28 HA ILE 28 -1.253 -22.940 -2.285 71 HB ILE 28 HB ILE 28 0.206 -24.014 -3.891 72 HG12 ILE 28 HG12 ILE 28 -1.329 -26.119 -2.288 73 HG13 ILE 28 HG13 ILE 28 -2.017 -25.068 -3.524 74 HG21 ILE 28 HG21 ILE 28 1.643 -25.948 -3.355 75 HG22 ILE 28 HG22 ILE 28 1.236 -25.781 -1.647 76 HG23 ILE 28 HG23 ILE 28 2.141 -24.504 -2.465 77 HD11 ILE 28 HD11 ILE 28 0.047 -27.234 -3.952 78 HD12 ILE 28 HD12 ILE 28 -0.582 -26.159 -5.205 79 HD13 ILE 28 HD13 ILE 28 -1.660 -27.289 -4.391 80 H ALA 29 H ALA 29 1.084 -24.274 0.077 81 HA ALA 29 HA ALA 29 -0.812 -25.959 1.410 82 HB1 ALA 29 HB1 ALA 29 1.839 -24.929 2.468 83 HB2 ALA 29 HB2 ALA 29 1.598 -26.413 1.547 84 HB3 ALA 29 HB3 ALA 29 0.884 -26.254 3.151 85 H ASP 30 H ASP 30 0.247 -22.601 1.901 86 HA ASP 30 HA ASP 30 -0.947 -22.120 4.434 87 HB2 ASP 30 HB2 ASP 30 -0.445 -20.133 2.174 88 HB3 ASP 30 HB3 ASP 30 -0.792 -19.705 3.852 89 H LEU 31 H LEU 31 -2.190 -21.978 1.133 90 HA LEU 31 HA LEU 31 -4.759 -20.894 1.598 91 HB2 LEU 31 HB2 LEU 31 -3.873 -22.962 -0.451 92 HB3 LEU 31 HB3 LEU 31 -5.424 -22.127 -0.492 93 HG LEU 31 HG LEU 31 -2.708 -20.765 -0.764 94 HD11 LEU 31 HD11 LEU 31 -3.283 -20.514 -3.149 95 HD12 LEU 31 HD12 LEU 31 -4.743 -21.476 -2.909 96 HD13 LEU 31 HD13 LEU 31 -3.152 -22.210 -2.684 97 HD21 LEU 31 HD21 LEU 31 -4.004 -18.777 -1.433 98 HD22 LEU 31 HD22 LEU 31 -4.415 -19.272 0.206 99 HD23 LEU 31 HD23 LEU 31 -5.517 -19.635 -1.127 100 H GLU 32 H GLU 32 -3.698 -24.306 1.348 101 HA GLU 32 HA GLU 32 -6.193 -25.518 1.826 102 HB2 GLU 32 HB2 GLU 32 -3.399 -26.681 2.245 103 HB3 GLU 32 HB3 GLU 32 -4.892 -27.622 2.141 104 HG2 GLU 32 HG2 GLU 32 -3.585 -25.992 -0.064 105 HG3 GLU 32 HG3 GLU 32 -3.698 -27.749 0.037 106 H ASN 33 H ASN 33 -3.567 -24.654 3.997 107 HA ASN 33 HA ASN 33 -4.530 -26.057 6.295 108 HB2 ASN 33 HB2 ASN 33 -2.340 -23.989 5.908 109 HB3 ASN 33 HB3 ASN 33 -2.722 -24.650 7.498 110 HD21 ASN 33 HD21 ASN 33 -0.335 -24.909 5.587 111 HD22 ASN 33 HD22 ASN 33 -0.031 -26.608 5.536 112 H HIS 34 H HIS 34 -4.747 -22.695 5.168 113 HA HIS 34 HA HIS 34 -6.043 -21.660 7.521 114 HB2 HIS 34 HB2 HIS 34 -4.755 -20.248 5.854 115 HB3 HIS 34 HB3 HIS 34 -6.066 -20.474 4.701 116 HD1 HIS 34 HD1 HIS 34 -8.235 -19.096 5.104 117 HD2 HIS 34 HD2 HIS 34 -5.329 -18.536 8.014 118 HE1 HIS 34 HE1 HIS 34 -8.986 -17.098 6.429 119 HE2 HIS 34 HE2 HIS 34 -7.329 -16.930 8.311 120 H ASN 35 H ASN 35 -7.075 -22.988 4.439 121 HA ASN 35 HA ASN 35 -9.815 -22.227 4.479 122 HB2 ASN 35 HB2 ASN 35 -8.512 -22.811 2.415 123 HB3 ASN 35 HB3 ASN 35 -8.489 -24.490 2.926 124 HD21 ASN 35 HD21 ASN 35 -10.420 -25.721 2.770 125 HD22 ASN 35 HD22 ASN 35 -11.775 -25.174 1.844 126 H ASN 36 H ASN 36 -8.155 -25.290 5.156 127 HA ASN 36 HA ASN 36 -10.457 -26.780 5.919 128 HB2 ASN 36 HB2 ASN 36 -8.369 -27.844 5.077 129 HB3 ASN 36 HB3 ASN 36 -7.509 -27.297 6.508 130 HD21 ASN 36 HD21 ASN 36 -6.954 -29.392 7.156 131 HD22 ASN 36 HD22 ASN 36 -8.112 -30.526 7.759 132 H ASP 37 H ASP 37 -8.228 -24.675 7.654 133 HA ASP 37 HA ASP 37 -8.884 -25.445 10.318 134 HB2 ASP 37 HB2 ASP 37 -6.813 -24.174 9.652 135 HB3 ASP 37 HB3 ASP 37 -7.814 -22.753 9.352 136 H GLY 38 H GLY 38 -10.477 -23.379 7.982 137 HA2 GLY 38 HA2 GLY 38 -12.985 -23.440 8.616 138 HA3 GLY 38 HA3 GLY 38 -12.476 -22.453 9.976 139 H GLY 39 H GLY 39 -10.426 -21.113 8.190 140 HA2 GLY 39 HA2 GLY 39 -12.189 -18.981 7.203 141 HA3 GLY 39 HA3 GLY 39 -10.435 -18.921 7.355 142 H PHE 40 H PHE 40 -13.012 -19.372 5.145 143 HA PHE 40 HA PHE 40 -11.742 -21.298 3.430 144 HB2 PHE 40 HB2 PHE 40 -14.293 -20.929 3.738 145 HB3 PHE 40 HB3 PHE 40 -14.123 -19.544 2.670 146 HD1 PHE 40 HD1 PHE 40 -13.229 -19.972 0.260 147 HD2 PHE 40 HD2 PHE 40 -14.500 -23.138 2.848 148 HE1 PHE 40 HE1 PHE 40 -13.456 -21.474 -1.679 149 HE2 PHE 40 HE2 PHE 40 -14.712 -24.631 0.901 150 HZ PHE 40 HZ PHE 40 -14.198 -23.803 -1.359 151 H TRP 41 H TRP 41 -9.974 -20.705 2.336 152 HA TRP 41 HA TRP 41 -9.795 -18.051 1.038 153 HB2 TRP 41 HB2 TRP 41 -7.723 -19.836 2.314 154 HB3 TRP 41 HB3 TRP 41 -7.212 -18.954 0.881 155 HD1 TRP 41 HD1 TRP 41 -9.618 -16.869 2.769 156 HE1 TRP 41 HE1 TRP 41 -8.380 -15.086 4.126 157 HE3 TRP 41 HE3 TRP 41 -4.872 -18.734 2.422 158 HZ2 TRP 41 HZ2 TRP 41 -5.757 -14.522 4.954 159 HZ3 TRP 41 HZ3 TRP 41 -3.043 -17.510 3.535 160 HH2 TRP 41 HH2 TRP 41 -3.480 -15.442 4.779 161 H THR 42 H THR 42 -9.538 -17.890 -1.087 162 HA THR 42 HA THR 42 -8.778 -20.179 -2.747 163 HB THR 42 HB THR 42 -11.337 -20.125 -2.615 164 HG1 THR 42 HG1 THR 42 -10.474 -21.166 -4.349 165 HG21 THR 42 HG21 THR 42 -12.552 -18.441 -3.941 166 HG22 THR 42 HG22 THR 42 -11.051 -17.578 -4.274 167 HG23 THR 42 HG23 THR 42 -11.672 -17.658 -2.623 168 H VAL 43 H VAL 43 -8.108 -19.500 -4.895 169 HA VAL 43 HA VAL 43 -7.016 -16.744 -4.914 170 HB VAL 43 HB VAL 43 -5.951 -19.259 -6.280 171 HG11 VAL 43 HG11 VAL 43 -4.785 -16.436 -6.271 172 HG12 VAL 43 HG12 VAL 43 -5.464 -17.273 -7.669 173 HG13 VAL 43 HG13 VAL 43 -3.983 -17.870 -6.920 174 HG21 VAL 43 HG21 VAL 43 -4.064 -19.058 -4.689 175 HG22 VAL 43 HG22 VAL 43 -5.598 -19.284 -3.846 176 HG23 VAL 43 HG23 VAL 43 -4.856 -17.682 -3.916 177 H ILE 44 H ILE 44 -8.033 -15.421 -6.259 178 HA ILE 44 HA ILE 44 -8.855 -16.357 -8.950 179 HB ILE 44 HB ILE 44 -10.250 -14.123 -7.387 180 HG12 ILE 44 HG12 ILE 44 -11.307 -16.968 -7.808 181 HG13 ILE 44 HG13 ILE 44 -10.639 -16.374 -6.293 182 HG21 ILE 44 HG21 ILE 44 -11.980 -14.276 -9.152 183 HG22 ILE 44 HG22 ILE 44 -11.058 -15.544 -9.960 184 HG23 ILE 44 HG23 ILE 44 -10.397 -13.912 -9.846 185 HD11 ILE 44 HD11 ILE 44 -13.127 -15.336 -7.649 186 HD12 ILE 44 HD12 ILE 44 -12.463 -14.758 -6.118 187 HD13 ILE 44 HD13 ILE 44 -13.060 -16.410 -6.253 188 H ASP 45 H ASP 45 -7.805 -15.301 -10.530 189 HA ASP 45 HA ASP 45 -6.590 -13.828 -11.760 190 HB2 ASP 45 HB2 ASP 45 -8.537 -12.332 -11.183 191 HB3 ASP 45 HB3 ASP 45 -7.639 -11.732 -9.801 192 H GLY 46 H GLY 46 -5.366 -15.234 -9.534 193 HA2 GLY 46 HA2 GLY 46 -3.202 -15.489 -8.769 194 HA3 GLY 46 HA3 GLY 46 -2.789 -13.929 -9.455 195 H LYS 47 H LYS 47 -5.488 -13.475 -7.546 196 HA LYS 47 HA LYS 47 -3.900 -12.615 -5.199 197 HB2 LYS 47 HB2 LYS 47 -6.475 -11.540 -6.413 198 HB3 LYS 47 HB3 LYS 47 -5.971 -11.121 -4.777 199 HG2 LYS 47 HG2 LYS 47 -4.314 -10.559 -7.266 200 HG3 LYS 47 HG3 LYS 47 -5.425 -9.403 -6.513 201 HD2 LYS 47 HD2 LYS 47 -4.094 -9.629 -4.384 202 HD3 LYS 47 HD3 LYS 47 -2.921 -10.612 -5.269 203 HE2 LYS 47 HE2 LYS 47 -2.394 -8.724 -6.728 204 HE3 LYS 47 HE3 LYS 47 -3.666 -7.752 -5.985 205 HZ1 LYS 47 HZ1 LYS 47 -1.586 -7.127 -5.084 206 HZ2 LYS 47 HZ2 LYS 47 -1.187 -8.722 -4.703 207 HZ3 LYS 47 HZ3 LYS 47 -2.440 -7.943 -3.872 208 H VAL 48 H VAL 48 -4.731 -13.027 -3.122 209 HA VAL 48 HA VAL 48 -6.487 -15.375 -2.900 210 HB VAL 48 HB VAL 48 -4.639 -14.150 -0.801 211 HG11 VAL 48 HG11 VAL 48 -6.474 -15.446 0.233 212 HG12 VAL 48 HG12 VAL 48 -4.936 -16.287 0.438 213 HG13 VAL 48 HG13 VAL 48 -6.084 -16.836 -0.785 214 HG21 VAL 48 HG21 VAL 48 -4.162 -16.560 -2.595 215 HG22 VAL 48 HG22 VAL 48 -3.096 -16.025 -1.296 216 HG23 VAL 48 HG23 VAL 48 -3.340 -15.001 -2.713 217 H TYR 49 H TYR 49 -8.410 -15.284 -1.846 218 HA TYR 49 HA TYR 49 -9.264 -12.830 -0.420 219 HB2 TYR 49 HB2 TYR 49 -10.974 -14.337 -2.462 220 HB3 TYR 49 HB3 TYR 49 -11.445 -12.901 -1.563 221 HD1 TYR 49 HD1 TYR 49 -10.344 -10.678 -2.116 222 HD2 TYR 49 HD2 TYR 49 -9.719 -14.157 -4.523 223 HE1 TYR 49 HE1 TYR 49 -9.489 -9.265 -3.935 224 HE2 TYR 49 HE2 TYR 49 -8.874 -12.732 -6.336 225 HH TYR 49 HH TYR 49 -8.950 -10.470 -7.104 226 H ASP 50 H ASP 50 -11.044 -13.216 1.087 227 HA ASP 50 HA ASP 50 -11.357 -16.045 1.919 228 HB2 ASP 50 HB2 ASP 50 -10.451 -14.300 3.594 229 HB3 ASP 50 HB3 ASP 50 -12.068 -13.607 3.604 230 H ILE 51 H ILE 51 -13.170 -16.952 1.286 231 HA ILE 51 HA ILE 51 -15.348 -15.588 0.049 232 HB ILE 51 HB ILE 51 -14.898 -18.501 0.812 233 HG12 ILE 51 HG12 ILE 51 -13.417 -17.633 -0.977 234 HG13 ILE 51 HG13 ILE 51 -14.528 -18.841 -1.616 235 HG21 ILE 51 HG21 ILE 51 -17.250 -17.434 -0.792 236 HG22 ILE 51 HG22 ILE 51 -17.323 -18.195 0.798 237 HG23 ILE 51 HG23 ILE 51 -16.826 -19.139 -0.606 238 HD11 ILE 51 HD11 ILE 51 -14.820 -15.852 -1.910 239 HD12 ILE 51 HD12 ILE 51 -15.919 -17.073 -2.562 240 HD13 ILE 51 HD13 ILE 51 -14.258 -16.983 -3.141 241 H LYS 52 H LYS 52 -14.832 -16.906 3.272 242 HA LYS 52 HA LYS 52 -17.574 -17.023 4.092 243 HB2 LYS 52 HB2 LYS 52 -15.843 -18.381 5.179 244 HB3 LYS 52 HB3 LYS 52 -14.981 -16.935 5.689 245 HG2 LYS 52 HG2 LYS 52 -16.881 -16.338 7.178 246 HG3 LYS 52 HG3 LYS 52 -17.725 -17.803 6.675 247 HD2 LYS 52 HD2 LYS 52 -16.600 -18.101 8.862 248 HD3 LYS 52 HD3 LYS 52 -15.947 -19.198 7.641 249 HE2 LYS 52 HE2 LYS 52 -13.995 -17.711 7.332 250 HE3 LYS 52 HE3 LYS 52 -14.658 -16.575 8.511 251 HZ1 LYS 52 HZ1 LYS 52 -13.902 -19.379 9.085 252 HZ2 LYS 52 HZ2 LYS 52 -14.442 -18.232 10.205 253 HZ3 LYS 52 HZ3 LYS 52 -12.958 -18.018 9.427 254 H ASP 53 H ASP 53 -14.954 -14.658 4.556 255 HA ASP 53 HA ASP 53 -16.379 -12.720 6.077 256 HB2 ASP 53 HB2 ASP 53 -13.860 -12.861 5.913 257 HB3 ASP 53 HB3 ASP 53 -13.963 -12.298 4.250 258 H PHE 54 H PHE 54 -15.712 -13.096 2.637 259 HA PHE 54 HA PHE 54 -16.965 -10.936 1.446 260 HB2 PHE 54 HB2 PHE 54 -15.630 -12.514 0.173 261 HB3 PHE 54 HB3 PHE 54 -16.691 -13.846 0.589 262 HD1 PHE 54 HD1 PHE 54 -16.255 -10.917 -1.614 263 HD2 PHE 54 HD2 PHE 54 -18.784 -14.221 -0.635 264 HE1 PHE 54 HE1 PHE 54 -17.499 -10.602 -3.708 265 HE2 PHE 54 HE2 PHE 54 -20.019 -13.892 -2.737 266 HZ PHE 54 HZ PHE 54 -19.379 -12.076 -4.268 267 H GLN 55 H GLN 55 -18.439 -14.049 2.388 268 HA GLN 55 HA GLN 55 -21.092 -13.411 1.518 269 HB2 GLN 55 HB2 GLN 55 -19.946 -15.629 3.225 270 HB3 GLN 55 HB3 GLN 55 -21.678 -15.502 2.917 271 HG2 GLN 55 HG2 GLN 55 -19.579 -15.719 0.732 272 HG3 GLN 55 HG3 GLN 55 -20.461 -17.083 1.419 273 HE21 GLN 55 HE21 GLN 55 -20.743 -14.199 -0.572 274 HE22 GLN 55 HE22 GLN 55 -22.278 -14.576 -1.259 275 H THR 56 H THR 56 -19.419 -13.150 4.594 276 HA THR 56 HA THR 56 -21.631 -12.485 6.237 277 HB THR 56 HB THR 56 -18.744 -11.545 6.530 278 HG1 THR 56 HG1 THR 56 -19.645 -13.982 6.513 279 HG21 THR 56 HG21 THR 56 -20.269 -10.310 8.043 280 HG22 THR 56 HG22 THR 56 -19.256 -11.423 8.961 281 HG23 THR 56 HG23 THR 56 -20.939 -11.834 8.631 282 H GLN 57 H GLN 57 -19.566 -10.534 4.104 283 HA GLN 57 HA GLN 57 -20.808 -8.001 4.638 284 HB2 GLN 57 HB2 GLN 57 -19.048 -8.948 2.331 285 HB3 GLN 57 HB3 GLN 57 -19.555 -7.277 2.566 286 HG2 GLN 57 HG2 GLN 57 -17.859 -8.878 4.517 287 HG3 GLN 57 HG3 GLN 57 -17.249 -7.704 3.346 288 HE21 GLN 57 HE21 GLN 57 -19.028 -8.116 6.334 289 HE22 GLN 57 HE22 GLN 57 -18.952 -6.464 6.837 290 H SER 58 H SER 58 -21.456 -10.679 2.449 291 HA SER 58 HA SER 58 -23.248 -9.345 0.667 292 HB2 SER 58 HB2 SER 58 -23.208 -12.322 1.322 293 HB3 SER 58 HB3 SER 58 -23.887 -11.557 -0.119 294 HG SER 58 HG SER 58 -21.220 -11.013 0.380 295 H LEU 59 H LEU 59 -23.597 -10.761 3.831 296 HA LEU 59 HA LEU 59 -26.393 -11.077 3.983 297 HB2 LEU 59 HB2 LEU 59 -24.727 -12.046 5.589 298 HB3 LEU 59 HB3 LEU 59 -24.428 -10.437 6.218 299 HG LEU 59 HG LEU 59 -26.832 -10.337 6.981 300 HD11 LEU 59 HD11 LEU 59 -26.923 -13.265 6.176 301 HD12 LEU 59 HD12 LEU 59 -27.804 -11.942 5.403 302 HD13 LEU 59 HD13 LEU 59 -28.172 -12.388 7.067 303 HD21 LEU 59 HD21 LEU 59 -25.214 -12.638 8.139 304 HD22 LEU 59 HD22 LEU 59 -26.531 -11.783 8.947 305 HD23 LEU 59 HD23 LEU 59 -25.038 -10.931 8.558 306 H THR 60 H THR 60 -24.358 -8.233 4.192 307 HA THR 60 HA THR 60 -26.323 -6.504 5.406 308 HB THR 60 HB THR 60 -23.772 -5.774 3.916 309 HG1 THR 60 HG1 THR 60 -24.170 -6.929 6.370 310 HG21 THR 60 HG21 THR 60 -23.830 -3.699 5.246 311 HG22 THR 60 HG22 THR 60 -25.361 -4.190 5.977 312 HG23 THR 60 HG23 THR 60 -25.278 -3.837 4.248 313 H GLU 61 H GLU 61 -27.799 -5.216 4.378 314 HA GLU 61 HA GLU 61 -28.532 -5.891 1.686 315 HB2 GLU 61 HB2 GLU 61 -30.515 -4.476 2.083 316 HB3 GLU 61 HB3 GLU 61 -30.264 -5.647 3.373 317 HG2 GLU 61 HG2 GLU 61 -29.382 -3.912 4.844 318 HG3 GLU 61 HG3 GLU 61 -29.471 -2.719 3.548 319 H ASN 62 H ASN 62 -27.096 -3.051 3.236 320 HA ASN 62 HA ASN 62 -27.326 -1.367 0.891 321 HB2 ASN 62 HB2 ASN 62 -25.981 0.295 2.207 322 HB3 ASN 62 HB3 ASN 62 -27.437 -0.236 3.031 323 HD21 ASN 62 HD21 ASN 62 -27.278 -1.414 4.913 324 HD22 ASN 62 HD22 ASN 62 -25.791 -1.621 5.763 325 H SER 63 H SER 63 -25.202 -3.846 1.751 326 HA SER 63 HA SER 63 -22.805 -2.898 0.475 327 HB2 SER 63 HB2 SER 63 -23.714 -5.707 1.273 328 HB3 SER 63 HB3 SER 63 -22.112 -5.341 0.635 329 HG SER 63 HG SER 63 -22.072 -5.355 2.880 330 H ILE 64 H ILE 64 -21.980 -3.551 -1.532 331 HA ILE 64 HA ILE 64 -23.724 -3.688 -3.746 332 HB ILE 64 HB ILE 64 -21.650 -4.219 -5.096 333 HG12 ILE 64 HG12 ILE 64 -20.305 -4.180 -2.347 334 HG13 ILE 64 HG13 ILE 64 -20.401 -5.556 -3.441 335 HG21 ILE 64 HG21 ILE 64 -21.373 -1.870 -3.189 336 HG22 ILE 64 HG22 ILE 64 -22.324 -1.891 -4.675 337 HG23 ILE 64 HG23 ILE 64 -20.569 -2.041 -4.753 338 HD11 ILE 64 HD11 ILE 64 -18.225 -4.680 -3.547 339 HD12 ILE 64 HD12 ILE 64 -18.804 -3.034 -3.775 340 HD13 ILE 64 HD13 ILE 64 -19.015 -4.234 -5.049 341 H LEU 65 H LEU 65 -22.431 -6.179 -1.732 342 HA LEU 65 HA LEU 65 -22.659 -8.371 -3.596 343 HB2 LEU 65 HB2 LEU 65 -22.259 -8.353 -0.586 344 HB3 LEU 65 HB3 LEU 65 -22.093 -9.766 -1.625 345 HG LEU 65 HG LEU 65 -20.328 -7.288 -1.648 346 HD11 LEU 65 HD11 LEU 65 -19.880 -8.721 0.264 347 HD12 LEU 65 HD12 LEU 65 -18.549 -8.824 -0.887 348 HD13 LEU 65 HD13 LEU 65 -19.728 -10.139 -0.777 349 HD21 LEU 65 HD21 LEU 65 -20.607 -8.106 -3.929 350 HD22 LEU 65 HD22 LEU 65 -20.183 -9.746 -3.431 351 HD23 LEU 65 HD23 LEU 65 -18.986 -8.457 -3.351 352 H ALA 66 H ALA 66 -24.990 -6.600 -2.048 353 HA ALA 66 HA ALA 66 -26.920 -8.538 -1.298 354 HB1 ALA 66 HB1 ALA 66 -28.562 -6.708 -1.519 355 HB2 ALA 66 HB2 ALA 66 -27.360 -5.719 -2.357 356 HB3 ALA 66 HB3 ALA 66 -27.115 -6.163 -0.667 357 H GLN 67 H GLN 67 -26.008 -7.137 -4.429 358 HA GLN 67 HA GLN 67 -28.157 -8.355 -5.949 359 HB2 GLN 67 HB2 GLN 67 -27.105 -7.429 -7.905 360 HB3 GLN 67 HB3 GLN 67 -26.931 -6.227 -6.632 361 HG2 GLN 67 HG2 GLN 67 -24.584 -7.035 -6.272 362 HG3 GLN 67 HG3 GLN 67 -24.787 -8.116 -7.649 363 HE21 GLN 67 HE21 GLN 67 -24.343 -4.819 -6.619 364 HE22 GLN 67 HE22 GLN 67 -24.027 -4.158 -8.187 365 H PHE 68 H PHE 68 -25.070 -9.344 -4.777 366 HA PHE 68 HA PHE 68 -24.786 -11.623 -6.613 367 HB2 PHE 68 HB2 PHE 68 -22.913 -10.419 -4.526 368 HB3 PHE 68 HB3 PHE 68 -22.541 -11.853 -5.463 369 HD1 PHE 68 HD1 PHE 68 -23.052 -11.407 -8.162 370 HD2 PHE 68 HD2 PHE 68 -21.788 -8.499 -5.292 371 HE1 PHE 68 HE1 PHE 68 -22.108 -10.024 -9.964 372 HE2 PHE 68 HE2 PHE 68 -20.845 -7.125 -7.104 373 HZ PHE 68 HZ PHE 68 -21.005 -7.886 -9.443 374 H ALA 69 H ALA 69 -26.493 -11.098 -3.886 375 HA ALA 69 HA ALA 69 -25.769 -13.314 -2.208 376 HB1 ALA 69 HB1 ALA 69 -26.903 -11.315 -1.325 377 HB2 ALA 69 HB2 ALA 69 -27.838 -12.772 -0.980 378 HB3 ALA 69 HB3 ALA 69 -28.334 -11.690 -2.286 379 H GLY 70 H GLY 70 -27.697 -12.960 -5.077 380 HA2 GLY 70 HA2 GLY 70 -29.060 -15.550 -4.825 381 HA3 GLY 70 HA3 GLY 70 -29.222 -14.393 -6.135 382 H GLU 71 H GLU 71 -25.981 -14.690 -5.584 383 HA GLU 71 HA GLU 71 -25.616 -16.616 -7.811 384 HB2 GLU 71 HB2 GLU 71 -25.002 -14.233 -8.290 385 HB3 GLU 71 HB3 GLU 71 -23.876 -14.241 -6.945 386 HG2 GLU 71 HG2 GLU 71 -22.707 -14.437 -9.083 387 HG3 GLU 71 HG3 GLU 71 -22.465 -15.876 -8.094 388 H ASP 72 H ASP 72 -23.753 -17.993 -7.724 389 HA ASP 72 HA ASP 72 -23.045 -19.257 -5.328 390 HB2 ASP 72 HB2 ASP 72 -22.692 -20.297 -7.547 391 HB3 ASP 72 HB3 ASP 72 -21.512 -19.072 -7.968 392 HA PRO 73 HA PRO 73 -20.531 -16.184 -3.147 393 HB2 PRO 73 HB2 PRO 73 -18.914 -18.645 -2.440 394 HB3 PRO 73 HB3 PRO 73 -19.464 -17.325 -1.392 395 HG2 PRO 73 HG2 PRO 73 -20.771 -19.648 -1.415 396 HG3 PRO 73 HG3 PRO 73 -21.668 -18.117 -1.334 397 HD2 PRO 73 HD2 PRO 73 -21.343 -20.004 -3.635 398 HD3 PRO 73 HD3 PRO 73 -22.710 -18.941 -3.224 399 H VAL 74 H VAL 74 -18.566 -18.719 -4.804 400 HA VAL 74 HA VAL 74 -16.219 -17.041 -4.900 401 HB VAL 74 HB VAL 74 -16.627 -19.642 -6.439 402 HG11 VAL 74 HG11 VAL 74 -14.152 -19.826 -6.307 403 HG12 VAL 74 HG12 VAL 74 -14.078 -18.276 -5.465 404 HG13 VAL 74 HG13 VAL 74 -14.642 -18.345 -7.136 405 HG21 VAL 74 HG21 VAL 74 -17.158 -20.064 -4.070 406 HG22 VAL 74 HG22 VAL 74 -15.637 -19.322 -3.572 407 HG23 VAL 74 HG23 VAL 74 -15.623 -20.827 -4.492 408 H VAL 75 H VAL 75 -18.653 -18.146 -7.236 409 HA VAL 75 HA VAL 75 -17.607 -16.917 -9.586 410 HB VAL 75 HB VAL 75 -20.465 -17.746 -8.912 411 HG11 VAL 75 HG11 VAL 75 -20.546 -16.105 -10.749 412 HG12 VAL 75 HG12 VAL 75 -20.933 -17.714 -11.354 413 HG13 VAL 75 HG13 VAL 75 -19.338 -17.022 -11.649 414 HG21 VAL 75 HG21 VAL 75 -18.296 -19.187 -10.484 415 HG22 VAL 75 HG22 VAL 75 -19.949 -19.765 -10.256 416 HG23 VAL 75 HG23 VAL 75 -18.870 -19.613 -8.867 417 H ALA 76 H ALA 76 -19.552 -15.749 -6.982 418 HA ALA 76 HA ALA 76 -20.512 -13.312 -8.108 419 HB1 ALA 76 HB1 ALA 76 -21.060 -12.753 -5.733 420 HB2 ALA 76 HB2 ALA 76 -20.244 -14.232 -5.229 421 HB3 ALA 76 HB3 ALA 76 -21.686 -14.323 -6.242 422 H LEU 77 H LEU 77 -17.697 -14.283 -6.225 423 HA LEU 77 HA LEU 77 -16.613 -11.672 -5.825 424 HB2 LEU 77 HB2 LEU 77 -16.187 -13.922 -4.536 425 HB3 LEU 77 HB3 LEU 77 -14.967 -14.218 -5.760 426 HG LEU 77 HG LEU 77 -14.966 -11.735 -3.987 427 HD11 LEU 77 HD11 LEU 77 -14.861 -13.704 -2.542 428 HD12 LEU 77 HD12 LEU 77 -13.335 -12.826 -2.537 429 HD13 LEU 77 HD13 LEU 77 -13.482 -14.325 -3.457 430 HD21 LEU 77 HD21 LEU 77 -13.586 -11.506 -6.014 431 HD22 LEU 77 HD22 LEU 77 -12.700 -12.973 -5.596 432 HD23 LEU 77 HD23 LEU 77 -12.583 -11.545 -4.565 433 H GLU 78 H GLU 78 -16.177 -14.239 -8.252 434 HA GLU 78 HA GLU 78 -14.111 -13.064 -9.810 435 HB2 GLU 78 HB2 GLU 78 -16.371 -14.931 -10.667 436 HB3 GLU 78 HB3 GLU 78 -14.953 -14.551 -11.651 437 HG2 GLU 78 HG2 GLU 78 -13.509 -15.585 -9.918 438 HG3 GLU 78 HG3 GLU 78 -14.947 -16.006 -8.984 439 H ALA 79 H ALA 79 -17.643 -12.850 -9.966 440 HA ALA 79 HA ALA 79 -17.898 -11.212 -12.271 441 HB1 ALA 79 HB1 ALA 79 -20.232 -10.902 -11.541 442 HB2 ALA 79 HB2 ALA 79 -19.838 -11.596 -9.963 443 HB3 ALA 79 HB3 ALA 79 -19.750 -12.596 -11.414 444 H ALA 80 H ALA 80 -17.540 -10.557 -8.843 445 HA ALA 80 HA ALA 80 -18.105 -7.764 -8.885 446 HB1 ALA 80 HB1 ALA 80 -17.200 -7.754 -6.610 447 HB2 ALA 80 HB2 ALA 80 -16.543 -9.378 -6.848 448 HB3 ALA 80 HB3 ALA 80 -18.289 -9.124 -6.845 449 H LEU 81 H LEU 81 -15.057 -9.642 -8.973 450 HA LEU 81 HA LEU 81 -13.218 -7.504 -9.145 451 HB2 LEU 81 HB2 LEU 81 -13.103 -10.357 -10.184 452 HB3 LEU 81 HB3 LEU 81 -11.747 -9.250 -10.364 453 HG LEU 81 HG LEU 81 -12.922 -10.149 -7.698 454 HD11 LEU 81 HD11 LEU 81 -10.341 -10.998 -9.047 455 HD12 LEU 81 HD12 LEU 81 -11.779 -11.994 -8.823 456 HD13 LEU 81 HD13 LEU 81 -10.860 -11.453 -7.422 457 HD21 LEU 81 HD21 LEU 81 -10.944 -9.047 -6.705 458 HD22 LEU 81 HD22 LEU 81 -11.985 -7.899 -7.539 459 HD23 LEU 81 HD23 LEU 81 -10.481 -8.435 -8.295 460 H GLN 82 H GLN 82 -14.904 -9.367 -11.611 461 HA GLN 82 HA GLN 82 -13.793 -8.258 -13.934 462 HB2 GLN 82 HB2 GLN 82 -15.020 -10.394 -13.906 463 HB3 GLN 82 HB3 GLN 82 -16.504 -9.565 -13.449 464 HG2 GLN 82 HG2 GLN 82 -16.513 -8.400 -15.649 465 HG3 GLN 82 HG3 GLN 82 -15.043 -9.276 -16.093 466 HE21 GLN 82 HE21 GLN 82 -18.477 -9.563 -15.468 467 HE22 GLN 82 HE22 GLN 82 -18.682 -11.115 -16.200 468 H PHE 83 H PHE 83 -16.553 -7.235 -11.940 469 HA PHE 83 HA PHE 83 -17.305 -5.140 -13.833 470 HB2 PHE 83 HB2 PHE 83 -19.018 -6.560 -12.652 471 HB3 PHE 83 HB3 PHE 83 -18.542 -5.804 -11.137 472 HD1 PHE 83 HD1 PHE 83 -19.149 -4.363 -14.562 473 HD2 PHE 83 HD2 PHE 83 -20.345 -4.451 -10.458 474 HE1 PHE 83 HE1 PHE 83 -20.811 -2.605 -15.000 475 HE2 PHE 83 HE2 PHE 83 -22.001 -2.692 -10.907 476 HZ PHE 83 HZ PHE 83 -22.237 -1.767 -13.178 477 H GLU 84 H GLU 84 -16.439 -3.241 -13.735 478 HA GLU 84 HA GLU 84 -14.318 -2.415 -12.201 479 HB2 GLU 84 HB2 GLU 84 -14.685 -0.186 -13.273 480 HB3 GLU 84 HB3 GLU 84 -14.740 -1.535 -14.405 481 HG2 GLU 84 HG2 GLU 84 -17.222 -1.459 -14.378 482 HG3 GLU 84 HG3 GLU 84 -17.172 -0.098 -13.264 483 H ASP 85 H ASP 85 -17.730 -1.871 -11.583 484 HA ASP 85 HA ASP 85 -17.351 0.260 -9.682 485 HB2 ASP 85 HB2 ASP 85 -19.428 0.114 -11.006 486 HB3 ASP 85 HB3 ASP 85 -19.801 -1.446 -10.286 487 H THR 86 H THR 86 -18.064 -3.222 -9.500 488 HA THR 86 HA THR 86 -18.435 -3.139 -6.618 489 HB THR 86 HB THR 86 -18.914 -5.627 -6.943 490 HG1 THR 86 HG1 THR 86 -17.677 -5.539 -9.057 491 HG21 THR 86 HG21 THR 86 -20.560 -3.680 -8.606 492 HG22 THR 86 HG22 THR 86 -20.746 -3.962 -6.872 493 HG23 THR 86 HG23 THR 86 -21.106 -5.256 -8.020 494 H ARG 87 H ARG 87 -15.714 -3.542 -8.608 495 HA ARG 87 HA ARG 87 -14.291 -5.608 -7.229 496 HB2 ARG 87 HB2 ARG 87 -12.273 -4.785 -8.409 497 HB3 ARG 87 HB3 ARG 87 -13.647 -4.936 -9.509 498 HG2 ARG 87 HG2 ARG 87 -14.019 -2.501 -9.384 499 HG3 ARG 87 HG3 ARG 87 -12.666 -2.342 -8.261 500 HD2 ARG 87 HD2 ARG 87 -11.099 -3.075 -9.990 501 HD3 ARG 87 HD3 ARG 87 -12.429 -3.364 -11.116 502 HE ARG 87 HE ARG 87 -12.781 -0.761 -10.521 503 HH11 ARG 87 HH11 ARG 87 -9.896 -2.475 -11.557 504 HH12 ARG 87 HH12 ARG 87 -9.219 -1.096 -12.353 505 HH21 ARG 87 HH21 ARG 87 -11.872 1.040 -11.586 506 HH22 ARG 87 HH22 ARG 87 -10.334 0.882 -12.372 507 H GLU 88 H GLU 88 -15.002 -2.405 -6.308 508 HA GLU 88 HA GLU 88 -12.671 -1.669 -4.868 509 HB2 GLU 88 HB2 GLU 88 -14.108 0.164 -3.951 510 HB3 GLU 88 HB3 GLU 88 -14.172 0.020 -5.700 511 HG2 GLU 88 HG2 GLU 88 -16.413 0.302 -5.305 512 HG3 GLU 88 HG3 GLU 88 -16.334 -1.446 -5.191 513 H SER 89 H SER 89 -15.407 -3.678 -3.930 514 HA SER 89 HA SER 89 -14.760 -3.613 -1.093 515 HB2 SER 89 HB2 SER 89 -17.078 -4.005 -1.789 516 HB3 SER 89 HB3 SER 89 -16.604 -5.453 -2.668 517 HG SER 89 HG SER 89 -15.894 -5.407 0.016 518 H MET 90 H MET 90 -13.991 -5.634 -3.887 519 HA MET 90 HA MET 90 -12.692 -7.758 -2.429 520 HB2 MET 90 HB2 MET 90 -12.519 -7.016 -5.373 521 HB3 MET 90 HB3 MET 90 -11.879 -8.502 -4.672 522 HG2 MET 90 HG2 MET 90 -13.989 -8.973 -5.739 523 HG3 MET 90 HG3 MET 90 -14.185 -9.127 -3.991 524 HE1 MET 90 HE1 MET 90 -16.120 -8.052 -2.759 525 HE2 MET 90 HE2 MET 90 -16.827 -8.951 -4.101 526 HE3 MET 90 HE3 MET 90 -17.430 -7.342 -3.698 527 H HIS 91 H HIS 91 -11.787 -4.620 -3.473 528 HA HIS 91 HA HIS 91 -8.996 -4.671 -3.360 529 HB2 HIS 91 HB2 HIS 91 -10.342 -2.687 -3.985 530 HB3 HIS 91 HB3 HIS 91 -10.932 -2.550 -2.337 531 HD1 HIS 91 HD1 HIS 91 -9.463 -1.313 -0.661 532 HD2 HIS 91 HD2 HIS 91 -7.636 -1.864 -4.361 533 HE1 HIS 91 HE1 HIS 91 -7.429 0.165 -0.637 534 HE2 HIS 91 HE2 HIS 91 -6.416 -0.087 -2.926 535 H ALA 92 H ALA 92 -11.415 -4.433 -0.750 536 HA ALA 92 HA ALA 92 -9.564 -4.451 1.443 537 HB1 ALA 92 HB1 ALA 92 -11.561 -4.739 2.849 538 HB2 ALA 92 HB2 ALA 92 -12.535 -5.090 1.415 539 HB3 ALA 92 HB3 ALA 92 -11.828 -3.490 1.630 540 H PHE 93 H PHE 93 -11.455 -6.968 -0.244 541 HA PHE 93 HA PHE 93 -10.829 -9.099 1.571 542 HB2 PHE 93 HB2 PHE 93 -11.798 -9.259 -1.310 543 HB3 PHE 93 HB3 PHE 93 -11.764 -10.604 -0.177 544 HD1 PHE 93 HD1 PHE 93 -12.816 -9.166 2.297 545 HD2 PHE 93 HD2 PHE 93 -14.127 -9.116 -1.775 546 HE1 PHE 93 HE1 PHE 93 -15.096 -8.610 3.023 547 HE2 PHE 93 HE2 PHE 93 -16.402 -8.561 -1.022 548 HZ PHE 93 HZ PHE 93 -16.883 -8.304 1.370 549 H CYS 94 H CYS 94 -9.051 -7.619 -0.972 550 HA CYS 94 HA CYS 94 -7.275 -9.750 -1.674 551 HB2 CYS 94 HB2 CYS 94 -7.611 -7.829 -3.177 552 HB3 CYS 94 HB3 CYS 94 -6.992 -6.725 -1.954 553 HG CYS 94 HG CYS 94 -5.120 -7.065 -4.030 554 H VAL 95 H VAL 95 -6.763 -10.595 0.396 555 HA VAL 95 HA VAL 95 -5.378 -9.130 2.426 556 HB VAL 95 HB VAL 95 -6.680 -11.141 2.984 557 HG11 VAL 95 HG11 VAL 95 -4.634 -12.769 1.420 558 HG12 VAL 95 HG12 VAL 95 -6.313 -12.488 0.958 559 HG13 VAL 95 HG13 VAL 95 -5.945 -13.432 2.402 560 HG21 VAL 95 HG21 VAL 95 -3.731 -11.547 3.654 561 HG22 VAL 95 HG22 VAL 95 -5.087 -12.284 4.512 562 HG23 VAL 95 HG23 VAL 95 -4.870 -10.535 4.546 563 H GLY 96 H GLY 96 -4.416 -10.970 -0.385 564 HA2 GLY 96 HA2 GLY 96 -1.828 -9.830 -0.567 565 HA3 GLY 96 HA3 GLY 96 -1.718 -11.457 0.106 566 H GLN 97 H GLN 97 -0.411 -11.395 -2.027 567 HA GLN 97 HA GLN 97 -2.069 -12.328 -4.297 568 HB2 GLN 97 HB2 GLN 97 -0.555 -10.498 -4.889 569 HB3 GLN 97 HB3 GLN 97 0.808 -11.340 -4.163 570 HG2 GLN 97 HG2 GLN 97 0.611 -13.109 -5.906 571 HG3 GLN 97 HG3 GLN 97 -0.700 -12.199 -6.656 572 HE21 GLN 97 HE21 GLN 97 -0.197 -10.259 -7.732 573 HE22 GLN 97 HE22 GLN 97 1.413 -9.858 -8.211 574 H TYR 98 H TYR 98 -1.910 -14.414 -4.899 575 HA TYR 98 HA TYR 98 -0.458 -16.352 -3.373 576 HB2 TYR 98 HB2 TYR 98 -2.607 -16.964 -4.319 577 HB3 TYR 98 HB3 TYR 98 -2.067 -16.571 -5.945 578 HD1 TYR 98 HD1 TYR 98 -1.222 -18.868 -3.082 579 HD2 TYR 98 HD2 TYR 98 -1.275 -18.357 -7.325 580 HE1 TYR 98 HE1 TYR 98 -0.479 -21.189 -3.384 581 HE2 TYR 98 HE2 TYR 98 -0.528 -20.675 -7.609 582 HH TYR 98 HH TYR 98 -0.622 -22.960 -5.202 583 H LEU 99 H LEU 99 1.647 -16.726 -3.607 584 HA LEU 99 HA LEU 99 2.933 -16.562 -6.254 585 HB2 LEU 99 HB2 LEU 99 3.969 -15.438 -4.184 586 HB3 LEU 99 HB3 LEU 99 4.300 -17.047 -3.573 587 HG LEU 99 HG LEU 99 5.405 -16.059 -6.245 588 HD11 LEU 99 HD11 LEU 99 6.231 -14.544 -4.516 589 HD12 LEU 99 HD12 LEU 99 7.536 -15.566 -5.124 590 HD13 LEU 99 HD13 LEU 99 6.796 -15.915 -3.556 591 HD21 LEU 99 HD21 LEU 99 7.100 -17.835 -5.946 592 HD22 LEU 99 HD22 LEU 99 5.469 -18.489 -5.997 593 HD23 LEU 99 HD23 LEU 99 6.305 -18.344 -4.452 594 H GLU 100 H GLU 100 2.862 -18.395 -7.387 595 HA GLU 100 HA GLU 100 2.244 -20.971 -6.331 596 HB2 GLU 100 HB2 GLU 100 1.669 -20.300 -8.657 597 HB3 GLU 100 HB3 GLU 100 3.374 -20.180 -9.056 598 HG2 GLU 100 HG2 GLU 100 3.583 -22.651 -8.579 599 HG3 GLU 100 HG3 GLU 100 1.832 -22.701 -8.363 600 HA PRO 101 HA PRO 101 6.391 -21.979 -4.797 601 HB2 PRO 101 HB2 PRO 101 6.184 -24.775 -4.890 602 HB3 PRO 101 HB3 PRO 101 5.557 -23.757 -3.586 603 HG2 PRO 101 HG2 PRO 101 4.106 -24.869 -5.990 604 HG3 PRO 101 HG3 PRO 101 3.586 -24.832 -4.288 605 HD2 PRO 101 HD2 PRO 101 2.621 -23.049 -6.012 606 HD3 PRO 101 HD3 PRO 101 3.055 -22.532 -4.371 607 H ASP 102 H ASP 102 5.180 -23.262 -7.836 608 HA ASP 102 HA ASP 102 7.781 -24.167 -8.791 609 HB2 ASP 102 HB2 ASP 102 5.677 -25.405 -9.353 610 HB3 ASP 102 HB3 ASP 102 5.130 -24.012 -10.277 611 H GLN 103 H GLN 103 5.769 -21.322 -9.043 612 HA GLN 103 HA GLN 103 6.489 -20.187 -11.477 613 HB2 GLN 103 HB2 GLN 103 4.671 -19.388 -9.958 614 HB3 GLN 103 HB3 GLN 103 5.885 -18.715 -8.878 615 HG2 GLN 103 HG2 GLN 103 4.920 -16.937 -10.198 616 HG3 GLN 103 HG3 GLN 103 6.596 -17.164 -10.688 617 HE21 GLN 103 HE21 GLN 103 6.232 -16.194 -12.699 618 HE22 GLN 103 HE22 GLN 103 5.324 -16.946 -13.959 619 H GLU 104 H GLU 104 8.270 -20.202 -8.460 620 HA GLU 104 HA GLU 104 10.223 -18.233 -9.011 621 HB2 GLU 104 HB2 GLU 104 10.347 -20.641 -7.150 622 HB3 GLU 104 HB3 GLU 104 11.507 -19.311 -7.148 623 HG2 GLU 104 HG2 GLU 104 8.543 -19.085 -6.524 624 HG3 GLU 104 HG3 GLU 104 9.849 -19.123 -5.335 625 H GLY 105 H GLY 105 10.092 -21.730 -9.659 626 HA2 GLY 105 HA2 GLY 105 12.906 -21.873 -10.463 627 HA3 GLY 105 HA3 GLY 105 11.788 -23.209 -10.294 628 H VAL 106 H VAL 106 9.720 -21.990 -12.014 629 HA VAL 106 HA VAL 106 10.727 -22.978 -14.525 630 HB VAL 106 HB VAL 106 8.446 -23.558 -13.899 631 HG11 VAL 106 HG11 VAL 106 7.710 -20.617 -14.078 632 HG12 VAL 106 HG12 VAL 106 7.805 -21.568 -12.596 633 HG13 VAL 106 HG13 VAL 106 6.584 -21.951 -13.812 634 HG21 VAL 106 HG21 VAL 106 7.273 -23.021 -16.016 635 HG22 VAL 106 HG22 VAL 106 8.959 -23.460 -16.306 636 HG23 VAL 106 HG23 VAL 106 8.467 -21.766 -16.358 637 H THR 107 H THR 107 12.014 -21.756 -15.683 638 HA THR 107 HA THR 107 11.181 -19.047 -16.509 639 HB THR 107 HB THR 107 12.995 -18.728 -14.864 640 HG1 THR 107 HG1 THR 107 14.093 -17.337 -16.091 641 HG21 THR 107 HG21 THR 107 15.279 -19.568 -15.241 642 HG22 THR 107 HG22 THR 107 14.737 -20.458 -16.662 643 HG23 THR 107 HG23 THR 107 14.145 -20.916 -15.063 644 H ILE 108 H ILE 108 11.286 -18.756 -18.735 645 HA ILE 108 HA ILE 108 12.068 -21.056 -20.387 646 HB ILE 108 HB ILE 108 10.769 -18.437 -21.238 647 HG12 ILE 108 HG12 ILE 108 9.490 -21.170 -20.742 648 HG13 ILE 108 HG13 ILE 108 9.259 -19.727 -19.754 649 HG21 ILE 108 HG21 ILE 108 10.267 -19.577 -23.382 650 HG22 ILE 108 HG22 ILE 108 11.123 -21.014 -22.824 651 HG23 ILE 108 HG23 ILE 108 12.009 -19.511 -23.094 652 HD11 ILE 108 HD11 ILE 108 7.339 -20.095 -21.163 653 HD12 ILE 108 HD12 ILE 108 8.342 -20.119 -22.613 654 HD13 ILE 108 HD13 ILE 108 8.163 -18.627 -21.682 655 HA PRO 109 HA PRO 109 15.940 -18.732 -21.267 656 HB2 PRO 109 HB2 PRO 109 17.408 -20.809 -22.183 657 HB3 PRO 109 HB3 PRO 109 17.064 -20.616 -20.457 658 HG2 PRO 109 HG2 PRO 109 15.727 -22.429 -22.463 659 HG3 PRO 109 HG3 PRO 109 16.239 -22.787 -20.800 660 HD2 PRO 109 HD2 PRO 109 13.641 -22.136 -21.504 661 HD3 PRO 109 HD3 PRO 109 14.312 -21.870 -19.884 662 H ASP 110 H ASP 110 17.317 -18.635 -23.373 663 HA ASP 110 HA ASP 110 15.603 -18.397 -25.690 664 HB2 ASP 110 HB2 ASP 110 17.389 -16.739 -25.362 665 HB3 ASP 110 HB3 ASP 110 18.611 -18.006 -25.388 666 H LEU 111 H LEU 111 15.400 -19.809 -27.350 667 HA LEU 111 HA LEU 111 17.315 -21.830 -28.035 668 HB2 LEU 111 HB2 LEU 111 15.994 -22.788 -26.013 669 HB3 LEU 111 HB3 LEU 111 14.599 -22.847 -27.064 670 HG LEU 111 HG LEU 111 15.790 -25.044 -26.727 671 HD11 LEU 111 HD11 LEU 111 15.678 -24.147 -29.611 672 HD12 LEU 111 HD12 LEU 111 14.336 -24.774 -28.655 673 HD13 LEU 111 HD13 LEU 111 15.702 -25.819 -29.036 674 HD21 LEU 111 HD21 LEU 111 17.910 -25.476 -27.869 675 HD22 LEU 111 HD22 LEU 111 18.086 -24.216 -26.652 676 HD23 LEU 111 HD23 LEU 111 18.007 -23.783 -28.362 677 H GLY 112 H GLY 112 13.841 -21.039 -28.256 678 HA2 GLY 112 HA2 GLY 112 13.872 -20.168 -30.943 679 HA3 GLY 112 HA3 GLY 112 13.411 -21.870 -30.914 Start of MODEL 11 1 H GLU 21 H GLU 21 3.163 -0.942 1.996 2 HA GLU 21 HA GLU 21 3.970 -0.109 4.086 3 HB2 GLU 21 HB2 GLU 21 2.516 -0.229 6.109 4 HB3 GLU 21 HB3 GLU 21 1.933 0.934 4.926 5 HG2 GLU 21 HG2 GLU 21 0.192 -0.607 4.194 6 HG3 GLU 21 HG3 GLU 21 0.814 -1.865 5.262 7 H LYS 22 H LYS 22 2.111 -2.820 3.001 8 HA LYS 22 HA LYS 22 3.983 -4.721 4.118 9 HB2 LYS 22 HB2 LYS 22 2.181 -6.109 5.216 10 HB3 LYS 22 HB3 LYS 22 2.513 -4.590 6.022 11 HG2 LYS 22 HG2 LYS 22 0.181 -4.768 6.122 12 HG3 LYS 22 HG3 LYS 22 0.454 -3.658 4.786 13 HD2 LYS 22 HD2 LYS 22 -1.330 -5.246 4.233 14 HD3 LYS 22 HD3 LYS 22 0.056 -5.496 3.172 15 HE2 LYS 22 HE2 LYS 22 -0.873 -7.641 3.898 16 HE3 LYS 22 HE3 LYS 22 0.751 -7.429 4.550 17 HZ1 LYS 22 HZ1 LYS 22 -0.688 -8.296 6.239 18 HZ2 LYS 22 HZ2 LYS 22 -1.809 -7.055 6.016 19 HZ3 LYS 22 HZ3 LYS 22 -0.283 -6.709 6.655 20 H VAL 23 H VAL 23 3.462 -6.984 3.399 21 HA VAL 23 HA VAL 23 1.576 -7.260 1.183 22 HB VAL 23 HB VAL 23 3.670 -6.692 0.001 23 HG11 VAL 23 HG11 VAL 23 5.685 -8.135 0.097 24 HG12 VAL 23 HG12 VAL 23 4.939 -9.080 1.388 25 HG13 VAL 23 HG13 VAL 23 5.337 -7.383 1.658 26 HG21 VAL 23 HG21 VAL 23 2.968 -9.635 -0.324 27 HG22 VAL 23 HG22 VAL 23 3.794 -8.637 -1.523 28 HG23 VAL 23 HG23 VAL 23 2.123 -8.281 -1.078 29 H THR 24 H THR 24 0.561 -9.198 1.271 30 HA THR 24 HA THR 24 1.644 -11.356 2.992 31 HB THR 24 HB THR 24 -1.261 -10.841 2.183 32 HG1 THR 24 HG1 THR 24 -1.517 -10.179 4.310 33 HG21 THR 24 HG21 THR 24 -1.835 -12.587 3.827 34 HG22 THR 24 HG22 THR 24 -0.125 -12.878 4.138 35 HG23 THR 24 HG23 THR 24 -0.805 -13.256 2.555 36 H LEU 25 H LEU 25 2.691 -12.724 1.716 37 HA LEU 25 HA LEU 25 1.708 -13.395 -0.980 38 HB2 LEU 25 HB2 LEU 25 4.360 -13.921 0.424 39 HB3 LEU 25 HB3 LEU 25 3.965 -14.529 -1.180 40 HG LEU 25 HG LEU 25 4.016 -11.567 -0.484 41 HD11 LEU 25 HD11 LEU 25 6.278 -12.454 -0.208 42 HD12 LEU 25 HD12 LEU 25 6.179 -11.403 -1.617 43 HD13 LEU 25 HD13 LEU 25 6.222 -13.157 -1.827 44 HD21 LEU 25 HD21 LEU 25 4.030 -11.216 -2.924 45 HD22 LEU 25 HD22 LEU 25 2.593 -12.099 -2.416 46 HD23 LEU 25 HD23 LEU 25 3.930 -12.959 -3.189 47 H VAL 26 H VAL 26 0.175 -14.919 -0.812 48 HA VAL 26 HA VAL 26 0.287 -17.000 1.248 49 HB VAL 26 HB VAL 26 -1.906 -16.382 -0.776 50 HG11 VAL 26 HG11 VAL 26 -3.389 -17.764 0.636 51 HG12 VAL 26 HG12 VAL 26 -2.023 -18.167 1.676 52 HG13 VAL 26 HG13 VAL 26 -2.036 -18.703 -0.005 53 HG21 VAL 26 HG21 VAL 26 -1.784 -15.541 2.145 54 HG22 VAL 26 HG22 VAL 26 -3.147 -15.285 1.053 55 HG23 VAL 26 HG23 VAL 26 -1.610 -14.472 0.749 56 H ARG 27 H ARG 27 1.292 -18.816 0.735 57 HA ARG 27 HA ARG 27 1.489 -19.788 -2.019 58 HB2 ARG 27 HB2 ARG 27 2.723 -20.741 0.595 59 HB3 ARG 27 HB3 ARG 27 2.957 -21.560 -0.950 60 HG2 ARG 27 HG2 ARG 27 4.085 -19.642 -1.884 61 HG3 ARG 27 HG3 ARG 27 3.703 -18.660 -0.467 62 HD2 ARG 27 HD2 ARG 27 6.066 -19.474 -0.519 63 HD3 ARG 27 HD3 ARG 27 5.175 -19.976 0.921 64 HE ARG 27 HE ARG 27 4.988 -22.002 -1.031 65 HH11 ARG 27 HH11 ARG 27 7.415 -20.590 1.094 66 HH12 ARG 27 HH12 ARG 27 8.295 -22.075 1.252 67 HH21 ARG 27 HH21 ARG 27 6.154 -23.943 -0.778 68 HH22 ARG 27 HH22 ARG 27 7.590 -23.962 0.200 69 H ILE 28 H ILE 28 1.023 -22.150 -2.399 70 HA ILE 28 HA ILE 28 -1.665 -22.752 -1.886 71 HB ILE 28 HB ILE 28 -0.554 -23.660 -3.849 72 HG12 ILE 28 HG12 ILE 28 -1.534 -25.928 -2.044 73 HG13 ILE 28 HG13 ILE 28 -2.547 -24.901 -3.050 74 HG21 ILE 28 HG21 ILE 28 1.099 -25.480 -3.768 75 HG22 ILE 28 HG22 ILE 28 1.106 -25.401 -2.005 76 HG23 ILE 28 HG23 ILE 28 1.684 -24.028 -2.952 77 HD11 ILE 28 HD11 ILE 28 -2.240 -27.085 -4.051 78 HD12 ILE 28 HD12 ILE 28 -0.489 -26.878 -4.042 79 HD13 ILE 28 HD13 ILE 28 -1.497 -25.841 -5.056 80 H ALA 29 H ALA 29 1.243 -23.766 -0.161 81 HA ALA 29 HA ALA 29 0.191 -25.750 1.541 82 HB1 ALA 29 HB1 ALA 29 2.613 -25.339 1.343 83 HB2 ALA 29 HB2 ALA 29 2.112 -25.245 3.033 84 HB3 ALA 29 HB3 ALA 29 2.432 -23.768 2.120 85 H ASP 30 H ASP 30 0.540 -22.238 2.033 86 HA ASP 30 HA ASP 30 -0.696 -22.076 4.591 87 HB2 ASP 30 HB2 ASP 30 0.864 -20.339 3.647 88 HB3 ASP 30 HB3 ASP 30 -0.370 -19.878 2.493 89 H LEU 31 H LEU 31 -1.880 -21.888 1.300 90 HA LEU 31 HA LEU 31 -4.476 -20.881 1.694 91 HB2 LEU 31 HB2 LEU 31 -3.360 -21.067 -0.519 92 HB3 LEU 31 HB3 LEU 31 -3.434 -22.816 -0.411 93 HG LEU 31 HG LEU 31 -5.983 -22.602 -0.415 94 HD11 LEU 31 HD11 LEU 31 -6.977 -20.546 -1.286 95 HD12 LEU 31 HD12 LEU 31 -5.405 -19.747 -1.246 96 HD13 LEU 31 HD13 LEU 31 -6.176 -20.258 0.259 97 HD21 LEU 31 HD21 LEU 31 -6.136 -22.326 -2.854 98 HD22 LEU 31 HD22 LEU 31 -4.753 -23.323 -2.410 99 HD23 LEU 31 HD23 LEU 31 -4.510 -21.641 -2.889 100 H GLU 32 H GLU 32 -3.228 -24.217 1.628 101 HA GLU 32 HA GLU 32 -5.632 -25.636 2.057 102 HB2 GLU 32 HB2 GLU 32 -2.766 -26.384 2.803 103 HB3 GLU 32 HB3 GLU 32 -4.122 -27.511 2.809 104 HG2 GLU 32 HG2 GLU 32 -3.069 -26.054 0.369 105 HG3 GLU 32 HG3 GLU 32 -2.667 -27.710 0.815 106 H ASN 33 H ASN 33 -3.074 -24.659 4.306 107 HA ASN 33 HA ASN 33 -4.084 -25.796 6.661 108 HB2 ASN 33 HB2 ASN 33 -2.236 -23.402 6.272 109 HB3 ASN 33 HB3 ASN 33 -2.485 -24.219 7.814 110 HD21 ASN 33 HD21 ASN 33 -0.086 -23.876 6.066 111 HD22 ASN 33 HD22 ASN 33 0.537 -25.469 5.847 112 H HIS 34 H HIS 34 -4.379 -22.465 5.433 113 HA HIS 34 HA HIS 34 -5.792 -21.442 7.688 114 HB2 HIS 34 HB2 HIS 34 -4.391 -20.093 5.999 115 HB3 HIS 34 HB3 HIS 34 -5.775 -20.178 4.914 116 HD1 HIS 34 HD1 HIS 34 -7.989 -18.963 5.759 117 HD2 HIS 34 HD2 HIS 34 -4.587 -18.236 8.025 118 HE1 HIS 34 HE1 HIS 34 -8.562 -17.009 7.223 119 HE2 HIS 34 HE2 HIS 34 -6.531 -16.660 8.662 120 H ASN 35 H ASN 35 -6.755 -22.850 4.626 121 HA ASN 35 HA ASN 35 -9.512 -22.208 4.635 122 HB2 ASN 35 HB2 ASN 35 -8.311 -23.045 2.633 123 HB3 ASN 35 HB3 ASN 35 -8.072 -24.601 3.416 124 HD21 ASN 35 HD21 ASN 35 -9.144 -25.704 1.766 125 HD22 ASN 35 HD22 ASN 35 -10.857 -25.620 1.553 126 H ASN 36 H ASN 36 -7.721 -25.053 5.833 127 HA ASN 36 HA ASN 36 -9.995 -26.464 6.858 128 HB2 ASN 36 HB2 ASN 36 -7.040 -26.834 7.518 129 HB3 ASN 36 HB3 ASN 36 -8.319 -28.006 7.809 130 HD21 ASN 36 HD21 ASN 36 -5.904 -28.323 6.268 131 HD22 ASN 36 HD22 ASN 36 -6.385 -28.731 4.663 132 H ASP 37 H ASP 37 -7.843 -24.034 8.117 133 HA ASP 37 HA ASP 37 -8.391 -24.257 10.903 134 HB2 ASP 37 HB2 ASP 37 -6.446 -23.019 10.001 135 HB3 ASP 37 HB3 ASP 37 -7.516 -21.873 9.210 136 H GLY 38 H GLY 38 -10.162 -22.903 8.215 137 HA2 GLY 38 HA2 GLY 38 -12.645 -22.896 8.740 138 HA3 GLY 38 HA3 GLY 38 -12.237 -21.782 10.040 139 H GLY 39 H GLY 39 -10.135 -20.520 8.369 140 HA2 GLY 39 HA2 GLY 39 -11.755 -18.497 7.095 141 HA3 GLY 39 HA3 GLY 39 -10.003 -18.546 7.193 142 H PHE 40 H PHE 40 -12.787 -19.479 5.332 143 HA PHE 40 HA PHE 40 -11.425 -21.162 3.445 144 HB2 PHE 40 HB2 PHE 40 -13.920 -21.275 4.031 145 HB3 PHE 40 HB3 PHE 40 -14.145 -19.810 3.090 146 HD1 PHE 40 HD1 PHE 40 -13.476 -19.903 0.556 147 HD2 PHE 40 HD2 PHE 40 -13.966 -23.397 2.975 148 HE1 PHE 40 HE1 PHE 40 -13.726 -21.275 -1.471 149 HE2 PHE 40 HE2 PHE 40 -14.209 -24.761 0.941 150 HZ PHE 40 HZ PHE 40 -14.089 -23.705 -1.277 151 H TRP 41 H TRP 41 -9.935 -20.271 2.195 152 HA TRP 41 HA TRP 41 -10.366 -17.678 0.844 153 HB2 TRP 41 HB2 TRP 41 -7.853 -19.312 1.384 154 HB3 TRP 41 HB3 TRP 41 -7.872 -17.926 0.303 155 HD1 TRP 41 HD1 TRP 41 -10.012 -16.667 2.866 156 HE1 TRP 41 HE1 TRP 41 -8.716 -15.346 4.647 157 HE3 TRP 41 HE3 TRP 41 -5.299 -18.371 1.875 158 HZ2 TRP 41 HZ2 TRP 41 -6.057 -15.052 5.516 159 HZ3 TRP 41 HZ3 TRP 41 -3.428 -17.528 3.232 160 HH2 TRP 41 HH2 TRP 41 -3.803 -15.897 5.013 161 H THR 42 H THR 42 -9.299 -17.664 -1.399 162 HA THR 42 HA THR 42 -9.369 -20.066 -2.979 163 HB THR 42 HB THR 42 -11.797 -19.604 -2.905 164 HG1 THR 42 HG1 THR 42 -12.086 -19.377 -5.239 165 HG21 THR 42 HG21 THR 42 -11.177 -16.896 -4.151 166 HG22 THR 42 HG22 THR 42 -11.764 -17.155 -2.506 167 HG23 THR 42 HG23 THR 42 -12.785 -17.572 -3.884 168 H VAL 43 H VAL 43 -8.043 -19.813 -4.740 169 HA VAL 43 HA VAL 43 -6.733 -17.216 -5.136 170 HB VAL 43 HB VAL 43 -6.008 -19.951 -6.284 171 HG11 VAL 43 HG11 VAL 43 -4.462 -17.327 -6.348 172 HG12 VAL 43 HG12 VAL 43 -5.200 -18.132 -7.735 173 HG13 VAL 43 HG13 VAL 43 -3.843 -18.888 -6.897 174 HG21 VAL 43 HG21 VAL 43 -4.771 -18.421 -3.958 175 HG22 VAL 43 HG22 VAL 43 -4.174 -19.944 -4.618 176 HG23 VAL 43 HG23 VAL 43 -5.750 -19.884 -3.829 177 H ILE 44 H ILE 44 -7.703 -15.905 -6.536 178 HA ILE 44 HA ILE 44 -8.643 -16.929 -9.153 179 HB ILE 44 HB ILE 44 -9.777 -14.523 -7.642 180 HG12 ILE 44 HG12 ILE 44 -11.086 -17.257 -8.059 181 HG13 ILE 44 HG13 ILE 44 -10.394 -16.703 -6.541 182 HG21 ILE 44 HG21 ILE 44 -10.719 -15.838 -10.220 183 HG22 ILE 44 HG22 ILE 44 -9.921 -14.269 -10.085 184 HG23 ILE 44 HG23 ILE 44 -11.528 -14.505 -9.397 185 HD11 ILE 44 HD11 ILE 44 -12.772 -15.477 -7.946 186 HD12 ILE 44 HD12 ILE 44 -12.086 -14.940 -6.411 187 HD13 ILE 44 HD13 ILE 44 -12.815 -16.539 -6.540 188 H ASP 45 H ASP 45 -7.115 -16.365 -10.582 189 HA ASP 45 HA ASP 45 -5.839 -15.171 -12.001 190 HB2 ASP 45 HB2 ASP 45 -7.904 -13.770 -12.143 191 HB3 ASP 45 HB3 ASP 45 -7.296 -12.750 -10.848 192 H GLY 46 H GLY 46 -4.550 -15.956 -9.751 193 HA2 GLY 46 HA2 GLY 46 -2.439 -15.755 -8.842 194 HA3 GLY 46 HA3 GLY 46 -2.236 -14.254 -9.732 195 H LYS 47 H LYS 47 -5.052 -14.150 -7.911 196 HA LYS 47 HA LYS 47 -3.771 -12.853 -5.571 197 HB2 LYS 47 HB2 LYS 47 -6.461 -12.231 -6.884 198 HB3 LYS 47 HB3 LYS 47 -5.843 -11.458 -5.424 199 HG2 LYS 47 HG2 LYS 47 -4.550 -11.295 -8.165 200 HG3 LYS 47 HG3 LYS 47 -5.615 -10.064 -7.472 201 HD2 LYS 47 HD2 LYS 47 -3.992 -9.719 -5.616 202 HD3 LYS 47 HD3 LYS 47 -2.926 -10.942 -6.323 203 HE2 LYS 47 HE2 LYS 47 -2.230 -8.606 -6.856 204 HE3 LYS 47 HE3 LYS 47 -2.584 -9.557 -8.302 205 HZ1 LYS 47 HZ1 LYS 47 -4.720 -8.504 -8.473 206 HZ2 LYS 47 HZ2 LYS 47 -3.530 -7.309 -8.373 207 HZ3 LYS 47 HZ3 LYS 47 -4.487 -7.660 -7.023 208 H VAL 48 H VAL 48 -4.921 -13.160 -3.564 209 HA VAL 48 HA VAL 48 -6.651 -15.558 -3.494 210 HB VAL 48 HB VAL 48 -4.856 -14.594 -1.222 211 HG11 VAL 48 HG11 VAL 48 -6.818 -15.910 -0.477 212 HG12 VAL 48 HG12 VAL 48 -5.320 -16.798 -0.204 213 HG13 VAL 48 HG13 VAL 48 -6.361 -17.221 -1.568 214 HG21 VAL 48 HG21 VAL 48 -4.349 -16.807 -3.237 215 HG22 VAL 48 HG22 VAL 48 -3.388 -16.528 -1.787 216 HG23 VAL 48 HG23 VAL 48 -3.430 -15.311 -3.062 217 H TYR 49 H TYR 49 -8.652 -14.989 -3.148 218 HA TYR 49 HA TYR 49 -9.362 -12.765 -1.324 219 HB2 TYR 49 HB2 TYR 49 -11.030 -14.098 -3.513 220 HB3 TYR 49 HB3 TYR 49 -11.569 -12.781 -2.477 221 HD1 TYR 49 HD1 TYR 49 -10.729 -10.475 -2.825 222 HD2 TYR 49 HD2 TYR 49 -9.476 -13.669 -5.384 223 HE1 TYR 49 HE1 TYR 49 -9.837 -8.847 -4.430 224 HE2 TYR 49 HE2 TYR 49 -8.587 -12.024 -6.982 225 HH TYR 49 HH TYR 49 -9.002 -9.601 -7.575 226 H ASP 50 H ASP 50 -11.095 -13.188 0.187 227 HA ASP 50 HA ASP 50 -11.368 -16.012 0.977 228 HB2 ASP 50 HB2 ASP 50 -12.415 -15.114 3.048 229 HB3 ASP 50 HB3 ASP 50 -10.822 -14.426 2.765 230 H ILE 51 H ILE 51 -13.302 -17.058 1.063 231 HA ILE 51 HA ILE 51 -15.741 -15.814 -0.043 232 HB ILE 51 HB ILE 51 -15.029 -18.746 0.453 233 HG12 ILE 51 HG12 ILE 51 -13.856 -17.820 -1.496 234 HG13 ILE 51 HG13 ILE 51 -15.099 -18.940 -2.048 235 HG21 ILE 51 HG21 ILE 51 -17.155 -19.358 -0.667 236 HG22 ILE 51 HG22 ILE 51 -17.615 -17.654 -0.716 237 HG23 ILE 51 HG23 ILE 51 -17.431 -18.471 0.835 238 HD11 ILE 51 HD11 ILE 51 -15.272 -15.928 -2.063 239 HD12 ILE 51 HD12 ILE 51 -16.552 -17.028 -2.586 240 HD13 ILE 51 HD13 ILE 51 -15.018 -16.981 -3.452 241 H LYS 52 H LYS 52 -14.203 -16.886 2.837 242 HA LYS 52 HA LYS 52 -16.357 -17.674 4.460 243 HB2 LYS 52 HB2 LYS 52 -13.894 -18.110 4.824 244 HB3 LYS 52 HB3 LYS 52 -13.698 -16.440 5.315 245 HG2 LYS 52 HG2 LYS 52 -15.587 -18.304 6.770 246 HG3 LYS 52 HG3 LYS 52 -13.863 -18.307 7.124 247 HD2 LYS 52 HD2 LYS 52 -15.741 -15.930 7.417 248 HD3 LYS 52 HD3 LYS 52 -15.127 -16.933 8.733 249 HE2 LYS 52 HE2 LYS 52 -12.805 -16.202 8.159 250 HE3 LYS 52 HE3 LYS 52 -13.471 -15.153 6.904 251 HZ1 LYS 52 HZ1 LYS 52 -14.056 -14.941 9.805 252 HZ2 LYS 52 HZ2 LYS 52 -14.647 -13.920 8.593 253 HZ3 LYS 52 HZ3 LYS 52 -12.993 -13.951 8.938 254 H ASP 53 H ASP 53 -14.584 -14.558 4.472 255 HA ASP 53 HA ASP 53 -16.550 -13.264 6.143 256 HB2 ASP 53 HB2 ASP 53 -14.079 -12.737 6.230 257 HB3 ASP 53 HB3 ASP 53 -14.214 -12.009 4.637 258 H PHE 54 H PHE 54 -15.825 -13.457 2.715 259 HA PHE 54 HA PHE 54 -17.241 -11.391 1.567 260 HB2 PHE 54 HB2 PHE 54 -15.772 -12.990 0.362 261 HB3 PHE 54 HB3 PHE 54 -16.975 -14.254 0.563 262 HD1 PHE 54 HD1 PHE 54 -19.122 -14.155 -0.739 263 HD2 PHE 54 HD2 PHE 54 -15.979 -11.331 -1.386 264 HE1 PHE 54 HE1 PHE 54 -20.128 -13.518 -2.889 265 HE2 PHE 54 HE2 PHE 54 -16.995 -10.711 -3.534 266 HZ PHE 54 HZ PHE 54 -19.069 -11.794 -4.286 267 H GLN 55 H GLN 55 -18.522 -14.644 2.265 268 HA GLN 55 HA GLN 55 -21.190 -14.088 1.438 269 HB2 GLN 55 HB2 GLN 55 -21.753 -16.283 2.315 270 HB3 GLN 55 HB3 GLN 55 -20.216 -16.359 1.459 271 HG2 GLN 55 HG2 GLN 55 -19.049 -16.234 3.689 272 HG3 GLN 55 HG3 GLN 55 -20.633 -16.354 4.461 273 HE21 GLN 55 HE21 GLN 55 -18.191 -18.037 2.643 274 HE22 GLN 55 HE22 GLN 55 -18.801 -19.629 2.893 275 H THR 56 H THR 56 -19.494 -13.738 4.473 276 HA THR 56 HA THR 56 -21.721 -13.221 6.166 277 HB THR 56 HB THR 56 -18.847 -12.215 6.400 278 HG1 THR 56 HG1 THR 56 -18.562 -14.322 6.592 279 HG21 THR 56 HG21 THR 56 -20.345 -10.981 7.923 280 HG22 THR 56 HG22 THR 56 -19.280 -12.063 8.823 281 HG23 THR 56 HG23 THR 56 -20.966 -12.509 8.558 282 H GLN 57 H GLN 57 -19.805 -11.164 3.947 283 HA GLN 57 HA GLN 57 -20.983 -8.678 4.812 284 HB2 GLN 57 HB2 GLN 57 -19.370 -9.252 2.296 285 HB3 GLN 57 HB3 GLN 57 -19.751 -7.666 2.940 286 HG2 GLN 57 HG2 GLN 57 -17.826 -9.719 4.025 287 HG3 GLN 57 HG3 GLN 57 -17.498 -8.070 3.513 288 HE21 GLN 57 HE21 GLN 57 -18.571 -10.107 6.089 289 HE22 GLN 57 HE22 GLN 57 -18.611 -8.899 7.323 290 H SER 58 H SER 58 -21.795 -11.097 2.390 291 HA SER 58 HA SER 58 -23.592 -9.428 0.885 292 HB2 SER 58 HB2 SER 58 -24.344 -11.597 -0.150 293 HB3 SER 58 HB3 SER 58 -22.609 -11.323 -0.239 294 HG SER 58 HG SER 58 -23.439 -13.474 0.466 295 H LEU 59 H LEU 59 -23.839 -10.859 3.941 296 HA LEU 59 HA LEU 59 -26.633 -11.133 4.282 297 HB2 LEU 59 HB2 LEU 59 -24.872 -11.869 5.903 298 HB3 LEU 59 HB3 LEU 59 -24.525 -10.196 6.274 299 HG LEU 59 HG LEU 59 -27.267 -11.390 6.837 300 HD11 LEU 59 HD11 LEU 59 -26.546 -11.890 9.132 301 HD12 LEU 59 HD12 LEU 59 -24.889 -11.439 8.721 302 HD13 LEU 59 HD13 LEU 59 -25.641 -12.840 7.955 303 HD21 LEU 59 HD21 LEU 59 -27.387 -9.641 8.596 304 HD22 LEU 59 HD22 LEU 59 -27.171 -8.942 6.995 305 HD23 LEU 59 HD23 LEU 59 -25.800 -9.040 8.101 306 H THR 60 H THR 60 -24.444 -8.343 4.323 307 HA THR 60 HA THR 60 -26.229 -6.386 5.350 308 HB THR 60 HB THR 60 -23.800 -6.026 3.549 309 HG1 THR 60 HG1 THR 60 -24.046 -6.672 6.253 310 HG21 THR 60 HG21 THR 60 -25.108 -3.938 3.800 311 HG22 THR 60 HG22 THR 60 -23.545 -3.816 4.607 312 HG23 THR 60 HG23 THR 60 -25.006 -4.085 5.558 313 H GLU 61 H GLU 61 -28.028 -5.579 4.294 314 HA GLU 61 HA GLU 61 -28.536 -6.148 1.512 315 HB2 GLU 61 HB2 GLU 61 -30.676 -5.054 1.842 316 HB3 GLU 61 HB3 GLU 61 -30.338 -6.084 3.226 317 HG2 GLU 61 HG2 GLU 61 -29.664 -4.117 4.545 318 HG3 GLU 61 HG3 GLU 61 -29.970 -3.073 3.159 319 H ASN 62 H ASN 62 -26.930 -3.642 3.148 320 HA ASN 62 HA ASN 62 -27.185 -1.709 0.934 321 HB2 ASN 62 HB2 ASN 62 -25.997 -1.399 3.724 322 HB3 ASN 62 HB3 ASN 62 -26.117 -0.111 2.527 323 HD21 ASN 62 HD21 ASN 62 -27.305 -0.364 5.232 324 HD22 ASN 62 HD22 ASN 62 -29.002 -0.138 5.014 325 H SER 63 H SER 63 -25.379 -4.337 1.357 326 HA SER 63 HA SER 63 -22.745 -3.217 0.724 327 HB2 SER 63 HB2 SER 63 -21.942 -5.529 0.759 328 HB3 SER 63 HB3 SER 63 -22.999 -5.321 2.142 329 HG SER 63 HG SER 63 -24.028 -6.967 1.374 330 H ILE 64 H ILE 64 -21.635 -3.833 -1.268 331 HA ILE 64 HA ILE 64 -23.124 -3.708 -3.688 332 HB ILE 64 HB ILE 64 -20.962 -4.279 -4.817 333 HG12 ILE 64 HG12 ILE 64 -19.788 -4.487 -2.000 334 HG13 ILE 64 HG13 ILE 64 -20.130 -5.871 -3.028 335 HG21 ILE 64 HG21 ILE 64 -20.698 -2.151 -2.663 336 HG22 ILE 64 HG22 ILE 64 -21.465 -1.943 -4.237 337 HG23 ILE 64 HG23 ILE 64 -19.732 -2.254 -4.138 338 HD11 ILE 64 HD11 ILE 64 -17.786 -5.302 -3.045 339 HD12 ILE 64 HD12 ILE 64 -18.156 -3.679 -3.630 340 HD13 ILE 64 HD13 ILE 64 -18.492 -5.086 -4.643 341 H LEU 65 H LEU 65 -22.286 -6.319 -1.594 342 HA LEU 65 HA LEU 65 -22.523 -8.455 -3.557 343 HB2 LEU 65 HB2 LEU 65 -22.268 -8.627 -0.533 344 HB3 LEU 65 HB3 LEU 65 -22.039 -9.943 -1.678 345 HG LEU 65 HG LEU 65 -20.248 -7.519 -1.292 346 HD11 LEU 65 HD11 LEU 65 -19.976 -9.231 0.425 347 HD12 LEU 65 HD12 LEU 65 -18.556 -9.154 -0.612 348 HD13 LEU 65 HD13 LEU 65 -19.718 -10.469 -0.811 349 HD21 LEU 65 HD21 LEU 65 -18.777 -8.475 -3.021 350 HD22 LEU 65 HD22 LEU 65 -20.342 -8.013 -3.680 351 HD23 LEU 65 HD23 LEU 65 -19.982 -9.716 -3.374 352 H ALA 66 H ALA 66 -24.699 -6.614 -1.745 353 HA ALA 66 HA ALA 66 -26.701 -8.495 -1.039 354 HB1 ALA 66 HB1 ALA 66 -27.007 -5.550 -1.699 355 HB2 ALA 66 HB2 ALA 66 -26.600 -6.215 -0.117 356 HB3 ALA 66 HB3 ALA 66 -28.178 -6.549 -0.831 357 H GLN 67 H GLN 67 -26.026 -6.751 -4.040 358 HA GLN 67 HA GLN 67 -28.411 -7.620 -5.416 359 HB2 GLN 67 HB2 GLN 67 -27.441 -6.616 -7.408 360 HB3 GLN 67 HB3 GLN 67 -27.206 -5.530 -6.045 361 HG2 GLN 67 HG2 GLN 67 -24.851 -6.345 -5.860 362 HG3 GLN 67 HG3 GLN 67 -25.112 -7.326 -7.302 363 HE21 GLN 67 HE21 GLN 67 -24.663 -4.097 -6.065 364 HE22 GLN 67 HE22 GLN 67 -24.420 -3.325 -7.591 365 H PHE 68 H PHE 68 -25.217 -8.899 -4.870 366 HA PHE 68 HA PHE 68 -25.439 -11.060 -6.826 367 HB2 PHE 68 HB2 PHE 68 -23.311 -10.420 -4.732 368 HB3 PHE 68 HB3 PHE 68 -23.215 -11.769 -5.857 369 HD1 PHE 68 HD1 PHE 68 -23.314 -11.183 -8.412 370 HD2 PHE 68 HD2 PHE 68 -22.361 -8.334 -5.364 371 HE1 PHE 68 HE1 PHE 68 -22.197 -9.759 -10.082 372 HE2 PHE 68 HE2 PHE 68 -21.251 -6.918 -7.043 373 HZ PHE 68 HZ PHE 68 -21.166 -7.626 -9.403 374 H ALA 69 H ALA 69 -26.621 -10.503 -3.709 375 HA ALA 69 HA ALA 69 -26.403 -13.073 -2.508 376 HB1 ALA 69 HB1 ALA 69 -28.202 -12.310 -1.001 377 HB2 ALA 69 HB2 ALA 69 -28.515 -10.928 -2.059 378 HB3 ALA 69 HB3 ALA 69 -26.974 -11.061 -1.210 379 H GLY 70 H GLY 70 -26.997 -14.781 -3.680 380 HA2 GLY 70 HA2 GLY 70 -29.244 -16.006 -4.185 381 HA3 GLY 70 HA3 GLY 70 -29.378 -14.750 -5.423 382 H GLU 71 H GLU 71 -26.524 -14.612 -5.856 383 HA GLU 71 HA GLU 71 -26.050 -17.007 -7.490 384 HB2 GLU 71 HB2 GLU 71 -25.756 -14.739 -8.496 385 HB3 GLU 71 HB3 GLU 71 -24.521 -14.352 -7.306 386 HG2 GLU 71 HG2 GLU 71 -23.554 -14.909 -9.495 387 HG3 GLU 71 HG3 GLU 71 -23.040 -16.054 -8.256 388 H ASP 72 H ASP 72 -24.086 -18.191 -7.317 389 HA ASP 72 HA ASP 72 -23.138 -18.909 -4.793 390 HB2 ASP 72 HB2 ASP 72 -22.956 -20.327 -6.839 391 HB3 ASP 72 HB3 ASP 72 -21.760 -19.223 -7.495 392 HA PRO 73 HA PRO 73 -20.552 -15.379 -3.588 393 HB2 PRO 73 HB2 PRO 73 -18.991 -17.626 -2.280 394 HB3 PRO 73 HB3 PRO 73 -19.434 -16.040 -1.624 395 HG2 PRO 73 HG2 PRO 73 -20.863 -18.158 -0.937 396 HG3 PRO 73 HG3 PRO 73 -21.693 -16.639 -1.343 397 HD2 PRO 73 HD2 PRO 73 -21.424 -19.150 -2.978 398 HD3 PRO 73 HD3 PRO 73 -22.790 -18.015 -2.862 399 H VAL 74 H VAL 74 -18.850 -18.296 -4.855 400 HA VAL 74 HA VAL 74 -16.373 -16.951 -5.400 401 HB VAL 74 HB VAL 74 -17.391 -19.568 -6.608 402 HG11 VAL 74 HG11 VAL 74 -15.550 -18.637 -7.951 403 HG12 VAL 74 HG12 VAL 74 -14.992 -20.062 -7.073 404 HG13 VAL 74 HG13 VAL 74 -14.557 -18.450 -6.501 405 HG21 VAL 74 HG21 VAL 74 -16.057 -20.710 -4.879 406 HG22 VAL 74 HG22 VAL 74 -17.272 -19.666 -4.137 407 HG23 VAL 74 HG23 VAL 74 -15.586 -19.152 -4.195 408 H VAL 75 H VAL 75 -19.094 -17.991 -7.433 409 HA VAL 75 HA VAL 75 -18.191 -17.030 -9.938 410 HB VAL 75 HB VAL 75 -21.078 -17.407 -8.992 411 HG11 VAL 75 HG11 VAL 75 -21.646 -17.697 -11.392 412 HG12 VAL 75 HG12 VAL 75 -19.981 -17.313 -11.832 413 HG13 VAL 75 HG13 VAL 75 -20.994 -16.088 -11.069 414 HG21 VAL 75 HG21 VAL 75 -19.767 -19.466 -8.686 415 HG22 VAL 75 HG22 VAL 75 -19.226 -19.397 -10.365 416 HG23 VAL 75 HG23 VAL 75 -20.931 -19.670 -9.998 417 H ALA 76 H ALA 76 -20.123 -15.580 -7.405 418 HA ALA 76 HA ALA 76 -20.824 -13.127 -8.643 419 HB1 ALA 76 HB1 ALA 76 -20.679 -13.838 -5.688 420 HB2 ALA 76 HB2 ALA 76 -22.077 -14.072 -6.739 421 HB3 ALA 76 HB3 ALA 76 -21.515 -12.440 -6.376 422 H LEU 77 H LEU 77 -18.071 -14.184 -6.718 423 HA LEU 77 HA LEU 77 -16.925 -11.637 -6.164 424 HB2 LEU 77 HB2 LEU 77 -16.511 -13.948 -5.040 425 HB3 LEU 77 HB3 LEU 77 -15.380 -14.250 -6.340 426 HG LEU 77 HG LEU 77 -15.111 -11.887 -4.433 427 HD11 LEU 77 HD11 LEU 77 -15.071 -13.947 -3.109 428 HD12 LEU 77 HD12 LEU 77 -13.484 -13.188 -3.147 429 HD13 LEU 77 HD13 LEU 77 -13.803 -14.611 -4.145 430 HD21 LEU 77 HD21 LEU 77 -13.047 -13.204 -6.229 431 HD22 LEU 77 HD22 LEU 77 -12.755 -11.854 -5.129 432 HD23 LEU 77 HD23 LEU 77 -13.824 -11.647 -6.513 433 H GLU 78 H GLU 78 -16.350 -14.105 -8.671 434 HA GLU 78 HA GLU 78 -14.217 -12.823 -10.034 435 HB2 GLU 78 HB2 GLU 78 -16.257 -14.829 -11.086 436 HB3 GLU 78 HB3 GLU 78 -14.746 -14.403 -11.890 437 HG2 GLU 78 HG2 GLU 78 -13.474 -15.320 -9.989 438 HG3 GLU 78 HG3 GLU 78 -14.983 -15.740 -9.177 439 H ALA 79 H ALA 79 -17.731 -12.790 -10.549 440 HA ALA 79 HA ALA 79 -17.858 -11.111 -12.820 441 HB1 ALA 79 HB1 ALA 79 -20.223 -10.772 -12.184 442 HB2 ALA 79 HB2 ALA 79 -19.899 -11.474 -10.597 443 HB3 ALA 79 HB3 ALA 79 -19.763 -12.471 -12.046 444 H ALA 80 H ALA 80 -17.725 -10.452 -9.368 445 HA ALA 80 HA ALA 80 -18.095 -7.617 -9.510 446 HB1 ALA 80 HB1 ALA 80 -18.684 -8.914 -7.511 447 HB2 ALA 80 HB2 ALA 80 -17.522 -7.642 -7.124 448 HB3 ALA 80 HB3 ALA 80 -16.985 -9.320 -7.262 449 H LEU 81 H LEU 81 -15.277 -9.711 -9.793 450 HA LEU 81 HA LEU 81 -13.298 -7.643 -9.456 451 HB2 LEU 81 HB2 LEU 81 -13.108 -10.338 -10.860 452 HB3 LEU 81 HB3 LEU 81 -11.738 -9.279 -10.558 453 HG LEU 81 HG LEU 81 -13.422 -10.682 -8.453 454 HD11 LEU 81 HD11 LEU 81 -10.542 -11.137 -9.271 455 HD12 LEU 81 HD12 LEU 81 -11.908 -12.203 -9.605 456 HD13 LEU 81 HD13 LEU 81 -11.384 -11.946 -7.943 457 HD21 LEU 81 HD21 LEU 81 -12.747 -8.496 -7.612 458 HD22 LEU 81 HD22 LEU 81 -11.066 -8.814 -8.050 459 HD23 LEU 81 HD23 LEU 81 -11.851 -9.773 -6.792 460 H GLN 82 H GLN 82 -15.088 -9.035 -12.138 461 HA GLN 82 HA GLN 82 -13.741 -7.625 -14.241 462 HB2 GLN 82 HB2 GLN 82 -14.983 -9.813 -14.524 463 HB3 GLN 82 HB3 GLN 82 -16.494 -8.952 -14.275 464 HG2 GLN 82 HG2 GLN 82 -16.254 -9.294 -16.621 465 HG3 GLN 82 HG3 GLN 82 -15.968 -7.583 -16.323 466 HE21 GLN 82 HE21 GLN 82 -15.166 -9.222 -18.592 467 HE22 GLN 82 HE22 GLN 82 -13.448 -9.099 -18.710 468 H PHE 83 H PHE 83 -16.376 -6.886 -12.056 469 HA PHE 83 HA PHE 83 -17.245 -4.547 -13.613 470 HB2 PHE 83 HB2 PHE 83 -18.939 -6.128 -12.607 471 HB3 PHE 83 HB3 PHE 83 -18.398 -5.634 -11.010 472 HD1 PHE 83 HD1 PHE 83 -18.835 -3.349 -13.935 473 HD2 PHE 83 HD2 PHE 83 -20.471 -4.717 -10.227 474 HE1 PHE 83 HE1 PHE 83 -20.513 -1.559 -14.011 475 HE2 PHE 83 HE2 PHE 83 -22.145 -2.919 -10.310 476 HZ PHE 83 HZ PHE 83 -22.175 -1.341 -12.203 477 H GLU 84 H GLU 84 -16.456 -2.605 -13.177 478 HA GLU 84 HA GLU 84 -14.292 -2.228 -11.418 479 HB2 GLU 84 HB2 GLU 84 -14.370 0.148 -12.200 480 HB3 GLU 84 HB3 GLU 84 -14.360 -1.040 -13.496 481 HG2 GLU 84 HG2 GLU 84 -16.783 -0.737 -13.816 482 HG3 GLU 84 HG3 GLU 84 -16.817 0.438 -12.502 483 H ASP 85 H ASP 85 -17.696 -1.374 -11.104 484 HA ASP 85 HA ASP 85 -17.417 0.448 -8.915 485 HB2 ASP 85 HB2 ASP 85 -19.864 -1.052 -9.941 486 HB3 ASP 85 HB3 ASP 85 -19.913 0.248 -8.749 487 H THR 86 H THR 86 -17.260 -2.941 -9.057 488 HA THR 86 HA THR 86 -17.923 -3.234 -6.184 489 HB THR 86 HB THR 86 -18.347 -5.676 -6.808 490 HG1 THR 86 HG1 THR 86 -17.253 -5.310 -8.959 491 HG21 THR 86 HG21 THR 86 -20.612 -5.268 -7.703 492 HG22 THR 86 HG22 THR 86 -20.156 -3.615 -8.118 493 HG23 THR 86 HG23 THR 86 -20.223 -4.111 -6.429 494 H ARG 87 H ARG 87 -15.338 -3.410 -8.472 495 HA ARG 87 HA ARG 87 -13.782 -5.496 -7.196 496 HB2 ARG 87 HB2 ARG 87 -12.007 -4.959 -8.745 497 HB3 ARG 87 HB3 ARG 87 -13.525 -4.843 -9.632 498 HG2 ARG 87 HG2 ARG 87 -13.477 -2.396 -9.430 499 HG3 ARG 87 HG3 ARG 87 -11.979 -2.485 -8.504 500 HD2 ARG 87 HD2 ARG 87 -10.823 -3.445 -10.461 501 HD3 ARG 87 HD3 ARG 87 -12.332 -3.372 -11.390 502 HE ARG 87 HE ARG 87 -11.326 -0.875 -10.226 503 HH11 ARG 87 HH11 ARG 87 -11.726 -2.790 -13.159 504 HH12 ARG 87 HH12 ARG 87 -11.385 -1.451 -14.202 505 HH21 ARG 87 HH21 ARG 87 -10.889 0.841 -11.601 506 HH22 ARG 87 HH22 ARG 87 -10.927 0.602 -13.318 507 H GLU 88 H GLU 88 -14.299 -2.174 -6.602 508 HA GLU 88 HA GLU 88 -11.812 -1.440 -5.444 509 HB2 GLU 88 HB2 GLU 88 -13.323 0.479 -4.419 510 HB3 GLU 88 HB3 GLU 88 -12.990 0.431 -6.140 511 HG2 GLU 88 HG2 GLU 88 -15.298 0.986 -5.856 512 HG3 GLU 88 HG3 GLU 88 -15.220 -0.644 -6.507 513 H SER 89 H SER 89 -14.757 -2.835 -4.020 514 HA SER 89 HA SER 89 -13.802 -2.646 -1.291 515 HB2 SER 89 HB2 SER 89 -16.245 -2.695 -1.945 516 HB3 SER 89 HB3 SER 89 -16.044 -4.378 -2.425 517 HG SER 89 HG SER 89 -16.075 -3.234 0.130 518 H MET 90 H MET 90 -13.413 -4.846 -3.968 519 HA MET 90 HA MET 90 -12.635 -7.187 -2.511 520 HB2 MET 90 HB2 MET 90 -12.003 -6.422 -5.385 521 HB3 MET 90 HB3 MET 90 -11.841 -8.036 -4.689 522 HG2 MET 90 HG2 MET 90 -14.404 -6.482 -5.088 523 HG3 MET 90 HG3 MET 90 -13.873 -7.901 -5.995 524 HE1 MET 90 HE1 MET 90 -16.650 -7.238 -4.237 525 HE2 MET 90 HE2 MET 90 -17.000 -8.848 -3.609 526 HE3 MET 90 HE3 MET 90 -16.526 -8.648 -5.293 527 H HIS 91 H HIS 91 -11.063 -4.232 -2.901 528 HA HIS 91 HA HIS 91 -8.330 -5.077 -2.740 529 HB2 HIS 91 HB2 HIS 91 -9.712 -2.495 -1.879 530 HB3 HIS 91 HB3 HIS 91 -7.968 -2.736 -1.786 531 HD1 HIS 91 HD1 HIS 91 -10.456 -3.411 -4.617 532 HD2 HIS 91 HD2 HIS 91 -6.935 -1.337 -3.890 533 HE1 HIS 91 HE1 HIS 91 -9.794 -2.430 -6.821 534 HE2 HIS 91 HE2 HIS 91 -7.584 -1.299 -6.386 535 H ALA 92 H ALA 92 -10.965 -4.761 -0.449 536 HA ALA 92 HA ALA 92 -9.345 -5.283 1.917 537 HB1 ALA 92 HB1 ALA 92 -12.365 -5.156 1.576 538 HB2 ALA 92 HB2 ALA 92 -11.324 -3.823 2.080 539 HB3 ALA 92 HB3 ALA 92 -11.501 -5.238 3.116 540 H PHE 93 H PHE 93 -11.690 -7.041 -0.148 541 HA PHE 93 HA PHE 93 -11.671 -9.504 1.288 542 HB2 PHE 93 HB2 PHE 93 -12.393 -8.929 -1.617 543 HB3 PHE 93 HB3 PHE 93 -12.632 -10.494 -0.844 544 HD1 PHE 93 HD1 PHE 93 -14.206 -10.650 1.147 545 HD2 PHE 93 HD2 PHE 93 -14.022 -7.178 -1.327 546 HE1 PHE 93 HE1 PHE 93 -16.379 -9.899 2.012 547 HE2 PHE 93 HE2 PHE 93 -16.198 -6.440 -0.456 548 HZ PHE 93 HZ PHE 93 -17.377 -7.807 1.219 549 H CYS 94 H CYS 94 -9.461 -8.139 -1.023 550 HA CYS 94 HA CYS 94 -8.001 -10.522 -1.647 551 HB2 CYS 94 HB2 CYS 94 -7.851 -8.460 -3.045 552 HB3 CYS 94 HB3 CYS 94 -7.072 -7.618 -1.710 553 HG CYS 94 HG CYS 94 -5.606 -9.109 -4.101 554 H VAL 95 H VAL 95 -7.619 -11.605 0.249 555 HA VAL 95 HA VAL 95 -6.471 -10.481 2.614 556 HB VAL 95 HB VAL 95 -6.167 -12.841 3.350 557 HG11 VAL 95 HG11 VAL 95 -8.889 -12.315 2.088 558 HG12 VAL 95 HG12 VAL 95 -8.363 -11.788 3.689 559 HG13 VAL 95 HG13 VAL 95 -8.551 -13.509 3.348 560 HG21 VAL 95 HG21 VAL 95 -7.155 -13.593 0.570 561 HG22 VAL 95 HG22 VAL 95 -6.872 -14.715 1.900 562 HG23 VAL 95 HG23 VAL 95 -5.520 -13.840 1.184 563 H GLY 96 H GLY 96 -5.147 -11.554 -0.383 564 HA2 GLY 96 HA2 GLY 96 -2.661 -10.389 -0.016 565 HA3 GLY 96 HA3 GLY 96 -2.460 -12.089 0.414 566 H GLN 97 H GLN 97 -0.958 -11.349 -1.586 567 HA GLN 97 HA GLN 97 -2.243 -12.106 -4.127 568 HB2 GLN 97 HB2 GLN 97 -0.701 -10.163 -4.146 569 HB3 GLN 97 HB3 GLN 97 0.596 -11.173 -3.516 570 HG2 GLN 97 HG2 GLN 97 0.498 -12.538 -5.603 571 HG3 GLN 97 HG3 GLN 97 -0.745 -11.455 -6.225 572 HE21 GLN 97 HE21 GLN 97 2.098 -10.398 -4.383 573 HE22 GLN 97 HE22 GLN 97 2.854 -9.577 -5.695 574 H TYR 98 H TYR 98 -1.815 -14.078 -5.109 575 HA TYR 98 HA TYR 98 -0.846 -16.218 -3.466 576 HB2 TYR 98 HB2 TYR 98 -2.708 -16.558 -5.056 577 HB3 TYR 98 HB3 TYR 98 -1.628 -16.240 -6.408 578 HD1 TYR 98 HD1 TYR 98 -1.781 -18.528 -3.398 579 HD2 TYR 98 HD2 TYR 98 -0.822 -18.152 -7.551 580 HE1 TYR 98 HE1 TYR 98 -1.218 -20.918 -3.492 581 HE2 TYR 98 HE2 TYR 98 -0.267 -20.541 -7.633 582 HH TYR 98 HH TYR 98 -1.123 -22.725 -5.285 583 H LEU 99 H LEU 99 0.943 -17.486 -3.724 584 HA LEU 99 HA LEU 99 3.063 -16.745 -5.614 585 HB2 LEU 99 HB2 LEU 99 3.375 -15.633 -3.318 586 HB3 LEU 99 HB3 LEU 99 3.552 -17.234 -2.635 587 HG LEU 99 HG LEU 99 5.424 -16.045 -4.729 588 HD11 LEU 99 HD11 LEU 99 5.856 -16.253 -1.737 589 HD12 LEU 99 HD12 LEU 99 5.608 -14.769 -2.660 590 HD13 LEU 99 HD13 LEU 99 7.059 -15.735 -2.927 591 HD21 LEU 99 HD21 LEU 99 6.966 -17.858 -4.112 592 HD22 LEU 99 HD22 LEU 99 5.459 -18.478 -4.771 593 HD23 LEU 99 HD23 LEU 99 5.744 -18.534 -3.030 594 H GLU 100 H GLU 100 3.527 -18.577 -6.711 595 HA GLU 100 HA GLU 100 2.760 -21.217 -5.839 596 HB2 GLU 100 HB2 GLU 100 4.448 -20.285 -8.194 597 HB3 GLU 100 HB3 GLU 100 3.821 -21.907 -7.991 598 HG2 GLU 100 HG2 GLU 100 1.603 -21.238 -8.407 599 HG3 GLU 100 HG3 GLU 100 1.958 -19.538 -8.101 600 HA PRO 101 HA PRO 101 6.682 -22.064 -3.627 601 HB2 PRO 101 HB2 PRO 101 6.547 -24.864 -3.786 602 HB3 PRO 101 HB3 PRO 101 5.765 -23.879 -2.543 603 HG2 PRO 101 HG2 PRO 101 4.591 -25.018 -5.074 604 HG3 PRO 101 HG3 PRO 101 3.889 -24.947 -3.441 605 HD2 PRO 101 HD2 PRO 101 3.129 -23.192 -5.334 606 HD3 PRO 101 HD3 PRO 101 3.320 -22.675 -3.642 607 H ASP 102 H ASP 102 5.840 -23.491 -6.750 608 HA ASP 102 HA ASP 102 8.507 -24.212 -7.555 609 HB2 ASP 102 HB2 ASP 102 6.538 -25.396 -8.435 610 HB3 ASP 102 HB3 ASP 102 5.937 -23.906 -9.155 611 H GLN 103 H GLN 103 6.557 -21.324 -7.767 612 HA GLN 103 HA GLN 103 7.958 -19.892 -9.795 613 HB2 GLN 103 HB2 GLN 103 5.638 -19.393 -8.863 614 HB3 GLN 103 HB3 GLN 103 6.410 -18.743 -7.427 615 HG2 GLN 103 HG2 GLN 103 5.737 -16.944 -8.869 616 HG3 GLN 103 HG3 GLN 103 7.499 -17.022 -8.829 617 HE21 GLN 103 HE21 GLN 103 4.648 -17.637 -10.776 618 HE22 GLN 103 HE22 GLN 103 5.465 -17.697 -12.299 619 H GLU 104 H GLU 104 8.466 -20.354 -6.346 620 HA GLU 104 HA GLU 104 10.601 -18.532 -5.943 621 HB2 GLU 104 HB2 GLU 104 9.936 -21.149 -4.538 622 HB3 GLU 104 HB3 GLU 104 11.217 -20.062 -4.009 623 HG2 GLU 104 HG2 GLU 104 8.265 -19.389 -4.163 624 HG3 GLU 104 HG3 GLU 104 9.160 -19.779 -2.694 625 H GLY 105 H GLY 105 12.228 -18.549 -7.370 626 HA2 GLY 105 HA2 GLY 105 14.336 -19.203 -8.108 627 HA3 GLY 105 HA3 GLY 105 14.076 -20.803 -7.428 628 H VAL 106 H VAL 106 11.949 -19.065 -9.651 629 HA VAL 106 HA VAL 106 11.717 -21.188 -11.514 630 HB VAL 106 HB VAL 106 9.919 -19.574 -11.330 631 HG11 VAL 106 HG11 VAL 106 10.096 -17.215 -12.036 632 HG12 VAL 106 HG12 VAL 106 11.823 -17.426 -12.331 633 HG13 VAL 106 HG13 VAL 106 11.187 -17.564 -10.691 634 HG21 VAL 106 HG21 VAL 106 9.491 -19.025 -13.698 635 HG22 VAL 106 HG22 VAL 106 10.182 -20.641 -13.545 636 HG23 VAL 106 HG23 VAL 106 11.193 -19.298 -14.080 637 H THR 107 H THR 107 12.995 -21.771 -13.202 638 HA THR 107 HA THR 107 15.347 -20.207 -13.898 639 HB THR 107 HB THR 107 15.685 -22.603 -13.710 640 HG1 THR 107 HG1 THR 107 16.578 -21.225 -15.624 641 HG21 THR 107 HG21 THR 107 13.683 -22.983 -15.959 642 HG22 THR 107 HG22 THR 107 13.432 -23.441 -14.274 643 HG23 THR 107 HG23 THR 107 14.672 -24.251 -15.234 644 H ILE 108 H ILE 108 15.588 -18.975 -15.668 645 HA ILE 108 HA ILE 108 13.306 -18.589 -17.493 646 HB ILE 108 HB ILE 108 15.754 -16.854 -16.943 647 HG12 ILE 108 HG12 ILE 108 12.826 -16.425 -16.192 648 HG13 ILE 108 HG13 ILE 108 14.096 -16.914 -15.075 649 HG21 ILE 108 HG21 ILE 108 13.396 -16.256 -18.767 650 HG22 ILE 108 HG22 ILE 108 15.059 -16.553 -19.279 651 HG23 ILE 108 HG23 ILE 108 14.670 -15.113 -18.338 652 HD11 ILE 108 HD11 ILE 108 13.920 -14.265 -16.523 653 HD12 ILE 108 HD12 ILE 108 15.208 -14.750 -15.417 654 HD13 ILE 108 HD13 ILE 108 13.559 -14.571 -14.825 655 HA PRO 109 HA PRO 109 16.002 -20.551 -20.641 656 HB2 PRO 109 HB2 PRO 109 14.105 -21.207 -22.418 657 HB3 PRO 109 HB3 PRO 109 14.194 -22.034 -20.855 658 HG2 PRO 109 HG2 PRO 109 12.337 -19.834 -21.735 659 HG3 PRO 109 HG3 PRO 109 11.975 -21.286 -20.782 660 HD2 PRO 109 HD2 PRO 109 12.459 -18.737 -19.712 661 HD3 PRO 109 HD3 PRO 109 12.577 -20.260 -18.803 662 H ASP 110 H ASP 110 16.577 -20.069 -22.885 663 HA ASP 110 HA ASP 110 16.016 -17.302 -23.726 664 HB2 ASP 110 HB2 ASP 110 18.009 -17.427 -25.102 665 HB3 ASP 110 HB3 ASP 110 18.406 -17.971 -23.479 666 H LEU 111 H LEU 111 15.409 -20.629 -24.627 667 HA LEU 111 HA LEU 111 14.300 -19.990 -27.241 668 HB2 LEU 111 HB2 LEU 111 14.174 -22.498 -25.518 669 HB3 LEU 111 HB3 LEU 111 13.235 -22.346 -26.988 670 HG LEU 111 HG LEU 111 15.381 -22.084 -28.279 671 HD11 LEU 111 HD11 LEU 111 17.501 -22.768 -27.268 672 HD12 LEU 111 HD12 LEU 111 16.727 -22.859 -25.684 673 HD13 LEU 111 HD13 LEU 111 16.868 -21.306 -26.510 674 HD21 LEU 111 HD21 LEU 111 14.214 -24.240 -28.184 675 HD22 LEU 111 HD22 LEU 111 15.098 -24.669 -26.715 676 HD23 LEU 111 HD23 LEU 111 15.963 -24.468 -28.242 677 H GLY 112 H GLY 112 12.969 -18.188 -26.516 678 HA2 GLY 112 HA2 GLY 112 10.256 -18.668 -26.382 679 HA3 GLY 112 HA3 GLY 112 10.774 -18.535 -24.701 Start of MODEL 12 1 H GLU 21 H GLU 21 3.055 -2.988 -3.377 2 HA GLU 21 HA GLU 21 5.273 -2.154 -3.677 3 HB2 GLU 21 HB2 GLU 21 4.814 -0.979 -0.903 4 HB3 GLU 21 HB3 GLU 21 6.427 -1.217 -1.554 5 HG2 GLU 21 HG2 GLU 21 5.800 1.085 -1.850 6 HG3 GLU 21 HG3 GLU 21 5.901 0.314 -3.429 7 H LYS 22 H LYS 22 4.244 -3.211 -0.396 8 HA LYS 22 HA LYS 22 5.718 -5.761 -0.783 9 HB2 LYS 22 HB2 LYS 22 4.964 -4.489 1.891 10 HB3 LYS 22 HB3 LYS 22 5.977 -5.909 1.639 11 HG2 LYS 22 HG2 LYS 22 6.677 -3.061 0.840 12 HG3 LYS 22 HG3 LYS 22 7.292 -3.914 2.262 13 HD2 LYS 22 HD2 LYS 22 7.767 -4.752 -0.629 14 HD3 LYS 22 HD3 LYS 22 8.910 -3.845 0.360 15 HE2 LYS 22 HE2 LYS 22 9.007 -5.785 1.946 16 HE3 LYS 22 HE3 LYS 22 7.949 -6.690 0.858 17 HZ1 LYS 22 HZ1 LYS 22 9.629 -6.483 -0.867 18 HZ2 LYS 22 HZ2 LYS 22 10.262 -7.245 0.500 19 HZ3 LYS 22 HZ3 LYS 22 10.638 -5.625 0.183 20 H VAL 23 H VAL 23 3.997 -6.815 -1.821 21 HA VAL 23 HA VAL 23 1.375 -6.995 -0.536 22 HB VAL 23 HB VAL 23 1.574 -6.767 -3.019 23 HG11 VAL 23 HG11 VAL 23 2.683 -9.600 -3.018 24 HG12 VAL 23 HG12 VAL 23 3.574 -8.137 -3.438 25 HG13 VAL 23 HG13 VAL 23 2.229 -8.670 -4.449 26 HG21 VAL 23 HG21 VAL 23 -0.498 -7.682 -2.054 27 HG22 VAL 23 HG22 VAL 23 0.159 -9.319 -2.137 28 HG23 VAL 23 HG23 VAL 23 -0.168 -8.420 -3.621 29 H THR 24 H THR 24 0.498 -8.869 0.380 30 HA THR 24 HA THR 24 2.259 -10.651 1.733 31 HB THR 24 HB THR 24 -0.770 -10.916 1.430 32 HG1 THR 24 HG1 THR 24 -1.004 -9.416 2.938 33 HG21 THR 24 HG21 THR 24 0.327 -12.887 2.476 34 HG22 THR 24 HG22 THR 24 -0.682 -12.018 3.632 35 HG23 THR 24 HG23 THR 24 1.070 -11.825 3.680 36 H LEU 25 H LEU 25 3.310 -12.300 0.638 37 HA LEU 25 HA LEU 25 2.071 -13.631 -1.641 38 HB2 LEU 25 HB2 LEU 25 4.748 -14.088 -0.271 39 HB3 LEU 25 HB3 LEU 25 4.197 -14.985 -1.682 40 HG LEU 25 HG LEU 25 4.803 -11.998 -1.557 41 HD11 LEU 25 HD11 LEU 25 6.194 -14.221 -3.092 42 HD12 LEU 25 HD12 LEU 25 6.817 -13.403 -1.656 43 HD13 LEU 25 HD13 LEU 25 6.599 -12.501 -3.153 44 HD21 LEU 25 HD21 LEU 25 4.297 -11.941 -3.989 45 HD22 LEU 25 HD22 LEU 25 2.871 -12.332 -3.033 46 HD23 LEU 25 HD23 LEU 25 3.722 -13.608 -3.910 47 H VAL 26 H VAL 26 0.396 -14.792 -1.012 48 HA VAL 26 HA VAL 26 0.538 -16.748 1.180 49 HB VAL 26 HB VAL 26 -1.793 -15.936 -0.626 50 HG11 VAL 26 HG11 VAL 26 -1.848 -17.693 1.852 51 HG12 VAL 26 HG12 VAL 26 -2.079 -18.237 0.191 52 HG13 VAL 26 HG13 VAL 26 -3.257 -17.156 0.935 53 HG21 VAL 26 HG21 VAL 26 -1.255 -15.147 2.265 54 HG22 VAL 26 HG22 VAL 26 -2.685 -14.724 1.321 55 HG23 VAL 26 HG23 VAL 26 -1.108 -14.092 0.855 56 H ARG 27 H ARG 27 1.257 -18.702 0.668 57 HA ARG 27 HA ARG 27 1.345 -19.639 -2.114 58 HB2 ARG 27 HB2 ARG 27 2.610 -20.763 0.423 59 HB3 ARG 27 HB3 ARG 27 2.872 -21.394 -1.201 60 HG2 ARG 27 HG2 ARG 27 4.365 -19.751 -1.761 61 HG3 ARG 27 HG3 ARG 27 3.452 -18.490 -0.936 62 HD2 ARG 27 HD2 ARG 27 5.340 -20.485 0.370 63 HD3 ARG 27 HD3 ARG 27 5.639 -18.754 0.119 64 HE ARG 27 HE ARG 27 3.230 -19.175 1.592 65 HH11 ARG 27 HH11 ARG 27 6.715 -19.082 2.071 66 HH12 ARG 27 HH12 ARG 27 6.570 -18.796 3.776 67 HH21 ARG 27 HH21 ARG 27 3.070 -18.832 3.789 68 HH22 ARG 27 HH22 ARG 27 4.509 -18.651 4.754 69 H ILE 28 H ILE 28 0.948 -22.117 -2.362 70 HA ILE 28 HA ILE 28 -1.741 -22.716 -1.754 71 HB ILE 28 HB ILE 28 -0.564 -23.692 -3.698 72 HG12 ILE 28 HG12 ILE 28 -1.720 -25.842 -1.843 73 HG13 ILE 28 HG13 ILE 28 -2.666 -24.770 -2.874 74 HG21 ILE 28 HG21 ILE 28 0.914 -25.450 -1.707 75 HG22 ILE 28 HG22 ILE 28 1.621 -24.172 -2.697 76 HG23 ILE 28 HG23 ILE 28 0.965 -25.615 -3.466 77 HD11 ILE 28 HD11 ILE 28 -0.717 -26.879 -3.808 78 HD12 ILE 28 HD12 ILE 28 -1.638 -25.796 -4.856 79 HD13 ILE 28 HD13 ILE 28 -2.477 -26.975 -3.850 80 H ALA 29 H ALA 29 1.269 -23.507 -0.101 81 HA ALA 29 HA ALA 29 0.479 -25.335 1.842 82 HB1 ALA 29 HB1 ALA 29 2.815 -24.568 1.530 83 HB2 ALA 29 HB2 ALA 29 2.320 -24.416 3.216 84 HB3 ALA 29 HB3 ALA 29 2.392 -22.984 2.187 85 H ASP 30 H ASP 30 0.367 -21.776 2.015 86 HA ASP 30 HA ASP 30 -0.919 -21.472 4.507 87 HB2 ASP 30 HB2 ASP 30 -1.036 -19.557 2.129 88 HB3 ASP 30 HB3 ASP 30 -1.361 -19.148 3.810 89 H LEU 31 H LEU 31 -2.131 -21.712 1.224 90 HA LEU 31 HA LEU 31 -4.823 -21.015 1.584 91 HB2 LEU 31 HB2 LEU 31 -3.631 -21.167 -0.609 92 HB3 LEU 31 HB3 LEU 31 -3.567 -22.912 -0.447 93 HG LEU 31 HG LEU 31 -6.115 -22.932 -0.530 94 HD11 LEU 31 HD11 LEU 31 -7.277 -20.961 -1.431 95 HD12 LEU 31 HD12 LEU 31 -5.783 -20.026 -1.341 96 HD13 LEU 31 HD13 LEU 31 -6.549 -20.614 0.137 97 HD21 LEU 31 HD21 LEU 31 -6.233 -22.668 -2.979 98 HD22 LEU 31 HD22 LEU 31 -4.767 -23.524 -2.503 99 HD23 LEU 31 HD23 LEU 31 -4.681 -21.824 -2.973 100 H GLU 32 H GLU 32 -3.188 -24.162 1.715 101 HA GLU 32 HA GLU 32 -5.531 -25.754 2.005 102 HB2 GLU 32 HB2 GLU 32 -2.621 -26.453 2.570 103 HB3 GLU 32 HB3 GLU 32 -3.942 -27.616 2.528 104 HG2 GLU 32 HG2 GLU 32 -2.814 -26.012 0.219 105 HG3 GLU 32 HG3 GLU 32 -2.736 -27.751 0.456 106 H ASN 33 H ASN 33 -3.048 -24.612 4.347 107 HA ASN 33 HA ASN 33 -4.203 -26.098 6.523 108 HB2 ASN 33 HB2 ASN 33 -2.515 -25.202 7.958 109 HB3 ASN 33 HB3 ASN 33 -1.743 -25.487 6.409 110 HD21 ASN 33 HD21 ASN 33 -0.663 -23.839 5.491 111 HD22 ASN 33 HD22 ASN 33 -0.632 -22.217 6.082 112 H HIS 34 H HIS 34 -4.563 -22.806 5.330 113 HA HIS 34 HA HIS 34 -5.929 -21.794 7.645 114 HB2 HIS 34 HB2 HIS 34 -4.658 -20.417 5.827 115 HB3 HIS 34 HB3 HIS 34 -6.136 -20.544 4.881 116 HD1 HIS 34 HD1 HIS 34 -4.596 -18.719 7.694 117 HD2 HIS 34 HD2 HIS 34 -8.382 -19.153 6.061 118 HE1 HIS 34 HE1 HIS 34 -5.965 -16.846 8.651 119 HE2 HIS 34 HE2 HIS 34 -8.250 -17.134 7.652 120 H ASN 35 H ASN 35 -6.902 -23.223 4.561 121 HA ASN 35 HA ASN 35 -9.713 -22.858 4.886 122 HB2 ASN 35 HB2 ASN 35 -8.621 -23.328 2.675 123 HB3 ASN 35 HB3 ASN 35 -8.270 -24.965 3.217 124 HD21 ASN 35 HD21 ASN 35 -9.480 -25.884 1.560 125 HD22 ASN 35 HD22 ASN 35 -11.202 -25.831 1.512 126 H ASN 36 H ASN 36 -7.430 -25.384 5.876 127 HA ASN 36 HA ASN 36 -9.388 -27.218 6.914 128 HB2 ASN 36 HB2 ASN 36 -7.072 -27.918 6.256 129 HB3 ASN 36 HB3 ASN 36 -6.419 -27.002 7.611 130 HD21 ASN 36 HD21 ASN 36 -5.547 -28.794 8.685 131 HD22 ASN 36 HD22 ASN 36 -6.509 -30.048 9.383 132 H ASP 37 H ASP 37 -7.695 -24.430 8.148 133 HA ASP 37 HA ASP 37 -8.330 -24.592 10.912 134 HB2 ASP 37 HB2 ASP 37 -6.663 -23.016 10.522 135 HB3 ASP 37 HB3 ASP 37 -7.349 -22.503 8.997 136 H GLY 38 H GLY 38 -10.149 -23.673 8.103 137 HA2 GLY 38 HA2 GLY 38 -12.614 -23.809 8.333 138 HA3 GLY 38 HA3 GLY 38 -12.463 -22.759 9.742 139 H GLY 39 H GLY 39 -10.223 -21.325 8.327 140 HA2 GLY 39 HA2 GLY 39 -11.713 -19.202 7.160 141 HA3 GLY 39 HA3 GLY 39 -9.972 -19.356 7.207 142 H PHE 40 H PHE 40 -12.858 -20.023 5.362 143 HA PHE 40 HA PHE 40 -11.585 -21.583 3.309 144 HB2 PHE 40 HB2 PHE 40 -14.054 -21.727 3.968 145 HB3 PHE 40 HB3 PHE 40 -14.306 -20.187 3.158 146 HD1 PHE 40 HD1 PHE 40 -13.808 -20.063 0.611 147 HD2 PHE 40 HD2 PHE 40 -14.077 -23.773 2.727 148 HE1 PHE 40 HE1 PHE 40 -14.171 -21.253 -1.511 149 HE2 PHE 40 HE2 PHE 40 -14.429 -24.954 0.593 150 HZ PHE 40 HZ PHE 40 -14.480 -23.696 -1.520 151 H TRP 41 H TRP 41 -10.087 -20.612 2.145 152 HA TRP 41 HA TRP 41 -10.503 -17.933 0.975 153 HB2 TRP 41 HB2 TRP 41 -8.014 -19.611 1.467 154 HB3 TRP 41 HB3 TRP 41 -7.993 -18.251 0.356 155 HD1 TRP 41 HD1 TRP 41 -10.091 -16.814 2.850 156 HE1 TRP 41 HE1 TRP 41 -8.756 -15.500 4.616 157 HE3 TRP 41 HE3 TRP 41 -5.422 -18.769 2.007 158 HZ2 TRP 41 HZ2 TRP 41 -6.115 -15.309 5.531 159 HZ3 TRP 41 HZ3 TRP 41 -3.548 -17.962 3.387 160 HH2 TRP 41 HH2 TRP 41 -3.889 -16.265 5.114 161 H THR 42 H THR 42 -9.652 -17.712 -1.281 162 HA THR 42 HA THR 42 -9.826 -20.035 -3.030 163 HB THR 42 HB THR 42 -12.201 -19.237 -2.801 164 HG1 THR 42 HG1 THR 42 -12.042 -20.125 -4.731 165 HG21 THR 42 HG21 THR 42 -11.251 -16.662 -4.120 166 HG22 THR 42 HG22 THR 42 -11.791 -16.810 -2.446 167 HG23 THR 42 HG23 THR 42 -12.924 -17.099 -3.769 168 H VAL 43 H VAL 43 -8.565 -19.743 -4.884 169 HA VAL 43 HA VAL 43 -6.988 -17.245 -5.015 170 HB VAL 43 HB VAL 43 -6.463 -19.971 -6.296 171 HG11 VAL 43 HG11 VAL 43 -4.245 -19.034 -6.942 172 HG12 VAL 43 HG12 VAL 43 -4.759 -17.446 -6.365 173 HG13 VAL 43 HG13 VAL 43 -5.577 -18.192 -7.739 174 HG21 VAL 43 HG21 VAL 43 -6.128 -19.975 -3.854 175 HG22 VAL 43 HG22 VAL 43 -5.081 -18.559 -3.972 176 HG23 VAL 43 HG23 VAL 43 -4.573 -20.091 -4.685 177 H ILE 44 H ILE 44 -7.769 -15.769 -6.338 178 HA ILE 44 HA ILE 44 -8.670 -16.425 -9.071 179 HB ILE 44 HB ILE 44 -10.228 -14.603 -7.157 180 HG12 ILE 44 HG12 ILE 44 -11.110 -17.265 -8.393 181 HG13 ILE 44 HG13 ILE 44 -10.637 -17.042 -6.715 182 HG21 ILE 44 HG21 ILE 44 -10.833 -15.271 -10.070 183 HG22 ILE 44 HG22 ILE 44 -10.243 -13.722 -9.460 184 HG23 ILE 44 HG23 ILE 44 -11.844 -14.298 -9.002 185 HD11 ILE 44 HD11 ILE 44 -13.047 -15.837 -8.061 186 HD12 ILE 44 HD12 ILE 44 -12.569 -15.565 -6.384 187 HD13 ILE 44 HD13 ILE 44 -13.022 -17.179 -6.924 188 H ASP 45 H ASP 45 -7.932 -14.915 -10.539 189 HA ASP 45 HA ASP 45 -6.930 -13.118 -11.511 190 HB2 ASP 45 HB2 ASP 45 -8.828 -11.886 -10.458 191 HB3 ASP 45 HB3 ASP 45 -7.884 -11.668 -8.996 192 H GLY 46 H GLY 46 -5.354 -14.912 -9.873 193 HA2 GLY 46 HA2 GLY 46 -3.184 -15.198 -9.194 194 HA3 GLY 46 HA3 GLY 46 -2.844 -13.573 -9.761 195 H LYS 47 H LYS 47 -5.380 -13.839 -7.476 196 HA LYS 47 HA LYS 47 -3.688 -12.902 -5.227 197 HB2 LYS 47 HB2 LYS 47 -6.628 -12.202 -5.608 198 HB3 LYS 47 HB3 LYS 47 -5.462 -11.426 -4.543 199 HG2 LYS 47 HG2 LYS 47 -5.348 -11.279 -7.570 200 HG3 LYS 47 HG3 LYS 47 -6.216 -10.104 -6.576 201 HD2 LYS 47 HD2 LYS 47 -4.155 -9.407 -5.500 202 HD3 LYS 47 HD3 LYS 47 -3.238 -10.687 -6.307 203 HE2 LYS 47 HE2 LYS 47 -2.971 -8.409 -7.341 204 HE3 LYS 47 HE3 LYS 47 -3.532 -9.643 -8.464 205 HZ1 LYS 47 HZ1 LYS 47 -4.698 -7.482 -8.616 206 HZ2 LYS 47 HZ2 LYS 47 -5.358 -7.761 -7.082 207 HZ3 LYS 47 HZ3 LYS 47 -5.726 -8.797 -8.361 208 H VAL 48 H VAL 48 -4.990 -13.248 -3.105 209 HA VAL 48 HA VAL 48 -6.645 -15.699 -3.168 210 HB VAL 48 HB VAL 48 -4.747 -14.897 -0.909 211 HG11 VAL 48 HG11 VAL 48 -5.287 -17.108 0.069 212 HG12 VAL 48 HG12 VAL 48 -6.448 -17.400 -1.230 213 HG13 VAL 48 HG13 VAL 48 -6.725 -16.095 -0.076 214 HG21 VAL 48 HG21 VAL 48 -3.400 -16.878 -1.549 215 HG22 VAL 48 HG22 VAL 48 -3.451 -15.677 -2.838 216 HG23 VAL 48 HG23 VAL 48 -4.444 -17.133 -2.951 217 H TYR 49 H TYR 49 -8.657 -15.139 -2.699 218 HA TYR 49 HA TYR 49 -9.286 -12.863 -0.915 219 HB2 TYR 49 HB2 TYR 49 -11.031 -14.248 -3.013 220 HB3 TYR 49 HB3 TYR 49 -11.531 -12.897 -2.005 221 HD1 TYR 49 HD1 TYR 49 -9.330 -13.882 -4.842 222 HD2 TYR 49 HD2 TYR 49 -10.930 -10.613 -2.597 223 HE1 TYR 49 HE1 TYR 49 -8.565 -12.301 -6.564 224 HE2 TYR 49 HE2 TYR 49 -10.162 -9.051 -4.325 225 HH TYR 49 HH TYR 49 -9.068 -10.066 -7.376 226 H ASP 50 H ASP 50 -11.083 -13.190 0.624 227 HA ASP 50 HA ASP 50 -11.390 -15.976 1.533 228 HB2 ASP 50 HB2 ASP 50 -12.441 -15.093 3.537 229 HB3 ASP 50 HB3 ASP 50 -10.973 -14.178 3.244 230 H ILE 51 H ILE 51 -13.488 -16.836 1.965 231 HA ILE 51 HA ILE 51 -15.732 -15.735 0.375 232 HB ILE 51 HB ILE 51 -14.906 -18.636 0.818 233 HG12 ILE 51 HG12 ILE 51 -13.794 -17.549 -1.083 234 HG13 ILE 51 HG13 ILE 51 -14.931 -18.752 -1.683 235 HG21 ILE 51 HG21 ILE 51 -17.314 -18.628 1.178 236 HG22 ILE 51 HG22 ILE 51 -16.954 -19.383 -0.374 237 HG23 ILE 51 HG23 ILE 51 -17.575 -17.732 -0.321 238 HD11 ILE 51 HD11 ILE 51 -15.361 -15.761 -1.623 239 HD12 ILE 51 HD12 ILE 51 -16.532 -16.950 -2.203 240 HD13 ILE 51 HD13 ILE 51 -14.992 -16.748 -3.036 241 H LYS 52 H LYS 52 -14.606 -16.942 3.439 242 HA LYS 52 HA LYS 52 -17.121 -17.594 4.606 243 HB2 LYS 52 HB2 LYS 52 -15.914 -17.646 6.773 244 HB3 LYS 52 HB3 LYS 52 -15.111 -18.582 5.521 245 HG2 LYS 52 HG2 LYS 52 -13.359 -16.999 5.284 246 HG3 LYS 52 HG3 LYS 52 -14.236 -15.762 6.192 247 HD2 LYS 52 HD2 LYS 52 -13.228 -18.379 7.369 248 HD3 LYS 52 HD3 LYS 52 -12.370 -16.842 7.485 249 HE2 LYS 52 HE2 LYS 52 -14.227 -15.890 8.779 250 HE3 LYS 52 HE3 LYS 52 -15.147 -17.386 8.607 251 HZ1 LYS 52 HZ1 LYS 52 -13.467 -18.544 9.868 252 HZ2 LYS 52 HZ2 LYS 52 -14.035 -17.216 10.753 253 HZ3 LYS 52 HZ3 LYS 52 -12.532 -17.140 9.990 254 H ASP 53 H ASP 53 -15.075 -14.640 4.875 255 HA ASP 53 HA ASP 53 -17.017 -13.233 6.494 256 HB2 ASP 53 HB2 ASP 53 -14.529 -12.792 6.627 257 HB3 ASP 53 HB3 ASP 53 -14.596 -12.113 5.008 258 H PHE 54 H PHE 54 -16.150 -13.484 3.122 259 HA PHE 54 HA PHE 54 -17.419 -11.389 1.860 260 HB2 PHE 54 HB2 PHE 54 -15.876 -13.017 0.804 261 HB3 PHE 54 HB3 PHE 54 -17.086 -14.275 0.950 262 HD1 PHE 54 HD1 PHE 54 -19.109 -14.256 -0.545 263 HD2 PHE 54 HD2 PHE 54 -15.933 -11.433 -1.032 264 HE1 PHE 54 HE1 PHE 54 -19.906 -13.737 -2.815 265 HE2 PHE 54 HE2 PHE 54 -16.743 -10.931 -3.299 266 HZ PHE 54 HZ PHE 54 -18.726 -12.074 -4.191 267 H GLN 55 H GLN 55 -18.782 -14.574 2.615 268 HA GLN 55 HA GLN 55 -21.383 -14.079 1.577 269 HB2 GLN 55 HB2 GLN 55 -22.011 -16.208 2.626 270 HB3 GLN 55 HB3 GLN 55 -20.453 -16.345 1.809 271 HG2 GLN 55 HG2 GLN 55 -19.342 -16.010 4.048 272 HG3 GLN 55 HG3 GLN 55 -20.934 -16.107 4.795 273 HE21 GLN 55 HE21 GLN 55 -18.451 -17.873 3.091 274 HE22 GLN 55 HE22 GLN 55 -19.013 -19.456 3.496 275 H THR 56 H THR 56 -19.900 -13.487 4.706 276 HA THR 56 HA THR 56 -22.315 -12.935 6.154 277 HB THR 56 HB THR 56 -19.592 -11.796 6.895 278 HG1 THR 56 HG1 THR 56 -20.437 -14.498 6.954 279 HG21 THR 56 HG21 THR 56 -20.347 -12.241 9.203 280 HG22 THR 56 HG22 THR 56 -21.846 -12.944 8.592 281 HG23 THR 56 HG23 THR 56 -21.522 -11.226 8.360 282 H GLN 57 H GLN 57 -20.072 -11.064 4.170 283 HA GLN 57 HA GLN 57 -21.108 -8.452 4.737 284 HB2 GLN 57 HB2 GLN 57 -19.334 -9.475 2.479 285 HB3 GLN 57 HB3 GLN 57 -19.717 -7.779 2.735 286 HG2 GLN 57 HG2 GLN 57 -18.222 -9.555 4.691 287 HG3 GLN 57 HG3 GLN 57 -17.490 -8.382 3.594 288 HE21 GLN 57 HE21 GLN 57 -19.340 -8.803 6.519 289 HE22 GLN 57 HE22 GLN 57 -19.185 -7.180 7.092 290 H SER 58 H SER 58 -21.887 -10.964 2.395 291 HA SER 58 HA SER 58 -23.478 -9.324 0.654 292 HB2 SER 58 HB2 SER 58 -24.203 -11.475 -0.368 293 HB3 SER 58 HB3 SER 58 -22.454 -11.393 -0.183 294 HG SER 58 HG SER 58 -23.687 -12.514 1.986 295 H LEU 59 H LEU 59 -24.054 -10.463 3.765 296 HA LEU 59 HA LEU 59 -26.915 -10.802 3.625 297 HB2 LEU 59 HB2 LEU 59 -25.094 -10.382 6.026 298 HB3 LEU 59 HB3 LEU 59 -26.793 -10.827 6.115 299 HG LEU 59 HG LEU 59 -24.587 -12.550 4.901 300 HD11 LEU 59 HD11 LEU 59 -24.909 -14.016 6.866 301 HD12 LEU 59 HD12 LEU 59 -26.038 -12.843 7.553 302 HD13 LEU 59 HD13 LEU 59 -24.341 -12.410 7.323 303 HD21 LEU 59 HD21 LEU 59 -26.295 -14.337 4.811 304 HD22 LEU 59 HD22 LEU 59 -26.735 -12.972 3.791 305 HD23 LEU 59 HD23 LEU 59 -27.528 -13.195 5.353 306 H THR 60 H THR 60 -24.873 -8.031 3.625 307 HA THR 60 HA THR 60 -26.722 -6.227 4.970 308 HB THR 60 HB THR 60 -24.262 -5.548 3.295 309 HG1 THR 60 HG1 THR 60 -23.272 -5.339 5.387 310 HG21 THR 60 HG21 THR 60 -25.755 -3.860 5.347 311 HG22 THR 60 HG22 THR 60 -25.791 -3.607 3.600 312 HG23 THR 60 HG23 THR 60 -24.284 -3.386 4.495 313 H GLU 61 H GLU 61 -28.295 -5.027 4.021 314 HA GLU 61 HA GLU 61 -29.231 -5.629 1.402 315 HB2 GLU 61 HB2 GLU 61 -31.027 -4.045 1.874 316 HB3 GLU 61 HB3 GLU 61 -30.713 -5.010 3.314 317 HG2 GLU 61 HG2 GLU 61 -29.420 -3.135 4.290 318 HG3 GLU 61 HG3 GLU 61 -29.726 -2.171 2.852 319 H ASN 62 H ASN 62 -27.237 -3.085 2.690 320 HA ASN 62 HA ASN 62 -27.148 -1.670 0.092 321 HB2 ASN 62 HB2 ASN 62 -28.043 -0.326 2.027 322 HB3 ASN 62 HB3 ASN 62 -26.520 -0.574 2.874 323 HD21 ASN 62 HD21 ASN 62 -28.062 1.015 0.160 324 HD22 ASN 62 HD22 ASN 62 -26.818 2.183 -0.105 325 H SER 63 H SER 63 -25.700 -3.454 -0.471 326 HA SER 63 HA SER 63 -22.911 -2.691 -0.106 327 HB2 SER 63 HB2 SER 63 -23.970 -5.442 0.705 328 HB3 SER 63 HB3 SER 63 -22.276 -5.178 0.290 329 HG SER 63 HG SER 63 -22.918 -3.303 2.012 330 H ILE 64 H ILE 64 -21.499 -3.865 -1.643 331 HA ILE 64 HA ILE 64 -22.547 -3.923 -4.274 332 HB ILE 64 HB ILE 64 -20.341 -4.665 -5.009 333 HG12 ILE 64 HG12 ILE 64 -19.288 -4.856 -2.160 334 HG13 ILE 64 HG13 ILE 64 -20.056 -6.254 -2.888 335 HG21 ILE 64 HG21 ILE 64 -18.952 -2.818 -4.104 336 HG22 ILE 64 HG22 ILE 64 -20.127 -2.578 -2.809 337 HG23 ILE 64 HG23 ILE 64 -20.592 -2.291 -4.486 338 HD11 ILE 64 HD11 ILE 64 -18.418 -6.320 -4.640 339 HD12 ILE 64 HD12 ILE 64 -17.627 -6.295 -3.064 340 HD13 ILE 64 HD13 ILE 64 -17.674 -4.832 -4.046 341 H LEU 65 H LEU 65 -22.196 -6.341 -1.827 342 HA LEU 65 HA LEU 65 -22.499 -8.610 -3.659 343 HB2 LEU 65 HB2 LEU 65 -22.101 -8.577 -0.645 344 HB3 LEU 65 HB3 LEU 65 -22.027 -9.989 -1.691 345 HG LEU 65 HG LEU 65 -20.061 -7.672 -1.670 346 HD11 LEU 65 HD11 LEU 65 -18.445 -9.313 -0.805 347 HD12 LEU 65 HD12 LEU 65 -19.712 -10.543 -0.740 348 HD13 LEU 65 HD13 LEU 65 -19.816 -9.110 0.286 349 HD21 LEU 65 HD21 LEU 65 -20.303 -8.525 -3.954 350 HD22 LEU 65 HD22 LEU 65 -20.020 -10.175 -3.397 351 HD23 LEU 65 HD23 LEU 65 -18.733 -8.971 -3.291 352 H ALA 66 H ALA 66 -24.587 -6.503 -2.244 353 HA ALA 66 HA ALA 66 -26.625 -8.233 -1.195 354 HB1 ALA 66 HB1 ALA 66 -28.063 -6.243 -1.246 355 HB2 ALA 66 HB2 ALA 66 -26.882 -5.397 -2.251 356 HB3 ALA 66 HB3 ALA 66 -26.473 -5.837 -0.594 357 H GLN 67 H GLN 67 -25.908 -6.838 -4.340 358 HA GLN 67 HA GLN 67 -28.163 -7.876 -5.783 359 HB2 GLN 67 HB2 GLN 67 -26.951 -7.157 -7.779 360 HB3 GLN 67 HB3 GLN 67 -26.755 -5.930 -6.530 361 HG2 GLN 67 HG2 GLN 67 -24.507 -7.052 -5.996 362 HG3 GLN 67 HG3 GLN 67 -24.711 -7.950 -7.496 363 HE21 GLN 67 HE21 GLN 67 -24.011 -4.861 -6.072 364 HE22 GLN 67 HE22 GLN 67 -23.506 -4.073 -7.521 365 H PHE 68 H PHE 68 -25.156 -9.188 -4.687 366 HA PHE 68 HA PHE 68 -25.277 -11.592 -6.378 367 HB2 PHE 68 HB2 PHE 68 -23.096 -10.581 -4.494 368 HB3 PHE 68 HB3 PHE 68 -22.986 -12.044 -5.465 369 HD1 PHE 68 HD1 PHE 68 -23.893 -11.269 -8.121 370 HD2 PHE 68 HD2 PHE 68 -21.540 -9.028 -5.341 371 HE1 PHE 68 HE1 PHE 68 -22.887 -10.001 -9.978 372 HE2 PHE 68 HE2 PHE 68 -20.541 -7.766 -7.209 373 HZ PHE 68 HZ PHE 68 -21.215 -8.254 -9.529 374 H ALA 69 H ALA 69 -26.747 -10.684 -3.641 375 HA ALA 69 HA ALA 69 -26.161 -12.863 -1.836 376 HB1 ALA 69 HB1 ALA 69 -26.910 -10.660 -1.006 377 HB2 ALA 69 HB2 ALA 69 -27.999 -11.945 -0.484 378 HB3 ALA 69 HB3 ALA 69 -28.469 -10.879 -1.809 379 H GLY 70 H GLY 70 -26.449 -14.654 -3.209 380 HA2 GLY 70 HA2 GLY 70 -28.502 -16.308 -3.346 381 HA3 GLY 70 HA3 GLY 70 -29.017 -15.136 -4.560 382 H GLU 71 H GLU 71 -26.160 -14.602 -5.240 383 HA GLU 71 HA GLU 71 -25.709 -16.718 -7.190 384 HB2 GLU 71 HB2 GLU 71 -25.409 -14.273 -7.725 385 HB3 GLU 71 HB3 GLU 71 -24.074 -14.203 -6.585 386 HG2 GLU 71 HG2 GLU 71 -23.284 -14.340 -8.908 387 HG3 GLU 71 HG3 GLU 71 -22.761 -15.735 -7.961 388 H ASP 72 H ASP 72 -23.784 -18.007 -7.285 389 HA ASP 72 HA ASP 72 -22.686 -19.082 -4.941 390 HB2 ASP 72 HB2 ASP 72 -22.545 -20.262 -7.102 391 HB3 ASP 72 HB3 ASP 72 -21.525 -18.995 -7.767 392 HA PRO 73 HA PRO 73 -20.208 -15.602 -3.516 393 HB2 PRO 73 HB2 PRO 73 -18.571 -17.738 -2.158 394 HB3 PRO 73 HB3 PRO 73 -19.293 -16.270 -1.477 395 HG2 PRO 73 HG2 PRO 73 -20.416 -18.640 -1.026 396 HG3 PRO 73 HG3 PRO 73 -21.435 -17.225 -1.374 397 HD2 PRO 73 HD2 PRO 73 -20.658 -19.499 -3.196 398 HD3 PRO 73 HD3 PRO 73 -22.223 -18.671 -3.029 399 H VAL 74 H VAL 74 -18.484 -18.419 -4.854 400 HA VAL 74 HA VAL 74 -15.957 -17.056 -5.198 401 HB VAL 74 HB VAL 74 -16.878 -19.707 -6.422 402 HG11 VAL 74 HG11 VAL 74 -14.466 -20.247 -6.588 403 HG12 VAL 74 HG12 VAL 74 -14.056 -18.645 -5.966 404 HG13 VAL 74 HG13 VAL 74 -14.862 -18.807 -7.526 405 HG21 VAL 74 HG21 VAL 74 -17.082 -19.767 -3.963 406 HG22 VAL 74 HG22 VAL 74 -15.408 -19.236 -3.791 407 HG23 VAL 74 HG23 VAL 74 -15.765 -20.811 -4.504 408 H VAL 75 H VAL 75 -18.728 -17.847 -7.235 409 HA VAL 75 HA VAL 75 -17.711 -16.800 -9.717 410 HB VAL 75 HB VAL 75 -20.535 -17.469 -8.764 411 HG11 VAL 75 HG11 VAL 75 -20.808 -15.745 -10.475 412 HG12 VAL 75 HG12 VAL 75 -21.286 -17.305 -11.141 413 HG13 VAL 75 HG13 VAL 75 -19.724 -16.603 -11.573 414 HG21 VAL 75 HG21 VAL 75 -19.037 -19.403 -9.044 415 HG22 VAL 75 HG22 VAL 75 -18.678 -18.912 -10.702 416 HG23 VAL 75 HG23 VAL 75 -20.310 -19.423 -10.266 417 H ALA 76 H ALA 76 -19.545 -15.496 -7.032 418 HA ALA 76 HA ALA 76 -20.356 -13.006 -8.172 419 HB1 ALA 76 HB1 ALA 76 -20.996 -12.428 -5.854 420 HB2 ALA 76 HB2 ALA 76 -20.139 -13.852 -5.259 421 HB3 ALA 76 HB3 ALA 76 -21.559 -14.045 -6.288 422 H LEU 77 H LEU 77 -17.575 -14.160 -6.412 423 HA LEU 77 HA LEU 77 -16.231 -11.756 -5.821 424 HB2 LEU 77 HB2 LEU 77 -15.778 -14.165 -4.998 425 HB3 LEU 77 HB3 LEU 77 -14.957 -14.439 -6.515 426 HG LEU 77 HG LEU 77 -13.377 -14.059 -4.658 427 HD11 LEU 77 HD11 LEU 77 -12.636 -13.408 -6.890 428 HD12 LEU 77 HD12 LEU 77 -11.910 -12.406 -5.639 429 HD13 LEU 77 HD13 LEU 77 -13.231 -11.769 -6.619 430 HD21 LEU 77 HD21 LEU 77 -14.601 -11.316 -4.383 431 HD22 LEU 77 HD22 LEU 77 -13.155 -11.892 -3.549 432 HD23 LEU 77 HD23 LEU 77 -14.716 -12.644 -3.228 433 H GLU 78 H GLU 78 -16.068 -13.962 -8.644 434 HA GLU 78 HA GLU 78 -14.148 -12.450 -10.119 435 HB2 GLU 78 HB2 GLU 78 -16.124 -14.509 -11.184 436 HB3 GLU 78 HB3 GLU 78 -14.706 -13.900 -12.042 437 HG2 GLU 78 HG2 GLU 78 -13.391 -14.816 -9.967 438 HG3 GLU 78 HG3 GLU 78 -14.846 -15.757 -9.665 439 H ALA 79 H ALA 79 -17.677 -12.567 -10.153 440 HA ALA 79 HA ALA 79 -18.178 -10.891 -12.375 441 HB1 ALA 79 HB1 ALA 79 -20.472 -10.714 -11.476 442 HB2 ALA 79 HB2 ALA 79 -19.930 -11.408 -9.944 443 HB3 ALA 79 HB3 ALA 79 -19.896 -12.382 -11.415 444 H ALA 80 H ALA 80 -17.610 -10.273 -8.953 445 HA ALA 80 HA ALA 80 -18.056 -7.465 -8.969 446 HB1 ALA 80 HB1 ALA 80 -16.872 -7.458 -6.816 447 HB2 ALA 80 HB2 ALA 80 -16.327 -9.117 -7.099 448 HB3 ALA 80 HB3 ALA 80 -18.046 -8.773 -6.892 449 H LEU 81 H LEU 81 -15.175 -9.483 -9.532 450 HA LEU 81 HA LEU 81 -13.294 -7.366 -9.823 451 HB2 LEU 81 HB2 LEU 81 -13.292 -10.259 -10.703 452 HB3 LEU 81 HB3 LEU 81 -11.949 -9.190 -11.086 453 HG LEU 81 HG LEU 81 -12.884 -9.822 -8.251 454 HD11 LEU 81 HD11 LEU 81 -11.937 -11.822 -9.286 455 HD12 LEU 81 HD12 LEU 81 -10.843 -11.189 -8.057 456 HD13 LEU 81 HD13 LEU 81 -10.499 -10.920 -9.769 457 HD21 LEU 81 HD21 LEU 81 -11.816 -7.613 -8.418 458 HD22 LEU 81 HD22 LEU 81 -10.420 -8.328 -9.230 459 HD23 LEU 81 HD23 LEU 81 -10.775 -8.743 -7.552 460 H GLN 82 H GLN 82 -15.550 -8.841 -12.038 461 HA GLN 82 HA GLN 82 -14.480 -7.796 -14.486 462 HB2 GLN 82 HB2 GLN 82 -17.237 -8.877 -13.760 463 HB3 GLN 82 HB3 GLN 82 -16.772 -8.428 -15.400 464 HG2 GLN 82 HG2 GLN 82 -15.099 -10.168 -15.479 465 HG3 GLN 82 HG3 GLN 82 -15.317 -10.526 -13.769 466 HE21 GLN 82 HE21 GLN 82 -17.957 -9.971 -16.061 467 HE22 GLN 82 HE22 GLN 82 -18.571 -11.582 -16.017 468 H PHE 83 H PHE 83 -17.008 -6.758 -12.212 469 HA PHE 83 HA PHE 83 -17.668 -4.380 -13.771 470 HB2 PHE 83 HB2 PHE 83 -19.437 -5.709 -12.608 471 HB3 PHE 83 HB3 PHE 83 -18.692 -5.327 -11.064 472 HD1 PHE 83 HD1 PHE 83 -19.032 -2.753 -13.724 473 HD2 PHE 83 HD2 PHE 83 -20.749 -4.397 -10.166 474 HE1 PHE 83 HE1 PHE 83 -20.536 -0.816 -13.538 475 HE2 PHE 83 HE2 PHE 83 -22.237 -2.450 -9.990 476 HZ PHE 83 HZ PHE 83 -22.134 -0.657 -11.669 477 H GLU 84 H GLU 84 -16.473 -2.585 -13.590 478 HA GLU 84 HA GLU 84 -14.168 -2.345 -12.080 479 HB2 GLU 84 HB2 GLU 84 -14.065 -0.001 -12.870 480 HB3 GLU 84 HB3 GLU 84 -14.472 -1.126 -14.165 481 HG2 GLU 84 HG2 GLU 84 -16.822 -0.456 -14.077 482 HG3 GLU 84 HG3 GLU 84 -16.512 0.570 -12.677 483 H ASP 85 H ASP 85 -17.375 -1.192 -11.334 484 HA ASP 85 HA ASP 85 -16.792 0.565 -9.209 485 HB2 ASP 85 HB2 ASP 85 -18.945 0.630 -10.325 486 HB3 ASP 85 HB3 ASP 85 -19.277 -1.046 -9.906 487 H THR 86 H THR 86 -17.739 -2.866 -9.238 488 HA THR 86 HA THR 86 -17.727 -3.076 -6.353 489 HB THR 86 HB THR 86 -18.418 -5.478 -6.853 490 HG1 THR 86 HG1 THR 86 -17.374 -5.100 -9.136 491 HG21 THR 86 HG21 THR 86 -20.654 -4.914 -7.705 492 HG22 THR 86 HG22 THR 86 -20.065 -3.346 -8.263 493 HG23 THR 86 HG23 THR 86 -20.131 -3.701 -6.538 494 H ARG 87 H ARG 87 -15.336 -3.455 -8.784 495 HA ARG 87 HA ARG 87 -13.848 -5.588 -7.513 496 HB2 ARG 87 HB2 ARG 87 -12.283 -5.452 -9.274 497 HB3 ARG 87 HB3 ARG 87 -13.839 -5.139 -10.003 498 HG2 ARG 87 HG2 ARG 87 -12.713 -3.482 -11.073 499 HG3 ARG 87 HG3 ARG 87 -13.045 -2.575 -9.598 500 HD2 ARG 87 HD2 ARG 87 -10.832 -3.095 -8.726 501 HD3 ARG 87 HD3 ARG 87 -10.496 -4.159 -10.098 502 HE ARG 87 HE ARG 87 -10.802 -1.211 -10.248 503 HH11 ARG 87 HH11 ARG 87 -9.509 -4.174 -11.604 504 HH12 ARG 87 HH12 ARG 87 -8.467 -3.350 -12.720 505 HH21 ARG 87 HH21 ARG 87 -9.420 -0.137 -11.706 506 HH22 ARG 87 HH22 ARG 87 -8.416 -1.062 -12.778 507 H GLU 88 H GLU 88 -14.102 -2.223 -7.143 508 HA GLU 88 HA GLU 88 -11.619 -1.541 -5.968 509 HB2 GLU 88 HB2 GLU 88 -14.374 -0.359 -5.378 510 HB3 GLU 88 HB3 GLU 88 -12.818 0.428 -5.105 511 HG2 GLU 88 HG2 GLU 88 -13.960 -0.348 -7.813 512 HG3 GLU 88 HG3 GLU 88 -14.018 1.260 -7.116 513 H SER 89 H SER 89 -14.683 -2.709 -4.620 514 HA SER 89 HA SER 89 -13.913 -2.641 -1.876 515 HB2 SER 89 HB2 SER 89 -16.245 -2.453 -2.549 516 HB3 SER 89 HB3 SER 89 -16.196 -4.054 -3.283 517 HG SER 89 HG SER 89 -15.837 -3.490 -0.516 518 H MET 90 H MET 90 -13.317 -4.919 -4.397 519 HA MET 90 HA MET 90 -13.044 -7.337 -2.952 520 HB2 MET 90 HB2 MET 90 -11.668 -6.406 -5.496 521 HB3 MET 90 HB3 MET 90 -11.590 -8.050 -4.880 522 HG2 MET 90 HG2 MET 90 -14.189 -6.704 -5.656 523 HG3 MET 90 HG3 MET 90 -13.209 -7.653 -6.765 524 HE1 MET 90 HE1 MET 90 -16.177 -7.808 -4.391 525 HE2 MET 90 HE2 MET 90 -14.921 -7.927 -3.159 526 HE3 MET 90 HE3 MET 90 -15.960 -9.313 -3.495 527 H HIS 91 H HIS 91 -11.075 -4.500 -2.918 528 HA HIS 91 HA HIS 91 -8.534 -5.466 -2.244 529 HB2 HIS 91 HB2 HIS 91 -8.013 -3.286 -1.472 530 HB3 HIS 91 HB3 HIS 91 -9.263 -3.008 -2.667 531 HD1 HIS 91 HD1 HIS 91 -8.332 -2.029 0.650 532 HD2 HIS 91 HD2 HIS 91 -11.949 -2.723 -1.273 533 HE1 HIS 91 HE1 HIS 91 -10.069 -0.894 2.048 534 HE2 HIS 91 HE2 HIS 91 -12.218 -1.169 0.762 535 H ALA 92 H ALA 92 -11.438 -5.235 -0.337 536 HA ALA 92 HA ALA 92 -10.310 -5.485 2.272 537 HB1 ALA 92 HB1 ALA 92 -12.651 -5.780 2.994 538 HB2 ALA 92 HB2 ALA 92 -13.152 -5.984 1.312 539 HB3 ALA 92 HB3 ALA 92 -12.507 -4.435 1.860 540 H PHE 93 H PHE 93 -11.412 -7.735 -0.176 541 HA PHE 93 HA PHE 93 -11.490 -10.004 1.673 542 HB2 PHE 93 HB2 PHE 93 -12.154 -9.885 -1.304 543 HB3 PHE 93 HB3 PHE 93 -12.468 -11.243 -0.221 544 HD1 PHE 93 HD1 PHE 93 -14.162 -10.984 1.640 545 HD2 PHE 93 HD2 PHE 93 -13.652 -7.995 -1.371 546 HE1 PHE 93 HE1 PHE 93 -16.315 -9.977 2.261 547 HE2 PHE 93 HE2 PHE 93 -15.818 -7.007 -0.752 548 HZ PHE 93 HZ PHE 93 -17.149 -7.997 1.071 549 H CYS 94 H CYS 94 -9.392 -8.670 -0.846 550 HA CYS 94 HA CYS 94 -7.826 -11.070 -1.172 551 HB2 CYS 94 HB2 CYS 94 -6.251 -9.651 -2.460 552 HB3 CYS 94 HB3 CYS 94 -7.906 -9.474 -3.018 553 HG CYS 94 HG CYS 94 -7.007 -7.176 -0.763 554 H VAL 95 H VAL 95 -6.863 -11.815 0.622 555 HA VAL 95 HA VAL 95 -5.622 -10.228 2.644 556 HB VAL 95 HB VAL 95 -4.658 -12.356 3.494 557 HG11 VAL 95 HG11 VAL 95 -6.782 -13.524 3.982 558 HG12 VAL 95 HG12 VAL 95 -7.587 -12.606 2.707 559 HG13 VAL 95 HG13 VAL 95 -6.957 -11.773 4.130 560 HG21 VAL 95 HG21 VAL 95 -4.144 -13.475 1.352 561 HG22 VAL 95 HG22 VAL 95 -5.867 -13.658 1.018 562 HG23 VAL 95 HG23 VAL 95 -5.136 -14.515 2.378 563 H GLY 96 H GLY 96 -4.555 -11.522 -0.415 564 HA2 GLY 96 HA2 GLY 96 -2.494 -9.713 -0.804 565 HA3 GLY 96 HA3 GLY 96 -1.736 -11.142 -0.105 566 H GLN 97 H GLN 97 -0.594 -11.065 -2.200 567 HA GLN 97 HA GLN 97 -2.008 -12.041 -4.567 568 HB2 GLN 97 HB2 GLN 97 -0.209 -10.345 -4.820 569 HB3 GLN 97 HB3 GLN 97 0.943 -11.442 -4.067 570 HG2 GLN 97 HG2 GLN 97 0.607 -13.014 -5.986 571 HG3 GLN 97 HG3 GLN 97 -0.420 -11.807 -6.755 572 HE21 GLN 97 HE21 GLN 97 0.549 -9.883 -7.550 573 HE22 GLN 97 HE22 GLN 97 2.248 -9.784 -7.846 574 H TYR 98 H TYR 98 -1.855 -14.148 -5.320 575 HA TYR 98 HA TYR 98 -0.929 -16.222 -3.556 576 HB2 TYR 98 HB2 TYR 98 -2.952 -16.571 -4.895 577 HB3 TYR 98 HB3 TYR 98 -2.036 -16.386 -6.385 578 HD1 TYR 98 HD1 TYR 98 -2.044 -18.521 -3.257 579 HD2 TYR 98 HD2 TYR 98 -1.332 -18.371 -7.477 580 HE1 TYR 98 HE1 TYR 98 -1.627 -20.949 -3.293 581 HE2 TYR 98 HE2 TYR 98 -0.925 -20.787 -7.493 582 HH TYR 98 HH TYR 98 -1.732 -22.820 -4.990 583 H LEU 99 H LEU 99 0.930 -17.341 -3.645 584 HA LEU 99 HA LEU 99 2.763 -17.094 -5.959 585 HB2 LEU 99 HB2 LEU 99 3.695 -15.933 -3.982 586 HB3 LEU 99 HB3 LEU 99 3.435 -17.362 -2.997 587 HG LEU 99 HG LEU 99 5.118 -18.598 -4.413 588 HD11 LEU 99 HD11 LEU 99 4.988 -17.275 -6.479 589 HD12 LEU 99 HD12 LEU 99 6.642 -17.352 -5.882 590 HD13 LEU 99 HD13 LEU 99 5.692 -15.882 -5.650 591 HD21 LEU 99 HD21 LEU 99 5.792 -17.637 -2.259 592 HD22 LEU 99 HD22 LEU 99 6.178 -16.104 -3.043 593 HD23 LEU 99 HD23 LEU 99 7.113 -17.551 -3.426 594 H GLU 100 H GLU 100 3.156 -19.034 -6.926 595 HA GLU 100 HA GLU 100 2.326 -21.547 -5.727 596 HB2 GLU 100 HB2 GLU 100 3.871 -21.032 -8.301 597 HB3 GLU 100 HB3 GLU 100 3.122 -22.543 -7.841 598 HG2 GLU 100 HG2 GLU 100 0.896 -21.529 -8.027 599 HG3 GLU 100 HG3 GLU 100 1.629 -19.969 -8.407 600 HA PRO 101 HA PRO 101 6.362 -22.452 -3.875 601 HB2 PRO 101 HB2 PRO 101 6.342 -25.198 -3.851 602 HB3 PRO 101 HB3 PRO 101 5.336 -24.223 -2.767 603 HG2 PRO 101 HG2 PRO 101 4.586 -25.539 -5.380 604 HG3 PRO 101 HG3 PRO 101 3.714 -25.551 -3.830 605 HD2 PRO 101 HD2 PRO 101 3.010 -23.876 -5.846 606 HD3 PRO 101 HD3 PRO 101 2.871 -23.389 -4.141 607 H ASP 102 H ASP 102 5.585 -23.202 -7.089 608 HA ASP 102 HA ASP 102 8.333 -24.001 -7.827 609 HB2 ASP 102 HB2 ASP 102 6.370 -25.510 -8.425 610 HB3 ASP 102 HB3 ASP 102 5.764 -24.227 -9.461 611 H GLN 103 H GLN 103 6.141 -21.367 -7.859 612 HA GLN 103 HA GLN 103 6.777 -20.199 -10.399 613 HB2 GLN 103 HB2 GLN 103 4.586 -19.890 -9.305 614 HB3 GLN 103 HB3 GLN 103 5.345 -18.979 -8.009 615 HG2 GLN 103 HG2 GLN 103 4.210 -17.525 -9.616 616 HG3 GLN 103 HG3 GLN 103 5.944 -17.200 -9.569 617 HE21 GLN 103 HE21 GLN 103 4.364 -19.894 -11.320 618 HE22 GLN 103 HE22 GLN 103 4.790 -19.333 -12.897 619 H GLU 104 H GLU 104 7.980 -19.752 -7.112 620 HA GLU 104 HA GLU 104 9.529 -17.414 -7.544 621 HB2 GLU 104 HB2 GLU 104 9.032 -18.276 -5.292 622 HB3 GLU 104 HB3 GLU 104 9.980 -19.725 -5.613 623 HG2 GLU 104 HG2 GLU 104 12.024 -18.324 -5.788 624 HG3 GLU 104 HG3 GLU 104 11.067 -16.889 -5.424 625 H GLY 105 H GLY 105 10.107 -20.829 -8.195 626 HA2 GLY 105 HA2 GLY 105 12.824 -20.336 -9.246 627 HA3 GLY 105 HA3 GLY 105 12.128 -21.895 -8.836 628 H VAL 106 H VAL 106 10.411 -19.461 -10.728 629 HA VAL 106 HA VAL 106 9.855 -21.317 -12.830 630 HB VAL 106 HB VAL 106 8.277 -19.491 -12.155 631 HG11 VAL 106 HG11 VAL 106 9.859 -17.641 -11.807 632 HG12 VAL 106 HG12 VAL 106 8.596 -17.168 -12.943 633 HG13 VAL 106 HG13 VAL 106 10.203 -17.584 -13.540 634 HG21 VAL 106 HG21 VAL 106 7.505 -18.860 -14.439 635 HG22 VAL 106 HG22 VAL 106 7.932 -20.568 -14.334 636 HG23 VAL 106 HG23 VAL 106 9.040 -19.431 -15.104 637 H THR 107 H THR 107 10.614 -21.358 -14.964 638 HA THR 107 HA THR 107 12.790 -19.513 -15.756 639 HB THR 107 HB THR 107 13.704 -21.813 -15.320 640 HG1 THR 107 HG1 THR 107 14.593 -22.031 -17.549 641 HG21 THR 107 HG21 THR 107 11.737 -23.197 -15.919 642 HG22 THR 107 HG22 THR 107 13.161 -23.685 -16.836 643 HG23 THR 107 HG23 THR 107 11.911 -22.717 -17.613 644 H ILE 108 H ILE 108 12.715 -18.894 -17.989 645 HA ILE 108 HA ILE 108 10.142 -19.402 -19.378 646 HB ILE 108 HB ILE 108 11.718 -16.789 -19.349 647 HG12 ILE 108 HG12 ILE 108 9.024 -17.438 -18.035 648 HG13 ILE 108 HG13 ILE 108 10.544 -17.234 -17.172 649 HG21 ILE 108 HG21 ILE 108 9.788 -15.825 -20.599 650 HG22 ILE 108 HG22 ILE 108 9.051 -17.424 -20.681 651 HG23 ILE 108 HG23 ILE 108 10.577 -17.116 -21.509 652 HD11 ILE 108 HD11 ILE 108 9.091 -15.088 -18.725 653 HD12 ILE 108 HD12 ILE 108 10.602 -14.881 -17.834 654 HD13 ILE 108 HD13 ILE 108 9.119 -15.284 -16.973 655 HA PRO 109 HA PRO 109 13.346 -20.609 -22.481 656 HB2 PRO 109 HB2 PRO 109 12.089 -22.786 -23.476 657 HB3 PRO 109 HB3 PRO 109 12.924 -22.844 -21.916 658 HG2 PRO 109 HG2 PRO 109 9.983 -22.580 -22.489 659 HG3 PRO 109 HG3 PRO 109 10.796 -23.554 -21.250 660 HD2 PRO 109 HD2 PRO 109 9.632 -21.058 -20.803 661 HD3 PRO 109 HD3 PRO 109 10.879 -21.778 -19.762 662 H ASP 110 H ASP 110 13.329 -20.424 -24.792 663 HA ASP 110 HA ASP 110 11.482 -18.521 -25.857 664 HB2 ASP 110 HB2 ASP 110 13.688 -20.104 -27.258 665 HB3 ASP 110 HB3 ASP 110 12.813 -18.754 -27.977 666 H LEU 111 H LEU 111 9.598 -18.898 -26.816 667 HA LEU 111 HA LEU 111 9.087 -21.286 -28.430 668 HB2 LEU 111 HB2 LEU 111 8.350 -21.635 -25.960 669 HB3 LEU 111 HB3 LEU 111 7.109 -20.440 -26.266 670 HG LEU 111 HG LEU 111 6.268 -22.778 -26.353 671 HD11 LEU 111 HD11 LEU 111 5.047 -21.098 -27.640 672 HD12 LEU 111 HD12 LEU 111 4.957 -22.686 -28.398 673 HD13 LEU 111 HD13 LEU 111 6.032 -21.450 -29.061 674 HD21 LEU 111 HD21 LEU 111 8.268 -23.909 -27.167 675 HD22 LEU 111 HD22 LEU 111 8.083 -23.153 -28.753 676 HD23 LEU 111 HD23 LEU 111 6.874 -24.301 -28.174 677 H GLY 112 H GLY 112 7.184 -18.564 -27.031 678 HA2 GLY 112 HA2 GLY 112 6.729 -17.409 -29.703 679 HA3 GLY 112 HA3 GLY 112 5.329 -18.013 -28.825 Start of MODEL 13 1 H GLU 21 H GLU 21 6.440 -0.991 -0.847 2 HA GLU 21 HA GLU 21 3.548 -0.847 -0.260 3 HB2 GLU 21 HB2 GLU 21 5.048 -1.470 -2.826 4 HB3 GLU 21 HB3 GLU 21 3.376 -1.948 -2.585 5 HG2 GLU 21 HG2 GLU 21 3.415 0.051 -3.902 6 HG3 GLU 21 HG3 GLU 21 2.744 0.442 -2.322 7 H LYS 22 H LYS 22 3.246 -2.421 1.204 8 HA LYS 22 HA LYS 22 4.653 -4.973 1.115 9 HB2 LYS 22 HB2 LYS 22 2.422 -3.948 2.929 10 HB3 LYS 22 HB3 LYS 22 3.211 -5.511 3.114 11 HG2 LYS 22 HG2 LYS 22 4.640 -2.843 3.282 12 HG3 LYS 22 HG3 LYS 22 4.036 -3.739 4.676 13 HD2 LYS 22 HD2 LYS 22 6.112 -4.761 2.700 14 HD3 LYS 22 HD3 LYS 22 6.477 -4.061 4.277 15 HE2 LYS 22 HE2 LYS 22 4.910 -6.618 3.775 16 HE3 LYS 22 HE3 LYS 22 6.568 -6.507 4.369 17 HZ1 LYS 22 HZ1 LYS 22 5.005 -6.885 6.168 18 HZ2 LYS 22 HZ2 LYS 22 4.164 -5.471 5.779 19 HZ3 LYS 22 HZ3 LYS 22 5.758 -5.380 6.340 20 H VAL 23 H VAL 23 3.851 -6.838 0.362 21 HA VAL 23 HA VAL 23 1.036 -7.200 -0.273 22 HB VAL 23 HB VAL 23 1.808 -6.227 -2.356 23 HG11 VAL 23 HG11 VAL 23 4.217 -6.554 -2.174 24 HG12 VAL 23 HG12 VAL 23 3.639 -7.142 -3.735 25 HG13 VAL 23 HG13 VAL 23 4.025 -8.287 -2.450 26 HG21 VAL 23 HG21 VAL 23 0.205 -8.069 -2.572 27 HG22 VAL 23 HG22 VAL 23 1.530 -9.227 -2.701 28 HG23 VAL 23 HG23 VAL 23 1.288 -8.021 -3.966 29 H THR 24 H THR 24 0.818 -8.827 1.138 30 HA THR 24 HA THR 24 2.809 -10.680 1.872 31 HB THR 24 HB THR 24 0.834 -11.900 3.001 32 HG1 THR 24 HG1 THR 24 -1.154 -11.097 2.747 33 HG21 THR 24 HG21 THR 24 0.503 -10.137 4.692 34 HG22 THR 24 HG22 THR 24 1.174 -8.933 3.593 35 HG23 THR 24 HG23 THR 24 2.202 -10.227 4.219 36 H LEU 25 H LEU 25 3.612 -12.230 0.649 37 HA LEU 25 HA LEU 25 2.224 -13.417 -1.587 38 HB2 LEU 25 HB2 LEU 25 4.943 -14.021 -0.356 39 HB3 LEU 25 HB3 LEU 25 4.337 -14.757 -1.834 40 HG LEU 25 HG LEU 25 4.940 -11.800 -1.428 41 HD11 LEU 25 HD11 LEU 25 6.422 -13.852 -3.097 42 HD12 LEU 25 HD12 LEU 25 6.977 -13.124 -1.587 43 HD13 LEU 25 HD13 LEU 25 6.767 -12.120 -3.017 44 HD21 LEU 25 HD21 LEU 25 3.949 -13.205 -3.933 45 HD22 LEU 25 HD22 LEU 25 4.481 -11.522 -3.830 46 HD23 LEU 25 HD23 LEU 25 3.051 -12.046 -2.947 47 H VAL 26 H VAL 26 0.680 -14.842 -1.160 48 HA VAL 26 HA VAL 26 0.751 -16.558 1.204 49 HB VAL 26 HB VAL 26 -1.510 -16.189 -0.812 50 HG11 VAL 26 HG11 VAL 26 -2.967 -17.117 0.944 51 HG12 VAL 26 HG12 VAL 26 -1.568 -17.345 1.995 52 HG13 VAL 26 HG13 VAL 26 -1.700 -18.261 0.492 53 HG21 VAL 26 HG21 VAL 26 -1.013 -14.009 0.230 54 HG22 VAL 26 HG22 VAL 26 -1.155 -14.728 1.837 55 HG23 VAL 26 HG23 VAL 26 -2.570 -14.634 0.785 56 H ARG 27 H ARG 27 1.390 -18.569 1.046 57 HA ARG 27 HA ARG 27 2.206 -19.813 -1.415 58 HB2 ARG 27 HB2 ARG 27 2.027 -20.956 1.418 59 HB3 ARG 27 HB3 ARG 27 2.774 -21.769 0.056 60 HG2 ARG 27 HG2 ARG 27 4.556 -20.889 1.352 61 HG3 ARG 27 HG3 ARG 27 4.436 -19.852 -0.068 62 HD2 ARG 27 HD2 ARG 27 3.325 -18.124 1.227 63 HD3 ARG 27 HD3 ARG 27 3.211 -19.183 2.632 64 HE ARG 27 HE ARG 27 5.704 -17.975 1.572 65 HH11 ARG 27 HH11 ARG 27 4.028 -19.541 4.241 66 HH12 ARG 27 HH12 ARG 27 5.168 -18.998 5.428 67 HH21 ARG 27 HH21 ARG 27 7.193 -17.274 3.153 68 HH22 ARG 27 HH22 ARG 27 6.973 -17.736 4.811 69 H ILE 28 H ILE 28 1.282 -21.804 -2.307 70 HA ILE 28 HA ILE 28 -1.540 -21.789 -2.462 71 HB ILE 28 HB ILE 28 -0.187 -22.646 -4.312 72 HG12 ILE 28 HG12 ILE 28 -2.064 -24.819 -3.266 73 HG13 ILE 28 HG13 ILE 28 -2.573 -23.373 -4.128 74 HG21 ILE 28 HG21 ILE 28 0.489 -25.038 -2.578 75 HG22 ILE 28 HG22 ILE 28 1.607 -23.772 -3.087 76 HG23 ILE 28 HG23 ILE 28 0.897 -24.854 -4.286 77 HD11 ILE 28 HD11 ILE 28 -0.849 -25.576 -5.262 78 HD12 ILE 28 HD12 ILE 28 -1.391 -24.134 -6.121 79 HD13 ILE 28 HD13 ILE 28 -2.567 -25.325 -5.572 80 H ALA 29 H ALA 29 0.668 -23.795 -0.591 81 HA ALA 29 HA ALA 29 -1.141 -25.693 0.456 82 HB1 ALA 29 HB1 ALA 29 1.451 -24.690 1.674 83 HB2 ALA 29 HB2 ALA 29 1.311 -25.999 0.502 84 HB3 ALA 29 HB3 ALA 29 0.612 -26.182 2.112 85 H ASP 30 H ASP 30 -0.377 -22.405 1.392 86 HA ASP 30 HA ASP 30 -1.425 -22.364 4.010 87 HB2 ASP 30 HB2 ASP 30 0.002 -20.539 2.948 88 HB3 ASP 30 HB3 ASP 30 -1.420 -20.020 2.060 89 H LEU 31 H LEU 31 -2.924 -21.597 0.829 90 HA LEU 31 HA LEU 31 -5.517 -20.953 1.736 91 HB2 LEU 31 HB2 LEU 31 -4.662 -22.188 -0.918 92 HB3 LEU 31 HB3 LEU 31 -6.316 -21.724 -0.569 93 HG LEU 31 HG LEU 31 -5.410 -19.331 -0.216 94 HD11 LEU 31 HD11 LEU 31 -3.349 -18.745 -1.373 95 HD12 LEU 31 HD12 LEU 31 -3.036 -20.448 -1.722 96 HD13 LEU 31 HD13 LEU 31 -3.030 -19.870 -0.053 97 HD21 LEU 31 HD21 LEU 31 -5.537 -18.814 -2.603 98 HD22 LEU 31 HD22 LEU 31 -6.767 -19.998 -2.159 99 HD23 LEU 31 HD23 LEU 31 -5.306 -20.519 -3.005 100 H GLU 32 H GLU 32 -4.121 -24.061 0.709 101 HA GLU 32 HA GLU 32 -6.350 -25.728 0.783 102 HB2 GLU 32 HB2 GLU 32 -3.478 -26.467 1.498 103 HB3 GLU 32 HB3 GLU 32 -4.735 -27.609 1.027 104 HG2 GLU 32 HG2 GLU 32 -3.518 -25.453 -0.724 105 HG3 GLU 32 HG3 GLU 32 -3.148 -27.175 -0.790 106 H ASN 33 H ASN 33 -4.058 -24.932 3.350 107 HA ASN 33 HA ASN 33 -5.213 -26.590 5.386 108 HB2 ASN 33 HB2 ASN 33 -3.201 -24.295 5.535 109 HB3 ASN 33 HB3 ASN 33 -3.634 -25.306 6.912 110 HD21 ASN 33 HD21 ASN 33 -1.047 -24.895 5.422 111 HD22 ASN 33 HD22 ASN 33 -0.525 -26.490 5.016 112 H HIS 34 H HIS 34 -5.543 -23.215 4.401 113 HA HIS 34 HA HIS 34 -6.535 -22.220 6.879 114 HB2 HIS 34 HB2 HIS 34 -5.400 -20.951 4.803 115 HB3 HIS 34 HB3 HIS 34 -7.067 -20.703 4.305 116 HD1 HIS 34 HD1 HIS 34 -4.500 -19.080 6.111 117 HD2 HIS 34 HD2 HIS 34 -8.580 -19.529 6.723 118 HE1 HIS 34 HE1 HIS 34 -5.138 -17.294 7.762 119 HE2 HIS 34 HE2 HIS 34 -7.626 -17.548 8.069 120 H ASN 35 H ASN 35 -8.118 -23.312 3.903 121 HA ASN 35 HA ASN 35 -10.747 -22.418 4.608 122 HB2 ASN 35 HB2 ASN 35 -11.557 -23.601 2.676 123 HB3 ASN 35 HB3 ASN 35 -10.034 -22.866 2.228 124 HD21 ASN 35 HD21 ASN 35 -8.318 -24.192 1.646 125 HD22 ASN 35 HD22 ASN 35 -8.466 -25.901 1.473 126 H ASN 36 H ASN 36 -8.950 -25.393 5.135 127 HA ASN 36 HA ASN 36 -11.088 -27.025 6.087 128 HB2 ASN 36 HB2 ASN 36 -8.784 -27.806 5.272 129 HB3 ASN 36 HB3 ASN 36 -8.146 -27.302 6.831 130 HD21 ASN 36 HD21 ASN 36 -8.162 -29.958 5.655 131 HD22 ASN 36 HD22 ASN 36 -9.029 -30.983 6.741 132 H ASP 37 H ASP 37 -8.955 -24.677 7.595 133 HA ASP 37 HA ASP 37 -9.718 -25.093 10.318 134 HB2 ASP 37 HB2 ASP 37 -7.634 -23.910 9.713 135 HB3 ASP 37 HB3 ASP 37 -8.555 -22.631 8.930 136 H GLY 38 H GLY 38 -11.016 -23.184 7.658 137 HA2 GLY 38 HA2 GLY 38 -13.562 -23.016 7.887 138 HA3 GLY 38 HA3 GLY 38 -13.211 -22.116 9.356 139 H GLY 39 H GLY 39 -10.794 -20.900 8.111 140 HA2 GLY 39 HA2 GLY 39 -12.011 -18.601 6.853 141 HA3 GLY 39 HA3 GLY 39 -10.297 -18.863 7.136 142 H PHE 40 H PHE 40 -12.951 -19.375 4.911 143 HA PHE 40 HA PHE 40 -11.506 -21.125 3.157 144 HB2 PHE 40 HB2 PHE 40 -14.053 -21.076 3.448 145 HB3 PHE 40 HB3 PHE 40 -14.058 -19.607 2.484 146 HD1 PHE 40 HD1 PHE 40 -13.262 -19.708 0.056 147 HD2 PHE 40 HD2 PHE 40 -13.873 -23.228 2.407 148 HE1 PHE 40 HE1 PHE 40 -13.278 -21.080 -1.991 149 HE2 PHE 40 HE2 PHE 40 -13.889 -24.589 0.355 150 HZ PHE 40 HZ PHE 40 -13.589 -23.519 -1.838 151 H TRP 41 H TRP 41 -9.813 -20.341 2.065 152 HA TRP 41 HA TRP 41 -9.882 -17.632 0.894 153 HB2 TRP 41 HB2 TRP 41 -7.598 -19.453 1.735 154 HB3 TRP 41 HB3 TRP 41 -7.329 -18.105 0.638 155 HD1 TRP 41 HD1 TRP 41 -9.852 -17.184 3.248 156 HE1 TRP 41 HE1 TRP 41 -8.768 -15.692 5.027 157 HE3 TRP 41 HE3 TRP 41 -4.946 -17.879 2.021 158 HZ2 TRP 41 HZ2 TRP 41 -6.203 -14.894 5.817 159 HZ3 TRP 41 HZ3 TRP 41 -3.233 -16.719 3.347 160 HH2 TRP 41 HH2 TRP 41 -3.842 -15.249 5.205 161 H THR 42 H THR 42 -9.377 -17.316 -1.267 162 HA THR 42 HA THR 42 -9.100 -19.628 -3.041 163 HB THR 42 HB THR 42 -11.551 -19.321 -2.851 164 HG1 THR 42 HG1 THR 42 -10.536 -18.493 -5.389 165 HG21 THR 42 HG21 THR 42 -12.677 -17.322 -3.730 166 HG22 THR 42 HG22 THR 42 -11.118 -16.545 -4.013 167 HG23 THR 42 HG23 THR 42 -11.644 -16.892 -2.363 168 H VAL 43 H VAL 43 -7.855 -19.208 -4.788 169 HA VAL 43 HA VAL 43 -6.782 -16.528 -5.183 170 HB VAL 43 HB VAL 43 -5.087 -18.215 -5.219 171 HG11 VAL 43 HG11 VAL 43 -6.419 -20.208 -5.744 172 HG12 VAL 43 HG12 VAL 43 -5.009 -20.111 -6.802 173 HG13 VAL 43 HG13 VAL 43 -6.605 -19.669 -7.415 174 HG21 VAL 43 HG21 VAL 43 -4.764 -16.369 -6.816 175 HG22 VAL 43 HG22 VAL 43 -5.571 -17.301 -8.079 176 HG23 VAL 43 HG23 VAL 43 -4.029 -17.856 -7.425 177 H ILE 44 H ILE 44 -7.929 -15.197 -6.334 178 HA ILE 44 HA ILE 44 -8.991 -15.932 -8.992 179 HB ILE 44 HB ILE 44 -10.335 -14.169 -6.884 180 HG12 ILE 44 HG12 ILE 44 -11.337 -16.718 -8.227 181 HG13 ILE 44 HG13 ILE 44 -10.704 -16.614 -6.588 182 HG21 ILE 44 HG21 ILE 44 -12.131 -13.707 -8.523 183 HG22 ILE 44 HG22 ILE 44 -11.218 -14.562 -9.766 184 HG23 ILE 44 HG23 ILE 44 -10.574 -13.076 -9.067 185 HD11 ILE 44 HD11 ILE 44 -13.123 -16.740 -6.638 186 HD12 ILE 44 HD12 ILE 44 -13.205 -15.256 -7.584 187 HD13 ILE 44 HD13 ILE 44 -12.575 -15.223 -5.936 188 H ASP 45 H ASP 45 -8.225 -14.587 -10.555 189 HA ASP 45 HA ASP 45 -7.126 -12.920 -11.642 190 HB2 ASP 45 HB2 ASP 45 -9.071 -11.627 -10.740 191 HB3 ASP 45 HB3 ASP 45 -8.120 -11.216 -9.317 192 H GLY 46 H GLY 46 -5.651 -14.552 -9.718 193 HA2 GLY 46 HA2 GLY 46 -3.453 -14.798 -9.082 194 HA3 GLY 46 HA3 GLY 46 -3.121 -13.179 -9.670 195 H LYS 47 H LYS 47 -5.682 -13.067 -7.546 196 HA LYS 47 HA LYS 47 -3.994 -12.245 -5.246 197 HB2 LYS 47 HB2 LYS 47 -6.829 -11.409 -6.023 198 HB3 LYS 47 HB3 LYS 47 -5.949 -10.831 -4.611 199 HG2 LYS 47 HG2 LYS 47 -4.988 -10.377 -7.447 200 HG3 LYS 47 HG3 LYS 47 -6.089 -9.269 -6.615 201 HD2 LYS 47 HD2 LYS 47 -4.381 -8.974 -4.822 202 HD3 LYS 47 HD3 LYS 47 -3.270 -10.012 -5.726 203 HE2 LYS 47 HE2 LYS 47 -3.173 -8.410 -7.546 204 HE3 LYS 47 HE3 LYS 47 -4.453 -7.434 -6.823 205 HZ1 LYS 47 HZ1 LYS 47 -2.224 -6.526 -6.489 206 HZ2 LYS 47 HZ2 LYS 47 -1.795 -7.897 -5.595 207 HZ3 LYS 47 HZ3 LYS 47 -3.007 -6.862 -5.028 208 H VAL 48 H VAL 48 -4.372 -13.264 -3.302 209 HA VAL 48 HA VAL 48 -6.465 -15.310 -3.119 210 HB VAL 48 HB VAL 48 -4.389 -14.518 -1.028 211 HG11 VAL 48 HG11 VAL 48 -6.212 -16.954 -1.157 212 HG12 VAL 48 HG12 VAL 48 -6.360 -15.614 -0.017 213 HG13 VAL 48 HG13 VAL 48 -4.954 -16.679 0.053 214 HG21 VAL 48 HG21 VAL 48 -3.171 -16.557 -1.725 215 HG22 VAL 48 HG22 VAL 48 -3.300 -15.390 -3.045 216 HG23 VAL 48 HG23 VAL 48 -4.348 -16.810 -3.016 217 H TYR 49 H TYR 49 -8.395 -14.821 -2.346 218 HA TYR 49 HA TYR 49 -8.817 -12.434 -0.644 219 HB2 TYR 49 HB2 TYR 49 -10.863 -13.940 -2.338 220 HB3 TYR 49 HB3 TYR 49 -11.158 -12.475 -1.409 221 HD1 TYR 49 HD1 TYR 49 -10.319 -10.285 -2.217 222 HD2 TYR 49 HD2 TYR 49 -9.741 -13.842 -4.505 223 HE1 TYR 49 HE1 TYR 49 -9.708 -8.934 -4.177 224 HE2 TYR 49 HE2 TYR 49 -9.144 -12.481 -6.452 225 HH TYR 49 HH TYR 49 -9.345 -10.290 -7.321 226 H ASP 50 H ASP 50 -10.668 -12.691 0.865 227 HA ASP 50 HA ASP 50 -10.784 -15.358 2.111 228 HB2 ASP 50 HB2 ASP 50 -10.011 -13.306 3.434 229 HB3 ASP 50 HB3 ASP 50 -11.652 -12.691 3.297 230 H ILE 51 H ILE 51 -12.786 -16.307 2.491 231 HA ILE 51 HA ILE 51 -15.073 -15.230 0.952 232 HB ILE 51 HB ILE 51 -14.119 -18.090 1.306 233 HG12 ILE 51 HG12 ILE 51 -13.121 -16.793 -0.557 234 HG13 ILE 51 HG13 ILE 51 -14.081 -18.141 -1.153 235 HG21 ILE 51 HG21 ILE 51 -16.839 -17.298 0.216 236 HG22 ILE 51 HG22 ILE 51 -16.521 -18.239 1.673 237 HG23 ILE 51 HG23 ILE 51 -16.124 -18.908 0.090 238 HD11 ILE 51 HD11 ILE 51 -14.939 -15.248 -1.094 239 HD12 ILE 51 HD12 ILE 51 -15.904 -16.599 -1.699 240 HD13 ILE 51 HD13 ILE 51 -14.398 -16.161 -2.501 241 H LYS 52 H LYS 52 -14.059 -16.617 4.074 242 HA LYS 52 HA LYS 52 -16.719 -17.121 5.029 243 HB2 LYS 52 HB2 LYS 52 -15.814 -17.360 7.262 244 HB3 LYS 52 HB3 LYS 52 -14.729 -18.162 6.137 245 HG2 LYS 52 HG2 LYS 52 -13.078 -16.455 6.351 246 HG3 LYS 52 HG3 LYS 52 -14.192 -15.362 7.176 247 HD2 LYS 52 HD2 LYS 52 -13.194 -18.010 8.311 248 HD3 LYS 52 HD3 LYS 52 -12.521 -16.426 8.713 249 HE2 LYS 52 HE2 LYS 52 -14.747 -15.748 9.615 250 HE3 LYS 52 HE3 LYS 52 -15.363 -17.363 9.262 251 HZ1 LYS 52 HZ1 LYS 52 -14.718 -17.104 11.572 252 HZ2 LYS 52 HZ2 LYS 52 -13.129 -16.750 11.114 253 HZ3 LYS 52 HZ3 LYS 52 -13.774 -18.281 10.804 254 H ASP 53 H ASP 53 -14.610 -14.332 4.956 255 HA ASP 53 HA ASP 53 -16.294 -12.534 6.428 256 HB2 ASP 53 HB2 ASP 53 -13.857 -12.109 6.176 257 HB3 ASP 53 HB3 ASP 53 -14.052 -11.959 4.431 258 H PHE 54 H PHE 54 -15.645 -13.115 2.971 259 HA PHE 54 HA PHE 54 -17.171 -11.224 1.693 260 HB2 PHE 54 HB2 PHE 54 -15.621 -12.801 0.574 261 HB3 PHE 54 HB3 PHE 54 -16.738 -14.126 0.868 262 HD1 PHE 54 HD1 PHE 54 -18.899 -14.244 -0.414 263 HD2 PHE 54 HD2 PHE 54 -15.922 -11.304 -1.287 264 HE1 PHE 54 HE1 PHE 54 -19.949 -13.820 -2.594 265 HE2 PHE 54 HE2 PHE 54 -16.982 -10.897 -3.464 266 HZ PHE 54 HZ PHE 54 -18.996 -12.141 -4.115 267 H GLN 55 H GLN 55 -18.273 -14.425 2.724 268 HA GLN 55 HA GLN 55 -20.935 -14.188 1.733 269 HB2 GLN 55 HB2 GLN 55 -21.349 -16.310 2.890 270 HB3 GLN 55 HB3 GLN 55 -19.825 -16.358 2.008 271 HG2 GLN 55 HG2 GLN 55 -18.634 -15.893 4.172 272 HG3 GLN 55 HG3 GLN 55 -20.186 -16.028 5.000 273 HE21 GLN 55 HE21 GLN 55 -17.695 -17.760 3.266 274 HE22 GLN 55 HE22 GLN 55 -18.170 -19.346 3.761 275 H THR 56 H THR 56 -19.423 -13.379 4.810 276 HA THR 56 HA THR 56 -21.811 -12.889 6.315 277 HB THR 56 HB THR 56 -18.988 -11.770 6.646 278 HG1 THR 56 HG1 THR 56 -18.583 -13.682 7.405 279 HG21 THR 56 HG21 THR 56 -21.247 -11.793 8.680 280 HG22 THR 56 HG22 THR 56 -20.585 -10.356 7.896 281 HG23 THR 56 HG23 THR 56 -19.581 -11.306 8.994 282 H GLN 57 H GLN 57 -19.827 -10.969 4.092 283 HA GLN 57 HA GLN 57 -20.965 -8.407 4.688 284 HB2 GLN 57 HB2 GLN 57 -19.326 -9.311 2.287 285 HB3 GLN 57 HB3 GLN 57 -19.660 -7.641 2.717 286 HG2 GLN 57 HG2 GLN 57 -18.026 -9.600 4.349 287 HG3 GLN 57 HG3 GLN 57 -17.386 -8.310 3.341 288 HE21 GLN 57 HE21 GLN 57 -17.097 -8.849 6.220 289 HE22 GLN 57 HE22 GLN 57 -17.620 -7.407 7.012 290 H SER 58 H SER 58 -21.870 -11.010 2.536 291 HA SER 58 HA SER 58 -23.487 -9.453 0.741 292 HB2 SER 58 HB2 SER 58 -24.307 -11.675 -0.074 293 HB3 SER 58 HB3 SER 58 -22.551 -11.538 -0.054 294 HG SER 58 HG SER 58 -23.567 -12.548 2.283 295 H LEU 59 H LEU 59 -24.005 -10.598 3.921 296 HA LEU 59 HA LEU 59 -26.874 -10.727 3.906 297 HB2 LEU 59 HB2 LEU 59 -24.787 -10.573 6.087 298 HB3 LEU 59 HB3 LEU 59 -26.466 -10.286 6.499 299 HG LEU 59 HG LEU 59 -27.078 -12.550 5.728 300 HD11 LEU 59 HD11 LEU 59 -24.131 -12.972 5.180 301 HD12 LEU 59 HD12 LEU 59 -25.419 -12.899 3.975 302 HD13 LEU 59 HD13 LEU 59 -25.380 -14.218 5.142 303 HD21 LEU 59 HD21 LEU 59 -26.002 -13.832 7.522 304 HD22 LEU 59 HD22 LEU 59 -26.477 -12.231 8.080 305 HD23 LEU 59 HD23 LEU 59 -24.784 -12.567 7.710 306 H THR 60 H THR 60 -24.547 -8.130 4.058 307 HA THR 60 HA THR 60 -26.267 -6.110 5.131 308 HB THR 60 HB THR 60 -23.827 -5.734 3.341 309 HG1 THR 60 HG1 THR 60 -24.068 -6.494 6.022 310 HG21 THR 60 HG21 THR 60 -23.566 -3.580 4.521 311 HG22 THR 60 HG22 THR 60 -25.040 -3.885 5.441 312 HG23 THR 60 HG23 THR 60 -25.122 -3.650 3.692 313 H GLU 61 H GLU 61 -27.959 -5.191 4.124 314 HA GLU 61 HA GLU 61 -28.703 -5.694 1.435 315 HB2 GLU 61 HB2 GLU 61 -30.622 -4.284 1.829 316 HB3 GLU 61 HB3 GLU 61 -30.333 -5.249 3.263 317 HG2 GLU 61 HG2 GLU 61 -29.588 -2.315 2.972 318 HG3 GLU 61 HG3 GLU 61 -31.044 -2.918 3.756 319 H ASN 62 H ASN 62 -27.155 -2.942 3.022 320 HA ASN 62 HA ASN 62 -26.875 -1.489 0.492 321 HB2 ASN 62 HB2 ASN 62 -27.438 -0.236 2.601 322 HB3 ASN 62 HB3 ASN 62 -25.898 -0.726 3.289 323 HD21 ASN 62 HD21 ASN 62 -23.973 0.235 2.496 324 HD22 ASN 62 HD22 ASN 62 -24.004 1.679 1.545 325 H SER 63 H SER 63 -25.630 -3.191 -0.468 326 HA SER 63 HA SER 63 -22.765 -2.933 -0.137 327 HB2 SER 63 HB2 SER 63 -23.248 -4.716 1.537 328 HB3 SER 63 HB3 SER 63 -24.109 -5.652 0.319 329 HG SER 63 HG SER 63 -21.562 -5.782 0.898 330 H ILE 64 H ILE 64 -21.632 -3.844 -1.924 331 HA ILE 64 HA ILE 64 -22.945 -4.014 -4.448 332 HB ILE 64 HB ILE 64 -20.729 -4.875 -5.288 333 HG12 ILE 64 HG12 ILE 64 -19.800 -4.611 -2.388 334 HG13 ILE 64 HG13 ILE 64 -20.084 -6.139 -3.210 335 HG21 ILE 64 HG21 ILE 64 -21.153 -2.457 -5.204 336 HG22 ILE 64 HG22 ILE 64 -19.451 -2.810 -4.904 337 HG23 ILE 64 HG23 ILE 64 -20.513 -2.387 -3.561 338 HD11 ILE 64 HD11 ILE 64 -18.006 -4.096 -3.969 339 HD12 ILE 64 HD12 ILE 64 -18.282 -5.643 -4.774 340 HD13 ILE 64 HD13 ILE 64 -17.728 -5.604 -3.102 341 H LEU 65 H LEU 65 -22.330 -6.321 -1.930 342 HA LEU 65 HA LEU 65 -22.576 -8.693 -3.613 343 HB2 LEU 65 HB2 LEU 65 -22.262 -8.421 -0.604 344 HB3 LEU 65 HB3 LEU 65 -22.201 -9.936 -1.499 345 HG LEU 65 HG LEU 65 -20.199 -7.655 -1.608 346 HD11 LEU 65 HD11 LEU 65 -19.884 -10.526 -0.666 347 HD12 LEU 65 HD12 LEU 65 -19.955 -9.082 0.349 348 HD13 LEU 65 HD13 LEU 65 -18.603 -9.310 -0.756 349 HD21 LEU 65 HD21 LEU 65 -20.257 -10.158 -3.325 350 HD22 LEU 65 HD22 LEU 65 -18.922 -9.009 -3.225 351 HD23 LEU 65 HD23 LEU 65 -20.473 -8.491 -3.869 352 H ALA 66 H ALA 66 -24.789 -6.595 -2.328 353 HA ALA 66 HA ALA 66 -26.813 -8.317 -1.308 354 HB1 ALA 66 HB1 ALA 66 -27.106 -5.571 -2.578 355 HB2 ALA 66 HB2 ALA 66 -26.788 -5.887 -0.872 356 HB3 ALA 66 HB3 ALA 66 -28.320 -6.389 -1.590 357 H GLN 67 H GLN 67 -26.047 -7.138 -4.572 358 HA GLN 67 HA GLN 67 -28.276 -8.374 -5.911 359 HB2 GLN 67 HB2 GLN 67 -27.095 -7.793 -7.988 360 HB3 GLN 67 HB3 GLN 67 -27.054 -6.438 -6.864 361 HG2 GLN 67 HG2 GLN 67 -24.727 -7.113 -6.221 362 HG3 GLN 67 HG3 GLN 67 -24.783 -8.354 -7.471 363 HE21 GLN 67 HE21 GLN 67 -24.629 -4.925 -6.832 364 HE22 GLN 67 HE22 GLN 67 -24.143 -4.447 -8.418 365 H PHE 68 H PHE 68 -25.120 -9.444 -4.885 366 HA PHE 68 HA PHE 68 -25.145 -11.909 -6.468 367 HB2 PHE 68 HB2 PHE 68 -23.119 -10.807 -4.465 368 HB3 PHE 68 HB3 PHE 68 -22.913 -12.302 -5.368 369 HD1 PHE 68 HD1 PHE 68 -23.260 -11.958 -8.058 370 HD2 PHE 68 HD2 PHE 68 -21.953 -8.943 -5.317 371 HE1 PHE 68 HE1 PHE 68 -22.184 -10.733 -9.904 372 HE2 PHE 68 HE2 PHE 68 -20.879 -7.727 -7.173 373 HZ PHE 68 HZ PHE 68 -20.996 -8.620 -9.468 374 H ALA 69 H ALA 69 -26.672 -10.976 -3.694 375 HA ALA 69 HA ALA 69 -26.164 -13.108 -1.872 376 HB1 ALA 69 HB1 ALA 69 -27.162 -10.960 -1.171 377 HB2 ALA 69 HB2 ALA 69 -28.182 -12.321 -0.708 378 HB3 ALA 69 HB3 ALA 69 -28.623 -11.328 -2.099 379 H GLY 70 H GLY 70 -26.284 -15.093 -2.835 380 HA2 GLY 70 HA2 GLY 70 -28.166 -16.873 -2.907 381 HA3 GLY 70 HA3 GLY 70 -28.717 -15.943 -4.301 382 H GLU 71 H GLU 71 -25.937 -15.283 -5.051 383 HA GLU 71 HA GLU 71 -25.273 -17.588 -6.662 384 HB2 GLU 71 HB2 GLU 71 -25.045 -15.274 -7.526 385 HB3 GLU 71 HB3 GLU 71 -23.871 -14.896 -6.274 386 HG2 GLU 71 HG2 GLU 71 -22.767 -15.237 -8.414 387 HG3 GLU 71 HG3 GLU 71 -22.277 -16.477 -7.264 388 H ASP 72 H ASP 72 -23.317 -18.808 -6.521 389 HA ASP 72 HA ASP 72 -22.240 -19.530 -4.038 390 HB2 ASP 72 HB2 ASP 72 -22.000 -20.947 -6.034 391 HB3 ASP 72 HB3 ASP 72 -21.018 -19.731 -6.829 392 HA PRO 73 HA PRO 73 -19.929 -15.875 -2.857 393 HB2 PRO 73 HB2 PRO 73 -17.998 -17.846 -1.635 394 HB3 PRO 73 HB3 PRO 73 -18.753 -16.412 -0.918 395 HG2 PRO 73 HG2 PRO 73 -19.687 -18.824 -0.316 396 HG3 PRO 73 HG3 PRO 73 -20.813 -17.482 -0.607 397 HD2 PRO 73 HD2 PRO 73 -20.103 -19.785 -2.413 398 HD3 PRO 73 HD3 PRO 73 -21.673 -18.985 -2.158 399 H VAL 74 H VAL 74 -17.987 -18.560 -4.176 400 HA VAL 74 HA VAL 74 -15.677 -16.939 -4.747 401 HB VAL 74 HB VAL 74 -16.345 -19.768 -5.670 402 HG11 VAL 74 HG11 VAL 74 -13.668 -18.318 -5.709 403 HG12 VAL 74 HG12 VAL 74 -14.624 -18.769 -7.123 404 HG13 VAL 74 HG13 VAL 74 -13.914 -20.023 -6.104 405 HG21 VAL 74 HG21 VAL 74 -14.880 -20.512 -3.809 406 HG22 VAL 74 HG22 VAL 74 -16.252 -19.580 -3.208 407 HG23 VAL 74 HG23 VAL 74 -14.659 -18.830 -3.312 408 H VAL 75 H VAL 75 -18.328 -18.332 -6.670 409 HA VAL 75 HA VAL 75 -17.492 -17.432 -9.241 410 HB VAL 75 HB VAL 75 -20.316 -18.088 -8.271 411 HG11 VAL 75 HG11 VAL 75 -20.399 -16.784 -10.366 412 HG12 VAL 75 HG12 VAL 75 -20.882 -18.456 -10.660 413 HG13 VAL 75 HG13 VAL 75 -19.270 -17.908 -11.127 414 HG21 VAL 75 HG21 VAL 75 -18.269 -19.864 -9.652 415 HG22 VAL 75 HG22 VAL 75 -19.925 -20.330 -9.260 416 HG23 VAL 75 HG23 VAL 75 -18.777 -19.983 -7.965 417 H ALA 76 H ALA 76 -19.550 -16.029 -6.763 418 HA ALA 76 HA ALA 76 -20.457 -13.693 -8.090 419 HB1 ALA 76 HB1 ALA 76 -21.068 -12.910 -5.827 420 HB2 ALA 76 HB2 ALA 76 -20.102 -14.205 -5.112 421 HB3 ALA 76 HB3 ALA 76 -21.538 -14.596 -6.057 422 H LEU 77 H LEU 77 -17.629 -14.445 -6.157 423 HA LEU 77 HA LEU 77 -16.567 -11.819 -5.912 424 HB2 LEU 77 HB2 LEU 77 -16.002 -13.647 -4.378 425 HB3 LEU 77 HB3 LEU 77 -15.258 -14.549 -5.684 426 HG LEU 77 HG LEU 77 -13.414 -12.947 -5.819 427 HD11 LEU 77 HD11 LEU 77 -13.178 -11.073 -4.255 428 HD12 LEU 77 HD12 LEU 77 -14.796 -11.381 -3.622 429 HD13 LEU 77 HD13 LEU 77 -14.585 -10.865 -5.298 430 HD21 LEU 77 HD21 LEU 77 -13.251 -14.800 -4.209 431 HD22 LEU 77 HD22 LEU 77 -13.944 -13.773 -2.950 432 HD23 LEU 77 HD23 LEU 77 -12.379 -13.375 -3.654 433 H GLU 78 H GLU 78 -16.042 -14.478 -8.246 434 HA GLU 78 HA GLU 78 -14.007 -13.300 -9.821 435 HB2 GLU 78 HB2 GLU 78 -16.227 -15.226 -10.648 436 HB3 GLU 78 HB3 GLU 78 -14.843 -14.812 -11.662 437 HG2 GLU 78 HG2 GLU 78 -13.323 -15.774 -9.992 438 HG3 GLU 78 HG3 GLU 78 -14.700 -16.179 -8.966 439 H ALA 79 H ALA 79 -17.550 -13.211 -10.148 440 HA ALA 79 HA ALA 79 -17.743 -11.516 -12.402 441 HB1 ALA 79 HB1 ALA 79 -20.104 -11.244 -11.747 442 HB2 ALA 79 HB2 ALA 79 -19.751 -11.940 -10.161 443 HB3 ALA 79 HB3 ALA 79 -19.601 -12.930 -11.613 444 H ALA 80 H ALA 80 -17.424 -10.860 -8.967 445 HA ALA 80 HA ALA 80 -17.937 -8.058 -9.015 446 HB1 ALA 80 HB1 ALA 80 -16.957 -8.048 -6.763 447 HB2 ALA 80 HB2 ALA 80 -16.336 -9.684 -7.015 448 HB3 ALA 80 HB3 ALA 80 -18.076 -9.399 -6.957 449 H LEU 81 H LEU 81 -14.991 -10.010 -9.484 450 HA LEU 81 HA LEU 81 -13.206 -7.770 -9.631 451 HB2 LEU 81 HB2 LEU 81 -12.989 -10.698 -10.204 452 HB3 LEU 81 HB3 LEU 81 -11.846 -9.673 -11.043 453 HG LEU 81 HG LEU 81 -10.830 -10.545 -9.017 454 HD11 LEU 81 HD11 LEU 81 -11.405 -7.580 -8.707 455 HD12 LEU 81 HD12 LEU 81 -10.167 -8.298 -9.743 456 HD13 LEU 81 HD13 LEU 81 -10.058 -8.477 -7.996 457 HD21 LEU 81 HD21 LEU 81 -13.082 -9.226 -7.465 458 HD22 LEU 81 HD22 LEU 81 -11.661 -10.013 -6.771 459 HD23 LEU 81 HD23 LEU 81 -12.833 -10.960 -7.682 460 H GLN 82 H GLN 82 -15.129 -9.558 -11.978 461 HA GLN 82 HA GLN 82 -14.001 -8.457 -14.353 462 HB2 GLN 82 HB2 GLN 82 -16.739 -9.724 -13.873 463 HB3 GLN 82 HB3 GLN 82 -16.059 -9.373 -15.464 464 HG2 GLN 82 HG2 GLN 82 -14.236 -10.964 -15.061 465 HG3 GLN 82 HG3 GLN 82 -14.843 -11.275 -13.439 466 HE21 GLN 82 HE21 GLN 82 -15.341 -11.833 -16.830 467 HE22 GLN 82 HE22 GLN 82 -16.521 -13.081 -16.670 468 H PHE 83 H PHE 83 -16.525 -7.328 -12.147 469 HA PHE 83 HA PHE 83 -17.176 -5.107 -13.983 470 HB2 PHE 83 HB2 PHE 83 -19.065 -6.373 -12.940 471 HB3 PHE 83 HB3 PHE 83 -18.527 -5.836 -11.357 472 HD1 PHE 83 HD1 PHE 83 -19.644 -4.523 -14.691 473 HD2 PHE 83 HD2 PHE 83 -19.351 -3.765 -10.489 474 HE1 PHE 83 HE1 PHE 83 -20.979 -2.472 -14.960 475 HE2 PHE 83 HE2 PHE 83 -20.694 -1.724 -10.773 476 HZ PHE 83 HZ PHE 83 -21.507 -1.074 -13.003 477 H GLU 84 H GLU 84 -16.824 -2.997 -13.460 478 HA GLU 84 HA GLU 84 -14.355 -2.470 -12.245 479 HB2 GLU 84 HB2 GLU 84 -14.936 -0.047 -12.790 480 HB3 GLU 84 HB3 GLU 84 -14.960 -1.188 -14.126 481 HG2 GLU 84 HG2 GLU 84 -17.448 -1.317 -13.927 482 HG3 GLU 84 HG3 GLU 84 -17.386 -0.087 -12.668 483 H ASP 85 H ASP 85 -17.604 -1.381 -11.155 484 HA ASP 85 HA ASP 85 -16.693 0.137 -8.938 485 HB2 ASP 85 HB2 ASP 85 -18.907 0.512 -9.944 486 HB3 ASP 85 HB3 ASP 85 -19.422 -1.105 -9.485 487 H THR 86 H THR 86 -17.648 -3.217 -9.294 488 HA THR 86 HA THR 86 -17.914 -3.742 -6.476 489 HB THR 86 HB THR 86 -18.367 -6.112 -7.289 490 HG1 THR 86 HG1 THR 86 -17.118 -5.573 -9.352 491 HG21 THR 86 HG21 THR 86 -20.052 -3.955 -8.617 492 HG22 THR 86 HG22 THR 86 -20.240 -4.508 -6.955 493 HG23 THR 86 HG23 THR 86 -20.558 -5.614 -8.290 494 H ARG 87 H ARG 87 -15.288 -3.826 -8.756 495 HA ARG 87 HA ARG 87 -13.762 -5.892 -7.402 496 HB2 ARG 87 HB2 ARG 87 -12.147 -5.677 -9.083 497 HB3 ARG 87 HB3 ARG 87 -13.591 -5.149 -9.931 498 HG2 ARG 87 HG2 ARG 87 -12.915 -2.766 -9.487 499 HG3 ARG 87 HG3 ARG 87 -11.419 -3.365 -8.776 500 HD2 ARG 87 HD2 ARG 87 -10.932 -4.483 -11.011 501 HD3 ARG 87 HD3 ARG 87 -12.322 -3.618 -11.671 502 HE ARG 87 HE ARG 87 -9.706 -2.584 -11.222 503 HH11 ARG 87 HH11 ARG 87 -13.041 -1.503 -10.973 504 HH12 ARG 87 HH12 ARG 87 -12.666 0.127 -11.407 505 HH21 ARG 87 HH21 ARG 87 -9.247 -0.422 -11.749 506 HH22 ARG 87 HH22 ARG 87 -10.533 0.739 -11.837 507 H GLU 88 H GLU 88 -14.288 -2.545 -7.022 508 HA GLU 88 HA GLU 88 -11.796 -1.682 -5.976 509 HB2 GLU 88 HB2 GLU 88 -14.597 -0.495 -5.820 510 HB3 GLU 88 HB3 GLU 88 -13.135 0.353 -5.306 511 HG2 GLU 88 HG2 GLU 88 -13.653 -0.674 -8.119 512 HG3 GLU 88 HG3 GLU 88 -13.897 0.983 -7.596 513 H SER 89 H SER 89 -14.769 -2.840 -4.424 514 HA SER 89 HA SER 89 -13.833 -2.435 -1.738 515 HB2 SER 89 HB2 SER 89 -16.251 -2.549 -2.314 516 HB3 SER 89 HB3 SER 89 -16.058 -4.244 -2.756 517 HG SER 89 HG SER 89 -16.774 -3.494 -0.479 518 H MET 90 H MET 90 -13.364 -4.904 -4.163 519 HA MET 90 HA MET 90 -12.743 -7.091 -2.409 520 HB2 MET 90 HB2 MET 90 -12.125 -6.739 -5.363 521 HB3 MET 90 HB3 MET 90 -11.936 -8.247 -4.461 522 HG2 MET 90 HG2 MET 90 -14.499 -6.768 -5.067 523 HG3 MET 90 HG3 MET 90 -14.017 -8.382 -5.612 524 HE1 MET 90 HE1 MET 90 -16.668 -8.888 -4.609 525 HE2 MET 90 HE2 MET 90 -16.722 -7.262 -3.929 526 HE3 MET 90 HE3 MET 90 -17.041 -8.660 -2.903 527 H HIS 91 H HIS 91 -10.964 -4.336 -3.229 528 HA HIS 91 HA HIS 91 -8.315 -5.298 -2.890 529 HB2 HIS 91 HB2 HIS 91 -9.480 -2.566 -2.179 530 HB3 HIS 91 HB3 HIS 91 -7.757 -2.933 -2.278 531 HD1 HIS 91 HD1 HIS 91 -9.807 -1.009 -4.120 532 HD2 HIS 91 HD2 HIS 91 -7.664 -4.411 -5.179 533 HE1 HIS 91 HE1 HIS 91 -9.524 -0.879 -6.609 534 HE2 HIS 91 HE2 HIS 91 -8.179 -2.914 -7.225 535 H ALA 92 H ALA 92 -10.882 -4.428 -0.643 536 HA ALA 92 HA ALA 92 -9.357 -4.698 1.772 537 HB1 ALA 92 HB1 ALA 92 -11.404 -3.331 1.677 538 HB2 ALA 92 HB2 ALA 92 -11.531 -4.579 2.920 539 HB3 ALA 92 HB3 ALA 92 -12.367 -4.779 1.375 540 H PHE 93 H PHE 93 -11.406 -6.888 -0.146 541 HA PHE 93 HA PHE 93 -11.382 -9.054 1.751 542 HB2 PHE 93 HB2 PHE 93 -12.103 -8.986 -1.211 543 HB3 PHE 93 HB3 PHE 93 -12.314 -10.401 -0.183 544 HD1 PHE 93 HD1 PHE 93 -13.502 -6.945 -0.811 545 HD2 PHE 93 HD2 PHE 93 -14.169 -10.551 1.371 546 HE1 PHE 93 HE1 PHE 93 -15.713 -6.117 -0.130 547 HE2 PHE 93 HE2 PHE 93 -16.374 -9.707 2.048 548 HZ PHE 93 HZ PHE 93 -17.150 -7.508 1.303 549 H CYS 94 H CYS 94 -9.226 -8.000 -0.764 550 HA CYS 94 HA CYS 94 -7.792 -10.431 -1.183 551 HB2 CYS 94 HB2 CYS 94 -7.719 -8.577 -2.813 552 HB3 CYS 94 HB3 CYS 94 -6.924 -7.548 -1.626 553 HG CYS 94 HG CYS 94 -5.416 -10.472 -2.404 554 H VAL 95 H VAL 95 -7.009 -11.399 0.588 555 HA VAL 95 HA VAL 95 -5.844 -10.055 2.849 556 HB VAL 95 HB VAL 95 -5.299 -12.331 3.676 557 HG11 VAL 95 HG11 VAL 95 -7.606 -13.232 3.825 558 HG12 VAL 95 HG12 VAL 95 -8.114 -12.156 2.520 559 HG13 VAL 95 HG13 VAL 95 -7.577 -11.483 4.061 560 HG21 VAL 95 HG21 VAL 95 -6.310 -13.341 0.982 561 HG22 VAL 95 HG22 VAL 95 -5.879 -14.356 2.362 562 HG23 VAL 95 HG23 VAL 95 -4.640 -13.399 1.550 563 H GLY 96 H GLY 96 -4.677 -11.195 -0.192 564 HA2 GLY 96 HA2 GLY 96 -2.293 -9.791 -0.182 565 HA3 GLY 96 HA3 GLY 96 -1.885 -11.415 0.374 566 H GLN 97 H GLN 97 -0.613 -10.900 -1.803 567 HA GLN 97 HA GLN 97 -2.086 -11.731 -4.191 568 HB2 GLN 97 HB2 GLN 97 -0.180 -10.099 -4.357 569 HB3 GLN 97 HB3 GLN 97 0.917 -11.356 -3.796 570 HG2 GLN 97 HG2 GLN 97 0.152 -12.707 -5.860 571 HG3 GLN 97 HG3 GLN 97 -0.589 -11.212 -6.423 572 HE21 GLN 97 HE21 GLN 97 2.412 -12.878 -5.788 573 HE22 GLN 97 HE22 GLN 97 3.438 -11.767 -6.628 574 H TYR 98 H TYR 98 -1.754 -13.731 -5.218 575 HA TYR 98 HA TYR 98 -1.034 -15.993 -3.587 576 HB2 TYR 98 HB2 TYR 98 -2.882 -16.098 -5.205 577 HB3 TYR 98 HB3 TYR 98 -1.779 -15.751 -6.526 578 HD1 TYR 98 HD1 TYR 98 -2.398 -18.283 -3.819 579 HD2 TYR 98 HD2 TYR 98 -0.836 -17.540 -7.727 580 HE1 TYR 98 HE1 TYR 98 -2.065 -20.700 -4.157 581 HE2 TYR 98 HE2 TYR 98 -0.514 -19.940 -8.062 582 HH TYR 98 HH TYR 98 -0.204 -21.952 -6.716 583 H LEU 99 H LEU 99 0.778 -17.249 -3.758 584 HA LEU 99 HA LEU 99 2.848 -16.616 -5.745 585 HB2 LEU 99 HB2 LEU 99 3.406 -15.506 -3.574 586 HB3 LEU 99 HB3 LEU 99 3.367 -17.062 -2.777 587 HG LEU 99 HG LEU 99 5.662 -15.986 -3.383 588 HD11 LEU 99 HD11 LEU 99 6.779 -18.117 -3.668 589 HD12 LEU 99 HD12 LEU 99 5.237 -18.893 -4.041 590 HD13 LEU 99 HD13 LEU 99 5.513 -18.198 -2.444 591 HD21 LEU 99 HD21 LEU 99 5.059 -17.156 -6.109 592 HD22 LEU 99 HD22 LEU 99 6.610 -16.510 -5.563 593 HD23 LEU 99 HD23 LEU 99 5.219 -15.441 -5.717 594 H GLU 100 H GLU 100 3.524 -18.351 -6.752 595 HA GLU 100 HA GLU 100 2.743 -21.039 -6.016 596 HB2 GLU 100 HB2 GLU 100 4.282 -19.873 -8.370 597 HB3 GLU 100 HB3 GLU 100 3.887 -21.576 -8.219 598 HG2 GLU 100 HG2 GLU 100 1.481 -21.028 -8.268 599 HG3 GLU 100 HG3 GLU 100 1.877 -19.312 -8.385 600 HA PRO 101 HA PRO 101 6.561 -21.775 -3.670 601 HB2 PRO 101 HB2 PRO 101 6.604 -24.573 -3.976 602 HB3 PRO 101 HB3 PRO 101 5.706 -23.697 -2.732 603 HG2 PRO 101 HG2 PRO 101 4.736 -24.742 -5.389 604 HG3 PRO 101 HG3 PRO 101 3.941 -24.812 -3.799 605 HD2 PRO 101 HD2 PRO 101 3.170 -23.000 -5.590 606 HD3 PRO 101 HD3 PRO 101 3.302 -22.544 -3.878 607 H ASP 102 H ASP 102 6.066 -23.236 -6.854 608 HA ASP 102 HA ASP 102 8.812 -23.823 -7.407 609 HB2 ASP 102 HB2 ASP 102 6.955 -25.032 -8.502 610 HB3 ASP 102 HB3 ASP 102 6.411 -23.546 -9.275 611 H GLN 103 H GLN 103 6.712 -21.036 -7.964 612 HA GLN 103 HA GLN 103 8.208 -19.677 -9.949 613 HB2 GLN 103 HB2 GLN 103 5.777 -19.230 -9.332 614 HB3 GLN 103 HB3 GLN 103 6.347 -18.390 -7.888 615 HG2 GLN 103 HG2 GLN 103 5.776 -16.803 -9.680 616 HG3 GLN 103 HG3 GLN 103 7.497 -16.733 -9.294 617 HE21 GLN 103 HE21 GLN 103 8.025 -15.830 -11.326 618 HE22 GLN 103 HE22 GLN 103 7.978 -16.759 -12.784 619 H GLU 104 H GLU 104 8.318 -19.632 -6.440 620 HA GLU 104 HA GLU 104 10.068 -17.427 -6.106 621 HB2 GLU 104 HB2 GLU 104 8.684 -18.237 -4.262 622 HB3 GLU 104 HB3 GLU 104 9.504 -19.795 -4.287 623 HG2 GLU 104 HG2 GLU 104 10.266 -18.387 -2.418 624 HG3 GLU 104 HG3 GLU 104 11.576 -18.775 -3.526 625 H GLY 105 H GLY 105 11.899 -17.482 -7.301 626 HA2 GLY 105 HA2 GLY 105 14.246 -18.239 -6.346 627 HA3 GLY 105 HA3 GLY 105 13.784 -19.735 -7.144 628 H VAL 106 H VAL 106 13.376 -19.657 -9.454 629 HA VAL 106 HA VAL 106 15.049 -17.649 -10.858 630 HB VAL 106 HB VAL 106 16.301 -19.775 -10.476 631 HG11 VAL 106 HG11 VAL 106 15.653 -21.876 -11.595 632 HG12 VAL 106 HG12 VAL 106 14.155 -21.128 -12.147 633 HG13 VAL 106 HG13 VAL 106 14.435 -21.367 -10.419 634 HG21 VAL 106 HG21 VAL 106 15.658 -19.294 -13.410 635 HG22 VAL 106 HG22 VAL 106 17.069 -20.161 -12.802 636 HG23 VAL 106 HG23 VAL 106 16.875 -18.440 -12.457 637 H THR 107 H THR 107 14.535 -17.312 -13.087 638 HA THR 107 HA THR 107 11.904 -18.299 -14.008 639 HB THR 107 HB THR 107 11.708 -15.915 -13.430 640 HG1 THR 107 HG1 THR 107 11.805 -16.071 -16.266 641 HG21 THR 107 HG21 THR 107 14.052 -15.175 -13.714 642 HG22 THR 107 HG22 THR 107 12.952 -14.155 -14.644 643 HG23 THR 107 HG23 THR 107 13.917 -15.387 -15.461 644 H ILE 108 H ILE 108 11.899 -19.276 -15.967 645 HA ILE 108 HA ILE 108 14.338 -19.289 -17.626 646 HB ILE 108 HB ILE 108 11.914 -21.148 -17.661 647 HG12 ILE 108 HG12 ILE 108 13.344 -21.506 -15.666 648 HG13 ILE 108 HG13 ILE 108 13.421 -22.884 -16.753 649 HG21 ILE 108 HG21 ILE 108 13.180 -22.574 -19.246 650 HG22 ILE 108 HG22 ILE 108 14.451 -21.352 -19.325 651 HG23 ILE 108 HG23 ILE 108 12.834 -20.979 -19.923 652 HD11 ILE 108 HD11 ILE 108 15.515 -20.733 -16.460 653 HD12 ILE 108 HD12 ILE 108 15.599 -22.106 -17.569 654 HD13 ILE 108 HD13 ILE 108 15.589 -22.378 -15.827 655 HA PRO 109 HA PRO 109 11.880 -16.772 -20.569 656 HB2 PRO 109 HB2 PRO 109 13.825 -16.197 -22.337 657 HB3 PRO 109 HB3 PRO 109 13.859 -15.498 -20.710 658 HG2 PRO 109 HG2 PRO 109 15.379 -17.876 -21.784 659 HG3 PRO 109 HG3 PRO 109 15.979 -16.525 -20.795 660 HD2 PRO 109 HD2 PRO 109 15.255 -18.982 -19.750 661 HD3 PRO 109 HD3 PRO 109 15.206 -17.473 -18.816 662 H ASP 110 H ASP 110 12.000 -16.872 -23.236 663 HA ASP 110 HA ASP 110 11.460 -19.648 -24.016 664 HB2 ASP 110 HB2 ASP 110 10.508 -18.712 -26.089 665 HB3 ASP 110 HB3 ASP 110 9.810 -17.917 -24.687 666 H LEU 111 H LEU 111 12.872 -20.854 -25.110 667 HA LEU 111 HA LEU 111 14.689 -19.783 -27.071 668 HB2 LEU 111 HB2 LEU 111 16.792 -20.627 -26.136 669 HB3 LEU 111 HB3 LEU 111 16.104 -19.374 -25.130 670 HG LEU 111 HG LEU 111 15.826 -22.325 -24.404 671 HD11 LEU 111 HD11 LEU 111 17.777 -22.101 -22.927 672 HD12 LEU 111 HD12 LEU 111 18.081 -20.476 -23.546 673 HD13 LEU 111 HD13 LEU 111 18.224 -21.871 -24.618 674 HD21 LEU 111 HD21 LEU 111 15.496 -21.486 -22.115 675 HD22 LEU 111 HD22 LEU 111 14.308 -20.792 -23.214 676 HD23 LEU 111 HD23 LEU 111 15.682 -19.821 -22.680 677 H GLY 112 H GLY 112 13.807 -22.633 -25.113 678 HA2 GLY 112 HA2 GLY 112 14.474 -24.468 -27.342 679 HA3 GLY 112 HA3 GLY 112 14.111 -24.904 -25.676 Start of MODEL 14 1 H GLU 21 H GLU 21 2.313 -1.378 1.500 2 HA GLU 21 HA GLU 21 2.976 -1.421 -1.377 3 HB2 GLU 21 HB2 GLU 21 4.354 -0.092 0.991 4 HB3 GLU 21 HB3 GLU 21 5.112 -0.286 -0.590 5 HG2 GLU 21 HG2 GLU 21 2.610 1.317 0.025 6 HG3 GLU 21 HG3 GLU 21 4.214 1.964 -0.334 7 H LYS 22 H LYS 22 3.720 -2.600 1.886 8 HA LYS 22 HA LYS 22 5.722 -4.462 1.128 9 HB2 LYS 22 HB2 LYS 22 5.376 -5.479 3.350 10 HB3 LYS 22 HB3 LYS 22 5.466 -3.736 3.461 11 HG2 LYS 22 HG2 LYS 22 3.739 -4.161 4.934 12 HG3 LYS 22 HG3 LYS 22 2.839 -3.842 3.456 13 HD2 LYS 22 HD2 LYS 22 1.905 -5.773 4.648 14 HD3 LYS 22 HD3 LYS 22 2.561 -6.275 3.090 15 HE2 LYS 22 HE2 LYS 22 4.618 -7.079 4.239 16 HE3 LYS 22 HE3 LYS 22 3.911 -6.621 5.792 17 HZ1 LYS 22 HZ1 LYS 22 2.776 -8.610 3.905 18 HZ2 LYS 22 HZ2 LYS 22 2.143 -8.202 5.418 19 HZ3 LYS 22 HZ3 LYS 22 3.639 -8.971 5.312 20 H VAL 23 H VAL 23 5.532 -6.765 0.853 21 HA VAL 23 HA VAL 23 2.960 -7.510 -0.401 22 HB VAL 23 HB VAL 23 4.914 -7.530 -1.919 23 HG11 VAL 23 HG11 VAL 23 6.079 -9.716 -0.158 24 HG12 VAL 23 HG12 VAL 23 6.723 -8.087 -0.368 25 HG13 VAL 23 HG13 VAL 23 6.715 -9.210 -1.729 26 HG21 VAL 23 HG21 VAL 23 3.029 -9.034 -2.363 27 HG22 VAL 23 HG22 VAL 23 3.787 -10.307 -1.405 28 HG23 VAL 23 HG23 VAL 23 4.540 -9.762 -2.904 29 H THR 24 H THR 24 1.772 -9.143 0.374 30 HA THR 24 HA THR 24 2.960 -11.158 2.204 31 HB THR 24 HB THR 24 0.011 -10.383 1.830 32 HG1 THR 24 HG1 THR 24 0.449 -8.889 3.233 33 HG21 THR 24 HG21 THR 24 1.265 -12.266 3.876 34 HG22 THR 24 HG22 THR 24 0.248 -12.752 2.516 35 HG23 THR 24 HG23 THR 24 -0.428 -11.780 3.826 36 H LEU 25 H LEU 25 3.607 -12.812 0.879 37 HA LEU 25 HA LEU 25 2.012 -13.543 -1.480 38 HB2 LEU 25 HB2 LEU 25 4.844 -14.247 -0.655 39 HB3 LEU 25 HB3 LEU 25 4.021 -15.084 -1.965 40 HG LEU 25 HG LEU 25 4.719 -12.120 -1.882 41 HD11 LEU 25 HD11 LEU 25 6.661 -13.553 -2.312 42 HD12 LEU 25 HD12 LEU 25 6.229 -12.631 -3.750 43 HD13 LEU 25 HD13 LEU 25 5.808 -14.345 -3.642 44 HD21 LEU 25 HD21 LEU 25 2.578 -12.367 -3.034 45 HD22 LEU 25 HD22 LEU 25 3.228 -13.665 -4.046 46 HD23 LEU 25 HD23 LEU 25 3.845 -12.019 -4.212 47 H VAL 26 H VAL 26 0.633 -15.068 -1.319 48 HA VAL 26 HA VAL 26 0.796 -17.177 0.743 49 HB VAL 26 HB VAL 26 -1.599 -16.099 -0.832 50 HG11 VAL 26 HG11 VAL 26 -3.036 -17.543 0.537 51 HG12 VAL 26 HG12 VAL 26 -1.617 -18.226 1.329 52 HG13 VAL 26 HG13 VAL 26 -1.883 -18.506 -0.390 53 HG21 VAL 26 HG21 VAL 26 -0.952 -15.792 2.132 54 HG22 VAL 26 HG22 VAL 26 -2.420 -15.221 1.333 55 HG23 VAL 26 HG23 VAL 26 -0.856 -14.520 0.911 56 H ARG 27 H ARG 27 1.153 -19.198 0.021 57 HA ARG 27 HA ARG 27 0.930 -19.821 -2.867 58 HB2 ARG 27 HB2 ARG 27 2.402 -21.770 -2.363 59 HB3 ARG 27 HB3 ARG 27 3.164 -20.234 -1.955 60 HG2 ARG 27 HG2 ARG 27 2.448 -20.641 0.445 61 HG3 ARG 27 HG3 ARG 27 1.968 -22.266 -0.050 62 HD2 ARG 27 HD2 ARG 27 4.771 -21.115 -0.307 63 HD3 ARG 27 HD3 ARG 27 4.227 -22.166 1.004 64 HE ARG 27 HE ARG 27 4.424 -22.956 -1.848 65 HH11 ARG 27 HH11 ARG 27 4.533 -23.838 1.554 66 HH12 ARG 27 HH12 ARG 27 4.995 -25.477 1.233 67 HH21 ARG 27 HH21 ARG 27 5.020 -25.126 -2.236 68 HH22 ARG 27 HH22 ARG 27 5.267 -26.195 -0.894 69 H ILE 28 H ILE 28 0.242 -22.211 -3.224 70 HA ILE 28 HA ILE 28 -2.427 -22.492 -2.440 71 HB ILE 28 HB ILE 28 -1.594 -23.463 -4.514 72 HG12 ILE 28 HG12 ILE 28 -2.714 -25.661 -2.696 73 HG13 ILE 28 HG13 ILE 28 -3.678 -24.433 -3.509 74 HG21 ILE 28 HG21 ILE 28 -0.065 -25.465 -2.816 75 HG22 ILE 28 HG22 ILE 28 0.630 -24.170 -3.797 76 HG23 ILE 28 HG23 ILE 28 -0.216 -25.504 -4.577 77 HD11 ILE 28 HD11 ILE 28 -2.060 -26.605 -4.840 78 HD12 ILE 28 HD12 ILE 28 -2.987 -25.358 -5.680 79 HD13 ILE 28 HD13 ILE 28 -3.813 -26.541 -4.668 80 H ALA 29 H ALA 29 0.482 -23.806 -0.981 81 HA ALA 29 HA ALA 29 -0.552 -25.776 0.717 82 HB1 ALA 29 HB1 ALA 29 1.862 -25.452 0.342 83 HB2 ALA 29 HB2 ALA 29 1.487 -25.459 2.067 84 HB3 ALA 29 HB3 ALA 29 1.812 -23.932 1.238 85 H ASP 30 H ASP 30 -0.241 -22.250 1.227 86 HA ASP 30 HA ASP 30 -1.136 -22.135 3.912 87 HB2 ASP 30 HB2 ASP 30 -1.300 -20.007 1.742 88 HB3 ASP 30 HB3 ASP 30 -1.626 -19.710 3.444 89 H LEU 31 H LEU 31 -2.859 -22.138 0.842 90 HA LEU 31 HA LEU 31 -5.424 -21.317 1.741 91 HB2 LEU 31 HB2 LEU 31 -4.773 -23.172 -0.590 92 HB3 LEU 31 HB3 LEU 31 -6.280 -22.293 -0.361 93 HG LEU 31 HG LEU 31 -3.562 -21.040 -0.944 94 HD11 LEU 31 HD11 LEU 31 -4.448 -22.256 -2.879 95 HD12 LEU 31 HD12 LEU 31 -4.473 -20.519 -3.163 96 HD13 LEU 31 HD13 LEU 31 -5.971 -21.366 -2.770 97 HD21 LEU 31 HD21 LEU 31 -6.284 -19.705 -0.716 98 HD22 LEU 31 HD22 LEU 31 -4.785 -18.924 -1.227 99 HD23 LEU 31 HD23 LEU 31 -4.938 -19.538 0.416 100 H GLU 32 H GLU 32 -3.961 -24.490 1.183 101 HA GLU 32 HA GLU 32 -6.201 -26.115 1.596 102 HB2 GLU 32 HB2 GLU 32 -3.232 -26.732 1.876 103 HB3 GLU 32 HB3 GLU 32 -4.496 -27.961 1.826 104 HG2 GLU 32 HG2 GLU 32 -5.083 -27.376 -0.445 105 HG3 GLU 32 HG3 GLU 32 -4.037 -25.957 -0.406 106 H ASN 33 H ASN 33 -3.616 -25.182 3.910 107 HA ASN 33 HA ASN 33 -4.763 -26.741 6.059 108 HB2 ASN 33 HB2 ASN 33 -2.938 -26.071 7.410 109 HB3 ASN 33 HB3 ASN 33 -2.264 -26.206 5.792 110 HD21 ASN 33 HD21 ASN 33 -1.578 -24.333 4.740 111 HD22 ASN 33 HD22 ASN 33 -1.374 -22.826 5.556 112 H HIS 34 H HIS 34 -5.024 -23.395 4.984 113 HA HIS 34 HA HIS 34 -6.205 -22.371 7.402 114 HB2 HIS 34 HB2 HIS 34 -4.987 -20.988 5.574 115 HB3 HIS 34 HB3 HIS 34 -6.497 -21.059 4.671 116 HD1 HIS 34 HD1 HIS 34 -4.942 -19.544 7.725 117 HD2 HIS 34 HD2 HIS 34 -8.555 -19.429 5.703 118 HE1 HIS 34 HE1 HIS 34 -6.232 -17.666 8.761 119 HE2 HIS 34 HE2 HIS 34 -8.461 -17.703 7.603 120 H ASN 35 H ASN 35 -7.413 -23.918 4.535 121 HA ASN 35 HA ASN 35 -10.186 -23.474 4.775 122 HB2 ASN 35 HB2 ASN 35 -9.118 -24.480 2.784 123 HB3 ASN 35 HB3 ASN 35 -8.674 -25.905 3.712 124 HD21 ASN 35 HD21 ASN 35 -10.226 -27.471 4.110 125 HD22 ASN 35 HD22 ASN 35 -11.787 -27.462 3.369 126 H ASN 36 H ASN 36 -8.025 -25.823 6.332 127 HA ASN 36 HA ASN 36 -9.991 -27.253 7.859 128 HB2 ASN 36 HB2 ASN 36 -7.770 -28.217 7.384 129 HB3 ASN 36 HB3 ASN 36 -6.987 -26.919 8.277 130 HD21 ASN 36 HD21 ASN 36 -8.937 -29.827 8.560 131 HD22 ASN 36 HD22 ASN 36 -8.611 -30.112 10.233 132 H ASP 37 H ASP 37 -8.066 -24.363 8.387 133 HA ASP 37 HA ASP 37 -8.546 -23.923 11.146 134 HB2 ASP 37 HB2 ASP 37 -6.743 -22.718 10.191 135 HB3 ASP 37 HB3 ASP 37 -7.685 -22.195 8.810 136 H GLY 38 H GLY 38 -10.395 -23.090 8.244 137 HA2 GLY 38 HA2 GLY 38 -12.863 -23.277 8.635 138 HA3 GLY 38 HA3 GLY 38 -12.648 -22.111 9.935 139 H GLY 39 H GLY 39 -10.602 -20.639 8.330 140 HA2 GLY 39 HA2 GLY 39 -12.323 -18.823 6.899 141 HA3 GLY 39 HA3 GLY 39 -10.567 -18.753 7.004 142 H PHE 40 H PHE 40 -13.194 -19.525 4.979 143 HA PHE 40 HA PHE 40 -11.758 -21.310 3.203 144 HB2 PHE 40 HB2 PHE 40 -14.307 -21.335 3.543 145 HB3 PHE 40 HB3 PHE 40 -14.377 -19.852 2.602 146 HD1 PHE 40 HD1 PHE 40 -13.854 -19.904 0.139 147 HD2 PHE 40 HD2 PHE 40 -13.875 -23.491 2.468 148 HE1 PHE 40 HE1 PHE 40 -13.934 -21.243 -1.923 149 HE2 PHE 40 HE2 PHE 40 -13.957 -24.825 0.398 150 HZ PHE 40 HZ PHE 40 -13.986 -23.707 -1.796 151 H TRP 41 H TRP 41 -10.089 -20.426 2.154 152 HA TRP 41 HA TRP 41 -10.218 -17.745 0.938 153 HB2 TRP 41 HB2 TRP 41 -7.912 -19.658 1.509 154 HB3 TRP 41 HB3 TRP 41 -7.713 -18.251 0.473 155 HD1 TRP 41 HD1 TRP 41 -9.894 -17.011 3.096 156 HE1 TRP 41 HE1 TRP 41 -8.562 -15.825 4.941 157 HE3 TRP 41 HE3 TRP 41 -5.211 -18.755 1.982 158 HZ2 TRP 41 HZ2 TRP 41 -5.894 -15.638 5.816 159 HZ3 TRP 41 HZ3 TRP 41 -3.319 -18.025 3.377 160 HH2 TRP 41 HH2 TRP 41 -3.655 -16.497 5.257 161 H THR 42 H THR 42 -9.714 -17.448 -1.258 162 HA THR 42 HA THR 42 -9.269 -19.730 -3.034 163 HB THR 42 HB THR 42 -11.769 -19.430 -3.034 164 HG1 THR 42 HG1 THR 42 -11.212 -18.569 -5.581 165 HG21 THR 42 HG21 THR 42 -11.184 -16.698 -4.240 166 HG22 THR 42 HG22 THR 42 -11.878 -16.984 -2.641 167 HG23 THR 42 HG23 THR 42 -12.771 -17.451 -4.089 168 H VAL 43 H VAL 43 -8.714 -18.896 -5.279 169 HA VAL 43 HA VAL 43 -7.216 -16.336 -5.087 170 HB VAL 43 HB VAL 43 -6.330 -18.905 -6.486 171 HG11 VAL 43 HG11 VAL 43 -4.904 -16.213 -6.269 172 HG12 VAL 43 HG12 VAL 43 -5.589 -16.909 -7.740 173 HG13 VAL 43 HG13 VAL 43 -4.216 -17.688 -6.957 174 HG21 VAL 43 HG21 VAL 43 -6.143 -19.042 -4.036 175 HG22 VAL 43 HG22 VAL 43 -5.222 -17.536 -4.004 176 HG23 VAL 43 HG23 VAL 43 -4.548 -18.967 -4.785 177 H ILE 44 H ILE 44 -8.018 -14.900 -6.416 178 HA ILE 44 HA ILE 44 -8.588 -15.551 -9.235 179 HB ILE 44 HB ILE 44 -10.390 -13.796 -7.484 180 HG12 ILE 44 HG12 ILE 44 -11.059 -16.455 -8.849 181 HG13 ILE 44 HG13 ILE 44 -10.722 -16.268 -7.134 182 HG21 ILE 44 HG21 ILE 44 -11.822 -13.535 -9.502 183 HG22 ILE 44 HG22 ILE 44 -10.643 -14.434 -10.461 184 HG23 ILE 44 HG23 ILE 44 -10.210 -12.873 -9.761 185 HD11 ILE 44 HD11 ILE 44 -13.042 -15.051 -8.609 186 HD12 ILE 44 HD12 ILE 44 -12.710 -14.901 -6.885 187 HD13 ILE 44 HD13 ILE 44 -13.084 -16.476 -7.575 188 H ASP 45 H ASP 45 -7.743 -14.022 -10.602 189 HA ASP 45 HA ASP 45 -6.600 -12.252 -11.433 190 HB2 ASP 45 HB2 ASP 45 -8.611 -11.029 -10.472 191 HB3 ASP 45 HB3 ASP 45 -7.675 -10.714 -9.021 192 H GLY 46 H GLY 46 -5.265 -14.111 -9.644 193 HA2 GLY 46 HA2 GLY 46 -3.188 -14.457 -8.717 194 HA3 GLY 46 HA3 GLY 46 -2.745 -12.849 -9.266 195 H LYS 47 H LYS 47 -5.497 -13.073 -7.218 196 HA LYS 47 HA LYS 47 -3.981 -12.200 -4.823 197 HB2 LYS 47 HB2 LYS 47 -6.702 -11.205 -5.795 198 HB3 LYS 47 HB3 LYS 47 -5.949 -10.750 -4.270 199 HG2 LYS 47 HG2 LYS 47 -4.820 -10.109 -7.016 200 HG3 LYS 47 HG3 LYS 47 -5.814 -9.009 -6.047 201 HD2 LYS 47 HD2 LYS 47 -4.088 -9.137 -4.234 202 HD3 LYS 47 HD3 LYS 47 -3.073 -10.113 -5.307 203 HE2 LYS 47 HE2 LYS 47 -3.077 -8.197 -6.940 204 HE3 LYS 47 HE3 LYS 47 -3.961 -7.237 -5.750 205 HZ1 LYS 47 HZ1 LYS 47 -2.075 -7.570 -4.223 206 HZ2 LYS 47 HZ2 LYS 47 -1.648 -6.739 -5.631 207 HZ3 LYS 47 HZ3 LYS 47 -1.235 -8.366 -5.462 208 H VAL 48 H VAL 48 -4.783 -12.956 -2.863 209 HA VAL 48 HA VAL 48 -6.722 -15.169 -2.930 210 HB VAL 48 HB VAL 48 -4.877 -14.344 -0.636 211 HG11 VAL 48 HG11 VAL 48 -6.833 -15.648 0.110 212 HG12 VAL 48 HG12 VAL 48 -5.356 -16.603 0.266 213 HG13 VAL 48 HG13 VAL 48 -6.466 -16.906 -1.073 214 HG21 VAL 48 HG21 VAL 48 -3.531 -15.007 -2.577 215 HG22 VAL 48 HG22 VAL 48 -4.452 -16.505 -2.732 216 HG23 VAL 48 HG23 VAL 48 -3.438 -16.236 -1.318 217 H TYR 49 H TYR 49 -8.710 -14.896 -2.093 218 HA TYR 49 HA TYR 49 -9.325 -12.547 -0.376 219 HB2 TYR 49 HB2 TYR 49 -11.259 -13.859 -2.351 220 HB3 TYR 49 HB3 TYR 49 -11.516 -12.382 -1.429 221 HD1 TYR 49 HD1 TYR 49 -10.346 -10.272 -2.107 222 HD2 TYR 49 HD2 TYR 49 -9.992 -13.840 -4.428 223 HE1 TYR 49 HE1 TYR 49 -9.446 -8.971 -3.984 224 HE2 TYR 49 HE2 TYR 49 -9.100 -12.526 -6.291 225 HH TYR 49 HH TYR 49 -9.027 -10.317 -7.120 226 H ASP 50 H ASP 50 -10.663 -12.945 1.390 227 HA ASP 50 HA ASP 50 -11.138 -15.737 2.120 228 HB2 ASP 50 HB2 ASP 50 -10.248 -14.133 3.818 229 HB3 ASP 50 HB3 ASP 50 -11.736 -13.192 3.693 230 H ILE 51 H ILE 51 -12.795 -16.569 1.037 231 HA ILE 51 HA ILE 51 -15.225 -15.347 0.284 232 HB ILE 51 HB ILE 51 -14.409 -18.252 0.662 233 HG12 ILE 51 HG12 ILE 51 -13.416 -17.065 -1.258 234 HG13 ILE 51 HG13 ILE 51 -14.505 -18.332 -1.813 235 HG21 ILE 51 HG21 ILE 51 -16.499 -19.005 -0.453 236 HG22 ILE 51 HG22 ILE 51 -17.134 -17.361 -0.347 237 HG23 ILE 51 HG23 ILE 51 -16.803 -18.275 1.124 238 HD11 ILE 51 HD11 ILE 51 -15.131 -15.378 -1.715 239 HD12 ILE 51 HD12 ILE 51 -16.228 -16.648 -2.269 240 HD13 ILE 51 HD13 ILE 51 -14.734 -16.328 -3.145 241 H LYS 52 H LYS 52 -14.202 -16.899 3.272 242 HA LYS 52 HA LYS 52 -16.695 -17.253 4.531 243 HB2 LYS 52 HB2 LYS 52 -14.473 -18.162 5.332 244 HB3 LYS 52 HB3 LYS 52 -14.047 -16.538 5.856 245 HG2 LYS 52 HG2 LYS 52 -16.467 -16.906 7.160 246 HG3 LYS 52 HG3 LYS 52 -15.835 -18.551 7.131 247 HD2 LYS 52 HD2 LYS 52 -15.150 -17.488 9.205 248 HD3 LYS 52 HD3 LYS 52 -13.717 -17.710 8.195 249 HE2 LYS 52 HE2 LYS 52 -13.747 -15.476 9.272 250 HE3 LYS 52 HE3 LYS 52 -13.804 -15.342 7.514 251 HZ1 LYS 52 HZ1 LYS 52 -16.111 -15.077 9.376 252 HZ2 LYS 52 HZ2 LYS 52 -16.231 -15.038 7.688 253 HZ3 LYS 52 HZ3 LYS 52 -15.370 -13.833 8.504 254 H ASP 53 H ASP 53 -14.555 -14.421 4.304 255 HA ASP 53 HA ASP 53 -16.189 -12.657 5.886 256 HB2 ASP 53 HB2 ASP 53 -13.731 -12.283 5.536 257 HB3 ASP 53 HB3 ASP 53 -14.041 -11.941 3.838 258 H PHE 54 H PHE 54 -15.774 -13.251 2.407 259 HA PHE 54 HA PHE 54 -17.256 -11.253 1.223 260 HB2 PHE 54 HB2 PHE 54 -15.839 -12.977 0.067 261 HB3 PHE 54 HB3 PHE 54 -17.098 -14.167 0.340 262 HD1 PHE 54 HD1 PHE 54 -19.240 -14.042 -0.950 263 HD2 PHE 54 HD2 PHE 54 -16.017 -11.339 -1.716 264 HE1 PHE 54 HE1 PHE 54 -20.243 -13.453 -3.116 265 HE2 PHE 54 HE2 PHE 54 -17.031 -10.756 -3.882 266 HZ PHE 54 HZ PHE 54 -19.141 -11.813 -4.584 267 H GLN 55 H GLN 55 -18.442 -14.432 2.261 268 HA GLN 55 HA GLN 55 -21.171 -13.967 1.638 269 HB2 GLN 55 HB2 GLN 55 -21.610 -16.058 2.903 270 HB3 GLN 55 HB3 GLN 55 -20.330 -16.225 1.705 271 HG2 GLN 55 HG2 GLN 55 -18.638 -16.057 3.487 272 HG3 GLN 55 HG3 GLN 55 -19.907 -15.873 4.688 273 HE21 GLN 55 HE21 GLN 55 -21.655 -17.905 3.514 274 HE22 GLN 55 HE22 GLN 55 -20.921 -19.429 3.850 275 H THR 56 H THR 56 -19.252 -13.273 4.513 276 HA THR 56 HA THR 56 -21.405 -12.748 6.317 277 HB THR 56 HB THR 56 -18.574 -11.598 6.333 278 HG1 THR 56 HG1 THR 56 -19.016 -14.014 6.454 279 HG21 THR 56 HG21 THR 56 -18.913 -11.268 8.764 280 HG22 THR 56 HG22 THR 56 -20.586 -11.807 8.613 281 HG23 THR 56 HG23 THR 56 -20.069 -10.311 7.833 282 H GLN 57 H GLN 57 -19.653 -10.758 3.933 283 HA GLN 57 HA GLN 57 -20.800 -8.242 4.709 284 HB2 GLN 57 HB2 GLN 57 -19.367 -8.980 2.123 285 HB3 GLN 57 HB3 GLN 57 -19.684 -7.352 2.702 286 HG2 GLN 57 HG2 GLN 57 -17.842 -9.385 3.988 287 HG3 GLN 57 HG3 GLN 57 -17.349 -7.984 3.048 288 HE21 GLN 57 HE21 GLN 57 -16.654 -8.743 5.767 289 HE22 GLN 57 HE22 GLN 57 -17.130 -7.423 6.775 290 H SER 58 H SER 58 -21.701 -10.801 2.467 291 HA SER 58 HA SER 58 -23.625 -9.282 0.964 292 HB2 SER 58 HB2 SER 58 -24.356 -11.512 0.073 293 HB3 SER 58 HB3 SER 58 -22.619 -11.250 -0.060 294 HG SER 58 HG SER 58 -23.581 -12.543 2.224 295 H LEU 59 H LEU 59 -23.717 -10.584 4.130 296 HA LEU 59 HA LEU 59 -26.556 -10.920 4.391 297 HB2 LEU 59 HB2 LEU 59 -24.250 -10.764 6.299 298 HB3 LEU 59 HB3 LEU 59 -25.814 -10.332 6.961 299 HG LEU 59 HG LEU 59 -26.715 -12.559 6.294 300 HD11 LEU 59 HD11 LEU 59 -23.876 -13.227 5.491 301 HD12 LEU 59 HD12 LEU 59 -25.263 -13.081 4.408 302 HD13 LEU 59 HD13 LEU 59 -25.221 -14.366 5.612 303 HD21 LEU 59 HD21 LEU 59 -24.250 -12.691 8.060 304 HD22 LEU 59 HD22 LEU 59 -25.575 -13.858 8.035 305 HD23 LEU 59 HD23 LEU 59 -25.872 -12.206 8.570 306 H THR 60 H THR 60 -24.556 -8.128 4.152 307 HA THR 60 HA THR 60 -26.543 -6.313 5.292 308 HB THR 60 HB THR 60 -24.014 -5.603 3.719 309 HG1 THR 60 HG1 THR 60 -22.915 -5.647 5.625 310 HG21 THR 60 HG21 THR 60 -24.131 -3.474 4.947 311 HG22 THR 60 HG22 THR 60 -25.581 -4.011 5.792 312 HG23 THR 60 HG23 THR 60 -25.631 -3.732 4.050 313 H GLU 61 H GLU 61 -28.129 -5.336 4.053 314 HA GLU 61 HA GLU 61 -28.425 -5.893 1.242 315 HB2 GLU 61 HB2 GLU 61 -30.380 -5.571 2.785 316 HB3 GLU 61 HB3 GLU 61 -29.935 -3.876 2.971 317 HG2 GLU 61 HG2 GLU 61 -30.281 -3.580 0.496 318 HG3 GLU 61 HG3 GLU 61 -30.857 -5.245 0.419 319 H ASN 62 H ASN 62 -27.219 -3.223 3.188 320 HA ASN 62 HA ASN 62 -26.674 -1.464 0.933 321 HB2 ASN 62 HB2 ASN 62 -25.923 -1.274 3.884 322 HB3 ASN 62 HB3 ASN 62 -25.537 -0.044 2.690 323 HD21 ASN 62 HD21 ASN 62 -27.223 1.195 1.793 324 HD22 ASN 62 HD22 ASN 62 -28.760 1.329 2.566 325 H SER 63 H SER 63 -25.552 -3.489 0.014 326 HA SER 63 HA SER 63 -22.667 -3.108 0.257 327 HB2 SER 63 HB2 SER 63 -22.163 -5.469 0.531 328 HB3 SER 63 HB3 SER 63 -23.324 -5.054 1.788 329 HG SER 63 HG SER 63 -24.376 -6.691 1.010 330 H ILE 64 H ILE 64 -21.526 -3.921 -1.589 331 HA ILE 64 HA ILE 64 -22.839 -3.839 -4.120 332 HB ILE 64 HB ILE 64 -20.666 -4.666 -5.054 333 HG12 ILE 64 HG12 ILE 64 -19.627 -4.661 -2.180 334 HG13 ILE 64 HG13 ILE 64 -20.066 -6.120 -3.052 335 HG21 ILE 64 HG21 ILE 64 -20.987 -2.255 -4.743 336 HG22 ILE 64 HG22 ILE 64 -19.300 -2.693 -4.476 337 HG23 ILE 64 HG23 ILE 64 -20.353 -2.362 -3.097 338 HD11 ILE 64 HD11 ILE 64 -17.882 -4.209 -3.843 339 HD12 ILE 64 HD12 ILE 64 -18.307 -5.709 -4.672 340 HD13 ILE 64 HD13 ILE 64 -17.676 -5.757 -3.027 341 H LEU 65 H LEU 65 -22.350 -6.332 -1.790 342 HA LEU 65 HA LEU 65 -22.549 -8.583 -3.651 343 HB2 LEU 65 HB2 LEU 65 -22.282 -8.604 -0.624 344 HB3 LEU 65 HB3 LEU 65 -22.059 -9.971 -1.709 345 HG LEU 65 HG LEU 65 -20.248 -7.547 -1.410 346 HD11 LEU 65 HD11 LEU 65 -19.986 -9.198 0.354 347 HD12 LEU 65 HD12 LEU 65 -18.571 -9.191 -0.692 348 HD13 LEU 65 HD13 LEU 65 -19.765 -10.486 -0.834 349 HD21 LEU 65 HD21 LEU 65 -18.768 -8.583 -3.100 350 HD22 LEU 65 HD22 LEU 65 -20.318 -8.098 -3.778 351 HD23 LEU 65 HD23 LEU 65 -20.006 -9.801 -3.432 352 H ALA 66 H ALA 66 -24.781 -6.597 -2.218 353 HA ALA 66 HA ALA 66 -26.798 -8.347 -1.286 354 HB1 ALA 66 HB1 ALA 66 -26.844 -5.906 -0.906 355 HB2 ALA 66 HB2 ALA 66 -28.346 -6.466 -1.646 356 HB3 ALA 66 HB3 ALA 66 -27.132 -5.640 -2.628 357 H GLN 67 H GLN 67 -25.912 -7.288 -4.527 358 HA GLN 67 HA GLN 67 -28.078 -8.567 -5.936 359 HB2 GLN 67 HB2 GLN 67 -26.869 -7.963 -7.966 360 HB3 GLN 67 HB3 GLN 67 -26.801 -6.607 -6.846 361 HG2 GLN 67 HG2 GLN 67 -24.492 -7.335 -6.192 362 HG3 GLN 67 HG3 GLN 67 -24.571 -8.582 -7.426 363 HE21 GLN 67 HE21 GLN 67 -24.158 -5.203 -6.807 364 HE22 GLN 67 HE22 GLN 67 -23.724 -4.749 -8.416 365 H PHE 68 H PHE 68 -24.910 -9.507 -4.809 366 HA PHE 68 HA PHE 68 -24.777 -12.000 -6.339 367 HB2 PHE 68 HB2 PHE 68 -22.842 -10.735 -4.347 368 HB3 PHE 68 HB3 PHE 68 -22.530 -12.228 -5.220 369 HD1 PHE 68 HD1 PHE 68 -23.143 -11.802 -7.956 370 HD2 PHE 68 HD2 PHE 68 -21.539 -8.969 -5.184 371 HE1 PHE 68 HE1 PHE 68 -22.112 -10.557 -9.813 372 HE2 PHE 68 HE2 PHE 68 -20.515 -7.730 -7.047 373 HZ PHE 68 HZ PHE 68 -20.802 -8.519 -9.365 374 H ALA 69 H ALA 69 -26.370 -11.097 -3.606 375 HA ALA 69 HA ALA 69 -25.785 -13.103 -1.693 376 HB1 ALA 69 HB1 ALA 69 -26.990 -11.017 -1.158 377 HB2 ALA 69 HB2 ALA 69 -27.906 -12.434 -0.640 378 HB3 ALA 69 HB3 ALA 69 -28.372 -11.566 -2.109 379 H GLY 70 H GLY 70 -27.749 -13.126 -4.601 380 HA2 GLY 70 HA2 GLY 70 -28.774 -15.853 -4.028 381 HA3 GLY 70 HA3 GLY 70 -29.383 -14.758 -5.262 382 H GLU 71 H GLU 71 -25.971 -15.275 -4.725 383 HA GLU 71 HA GLU 71 -25.688 -17.090 -7.028 384 HB2 GLU 71 HB2 GLU 71 -25.408 -14.767 -7.898 385 HB3 GLU 71 HB3 GLU 71 -24.182 -14.440 -6.686 386 HG2 GLU 71 HG2 GLU 71 -23.159 -14.807 -8.862 387 HG3 GLU 71 HG3 GLU 71 -22.673 -16.070 -7.736 388 H ASP 72 H ASP 72 -23.692 -18.290 -6.969 389 HA ASP 72 HA ASP 72 -22.721 -19.120 -4.467 390 HB2 ASP 72 HB2 ASP 72 -22.542 -20.526 -6.494 391 HB3 ASP 72 HB3 ASP 72 -21.435 -19.371 -7.225 392 HA PRO 73 HA PRO 73 -20.181 -15.612 -3.357 393 HB2 PRO 73 HB2 PRO 73 -18.366 -16.853 -1.630 394 HB3 PRO 73 HB3 PRO 73 -20.013 -16.377 -1.188 395 HG2 PRO 73 HG2 PRO 73 -18.995 -19.071 -2.102 396 HG3 PRO 73 HG3 PRO 73 -20.084 -18.687 -0.749 397 HD2 PRO 73 HD2 PRO 73 -21.082 -19.597 -3.047 398 HD3 PRO 73 HD3 PRO 73 -21.922 -18.294 -2.175 399 H VAL 74 H VAL 74 -18.412 -18.531 -4.472 400 HA VAL 74 HA VAL 74 -15.916 -17.140 -4.943 401 HB VAL 74 HB VAL 74 -16.771 -19.893 -5.969 402 HG11 VAL 74 HG11 VAL 74 -14.333 -20.345 -6.182 403 HG12 VAL 74 HG12 VAL 74 -13.984 -18.684 -5.695 404 HG13 VAL 74 HG13 VAL 74 -14.837 -18.998 -7.207 405 HG21 VAL 74 HG21 VAL 74 -16.903 -19.799 -3.503 406 HG22 VAL 74 HG22 VAL 74 -15.247 -19.196 -3.420 407 HG23 VAL 74 HG23 VAL 74 -15.562 -20.828 -4.015 408 H VAL 75 H VAL 75 -18.548 -18.385 -6.969 409 HA VAL 75 HA VAL 75 -17.540 -17.562 -9.505 410 HB VAL 75 HB VAL 75 -20.416 -18.157 -8.637 411 HG11 VAL 75 HG11 VAL 75 -19.272 -17.984 -11.458 412 HG12 VAL 75 HG12 VAL 75 -20.443 -16.881 -10.733 413 HG13 VAL 75 HG13 VAL 75 -20.894 -18.554 -11.048 414 HG21 VAL 75 HG21 VAL 75 -18.918 -20.072 -8.271 415 HG22 VAL 75 HG22 VAL 75 -18.336 -19.972 -9.935 416 HG23 VAL 75 HG23 VAL 75 -20.015 -20.414 -9.612 417 H ALA 76 H ALA 76 -19.549 -16.021 -7.096 418 HA ALA 76 HA ALA 76 -20.348 -13.698 -8.544 419 HB1 ALA 76 HB1 ALA 76 -20.186 -14.149 -5.544 420 HB2 ALA 76 HB2 ALA 76 -21.579 -14.494 -6.568 421 HB3 ALA 76 HB3 ALA 76 -21.043 -12.828 -6.349 422 H LEU 77 H LEU 77 -17.641 -14.538 -6.471 423 HA LEU 77 HA LEU 77 -16.458 -11.984 -6.193 424 HB2 LEU 77 HB2 LEU 77 -15.973 -13.939 -4.737 425 HB3 LEU 77 HB3 LEU 77 -15.193 -14.746 -6.085 426 HG LEU 77 HG LEU 77 -13.440 -12.939 -6.102 427 HD11 LEU 77 HD11 LEU 77 -14.722 -12.004 -3.523 428 HD12 LEU 77 HD12 LEU 77 -14.710 -11.123 -5.053 429 HD13 LEU 77 HD13 LEU 77 -13.197 -11.433 -4.208 430 HD21 LEU 77 HD21 LEU 77 -13.063 -15.085 -4.965 431 HD22 LEU 77 HD22 LEU 77 -13.732 -14.420 -3.471 432 HD23 LEU 77 HD23 LEU 77 -12.240 -13.764 -4.145 433 H GLU 78 H GLU 78 -16.050 -14.593 -8.614 434 HA GLU 78 HA GLU 78 -13.985 -13.483 -10.185 435 HB2 GLU 78 HB2 GLU 78 -16.377 -15.113 -11.151 436 HB3 GLU 78 HB3 GLU 78 -14.903 -14.824 -12.075 437 HG2 GLU 78 HG2 GLU 78 -13.619 -16.096 -10.381 438 HG3 GLU 78 HG3 GLU 78 -15.112 -16.397 -9.488 439 H ALA 79 H ALA 79 -17.516 -13.157 -10.474 440 HA ALA 79 HA ALA 79 -17.632 -11.343 -12.637 441 HB1 ALA 79 HB1 ALA 79 -19.972 -10.966 -11.929 442 HB2 ALA 79 HB2 ALA 79 -19.641 -11.775 -10.393 443 HB3 ALA 79 HB3 ALA 79 -19.565 -12.684 -11.903 444 H ALA 80 H ALA 80 -17.252 -10.890 -9.183 445 HA ALA 80 HA ALA 80 -17.734 -8.074 -9.104 446 HB1 ALA 80 HB1 ALA 80 -16.395 -9.863 -7.057 447 HB2 ALA 80 HB2 ALA 80 -18.122 -9.518 -7.155 448 HB3 ALA 80 HB3 ALA 80 -16.985 -8.221 -6.778 449 H LEU 81 H LEU 81 -14.843 -10.087 -9.551 450 HA LEU 81 HA LEU 81 -12.963 -7.923 -9.398 451 HB2 LEU 81 HB2 LEU 81 -12.834 -10.792 -10.243 452 HB3 LEU 81 HB3 LEU 81 -11.652 -9.752 -11.005 453 HG LEU 81 HG LEU 81 -10.594 -10.756 -9.116 454 HD11 LEU 81 HD11 LEU 81 -9.893 -8.827 -7.802 455 HD12 LEU 81 HD12 LEU 81 -11.278 -7.893 -8.369 456 HD13 LEU 81 HD13 LEU 81 -10.026 -8.403 -9.507 457 HD21 LEU 81 HD21 LEU 81 -12.900 -9.796 -7.395 458 HD22 LEU 81 HD22 LEU 81 -11.427 -10.571 -6.803 459 HD23 LEU 81 HD23 LEU 81 -12.534 -11.463 -7.841 460 H GLN 82 H GLN 82 -15.092 -9.092 -11.876 461 HA GLN 82 HA GLN 82 -13.681 -7.770 -14.073 462 HB2 GLN 82 HB2 GLN 82 -16.201 -9.483 -14.029 463 HB3 GLN 82 HB3 GLN 82 -15.426 -8.863 -15.490 464 HG2 GLN 82 HG2 GLN 82 -13.423 -10.187 -15.030 465 HG3 GLN 82 HG3 GLN 82 -14.099 -10.738 -13.501 466 HE21 GLN 82 HE21 GLN 82 -15.801 -12.250 -13.530 467 HE22 GLN 82 HE22 GLN 82 -16.127 -13.229 -14.910 468 H PHE 83 H PHE 83 -16.417 -7.190 -11.968 469 HA PHE 83 HA PHE 83 -17.596 -5.185 -13.756 470 HB2 PHE 83 HB2 PHE 83 -19.018 -6.837 -12.458 471 HB3 PHE 83 HB3 PHE 83 -18.549 -6.001 -10.985 472 HD1 PHE 83 HD1 PHE 83 -20.064 -5.324 -14.354 473 HD2 PHE 83 HD2 PHE 83 -19.955 -4.246 -10.212 474 HE1 PHE 83 HE1 PHE 83 -21.930 -3.759 -14.707 475 HE2 PHE 83 HE2 PHE 83 -21.822 -2.684 -10.581 476 HZ PHE 83 HZ PHE 83 -22.811 -2.439 -12.823 477 H GLU 84 H GLU 84 -17.560 -3.007 -13.405 478 HA GLU 84 HA GLU 84 -15.164 -1.984 -12.347 479 HB2 GLU 84 HB2 GLU 84 -16.056 0.234 -13.098 480 HB3 GLU 84 HB3 GLU 84 -16.134 -1.029 -14.324 481 HG2 GLU 84 HG2 GLU 84 -18.564 -1.354 -13.767 482 HG3 GLU 84 HG3 GLU 84 -18.453 0.007 -12.648 483 H ASP 85 H ASP 85 -18.442 -1.867 -11.069 484 HA ASP 85 HA ASP 85 -17.967 0.139 -9.067 485 HB2 ASP 85 HB2 ASP 85 -20.207 -0.263 -10.066 486 HB3 ASP 85 HB3 ASP 85 -20.244 -1.870 -9.363 487 H THR 86 H THR 86 -17.546 -3.275 -9.247 488 HA THR 86 HA THR 86 -17.619 -3.671 -6.326 489 HB THR 86 HB THR 86 -17.752 -6.122 -6.990 490 HG1 THR 86 HG1 THR 86 -16.821 -5.634 -9.153 491 HG21 THR 86 HG21 THR 86 -19.818 -4.809 -6.520 492 HG22 THR 86 HG22 THR 86 -20.090 -6.047 -7.739 493 HG23 THR 86 HG23 THR 86 -19.912 -4.359 -8.222 494 H ARG 87 H ARG 87 -15.411 -3.839 -9.088 495 HA ARG 87 HA ARG 87 -13.466 -5.600 -8.068 496 HB2 ARG 87 HB2 ARG 87 -11.927 -4.628 -9.830 497 HB3 ARG 87 HB3 ARG 87 -13.472 -5.214 -10.421 498 HG2 ARG 87 HG2 ARG 87 -13.206 -3.235 -11.617 499 HG3 ARG 87 HG3 ARG 87 -14.248 -2.738 -10.290 500 HD2 ARG 87 HD2 ARG 87 -12.151 -1.896 -9.114 501 HD3 ARG 87 HD3 ARG 87 -11.280 -2.190 -10.623 502 HE ARG 87 HE ARG 87 -13.586 -0.606 -11.109 503 HH11 ARG 87 HH11 ARG 87 -10.362 -0.294 -9.723 504 HH12 ARG 87 HH12 ARG 87 -10.288 1.412 -10.006 505 HH21 ARG 87 HH21 ARG 87 -13.461 1.632 -11.454 506 HH22 ARG 87 HH22 ARG 87 -12.024 2.493 -11.002 507 H GLU 88 H GLU 88 -13.907 -2.197 -7.582 508 HA GLU 88 HA GLU 88 -11.403 -1.523 -6.453 509 HB2 GLU 88 HB2 GLU 88 -12.705 0.449 -5.484 510 HB3 GLU 88 HB3 GLU 88 -12.797 0.256 -7.232 511 HG2 GLU 88 HG2 GLU 88 -15.025 -0.729 -7.053 512 HG3 GLU 88 HG3 GLU 88 -14.933 -0.683 -5.292 513 H SER 89 H SER 89 -14.427 -2.707 -5.032 514 HA SER 89 HA SER 89 -13.546 -2.500 -2.294 515 HB2 SER 89 HB2 SER 89 -15.911 -2.185 -2.943 516 HB3 SER 89 HB3 SER 89 -15.991 -3.861 -3.480 517 HG SER 89 HG SER 89 -16.334 -2.874 -1.022 518 H MET 90 H MET 90 -13.247 -4.883 -4.786 519 HA MET 90 HA MET 90 -13.044 -7.281 -3.311 520 HB2 MET 90 HB2 MET 90 -11.632 -6.474 -5.881 521 HB3 MET 90 HB3 MET 90 -11.659 -8.113 -5.236 522 HG2 MET 90 HG2 MET 90 -14.116 -6.556 -6.078 523 HG3 MET 90 HG3 MET 90 -13.277 -7.747 -7.067 524 HE1 MET 90 HE1 MET 90 -16.298 -7.281 -4.892 525 HE2 MET 90 HE2 MET 90 -15.158 -7.321 -3.544 526 HE3 MET 90 HE3 MET 90 -16.305 -8.643 -3.773 527 H HIS 91 H HIS 91 -10.800 -4.645 -3.722 528 HA HIS 91 HA HIS 91 -8.409 -5.872 -2.814 529 HB2 HIS 91 HB2 HIS 91 -9.311 -2.965 -2.847 530 HB3 HIS 91 HB3 HIS 91 -7.706 -3.447 -2.299 531 HD1 HIS 91 HD1 HIS 91 -6.049 -3.040 -4.087 532 HD2 HIS 91 HD2 HIS 91 -9.699 -4.261 -5.666 533 HE1 HIS 91 HE1 HIS 91 -5.708 -3.143 -6.573 534 HE2 HIS 91 HE2 HIS 91 -7.870 -4.048 -7.482 535 H ALA 92 H ALA 92 -11.201 -4.655 -1.104 536 HA ALA 92 HA ALA 92 -10.035 -4.584 1.533 537 HB1 ALA 92 HB1 ALA 92 -12.968 -4.704 0.726 538 HB2 ALA 92 HB2 ALA 92 -12.026 -3.230 0.958 539 HB3 ALA 92 HB3 ALA 92 -12.343 -4.293 2.329 540 H PHE 93 H PHE 93 -11.497 -7.066 -0.471 541 HA PHE 93 HA PHE 93 -11.751 -9.030 1.681 542 HB2 PHE 93 HB2 PHE 93 -12.123 -9.281 -1.339 543 HB3 PHE 93 HB3 PHE 93 -12.423 -10.584 -0.191 544 HD1 PHE 93 HD1 PHE 93 -14.309 -10.448 1.399 545 HD2 PHE 93 HD2 PHE 93 -13.713 -7.440 -1.575 546 HE1 PHE 93 HE1 PHE 93 -16.587 -9.623 1.760 547 HE2 PHE 93 HE2 PHE 93 -16.005 -6.618 -1.197 548 HZ PHE 93 HZ PHE 93 -17.440 -7.722 0.476 549 H CYS 94 H CYS 94 -9.352 -7.986 -0.551 550 HA CYS 94 HA CYS 94 -7.916 -10.399 -0.954 551 HB2 CYS 94 HB2 CYS 94 -7.709 -8.418 -2.449 552 HB3 CYS 94 HB3 CYS 94 -6.896 -7.537 -1.156 553 HG CYS 94 HG CYS 94 -5.584 -10.504 -2.136 554 H VAL 95 H VAL 95 -7.431 -11.469 0.892 555 HA VAL 95 HA VAL 95 -6.246 -10.287 3.237 556 HB VAL 95 HB VAL 95 -5.990 -12.631 4.054 557 HG11 VAL 95 HG11 VAL 95 -8.398 -13.210 4.145 558 HG12 VAL 95 HG12 VAL 95 -8.729 -12.061 2.845 559 HG13 VAL 95 HG13 VAL 95 -8.137 -11.483 4.404 560 HG21 VAL 95 HG21 VAL 95 -5.438 -13.755 1.927 561 HG22 VAL 95 HG22 VAL 95 -7.067 -13.454 1.319 562 HG23 VAL 95 HG23 VAL 95 -6.824 -14.538 2.691 563 H GLY 96 H GLY 96 -4.980 -11.225 0.225 564 HA2 GLY 96 HA2 GLY 96 -2.463 -10.172 0.652 565 HA3 GLY 96 HA3 GLY 96 -2.300 -11.899 0.969 566 H GLN 97 H GLN 97 -0.819 -10.964 -1.033 567 HA GLN 97 HA GLN 97 -2.055 -11.428 -3.614 568 HB2 GLN 97 HB2 GLN 97 0.908 -11.348 -2.885 569 HB3 GLN 97 HB3 GLN 97 0.237 -11.292 -4.516 570 HG2 GLN 97 HG2 GLN 97 -0.906 -9.125 -3.827 571 HG3 GLN 97 HG3 GLN 97 0.063 -9.183 -2.358 572 HE21 GLN 97 HE21 GLN 97 1.287 -10.179 -5.528 573 HE22 GLN 97 HE22 GLN 97 2.393 -8.866 -5.702 574 H TYR 98 H TYR 98 -1.288 -13.214 -5.030 575 HA TYR 98 HA TYR 98 -0.596 -15.679 -3.535 576 HB2 TYR 98 HB2 TYR 98 -2.913 -15.711 -4.496 577 HB3 TYR 98 HB3 TYR 98 -2.238 -15.475 -6.103 578 HD1 TYR 98 HD1 TYR 98 -2.290 -17.848 -3.208 579 HD2 TYR 98 HD2 TYR 98 -1.450 -17.375 -7.371 580 HE1 TYR 98 HE1 TYR 98 -2.010 -20.277 -3.439 581 HE2 TYR 98 HE2 TYR 98 -1.178 -19.802 -7.584 582 HH TYR 98 HH TYR 98 -2.205 -21.979 -5.362 583 H LEU 99 H LEU 99 0.957 -16.994 -4.389 584 HA LEU 99 HA LEU 99 2.155 -16.442 -7.005 585 HB2 LEU 99 HB2 LEU 99 3.380 -15.344 -4.886 586 HB3 LEU 99 HB3 LEU 99 3.977 -16.967 -4.633 587 HG LEU 99 HG LEU 99 5.638 -15.609 -5.801 588 HD11 LEU 99 HD11 LEU 99 4.524 -17.648 -7.730 589 HD12 LEU 99 HD12 LEU 99 5.638 -17.968 -6.400 590 HD13 LEU 99 HD13 LEU 99 6.154 -16.966 -7.754 591 HD21 LEU 99 HD21 LEU 99 5.261 -14.635 -8.021 592 HD22 LEU 99 HD22 LEU 99 4.153 -13.959 -6.830 593 HD23 LEU 99 HD23 LEU 99 3.578 -15.171 -7.979 594 H GLU 100 H GLU 100 2.275 -18.349 -8.081 595 HA GLU 100 HA GLU 100 1.524 -20.833 -6.920 596 HB2 GLU 100 HB2 GLU 100 2.717 -20.180 -9.641 597 HB3 GLU 100 HB3 GLU 100 2.194 -21.779 -9.189 598 HG2 GLU 100 HG2 GLU 100 0.443 -20.917 -10.490 599 HG3 GLU 100 HG3 GLU 100 -0.123 -20.788 -8.823 600 HA PRO 101 HA PRO 101 5.588 -22.448 -5.504 601 HB2 PRO 101 HB2 PRO 101 4.273 -25.018 -6.408 602 HB3 PRO 101 HB3 PRO 101 5.155 -24.675 -4.911 603 HG2 PRO 101 HG2 PRO 101 2.495 -24.788 -4.922 604 HG3 PRO 101 HG3 PRO 101 3.336 -23.569 -3.941 605 HD2 PRO 101 HD2 PRO 101 1.853 -23.241 -6.531 606 HD3 PRO 101 HD3 PRO 101 1.997 -22.116 -5.161 607 H ASP 102 H ASP 102 3.992 -23.657 -8.400 608 HA ASP 102 HA ASP 102 6.169 -24.578 -9.908 609 HB2 ASP 102 HB2 ASP 102 3.772 -25.042 -10.443 610 HB3 ASP 102 HB3 ASP 102 3.547 -23.362 -10.903 611 H GLN 103 H GLN 103 4.530 -21.431 -9.987 612 HA GLN 103 HA GLN 103 6.028 -20.123 -11.962 613 HB2 GLN 103 HB2 GLN 103 3.812 -19.350 -11.046 614 HB3 GLN 103 HB3 GLN 103 4.606 -18.896 -9.542 615 HG2 GLN 103 HG2 GLN 103 4.228 -16.917 -10.836 616 HG3 GLN 103 HG3 GLN 103 5.966 -17.225 -10.810 617 HE21 GLN 103 HE21 GLN 103 6.449 -16.142 -12.707 618 HE22 GLN 103 HE22 GLN 103 5.891 -16.631 -14.266 619 H GLU 104 H GLU 104 6.550 -20.503 -8.509 620 HA GLU 104 HA GLU 104 8.587 -18.547 -8.157 621 HB2 GLU 104 HB2 GLU 104 7.012 -19.956 -6.424 622 HB3 GLU 104 HB3 GLU 104 8.470 -20.926 -6.298 623 HG2 GLU 104 HG2 GLU 104 8.169 -17.970 -5.673 624 HG3 GLU 104 HG3 GLU 104 8.391 -19.279 -4.516 625 H GLY 105 H GLY 105 8.625 -22.061 -8.769 626 HA2 GLY 105 HA2 GLY 105 11.488 -22.360 -8.722 627 HA3 GLY 105 HA3 GLY 105 10.320 -23.524 -9.327 628 H VAL 106 H VAL 106 9.480 -23.232 -11.496 629 HA VAL 106 HA VAL 106 10.884 -21.349 -13.253 630 HB VAL 106 HB VAL 106 12.194 -23.408 -13.520 631 HG11 VAL 106 HG11 VAL 106 9.631 -24.821 -14.328 632 HG12 VAL 106 HG12 VAL 106 10.534 -25.089 -12.838 633 HG13 VAL 106 HG13 VAL 106 11.255 -25.512 -14.391 634 HG21 VAL 106 HG21 VAL 106 11.897 -21.990 -15.513 635 HG22 VAL 106 HG22 VAL 106 10.444 -22.886 -15.961 636 HG23 VAL 106 HG23 VAL 106 12.015 -23.689 -15.982 637 H THR 107 H THR 107 9.528 -20.417 -14.653 638 HA THR 107 HA THR 107 6.705 -20.986 -14.416 639 HB THR 107 HB THR 107 7.471 -18.649 -14.293 640 HG1 THR 107 HG1 THR 107 5.377 -19.084 -15.122 641 HG21 THR 107 HG21 THR 107 8.281 -17.423 -16.269 642 HG22 THR 107 HG22 THR 107 8.287 -18.915 -17.211 643 HG23 THR 107 HG23 THR 107 9.398 -18.729 -15.852 644 H ILE 108 H ILE 108 5.385 -21.769 -16.017 645 HA ILE 108 HA ILE 108 6.638 -22.977 -18.381 646 HB ILE 108 HB ILE 108 3.767 -23.292 -17.405 647 HG12 ILE 108 HG12 ILE 108 6.159 -25.115 -16.838 648 HG13 ILE 108 HG13 ILE 108 5.396 -24.051 -15.659 649 HG21 ILE 108 HG21 ILE 108 4.082 -23.898 -19.782 650 HG22 ILE 108 HG22 ILE 108 3.734 -25.329 -18.813 651 HG23 ILE 108 HG23 ILE 108 5.388 -25.008 -19.338 652 HD11 ILE 108 HD11 ILE 108 4.700 -26.341 -15.332 653 HD12 ILE 108 HD12 ILE 108 4.118 -26.452 -16.992 654 HD13 ILE 108 HD13 ILE 108 3.318 -25.373 -15.844 655 HA PRO 109 HA PRO 109 5.040 -19.258 -20.529 656 HB2 PRO 109 HB2 PRO 109 6.249 -19.728 -22.954 657 HB3 PRO 109 HB3 PRO 109 7.115 -19.065 -21.563 658 HG2 PRO 109 HG2 PRO 109 7.054 -21.896 -22.588 659 HG3 PRO 109 HG3 PRO 109 8.436 -20.949 -21.997 660 HD2 PRO 109 HD2 PRO 109 7.141 -22.803 -20.452 661 HD3 PRO 109 HD3 PRO 109 7.925 -21.375 -19.756 662 H ASP 110 H ASP 110 3.033 -19.128 -21.369 663 HA ASP 110 HA ASP 110 1.518 -21.410 -22.072 664 HB2 ASP 110 HB2 ASP 110 0.484 -19.399 -21.066 665 HB3 ASP 110 HB3 ASP 110 0.830 -18.474 -22.522 666 H LEU 111 H LEU 111 1.932 -22.539 -23.821 667 HA LEU 111 HA LEU 111 1.699 -21.534 -26.492 668 HB2 LEU 111 HB2 LEU 111 4.074 -20.869 -25.750 669 HB3 LEU 111 HB3 LEU 111 4.463 -22.574 -25.679 670 HG LEU 111 HG LEU 111 3.526 -21.253 -28.268 671 HD11 LEU 111 HD11 LEU 111 5.876 -20.944 -28.921 672 HD12 LEU 111 HD12 LEU 111 6.408 -21.480 -27.325 673 HD13 LEU 111 HD13 LEU 111 5.482 -19.987 -27.493 674 HD21 LEU 111 HD21 LEU 111 3.464 -23.710 -28.286 675 HD22 LEU 111 HD22 LEU 111 5.154 -23.783 -27.779 676 HD23 LEU 111 HD23 LEU 111 4.730 -23.119 -29.359 677 H GLY 112 H GLY 112 0.972 -23.214 -27.740 678 HA2 GLY 112 HA2 GLY 112 1.644 -25.969 -27.289 679 HA3 GLY 112 HA3 GLY 112 0.048 -25.577 -26.659 Start of MODEL 15 1 H GLU 21 H GLU 21 2.007 -1.987 -3.258 2 HA GLU 21 HA GLU 21 4.762 -0.914 -3.072 3 HB2 GLU 21 HB2 GLU 21 2.499 -1.019 -1.028 4 HB3 GLU 21 HB3 GLU 21 4.158 -0.620 -0.609 5 HG2 GLU 21 HG2 GLU 21 2.852 1.407 -0.766 6 HG3 GLU 21 HG3 GLU 21 4.040 1.378 -2.071 7 H LYS 22 H LYS 22 2.486 -3.270 -1.641 8 HA LYS 22 HA LYS 22 4.474 -5.404 -1.841 9 HB2 LYS 22 HB2 LYS 22 4.200 -6.117 0.508 10 HB3 LYS 22 HB3 LYS 22 4.869 -4.499 0.426 11 HG2 LYS 22 HG2 LYS 22 3.321 -4.206 2.125 12 HG3 LYS 22 HG3 LYS 22 2.354 -3.742 0.724 13 HD2 LYS 22 HD2 LYS 22 1.551 -6.219 0.707 14 HD3 LYS 22 HD3 LYS 22 2.236 -6.319 2.332 15 HE2 LYS 22 HE2 LYS 22 0.127 -4.336 1.424 16 HE3 LYS 22 HE3 LYS 22 -0.197 -5.809 2.340 17 HZ1 LYS 22 HZ1 LYS 22 1.419 -3.490 3.266 18 HZ2 LYS 22 HZ2 LYS 22 1.172 -4.909 4.146 19 HZ3 LYS 22 HZ3 LYS 22 -0.136 -3.900 3.794 20 H VAL 23 H VAL 23 3.498 -7.552 -1.524 21 HA VAL 23 HA VAL 23 0.634 -7.753 -1.242 22 HB VAL 23 HB VAL 23 0.951 -7.360 -3.710 23 HG11 VAL 23 HG11 VAL 23 3.096 -8.473 -4.113 24 HG12 VAL 23 HG12 VAL 23 1.853 -9.118 -5.187 25 HG13 VAL 23 HG13 VAL 23 2.367 -10.048 -3.777 26 HG21 VAL 23 HG21 VAL 23 -0.574 -9.157 -4.451 27 HG22 VAL 23 HG22 VAL 23 -1.042 -8.499 -2.882 28 HG23 VAL 23 HG23 VAL 23 -0.222 -10.058 -2.972 29 H THR 24 H THR 24 0.168 -9.531 -0.081 30 HA THR 24 HA THR 24 2.225 -11.152 1.026 31 HB THR 24 HB THR 24 -0.802 -11.545 1.142 32 HG1 THR 24 HG1 THR 24 -0.829 -10.048 2.666 33 HG21 THR 24 HG21 THR 24 1.360 -12.527 3.044 34 HG22 THR 24 HG22 THR 24 0.416 -13.541 1.947 35 HG23 THR 24 HG23 THR 24 -0.380 -12.704 3.283 36 H LEU 25 H LEU 25 3.235 -12.719 -0.145 37 HA LEU 25 HA LEU 25 1.973 -14.050 -2.377 38 HB2 LEU 25 HB2 LEU 25 4.680 -14.490 -1.057 39 HB3 LEU 25 HB3 LEU 25 4.137 -15.326 -2.509 40 HG LEU 25 HG LEU 25 4.623 -12.326 -2.243 41 HD11 LEU 25 HD11 LEU 25 6.164 -14.412 -3.814 42 HD12 LEU 25 HD12 LEU 25 6.701 -13.595 -2.343 43 HD13 LEU 25 HD13 LEU 25 6.462 -12.671 -3.822 44 HD21 LEU 25 HD21 LEU 25 2.740 -12.705 -3.767 45 HD22 LEU 25 HD22 LEU 25 3.687 -13.873 -4.692 46 HD23 LEU 25 HD23 LEU 25 4.160 -12.172 -4.666 47 H VAL 26 H VAL 26 0.386 -15.386 -1.848 48 HA VAL 26 HA VAL 26 0.514 -17.147 0.485 49 HB VAL 26 HB VAL 26 -1.745 -16.589 -1.484 50 HG11 VAL 26 HG11 VAL 26 -1.827 -18.225 1.076 51 HG12 VAL 26 HG12 VAL 26 -2.000 -18.848 -0.567 52 HG13 VAL 26 HG13 VAL 26 -3.233 -17.777 0.105 53 HG21 VAL 26 HG21 VAL 26 -1.238 -14.622 -0.090 54 HG22 VAL 26 HG22 VAL 26 -1.396 -15.600 1.371 55 HG23 VAL 26 HG23 VAL 26 -2.805 -15.313 0.348 56 H ARG 27 H ARG 27 1.388 -19.051 0.205 57 HA ARG 27 HA ARG 27 1.637 -20.386 -2.355 58 HB2 ARG 27 HB2 ARG 27 2.382 -21.313 0.451 59 HB3 ARG 27 HB3 ARG 27 2.864 -22.098 -1.059 60 HG2 ARG 27 HG2 ARG 27 4.286 -20.275 -1.671 61 HG3 ARG 27 HG3 ARG 27 3.617 -19.230 -0.411 62 HD2 ARG 27 HD2 ARG 27 5.298 -21.722 0.034 63 HD3 ARG 27 HD3 ARG 27 5.829 -20.046 0.230 64 HE ARG 27 HE ARG 27 3.713 -20.149 1.890 65 HH11 ARG 27 HH11 ARG 27 6.550 -22.208 1.684 66 HH12 ARG 27 HH12 ARG 27 6.460 -22.673 3.352 67 HH21 ARG 27 HH21 ARG 27 3.618 -20.777 4.039 68 HH22 ARG 27 HH22 ARG 27 4.804 -21.866 4.683 69 H ILE 28 H ILE 28 0.953 -22.673 -2.587 70 HA ILE 28 HA ILE 28 -1.730 -23.243 -2.093 71 HB ILE 28 HB ILE 28 -0.480 -24.427 -3.813 72 HG12 ILE 28 HG12 ILE 28 -1.468 -26.456 -1.747 73 HG13 ILE 28 HG13 ILE 28 -2.509 -25.551 -2.837 74 HG21 ILE 28 HG21 ILE 28 1.097 -25.802 -1.609 75 HG22 ILE 28 HG22 ILE 28 1.717 -24.579 -2.720 76 HG23 ILE 28 HG23 ILE 28 1.212 -26.156 -3.337 77 HD11 ILE 28 HD11 ILE 28 -0.420 -27.568 -3.666 78 HD12 ILE 28 HD12 ILE 28 -1.480 -26.666 -4.753 79 HD13 ILE 28 HD13 ILE 28 -2.165 -27.822 -3.612 80 H ALA 29 H ALA 29 1.132 -24.023 -0.186 81 HA ALA 29 HA ALA 29 0.068 -25.693 1.778 82 HB1 ALA 29 HB1 ALA 29 2.488 -25.339 1.475 83 HB2 ALA 29 HB2 ALA 29 2.014 -25.044 3.149 84 HB3 ALA 29 HB3 ALA 29 2.338 -23.685 2.070 85 H ASP 30 H ASP 30 0.353 -22.139 1.721 86 HA ASP 30 HA ASP 30 -0.766 -21.618 4.294 87 HB2 ASP 30 HB2 ASP 30 -0.627 -19.736 1.897 88 HB3 ASP 30 HB3 ASP 30 -0.858 -19.262 3.580 89 H LEU 31 H LEU 31 -2.072 -21.853 1.072 90 HA LEU 31 HA LEU 31 -4.644 -20.791 1.391 91 HB2 LEU 31 HB2 LEU 31 -3.501 -21.329 -0.778 92 HB3 LEU 31 HB3 LEU 31 -3.702 -23.036 -0.441 93 HG LEU 31 HG LEU 31 -6.229 -22.650 -0.506 94 HD11 LEU 31 HD11 LEU 31 -5.428 -19.967 -1.667 95 HD12 LEU 31 HD12 LEU 31 -6.238 -20.233 -0.122 96 HD13 LEU 31 HD13 LEU 31 -7.062 -20.638 -1.626 97 HD21 LEU 31 HD21 LEU 31 -5.032 -23.688 -2.388 98 HD22 LEU 31 HD22 LEU 31 -4.674 -22.095 -3.060 99 HD23 LEU 31 HD23 LEU 31 -6.344 -22.660 -2.972 100 H GLU 32 H GLU 32 -3.413 -24.088 1.787 101 HA GLU 32 HA GLU 32 -5.906 -25.365 2.333 102 HB2 GLU 32 HB2 GLU 32 -3.050 -26.278 2.857 103 HB3 GLU 32 HB3 GLU 32 -4.468 -27.325 2.922 104 HG2 GLU 32 HG2 GLU 32 -4.830 -27.109 0.557 105 HG3 GLU 32 HG3 GLU 32 -3.629 -25.822 0.429 106 H ASN 33 H ASN 33 -3.179 -24.315 4.445 107 HA ASN 33 HA ASN 33 -4.279 -25.589 6.765 108 HB2 ASN 33 HB2 ASN 33 -2.434 -24.704 8.046 109 HB3 ASN 33 HB3 ASN 33 -1.819 -25.252 6.496 110 HD21 ASN 33 HD21 ASN 33 -0.481 -23.908 5.469 111 HD22 ASN 33 HD22 ASN 33 -0.287 -22.223 5.799 112 H HIS 34 H HIS 34 -4.452 -22.262 5.519 113 HA HIS 34 HA HIS 34 -5.639 -21.173 7.908 114 HB2 HIS 34 HB2 HIS 34 -4.448 -19.771 6.167 115 HB3 HIS 34 HB3 HIS 34 -5.845 -19.981 5.115 116 HD1 HIS 34 HD1 HIS 34 -7.846 -18.462 5.540 117 HD2 HIS 34 HD2 HIS 34 -4.997 -18.255 8.559 118 HE1 HIS 34 HE1 HIS 34 -8.541 -16.536 6.994 119 HE2 HIS 34 HE2 HIS 34 -6.917 -16.565 8.919 120 H ASN 35 H ASN 35 -6.880 -22.687 4.987 121 HA ASN 35 HA ASN 35 -9.648 -22.180 5.421 122 HB2 ASN 35 HB2 ASN 35 -8.877 -22.925 3.235 123 HB3 ASN 35 HB3 ASN 35 -8.229 -24.408 3.918 124 HD21 ASN 35 HD21 ASN 35 -11.412 -23.050 4.765 125 HD22 ASN 35 HD22 ASN 35 -12.323 -24.309 4.016 126 H ASN 36 H ASN 36 -7.435 -24.747 6.465 127 HA ASN 36 HA ASN 36 -9.275 -26.381 7.878 128 HB2 ASN 36 HB2 ASN 36 -6.998 -27.145 7.247 129 HB3 ASN 36 HB3 ASN 36 -6.288 -25.964 8.343 130 HD21 ASN 36 HD21 ASN 36 -5.303 -27.310 9.778 131 HD22 ASN 36 HD22 ASN 36 -6.117 -28.491 10.744 132 H ASP 37 H ASP 37 -7.418 -23.517 8.751 133 HA ASP 37 HA ASP 37 -7.954 -23.393 11.530 134 HB2 ASP 37 HB2 ASP 37 -6.165 -22.037 10.776 135 HB3 ASP 37 HB3 ASP 37 -7.084 -21.396 9.428 136 H GLY 38 H GLY 38 -9.759 -22.306 8.696 137 HA2 GLY 38 HA2 GLY 38 -12.281 -22.530 9.248 138 HA3 GLY 38 HA3 GLY 38 -11.947 -21.218 10.373 139 H GLY 39 H GLY 39 -9.926 -20.106 8.483 140 HA2 GLY 39 HA2 GLY 39 -11.711 -18.354 7.021 141 HA3 GLY 39 HA3 GLY 39 -9.968 -18.228 7.129 142 H PHE 40 H PHE 40 -12.631 -19.412 5.273 143 HA PHE 40 HA PHE 40 -11.127 -21.169 3.558 144 HB2 PHE 40 HB2 PHE 40 -13.567 -21.532 3.904 145 HB3 PHE 40 HB3 PHE 40 -13.917 -19.975 3.158 146 HD1 PHE 40 HD1 PHE 40 -12.750 -23.435 2.508 147 HD2 PHE 40 HD2 PHE 40 -13.843 -19.721 0.705 148 HE1 PHE 40 HE1 PHE 40 -12.792 -24.517 0.304 149 HE2 PHE 40 HE2 PHE 40 -13.894 -20.811 -1.501 150 HZ PHE 40 HZ PHE 40 -13.365 -23.210 -1.702 151 H TRP 41 H TRP 41 -9.661 -20.361 2.216 152 HA TRP 41 HA TRP 41 -10.012 -17.739 0.930 153 HB2 TRP 41 HB2 TRP 41 -7.619 -19.599 1.205 154 HB3 TRP 41 HB3 TRP 41 -7.603 -18.205 0.137 155 HD1 TRP 41 HD1 TRP 41 -9.341 -16.646 2.747 156 HE1 TRP 41 HE1 TRP 41 -7.798 -15.544 4.469 157 HE3 TRP 41 HE3 TRP 41 -5.003 -19.096 1.632 158 HZ2 TRP 41 HZ2 TRP 41 -5.093 -15.676 5.252 159 HZ3 TRP 41 HZ3 TRP 41 -2.977 -18.554 2.918 160 HH2 TRP 41 HH2 TRP 41 -3.022 -16.878 4.692 161 H THR 42 H THR 42 -9.402 -17.606 -1.345 162 HA THR 42 HA THR 42 -9.767 -19.967 -3.035 163 HB THR 42 HB THR 42 -12.077 -19.045 -2.666 164 HG1 THR 42 HG1 THR 42 -12.434 -19.693 -4.624 165 HG21 THR 42 HG21 THR 42 -12.739 -16.883 -3.643 166 HG22 THR 42 HG22 THR 42 -11.062 -16.540 -4.063 167 HG23 THR 42 HG23 THR 42 -11.538 -16.647 -2.367 168 H VAL 43 H VAL 43 -8.406 -19.818 -4.780 169 HA VAL 43 HA VAL 43 -7.016 -17.280 -5.311 170 HB VAL 43 HB VAL 43 -6.481 -20.068 -6.433 171 HG11 VAL 43 HG11 VAL 43 -4.332 -19.106 -7.248 172 HG12 VAL 43 HG12 VAL 43 -4.848 -17.509 -6.703 173 HG13 VAL 43 HG13 VAL 43 -5.727 -18.324 -7.998 174 HG21 VAL 43 HG21 VAL 43 -6.021 -19.975 -4.017 175 HG22 VAL 43 HG22 VAL 43 -5.005 -18.550 -4.247 176 HG23 VAL 43 HG23 VAL 43 -4.515 -20.099 -4.930 177 H ILE 44 H ILE 44 -8.214 -16.017 -6.584 178 HA ILE 44 HA ILE 44 -9.374 -17.083 -9.089 179 HB ILE 44 HB ILE 44 -10.270 -14.644 -7.476 180 HG12 ILE 44 HG12 ILE 44 -11.703 -17.308 -7.921 181 HG13 ILE 44 HG13 ILE 44 -10.926 -16.817 -6.420 182 HG21 ILE 44 HG21 ILE 44 -12.122 -14.454 -9.111 183 HG22 ILE 44 HG22 ILE 44 -11.436 -15.784 -10.044 184 HG23 ILE 44 HG23 ILE 44 -10.550 -14.265 -9.893 185 HD11 ILE 44 HD11 ILE 44 -13.322 -15.487 -7.687 186 HD12 ILE 44 HD12 ILE 44 -12.549 -15.008 -6.176 187 HD13 ILE 44 HD13 ILE 44 -13.333 -16.580 -6.304 188 H ASP 45 H ASP 45 -8.040 -16.618 -10.691 189 HA ASP 45 HA ASP 45 -6.819 -15.528 -12.242 190 HB2 ASP 45 HB2 ASP 45 -8.827 -14.012 -12.173 191 HB3 ASP 45 HB3 ASP 45 -8.003 -13.004 -10.993 192 H GLY 46 H GLY 46 -5.612 -16.222 -9.735 193 HA2 GLY 46 HA2 GLY 46 -3.391 -16.209 -9.067 194 HA3 GLY 46 HA3 GLY 46 -3.108 -14.757 -10.007 195 H LYS 47 H LYS 47 -5.808 -14.285 -8.059 196 HA LYS 47 HA LYS 47 -4.223 -13.069 -5.856 197 HB2 LYS 47 HB2 LYS 47 -6.937 -12.221 -6.954 198 HB3 LYS 47 HB3 LYS 47 -6.127 -11.486 -5.571 199 HG2 LYS 47 HG2 LYS 47 -4.998 -11.515 -8.383 200 HG3 LYS 47 HG3 LYS 47 -5.980 -10.199 -7.730 201 HD2 LYS 47 HD2 LYS 47 -4.266 -9.821 -5.963 202 HD3 LYS 47 HD3 LYS 47 -3.284 -11.124 -6.648 203 HE2 LYS 47 HE2 LYS 47 -2.520 -8.872 -7.376 204 HE3 LYS 47 HE3 LYS 47 -3.021 -9.881 -8.733 205 HZ1 LYS 47 HZ1 LYS 47 -4.672 -7.750 -7.469 206 HZ2 LYS 47 HZ2 LYS 47 -5.133 -8.708 -8.784 207 HZ3 LYS 47 HZ3 LYS 47 -3.850 -7.622 -8.942 208 H VAL 48 H VAL 48 -5.140 -13.231 -3.749 209 HA VAL 48 HA VAL 48 -6.850 -15.607 -3.368 210 HB VAL 48 HB VAL 48 -4.625 -14.590 -1.546 211 HG11 VAL 48 HG11 VAL 48 -4.921 -16.710 -0.286 212 HG12 VAL 48 HG12 VAL 48 -6.301 -17.119 -1.306 213 HG13 VAL 48 HG13 VAL 48 -6.384 -15.718 -0.237 214 HG21 VAL 48 HG21 VAL 48 -4.660 -16.976 -3.425 215 HG22 VAL 48 HG22 VAL 48 -3.381 -16.626 -2.265 216 HG23 VAL 48 HG23 VAL 48 -3.682 -15.517 -3.604 217 H TYR 49 H TYR 49 -8.763 -15.187 -2.475 218 HA TYR 49 HA TYR 49 -9.130 -12.855 -0.662 219 HB2 TYR 49 HB2 TYR 49 -11.225 -13.986 -2.586 220 HB3 TYR 49 HB3 TYR 49 -11.397 -12.568 -1.559 221 HD1 TYR 49 HD1 TYR 49 -9.775 -13.902 -4.604 222 HD2 TYR 49 HD2 TYR 49 -10.499 -10.400 -2.260 223 HE1 TYR 49 HE1 TYR 49 -8.919 -12.502 -6.428 224 HE2 TYR 49 HE2 TYR 49 -9.644 -9.005 -4.091 225 HH TYR 49 HH TYR 49 -9.026 -10.236 -7.231 226 H ASP 50 H ASP 50 -10.705 -13.201 1.045 227 HA ASP 50 HA ASP 50 -11.176 -16.037 1.710 228 HB2 ASP 50 HB2 ASP 50 -10.174 -14.303 3.372 229 HB3 ASP 50 HB3 ASP 50 -11.800 -13.661 3.507 230 H ILE 51 H ILE 51 -13.099 -16.901 1.234 231 HA ILE 51 HA ILE 51 -15.264 -15.368 0.138 232 HB ILE 51 HB ILE 51 -14.966 -18.345 0.720 233 HG12 ILE 51 HG12 ILE 51 -13.585 -17.441 -1.135 234 HG13 ILE 51 HG13 ILE 51 -14.805 -18.563 -1.731 235 HG21 ILE 51 HG21 ILE 51 -17.344 -17.016 -0.640 236 HG22 ILE 51 HG22 ILE 51 -17.363 -17.878 0.900 237 HG23 ILE 51 HG23 ILE 51 -17.036 -18.755 -0.595 238 HD11 ILE 51 HD11 ILE 51 -14.982 -15.549 -1.850 239 HD12 ILE 51 HD12 ILE 51 -16.190 -16.682 -2.467 240 HD13 ILE 51 HD13 ILE 51 -14.580 -16.631 -3.182 241 H LYS 52 H LYS 52 -14.628 -16.854 3.275 242 HA LYS 52 HA LYS 52 -17.266 -16.707 4.353 243 HB2 LYS 52 HB2 LYS 52 -15.677 -18.099 5.495 244 HB3 LYS 52 HB3 LYS 52 -14.484 -16.815 5.567 245 HG2 LYS 52 HG2 LYS 52 -16.010 -15.616 7.210 246 HG3 LYS 52 HG3 LYS 52 -16.997 -17.082 7.237 247 HD2 LYS 52 HD2 LYS 52 -15.412 -17.038 9.138 248 HD3 LYS 52 HD3 LYS 52 -15.071 -18.389 8.055 249 HE2 LYS 52 HE2 LYS 52 -12.983 -17.343 8.747 250 HE3 LYS 52 HE3 LYS 52 -13.227 -17.054 7.028 251 HZ1 LYS 52 HZ1 LYS 52 -13.995 -14.837 7.544 252 HZ2 LYS 52 HZ2 LYS 52 -12.441 -15.092 8.147 253 HZ3 LYS 52 HZ3 LYS 52 -13.765 -15.112 9.198 254 H ASP 53 H ASP 53 -14.469 -14.495 4.478 255 HA ASP 53 HA ASP 53 -15.713 -12.346 5.836 256 HB2 ASP 53 HB2 ASP 53 -13.254 -12.577 4.080 257 HB3 ASP 53 HB3 ASP 53 -13.776 -11.004 4.652 258 H PHE 54 H PHE 54 -15.454 -13.150 2.399 259 HA PHE 54 HA PHE 54 -16.546 -10.845 1.222 260 HB2 PHE 54 HB2 PHE 54 -15.481 -12.551 -0.144 261 HB3 PHE 54 HB3 PHE 54 -16.635 -13.770 0.369 262 HD1 PHE 54 HD1 PHE 54 -16.142 -10.808 -1.800 263 HD2 PHE 54 HD2 PHE 54 -18.834 -13.942 -0.697 264 HE1 PHE 54 HE1 PHE 54 -17.526 -10.331 -3.771 265 HE2 PHE 54 HE2 PHE 54 -20.217 -13.444 -2.671 266 HZ PHE 54 HZ PHE 54 -19.563 -11.637 -4.210 267 H GLN 55 H GLN 55 -18.146 -13.821 2.346 268 HA GLN 55 HA GLN 55 -20.778 -13.188 1.525 269 HB2 GLN 55 HB2 GLN 55 -19.797 -15.134 3.641 270 HB3 GLN 55 HB3 GLN 55 -21.469 -15.043 3.091 271 HG2 GLN 55 HG2 GLN 55 -20.736 -15.635 0.820 272 HG3 GLN 55 HG3 GLN 55 -19.077 -15.744 1.371 273 HE21 GLN 55 HE21 GLN 55 -21.860 -16.907 3.206 274 HE22 GLN 55 HE22 GLN 55 -21.466 -18.581 3.083 275 H THR 56 H THR 56 -18.978 -12.418 4.405 276 HA THR 56 HA THR 56 -20.994 -11.861 6.251 277 HB THR 56 HB THR 56 -18.338 -10.392 5.972 278 HG1 THR 56 HG1 THR 56 -18.656 -12.924 6.263 279 HG21 THR 56 HG21 THR 56 -19.850 -9.303 7.611 280 HG22 THR 56 HG22 THR 56 -18.492 -10.077 8.427 281 HG23 THR 56 HG23 THR 56 -20.079 -10.849 8.434 282 H GLN 57 H GLN 57 -19.721 -9.827 3.632 283 HA GLN 57 HA GLN 57 -21.231 -7.475 4.335 284 HB2 GLN 57 HB2 GLN 57 -19.633 -8.215 1.850 285 HB3 GLN 57 HB3 GLN 57 -20.425 -6.661 2.061 286 HG2 GLN 57 HG2 GLN 57 -18.245 -7.775 3.857 287 HG3 GLN 57 HG3 GLN 57 -18.017 -6.570 2.594 288 HE21 GLN 57 HE21 GLN 57 -19.331 -7.171 5.776 289 HE22 GLN 57 HE22 GLN 57 -19.550 -5.516 6.224 290 H SER 58 H SER 58 -21.783 -10.275 2.235 291 HA SER 58 HA SER 58 -24.089 -9.090 0.921 292 HB2 SER 58 HB2 SER 58 -24.352 -11.358 -0.117 293 HB3 SER 58 HB3 SER 58 -22.756 -10.659 -0.354 294 HG SER 58 HG SER 58 -23.344 -12.511 1.712 295 H LEU 59 H LEU 59 -23.730 -10.161 4.020 296 HA LEU 59 HA LEU 59 -26.221 -11.617 4.353 297 HB2 LEU 59 HB2 LEU 59 -24.314 -10.479 6.431 298 HB3 LEU 59 HB3 LEU 59 -25.688 -11.512 6.792 299 HG LEU 59 HG LEU 59 -23.176 -12.304 5.274 300 HD11 LEU 59 HD11 LEU 59 -22.810 -12.142 7.675 301 HD12 LEU 59 HD12 LEU 59 -22.756 -13.823 7.153 302 HD13 LEU 59 HD13 LEU 59 -24.187 -13.205 7.985 303 HD21 LEU 59 HD21 LEU 59 -25.626 -13.994 5.855 304 HD22 LEU 59 HD22 LEU 59 -24.101 -14.590 5.190 305 HD23 LEU 59 HD23 LEU 59 -25.075 -13.448 4.269 306 H THR 60 H THR 60 -25.925 -8.516 3.553 307 HA THR 60 HA THR 60 -28.152 -7.599 5.270 308 HB THR 60 HB THR 60 -26.052 -6.492 6.005 309 HG1 THR 60 HG1 THR 60 -27.086 -4.657 6.283 310 HG21 THR 60 HG21 THR 60 -24.804 -6.464 3.878 311 HG22 THR 60 HG22 THR 60 -24.915 -4.849 4.579 312 HG23 THR 60 HG23 THR 60 -25.947 -5.291 3.217 313 H GLU 61 H GLU 61 -29.332 -5.742 4.284 314 HA GLU 61 HA GLU 61 -30.281 -6.468 1.690 315 HB2 GLU 61 HB2 GLU 61 -31.785 -5.600 3.465 316 HB3 GLU 61 HB3 GLU 61 -30.973 -4.043 3.401 317 HG2 GLU 61 HG2 GLU 61 -33.090 -3.931 2.207 318 HG3 GLU 61 HG3 GLU 61 -31.750 -3.725 1.076 319 H ASN 62 H ASN 62 -28.924 -3.414 2.904 320 HA ASN 62 HA ASN 62 -28.306 -2.443 0.234 321 HB2 ASN 62 HB2 ASN 62 -27.877 -1.231 3.000 322 HB3 ASN 62 HB3 ASN 62 -27.439 -0.428 1.492 323 HD21 ASN 62 HD21 ASN 62 -30.128 -1.687 3.379 324 HD22 ASN 62 HD22 ASN 62 -31.353 -0.718 2.640 325 H SER 63 H SER 63 -26.817 -3.851 -0.506 326 HA SER 63 HA SER 63 -24.063 -3.568 0.472 327 HB2 SER 63 HB2 SER 63 -24.866 -5.686 1.484 328 HB3 SER 63 HB3 SER 63 -25.418 -6.257 -0.090 329 HG SER 63 HG SER 63 -22.970 -6.421 1.004 330 H ILE 64 H ILE 64 -22.549 -3.738 -1.209 331 HA ILE 64 HA ILE 64 -23.361 -3.407 -3.927 332 HB ILE 64 HB ILE 64 -20.935 -3.715 -4.490 333 HG12 ILE 64 HG12 ILE 64 -20.563 -4.162 -1.484 334 HG13 ILE 64 HG13 ILE 64 -20.402 -5.406 -2.718 335 HG21 ILE 64 HG21 ILE 64 -20.097 -1.694 -3.323 336 HG22 ILE 64 HG22 ILE 64 -21.449 -1.789 -2.189 337 HG23 ILE 64 HG23 ILE 64 -21.755 -1.478 -3.900 338 HD11 ILE 64 HD11 ILE 64 -18.657 -2.975 -2.402 339 HD12 ILE 64 HD12 ILE 64 -18.494 -4.199 -3.664 340 HD13 ILE 64 HD13 ILE 64 -18.253 -4.635 -1.974 341 H LEU 65 H LEU 65 -22.924 -6.171 -1.941 342 HA LEU 65 HA LEU 65 -22.555 -8.089 -4.133 343 HB2 LEU 65 HB2 LEU 65 -22.680 -8.565 -1.138 344 HB3 LEU 65 HB3 LEU 65 -22.176 -9.731 -2.355 345 HG LEU 65 HG LEU 65 -20.700 -7.197 -1.542 346 HD11 LEU 65 HD11 LEU 65 -18.967 -8.723 -0.710 347 HD12 LEU 65 HD12 LEU 65 -19.964 -10.116 -1.139 348 HD13 LEU 65 HD13 LEU 65 -20.506 -8.989 0.108 349 HD21 LEU 65 HD21 LEU 65 -19.965 -9.221 -3.685 350 HD22 LEU 65 HD22 LEU 65 -18.925 -7.925 -3.094 351 HD23 LEU 65 HD23 LEU 65 -20.418 -7.531 -3.935 352 H ALA 66 H ALA 66 -25.142 -6.575 -2.704 353 HA ALA 66 HA ALA 66 -26.970 -8.711 -2.210 354 HB1 ALA 66 HB1 ALA 66 -28.708 -6.961 -2.194 355 HB2 ALA 66 HB2 ALA 66 -27.558 -5.802 -2.868 356 HB3 ALA 66 HB3 ALA 66 -27.298 -6.464 -1.251 357 H GLN 67 H GLN 67 -26.055 -6.936 -5.094 358 HA GLN 67 HA GLN 67 -28.108 -7.887 -6.851 359 HB2 GLN 67 HB2 GLN 67 -26.646 -7.020 -8.663 360 HB3 GLN 67 HB3 GLN 67 -26.879 -5.849 -7.370 361 HG2 GLN 67 HG2 GLN 67 -24.641 -6.402 -6.468 362 HG3 GLN 67 HG3 GLN 67 -24.404 -7.560 -7.770 363 HE21 GLN 67 HE21 GLN 67 -24.485 -4.200 -6.900 364 HE22 GLN 67 HE22 GLN 67 -23.856 -3.584 -8.386 365 H PHE 68 H PHE 68 -25.250 -9.303 -5.585 366 HA PHE 68 HA PHE 68 -25.081 -11.438 -7.610 367 HB2 PHE 68 HB2 PHE 68 -23.249 -10.664 -5.300 368 HB3 PHE 68 HB3 PHE 68 -22.968 -12.026 -6.371 369 HD1 PHE 68 HD1 PHE 68 -22.802 -11.469 -8.942 370 HD2 PHE 68 HD2 PHE 68 -22.268 -8.572 -5.839 371 HE1 PHE 68 HE1 PHE 68 -21.539 -10.031 -10.490 372 HE2 PHE 68 HE2 PHE 68 -21.018 -7.146 -7.402 373 HZ PHE 68 HZ PHE 68 -20.648 -7.867 -9.724 374 H ALA 69 H ALA 69 -27.063 -11.023 -5.141 375 HA ALA 69 HA ALA 69 -26.588 -13.097 -3.271 376 HB1 ALA 69 HB1 ALA 69 -29.232 -11.803 -3.995 377 HB2 ALA 69 HB2 ALA 69 -28.069 -11.178 -2.828 378 HB3 ALA 69 HB3 ALA 69 -28.886 -12.713 -2.518 379 H GLY 70 H GLY 70 -28.075 -13.136 -6.446 380 HA2 GLY 70 HA2 GLY 70 -29.195 -15.836 -6.135 381 HA3 GLY 70 HA3 GLY 70 -29.352 -14.779 -7.528 382 H GLU 71 H GLU 71 -26.175 -15.123 -6.251 383 HA GLU 71 HA GLU 71 -25.425 -17.177 -8.247 384 HB2 GLU 71 HB2 GLU 71 -24.945 -14.892 -9.175 385 HB3 GLU 71 HB3 GLU 71 -23.959 -14.522 -7.769 386 HG2 GLU 71 HG2 GLU 71 -22.522 -15.056 -9.635 387 HG3 GLU 71 HG3 GLU 71 -22.379 -16.320 -8.420 388 H ASP 72 H ASP 72 -23.638 -18.414 -7.692 389 HA ASP 72 HA ASP 72 -22.985 -19.058 -5.052 390 HB2 ASP 72 HB2 ASP 72 -22.491 -20.578 -6.909 391 HB3 ASP 72 HB3 ASP 72 -21.425 -19.398 -7.652 392 HA PRO 73 HA PRO 73 -20.739 -15.378 -3.779 393 HB2 PRO 73 HB2 PRO 73 -19.126 -16.514 -1.764 394 HB3 PRO 73 HB3 PRO 73 -20.798 -15.977 -1.560 395 HG2 PRO 73 HG2 PRO 73 -19.745 -18.739 -2.129 396 HG3 PRO 73 HG3 PRO 73 -21.016 -18.240 -0.990 397 HD2 PRO 73 HD2 PRO 73 -21.680 -19.325 -3.331 398 HD3 PRO 73 HD3 PRO 73 -22.611 -17.941 -2.710 399 H VAL 74 H VAL 74 -18.842 -18.256 -4.680 400 HA VAL 74 HA VAL 74 -16.309 -16.875 -4.843 401 HB VAL 74 HB VAL 74 -17.053 -19.534 -6.144 402 HG11 VAL 74 HG11 VAL 74 -14.332 -18.396 -5.386 403 HG12 VAL 74 HG12 VAL 74 -14.965 -18.563 -7.025 404 HG13 VAL 74 HG13 VAL 74 -14.618 -20.001 -6.064 405 HG21 VAL 74 HG21 VAL 74 -16.125 -20.642 -4.127 406 HG22 VAL 74 HG22 VAL 74 -17.528 -19.649 -3.726 407 HG23 VAL 74 HG23 VAL 74 -15.902 -19.066 -3.363 408 H VAL 75 H VAL 75 -18.693 -18.067 -7.190 409 HA VAL 75 HA VAL 75 -17.437 -17.063 -9.558 410 HB VAL 75 HB VAL 75 -20.345 -17.875 -9.102 411 HG11 VAL 75 HG11 VAL 75 -18.818 -17.622 -11.728 412 HG12 VAL 75 HG12 VAL 75 -20.127 -16.570 -11.184 413 HG13 VAL 75 HG13 VAL 75 -20.456 -18.264 -11.549 414 HG21 VAL 75 HG21 VAL 75 -18.790 -19.689 -8.526 415 HG22 VAL 75 HG22 VAL 75 -17.996 -19.534 -10.097 416 HG23 VAL 75 HG23 VAL 75 -19.673 -20.082 -10.003 417 H ALA 76 H ALA 76 -19.685 -15.772 -7.286 418 HA ALA 76 HA ALA 76 -20.611 -13.455 -8.651 419 HB1 ALA 76 HB1 ALA 76 -20.468 -14.101 -5.683 420 HB2 ALA 76 HB2 ALA 76 -21.853 -14.355 -6.745 421 HB3 ALA 76 HB3 ALA 76 -21.317 -12.717 -6.371 422 H LEU 77 H LEU 77 -18.015 -14.167 -6.380 423 HA LEU 77 HA LEU 77 -16.905 -11.596 -6.111 424 HB2 LEU 77 HB2 LEU 77 -16.394 -13.390 -4.548 425 HB3 LEU 77 HB3 LEU 77 -15.681 -14.363 -5.821 426 HG LEU 77 HG LEU 77 -13.775 -12.821 -5.994 427 HD11 LEU 77 HD11 LEU 77 -14.860 -10.699 -5.453 428 HD12 LEU 77 HD12 LEU 77 -13.458 -10.968 -4.422 429 HD13 LEU 77 HD13 LEU 77 -15.082 -11.217 -3.779 430 HD21 LEU 77 HD21 LEU 77 -12.732 -13.283 -3.839 431 HD22 LEU 77 HD22 LEU 77 -13.653 -14.680 -4.384 432 HD23 LEU 77 HD23 LEU 77 -14.303 -13.631 -3.119 433 H GLU 78 H GLU 78 -16.278 -14.224 -8.448 434 HA GLU 78 HA GLU 78 -14.056 -13.153 -9.803 435 HB2 GLU 78 HB2 GLU 78 -16.293 -14.878 -10.955 436 HB3 GLU 78 HB3 GLU 78 -14.714 -14.615 -11.700 437 HG2 GLU 78 HG2 GLU 78 -13.687 -15.656 -9.630 438 HG3 GLU 78 HG3 GLU 78 -15.315 -16.089 -9.126 439 H ALA 79 H ALA 79 -17.522 -12.818 -10.536 440 HA ALA 79 HA ALA 79 -17.320 -11.012 -12.707 441 HB1 ALA 79 HB1 ALA 79 -19.727 -10.619 -12.328 442 HB2 ALA 79 HB2 ALA 79 -19.613 -11.423 -10.758 443 HB3 ALA 79 HB3 ALA 79 -19.341 -12.340 -12.242 444 H ALA 80 H ALA 80 -17.443 -10.569 -9.226 445 HA ALA 80 HA ALA 80 -17.858 -7.730 -9.215 446 HB1 ALA 80 HB1 ALA 80 -16.941 -9.581 -6.997 447 HB2 ALA 80 HB2 ALA 80 -18.616 -9.189 -7.393 448 HB3 ALA 80 HB3 ALA 80 -17.537 -7.927 -6.798 449 H LEU 81 H LEU 81 -15.028 -9.738 -9.518 450 HA LEU 81 HA LEU 81 -13.106 -7.712 -8.763 451 HB2 LEU 81 HB2 LEU 81 -12.782 -10.261 -10.394 452 HB3 LEU 81 HB3 LEU 81 -11.448 -9.243 -9.865 453 HG LEU 81 HG LEU 81 -13.336 -10.788 -8.056 454 HD11 LEU 81 HD11 LEU 81 -11.400 -12.123 -7.440 455 HD12 LEU 81 HD12 LEU 81 -10.398 -11.229 -8.588 456 HD13 LEU 81 HD13 LEU 81 -11.727 -12.232 -9.169 457 HD21 LEU 81 HD21 LEU 81 -12.739 -8.684 -6.994 458 HD22 LEU 81 HD22 LEU 81 -11.023 -8.990 -7.287 459 HD23 LEU 81 HD23 LEU 81 -11.935 -10.030 -6.190 460 H GLN 82 H GLN 82 -14.626 -8.858 -11.707 461 HA GLN 82 HA GLN 82 -13.279 -7.066 -13.508 462 HB2 GLN 82 HB2 GLN 82 -14.231 -9.287 -14.163 463 HB3 GLN 82 HB3 GLN 82 -15.855 -8.677 -13.858 464 HG2 GLN 82 HG2 GLN 82 -15.631 -7.074 -15.692 465 HG3 GLN 82 HG3 GLN 82 -13.955 -7.561 -15.950 466 HE21 GLN 82 HE21 GLN 82 -17.307 -8.516 -16.315 467 HE22 GLN 82 HE22 GLN 82 -17.019 -9.832 -17.402 468 H PHE 83 H PHE 83 -15.944 -6.816 -11.327 469 HA PHE 83 HA PHE 83 -17.208 -4.535 -12.656 470 HB2 PHE 83 HB2 PHE 83 -18.548 -6.393 -11.608 471 HB3 PHE 83 HB3 PHE 83 -17.937 -5.901 -10.037 472 HD1 PHE 83 HD1 PHE 83 -18.910 -3.469 -12.667 473 HD2 PHE 83 HD2 PHE 83 -20.128 -5.479 -9.098 474 HE1 PHE 83 HE1 PHE 83 -20.822 -1.959 -12.467 475 HE2 PHE 83 HE2 PHE 83 -22.045 -3.958 -8.908 476 HZ PHE 83 HZ PHE 83 -22.404 -2.206 -10.588 477 H GLU 84 H GLU 84 -16.510 -2.538 -12.285 478 HA GLU 84 HA GLU 84 -14.371 -1.951 -10.518 479 HB2 GLU 84 HB2 GLU 84 -14.462 0.312 -11.435 480 HB3 GLU 84 HB3 GLU 84 -14.622 -0.885 -12.714 481 HG2 GLU 84 HG2 GLU 84 -17.019 -0.486 -12.862 482 HG3 GLU 84 HG3 GLU 84 -16.944 0.642 -11.509 483 H ASP 85 H ASP 85 -17.803 -1.683 -10.116 484 HA ASP 85 HA ASP 85 -17.768 0.330 -8.036 485 HB2 ASP 85 HB2 ASP 85 -19.970 -1.501 -9.059 486 HB3 ASP 85 HB3 ASP 85 -20.222 -0.271 -7.820 487 H THR 86 H THR 86 -17.208 -3.024 -8.105 488 HA THR 86 HA THR 86 -17.861 -3.361 -5.244 489 HB THR 86 HB THR 86 -17.646 -5.887 -5.874 490 HG1 THR 86 HG1 THR 86 -16.775 -5.318 -8.012 491 HG21 THR 86 HG21 THR 86 -19.966 -4.260 -6.964 492 HG22 THR 86 HG22 THR 86 -19.803 -4.863 -5.314 493 HG23 THR 86 HG23 THR 86 -19.984 -5.994 -6.649 494 H ARG 87 H ARG 87 -15.237 -3.517 -7.575 495 HA ARG 87 HA ARG 87 -13.372 -5.211 -6.421 496 HB2 ARG 87 HB2 ARG 87 -11.632 -3.991 -7.678 497 HB3 ARG 87 HB3 ARG 87 -13.091 -4.167 -8.656 498 HG2 ARG 87 HG2 ARG 87 -13.737 -1.849 -8.151 499 HG3 ARG 87 HG3 ARG 87 -12.316 -1.659 -7.124 500 HD2 ARG 87 HD2 ARG 87 -10.835 -1.841 -9.041 501 HD3 ARG 87 HD3 ARG 87 -12.193 -2.248 -10.102 502 HE ARG 87 HE ARG 87 -12.725 0.218 -8.854 503 HH11 ARG 87 HH11 ARG 87 -10.518 -1.014 -11.310 504 HH12 ARG 87 HH12 ARG 87 -10.449 0.502 -12.142 505 HH21 ARG 87 HH21 ARG 87 -12.612 2.159 -9.966 506 HH22 ARG 87 HH22 ARG 87 -11.614 2.285 -11.379 507 H GLU 88 H GLU 88 -14.209 -2.014 -5.397 508 HA GLU 88 HA GLU 88 -12.066 -1.161 -3.870 509 HB2 GLU 88 HB2 GLU 88 -13.861 0.179 -2.611 510 HB3 GLU 88 HB3 GLU 88 -13.822 0.375 -4.360 511 HG2 GLU 88 HG2 GLU 88 -15.753 -1.049 -4.648 512 HG3 GLU 88 HG3 GLU 88 -15.741 -1.501 -2.948 513 H SER 89 H SER 89 -14.860 -3.139 -2.776 514 HA SER 89 HA SER 89 -13.899 -3.384 -0.063 515 HB2 SER 89 HB2 SER 89 -16.119 -4.888 -1.504 516 HB3 SER 89 HB3 SER 89 -15.858 -4.868 0.237 517 HG SER 89 HG SER 89 -15.910 -2.342 -0.612 518 H MET 90 H MET 90 -13.400 -5.115 -3.005 519 HA MET 90 HA MET 90 -12.504 -7.606 -1.889 520 HB2 MET 90 HB2 MET 90 -12.209 -6.374 -4.650 521 HB3 MET 90 HB3 MET 90 -11.578 -7.969 -4.247 522 HG2 MET 90 HG2 MET 90 -13.808 -8.003 -5.373 523 HG3 MET 90 HG3 MET 90 -13.772 -8.818 -3.806 524 HE1 MET 90 HE1 MET 90 -16.453 -8.767 -3.561 525 HE2 MET 90 HE2 MET 90 -16.450 -8.108 -5.197 526 HE3 MET 90 HE3 MET 90 -17.389 -7.319 -3.933 527 H HIS 91 H HIS 91 -11.098 -4.519 -2.180 528 HA HIS 91 HA HIS 91 -8.339 -5.323 -2.009 529 HB2 HIS 91 HB2 HIS 91 -9.654 -2.675 -1.251 530 HB3 HIS 91 HB3 HIS 91 -7.922 -2.942 -1.426 531 HD1 HIS 91 HD1 HIS 91 -9.753 -0.932 -3.149 532 HD2 HIS 91 HD2 HIS 91 -8.299 -4.621 -4.353 533 HE1 HIS 91 HE1 HIS 91 -9.694 -0.842 -5.657 534 HE2 HIS 91 HE2 HIS 91 -8.837 -3.103 -6.364 535 H ALA 92 H ALA 92 -10.982 -4.966 0.214 536 HA ALA 92 HA ALA 92 -9.366 -5.258 2.619 537 HB1 ALA 92 HB1 ALA 92 -11.453 -3.940 2.679 538 HB2 ALA 92 HB2 ALA 92 -11.525 -5.307 3.794 539 HB3 ALA 92 HB3 ALA 92 -12.378 -5.380 2.248 540 H PHE 93 H PHE 93 -11.206 -7.312 0.381 541 HA PHE 93 HA PHE 93 -11.113 -9.664 2.106 542 HB2 PHE 93 HB2 PHE 93 -11.923 -9.492 -0.831 543 HB3 PHE 93 HB3 PHE 93 -12.202 -10.860 0.243 544 HD1 PHE 93 HD1 PHE 93 -13.154 -9.262 2.706 545 HD2 PHE 93 HD2 PHE 93 -14.179 -9.029 -1.445 546 HE1 PHE 93 HE1 PHE 93 -15.357 -8.332 3.291 547 HE2 PHE 93 HE2 PHE 93 -16.377 -8.101 -0.845 548 HZ PHE 93 HZ PHE 93 -16.964 -7.752 1.518 549 H CYS 94 H CYS 94 -9.100 -8.247 -0.372 550 HA CYS 94 HA CYS 94 -7.816 -10.664 -1.231 551 HB2 CYS 94 HB2 CYS 94 -6.237 -9.220 -2.432 552 HB3 CYS 94 HB3 CYS 94 -7.888 -8.682 -2.706 553 HG CYS 94 HG CYS 94 -6.722 -7.009 -0.158 554 H VAL 95 H VAL 95 -6.743 -11.802 0.180 555 HA VAL 95 HA VAL 95 -5.171 -10.865 2.351 556 HB VAL 95 HB VAL 95 -4.962 -13.537 0.884 557 HG11 VAL 95 HG11 VAL 95 -3.033 -13.134 2.365 558 HG12 VAL 95 HG12 VAL 95 -4.057 -14.413 3.020 559 HG13 VAL 95 HG13 VAL 95 -4.119 -12.793 3.717 560 HG21 VAL 95 HG21 VAL 95 -6.552 -14.417 2.562 561 HG22 VAL 95 HG22 VAL 95 -7.283 -13.137 1.593 562 HG23 VAL 95 HG23 VAL 95 -6.740 -12.799 3.241 563 H GLY 96 H GLY 96 -4.449 -11.949 -0.961 564 HA2 GLY 96 HA2 GLY 96 -2.372 -10.176 -1.497 565 HA3 GLY 96 HA3 GLY 96 -1.635 -11.644 -0.863 566 H GLN 97 H GLN 97 -0.623 -12.111 -2.780 567 HA GLN 97 HA GLN 97 -2.255 -12.907 -5.118 568 HB2 GLN 97 HB2 GLN 97 -0.767 -11.000 -5.569 569 HB3 GLN 97 HB3 GLN 97 0.614 -11.897 -4.951 570 HG2 GLN 97 HG2 GLN 97 0.487 -13.451 -6.838 571 HG3 GLN 97 HG3 GLN 97 -0.969 -12.637 -7.429 572 HE21 GLN 97 HE21 GLN 97 2.504 -12.350 -6.967 573 HE22 GLN 97 HE22 GLN 97 2.729 -11.039 -8.070 574 H TYR 98 H TYR 98 -1.994 -14.996 -5.848 575 HA TYR 98 HA TYR 98 -0.831 -16.946 -4.125 576 HB2 TYR 98 HB2 TYR 98 -2.864 -17.426 -5.437 577 HB3 TYR 98 HB3 TYR 98 -1.966 -17.248 -6.939 578 HD1 TYR 98 HD1 TYR 98 -2.144 -19.321 -3.818 579 HD2 TYR 98 HD2 TYR 98 -0.871 -19.176 -7.895 580 HE1 TYR 98 HE1 TYR 98 -1.620 -21.718 -3.745 581 HE2 TYR 98 HE2 TYR 98 -0.350 -21.573 -7.822 582 HH TYR 98 HH TYR 98 0.217 -23.279 -6.116 583 H LEU 99 H LEU 99 1.076 -17.937 -4.246 584 HA LEU 99 HA LEU 99 2.801 -17.798 -6.593 585 HB2 LEU 99 HB2 LEU 99 3.359 -15.829 -5.185 586 HB3 LEU 99 HB3 LEU 99 3.608 -16.868 -3.800 587 HG LEU 99 HG LEU 99 5.656 -15.902 -5.119 588 HD11 LEU 99 HD11 LEU 99 5.647 -18.806 -4.298 589 HD12 LEU 99 HD12 LEU 99 5.904 -17.411 -3.249 590 HD13 LEU 99 HD13 LEU 99 7.072 -17.783 -4.511 591 HD21 LEU 99 HD21 LEU 99 6.537 -17.287 -6.916 592 HD22 LEU 99 HD22 LEU 99 4.970 -16.618 -7.363 593 HD23 LEU 99 HD23 LEU 99 5.100 -18.311 -6.873 594 H GLU 100 H GLU 100 3.473 -19.814 -6.963 595 HA GLU 100 HA GLU 100 3.002 -22.001 -5.244 596 HB2 GLU 100 HB2 GLU 100 4.696 -21.699 -7.747 597 HB3 GLU 100 HB3 GLU 100 4.432 -23.245 -6.978 598 HG2 GLU 100 HG2 GLU 100 1.932 -22.828 -7.317 599 HG3 GLU 100 HG3 GLU 100 2.388 -21.440 -8.305 600 HA PRO 101 HA PRO 101 6.534 -21.676 -2.475 601 HB2 PRO 101 HB2 PRO 101 6.773 -24.392 -1.792 602 HB3 PRO 101 HB3 PRO 101 5.685 -23.232 -1.024 603 HG2 PRO 101 HG2 PRO 101 5.110 -25.237 -3.184 604 HG3 PRO 101 HG3 PRO 101 4.107 -24.759 -1.796 605 HD2 PRO 101 HD2 PRO 101 3.585 -23.843 -4.265 606 HD3 PRO 101 HD3 PRO 101 3.347 -22.817 -2.840 607 H ASP 102 H ASP 102 6.588 -23.958 -5.173 608 HA ASP 102 HA ASP 102 9.470 -24.254 -5.266 609 HB2 ASP 102 HB2 ASP 102 8.048 -26.042 -6.176 610 HB3 ASP 102 HB3 ASP 102 7.299 -24.917 -7.303 611 H GLN 103 H GLN 103 7.015 -22.305 -6.926 612 HA GLN 103 HA GLN 103 8.680 -21.198 -8.949 613 HB2 GLN 103 HB2 GLN 103 6.173 -21.428 -9.022 614 HB3 GLN 103 HB3 GLN 103 6.057 -20.127 -7.842 615 HG2 GLN 103 HG2 GLN 103 7.094 -18.583 -9.461 616 HG3 GLN 103 HG3 GLN 103 7.195 -19.887 -10.637 617 HE21 GLN 103 HE21 GLN 103 4.574 -21.008 -10.006 618 HE22 GLN 103 HE22 GLN 103 3.414 -19.901 -10.639 619 H GLU 104 H GLU 104 8.478 -20.511 -5.633 620 HA GLU 104 HA GLU 104 9.065 -17.803 -5.377 621 HB2 GLU 104 HB2 GLU 104 8.610 -19.637 -3.582 622 HB3 GLU 104 HB3 GLU 104 10.330 -19.979 -3.660 623 HG2 GLU 104 HG2 GLU 104 9.091 -17.321 -2.883 624 HG3 GLU 104 HG3 GLU 104 9.657 -18.535 -1.744 625 H GLY 105 H GLY 105 11.260 -20.566 -5.892 626 HA2 GLY 105 HA2 GLY 105 13.627 -18.818 -6.114 627 HA3 GLY 105 HA3 GLY 105 13.622 -20.562 -5.929 628 H VAL 106 H VAL 106 11.398 -20.234 -8.267 629 HA VAL 106 HA VAL 106 13.328 -20.017 -10.501 630 HB VAL 106 HB VAL 106 13.061 -22.430 -10.045 631 HG11 VAL 106 HG11 VAL 106 10.827 -22.446 -9.023 632 HG12 VAL 106 HG12 VAL 106 10.916 -23.604 -10.350 633 HG13 VAL 106 HG13 VAL 106 10.097 -22.059 -10.584 634 HG21 VAL 106 HG21 VAL 106 12.451 -23.192 -12.313 635 HG22 VAL 106 HG22 VAL 106 13.437 -21.730 -12.388 636 HG23 VAL 106 HG23 VAL 106 11.693 -21.631 -12.647 637 H THR 107 H THR 107 12.608 -18.960 -12.251 638 HA THR 107 HA THR 107 9.758 -18.158 -12.434 639 HB THR 107 HB THR 107 11.123 -16.216 -11.781 640 HG1 THR 107 HG1 THR 107 9.587 -15.437 -13.067 641 HG21 THR 107 HG21 THR 107 13.322 -16.932 -12.654 642 HG22 THR 107 HG22 THR 107 12.905 -15.316 -13.226 643 HG23 THR 107 HG23 THR 107 12.747 -16.700 -14.308 644 H ILE 108 H ILE 108 8.921 -17.904 -14.566 645 HA ILE 108 HA ILE 108 10.467 -19.160 -16.768 646 HB ILE 108 HB ILE 108 7.440 -19.235 -16.384 647 HG12 ILE 108 HG12 ILE 108 8.538 -20.733 -14.757 648 HG13 ILE 108 HG13 ILE 108 7.684 -21.671 -15.973 649 HG21 ILE 108 HG21 ILE 108 7.418 -20.791 -18.317 650 HG22 ILE 108 HG22 ILE 108 9.153 -20.548 -18.528 651 HG23 ILE 108 HG23 ILE 108 8.039 -19.198 -18.758 652 HD11 ILE 108 HD11 ILE 108 9.825 -22.137 -17.089 653 HD12 ILE 108 HD12 ILE 108 9.794 -22.688 -15.416 654 HD13 ILE 108 HD13 ILE 108 10.664 -21.215 -15.836 655 HA PRO 109 HA PRO 109 9.518 -14.934 -18.323 656 HB2 PRO 109 HB2 PRO 109 11.722 -14.607 -19.868 657 HB3 PRO 109 HB3 PRO 109 11.798 -14.475 -18.104 658 HG2 PRO 109 HG2 PRO 109 12.599 -16.780 -19.869 659 HG3 PRO 109 HG3 PRO 109 13.424 -16.122 -18.439 660 HD2 PRO 109 HD2 PRO 109 11.770 -18.365 -18.406 661 HD3 PRO 109 HD3 PRO 109 12.132 -17.372 -16.980 662 H ASP 110 H ASP 110 7.731 -16.345 -19.261 663 HA ASP 110 HA ASP 110 8.063 -17.442 -21.897 664 HB2 ASP 110 HB2 ASP 110 5.659 -17.898 -21.829 665 HB3 ASP 110 HB3 ASP 110 6.402 -18.368 -20.308 666 H LEU 111 H LEU 111 7.158 -16.676 -23.831 667 HA LEU 111 HA LEU 111 7.239 -13.754 -24.095 668 HB2 LEU 111 HB2 LEU 111 7.259 -15.961 -26.206 669 HB3 LEU 111 HB3 LEU 111 7.364 -14.252 -26.566 670 HG LEU 111 HG LEU 111 9.569 -15.121 -26.778 671 HD11 LEU 111 HD11 LEU 111 10.863 -13.895 -25.125 672 HD12 LEU 111 HD12 LEU 111 9.439 -13.745 -24.094 673 HD13 LEU 111 HD13 LEU 111 9.472 -12.959 -25.674 674 HD21 LEU 111 HD21 LEU 111 9.316 -16.397 -24.043 675 HD22 LEU 111 HD22 LEU 111 10.755 -16.408 -25.069 676 HD23 LEU 111 HD23 LEU 111 9.292 -17.237 -25.595 677 H GLY 112 H GLY 112 5.066 -16.494 -24.674 678 HA2 GLY 112 HA2 GLY 112 2.686 -14.925 -24.501 679 HA3 GLY 112 HA3 GLY 112 3.047 -15.322 -26.181 Start of MODEL 16 1 H GLU 21 H GLU 21 0.567 0.002 -0.531 2 HA GLU 21 HA GLU 21 1.838 -0.478 -2.520 3 HB2 GLU 21 HB2 GLU 21 2.759 1.113 -0.897 4 HB3 GLU 21 HB3 GLU 21 3.488 -0.193 0.024 5 HG2 GLU 21 HG2 GLU 21 5.163 1.010 -1.290 6 HG3 GLU 21 HG3 GLU 21 5.045 -0.670 -1.803 7 H LYS 22 H LYS 22 3.068 -2.490 0.210 8 HA LYS 22 HA LYS 22 4.543 -4.247 -1.503 9 HB2 LYS 22 HB2 LYS 22 4.979 -5.582 0.540 10 HB3 LYS 22 HB3 LYS 22 5.320 -3.881 0.766 11 HG2 LYS 22 HG2 LYS 22 4.315 -4.453 2.786 12 HG3 LYS 22 HG3 LYS 22 2.977 -3.755 1.883 13 HD2 LYS 22 HD2 LYS 22 2.276 -5.776 3.113 14 HD3 LYS 22 HD3 LYS 22 2.111 -6.006 1.373 15 HE2 LYS 22 HE2 LYS 22 3.037 -8.010 2.423 16 HE3 LYS 22 HE3 LYS 22 4.222 -7.281 1.339 17 HZ1 LYS 22 HZ1 LYS 22 5.343 -6.324 3.232 18 HZ2 LYS 22 HZ2 LYS 22 5.200 -7.992 3.442 19 HZ3 LYS 22 HZ3 LYS 22 4.183 -6.943 4.295 20 H VAL 23 H VAL 23 4.138 -6.429 -2.008 21 HA VAL 23 HA VAL 23 1.288 -7.170 -2.041 22 HB VAL 23 HB VAL 23 2.410 -7.127 -4.227 23 HG11 VAL 23 HG11 VAL 23 4.238 -9.335 -3.226 24 HG12 VAL 23 HG12 VAL 23 4.717 -7.678 -3.587 25 HG13 VAL 23 HG13 VAL 23 4.156 -8.734 -4.886 26 HG21 VAL 23 HG21 VAL 23 0.534 -8.665 -3.873 27 HG22 VAL 23 HG22 VAL 23 1.643 -9.941 -3.373 28 HG23 VAL 23 HG23 VAL 23 1.675 -9.346 -5.035 29 H THR 24 H THR 24 0.633 -8.428 -0.425 30 HA THR 24 HA THR 24 2.354 -10.010 1.238 31 HB THR 24 HB THR 24 -0.697 -10.013 1.023 32 HG1 THR 24 HG1 THR 24 -0.639 -8.251 2.197 33 HG21 THR 24 HG21 THR 24 -0.674 -10.915 3.329 34 HG22 THR 24 HG22 THR 24 1.087 -11.001 3.295 35 HG23 THR 24 HG23 THR 24 0.135 -12.027 2.217 36 H LEU 25 H LEU 25 3.291 -11.787 0.358 37 HA LEU 25 HA LEU 25 1.958 -13.356 -1.706 38 HB2 LEU 25 HB2 LEU 25 4.732 -13.607 -0.473 39 HB3 LEU 25 HB3 LEU 25 4.119 -14.640 -1.760 40 HG LEU 25 HG LEU 25 4.597 -11.634 -1.954 41 HD11 LEU 25 HD11 LEU 25 6.072 -13.942 -3.265 42 HD12 LEU 25 HD12 LEU 25 6.675 -12.919 -1.959 43 HD13 LEU 25 HD13 LEU 25 6.374 -12.223 -3.548 44 HD21 LEU 25 HD21 LEU 25 2.650 -12.231 -3.326 45 HD22 LEU 25 HD22 LEU 25 3.561 -13.526 -4.108 46 HD23 LEU 25 HD23 LEU 25 4.027 -11.841 -4.355 47 H VAL 26 H VAL 26 0.518 -14.740 -1.048 48 HA VAL 26 HA VAL 26 0.683 -16.195 1.474 49 HB VAL 26 HB VAL 26 -1.466 -16.253 -0.711 50 HG11 VAL 26 HG11 VAL 26 -2.931 -17.307 0.988 51 HG12 VAL 26 HG12 VAL 26 -1.583 -17.355 2.128 52 HG13 VAL 26 HG13 VAL 26 -1.515 -18.304 0.640 53 HG21 VAL 26 HG21 VAL 26 -1.466 -14.673 1.896 54 HG22 VAL 26 HG22 VAL 26 -2.818 -14.787 0.764 55 HG23 VAL 26 HG23 VAL 26 -1.316 -14.004 0.270 56 H ARG 27 H ARG 27 1.876 -17.941 1.446 57 HA ARG 27 HA ARG 27 2.727 -19.372 -0.875 58 HB2 ARG 27 HB2 ARG 27 3.901 -20.816 0.725 59 HB3 ARG 27 HB3 ARG 27 4.086 -19.134 1.216 60 HG2 ARG 27 HG2 ARG 27 2.082 -19.593 2.796 61 HG3 ARG 27 HG3 ARG 27 2.396 -21.301 2.489 62 HD2 ARG 27 HD2 ARG 27 3.497 -20.699 4.544 63 HD3 ARG 27 HD3 ARG 27 4.758 -20.913 3.324 64 HE ARG 27 HE ARG 27 4.866 -18.477 3.119 65 HH11 ARG 27 HH11 ARG 27 3.335 -19.692 6.041 66 HH12 ARG 27 HH12 ARG 27 3.624 -18.237 6.934 67 HH21 ARG 27 HH21 ARG 27 5.216 -16.584 4.297 68 HH22 ARG 27 HH22 ARG 27 4.707 -16.479 5.953 69 H ILE 28 H ILE 28 2.278 -21.688 -1.287 70 HA ILE 28 HA ILE 28 -0.430 -22.303 -1.498 71 HB ILE 28 HB ILE 28 1.148 -23.394 -2.973 72 HG12 ILE 28 HG12 ILE 28 -0.308 -25.458 -1.238 73 HG13 ILE 28 HG13 ILE 28 -0.998 -24.578 -2.597 74 HG21 ILE 28 HG21 ILE 28 2.709 -25.161 -2.261 75 HG22 ILE 28 HG22 ILE 28 2.232 -24.919 -0.580 76 HG23 ILE 28 HG23 ILE 28 3.065 -23.633 -1.452 77 HD11 ILE 28 HD11 ILE 28 0.565 -25.734 -4.103 78 HD12 ILE 28 HD12 ILE 28 -0.485 -26.841 -3.221 79 HD13 ILE 28 HD13 ILE 28 1.196 -26.642 -2.725 80 H ALA 29 H ALA 29 1.905 -23.369 0.958 81 HA ALA 29 HA ALA 29 0.273 -25.233 2.316 82 HB1 ALA 29 HB1 ALA 29 2.628 -23.643 3.405 83 HB2 ALA 29 HB2 ALA 29 2.725 -25.184 2.556 84 HB3 ALA 29 HB3 ALA 29 1.936 -25.102 4.131 85 H ASP 30 H ASP 30 0.573 -21.726 2.615 86 HA ASP 30 HA ASP 30 -0.847 -21.509 5.119 87 HB2 ASP 30 HB2 ASP 30 0.806 -19.775 4.320 88 HB3 ASP 30 HB3 ASP 30 -0.327 -19.326 3.053 89 H LEU 31 H LEU 31 -1.623 -21.126 1.687 90 HA LEU 31 HA LEU 31 -4.306 -20.308 1.913 91 HB2 LEU 31 HB2 LEU 31 -3.039 -20.171 -0.200 92 HB3 LEU 31 HB3 LEU 31 -2.942 -21.923 -0.282 93 HG LEU 31 HG LEU 31 -5.414 -22.052 -0.590 94 HD11 LEU 31 HD11 LEU 31 -6.104 -20.034 0.602 95 HD12 LEU 31 HD12 LEU 31 -6.740 -20.043 -1.039 96 HD13 LEU 31 HD13 LEU 31 -5.358 -19.021 -0.639 97 HD21 LEU 31 HD21 LEU 31 -5.507 -21.183 -2.882 98 HD22 LEU 31 HD22 LEU 31 -3.979 -22.001 -2.571 99 HD23 LEU 31 HD23 LEU 31 -4.045 -20.235 -2.598 100 H GLU 32 H GLU 32 -2.943 -23.581 1.471 101 HA GLU 32 HA GLU 32 -5.302 -25.069 1.433 102 HB2 GLU 32 HB2 GLU 32 -2.537 -25.941 2.378 103 HB3 GLU 32 HB3 GLU 32 -3.864 -27.036 1.991 104 HG2 GLU 32 HG2 GLU 32 -2.404 -25.206 0.067 105 HG3 GLU 32 HG3 GLU 32 -2.246 -26.954 0.179 106 H ASN 33 H ASN 33 -3.098 -24.410 4.189 107 HA ASN 33 HA ASN 33 -4.585 -25.950 6.074 108 HB2 ASN 33 HB2 ASN 33 -2.238 -24.063 6.308 109 HB3 ASN 33 HB3 ASN 33 -3.088 -24.536 7.772 110 HD21 ASN 33 HD21 ASN 33 -1.074 -25.698 5.133 111 HD22 ASN 33 HD22 ASN 33 -0.650 -27.196 5.876 112 H HIS 34 H HIS 34 -4.563 -22.435 5.367 113 HA HIS 34 HA HIS 34 -6.236 -21.736 7.599 114 HB2 HIS 34 HB2 HIS 34 -4.707 -20.091 6.455 115 HB3 HIS 34 HB3 HIS 34 -5.774 -20.101 5.055 116 HD1 HIS 34 HD1 HIS 34 -8.274 -19.139 5.532 117 HD2 HIS 34 HD2 HIS 34 -5.432 -18.348 8.459 118 HE1 HIS 34 HE1 HIS 34 -9.260 -17.319 6.956 119 HE2 HIS 34 HE2 HIS 34 -7.594 -16.978 8.807 120 H ASN 35 H ASN 35 -6.803 -22.370 4.169 121 HA ASN 35 HA ASN 35 -9.538 -21.657 4.029 122 HB2 ASN 35 HB2 ASN 35 -8.110 -21.851 2.033 123 HB3 ASN 35 HB3 ASN 35 -7.915 -23.575 2.308 124 HD21 ASN 35 HD21 ASN 35 -8.704 -23.946 0.188 125 HD22 ASN 35 HD22 ASN 35 -10.387 -23.844 -0.183 126 H ASN 36 H ASN 36 -7.964 -24.844 4.398 127 HA ASN 36 HA ASN 36 -10.436 -26.292 4.720 128 HB2 ASN 36 HB2 ASN 36 -7.532 -27.170 5.000 129 HB3 ASN 36 HB3 ASN 36 -8.908 -28.260 5.085 130 HD21 ASN 36 HD21 ASN 36 -8.454 -29.475 3.282 131 HD22 ASN 36 HD22 ASN 36 -8.417 -28.851 1.671 132 H ASP 37 H ASP 37 -8.967 -24.276 6.819 133 HA ASP 37 HA ASP 37 -9.410 -25.801 9.279 134 HB2 ASP 37 HB2 ASP 37 -7.455 -24.306 9.095 135 HB3 ASP 37 HB3 ASP 37 -8.503 -22.926 8.786 136 H GLY 38 H GLY 38 -11.302 -24.069 7.119 137 HA2 GLY 38 HA2 GLY 38 -13.690 -23.839 7.521 138 HA3 GLY 38 HA3 GLY 38 -13.334 -23.341 9.171 139 H GLY 39 H GLY 39 -11.037 -21.697 8.265 140 HA2 GLY 39 HA2 GLY 39 -12.328 -19.231 7.518 141 HA3 GLY 39 HA3 GLY 39 -10.601 -19.502 7.701 142 H PHE 40 H PHE 40 -13.347 -19.874 5.492 143 HA PHE 40 HA PHE 40 -11.853 -21.354 3.561 144 HB2 PHE 40 HB2 PHE 40 -14.410 -21.506 3.976 145 HB3 PHE 40 HB3 PHE 40 -14.559 -20.031 3.027 146 HD1 PHE 40 HD1 PHE 40 -13.770 -20.084 0.566 147 HD2 PHE 40 HD2 PHE 40 -14.148 -23.634 2.906 148 HE1 PHE 40 HE1 PHE 40 -13.736 -21.444 -1.484 149 HE2 PHE 40 HE2 PHE 40 -14.119 -24.987 0.851 150 HZ PHE 40 HZ PHE 40 -13.905 -23.896 -1.340 151 H TRP 41 H TRP 41 -10.464 -20.524 2.243 152 HA TRP 41 HA TRP 41 -10.701 -17.792 1.150 153 HB2 TRP 41 HB2 TRP 41 -8.306 -19.578 1.715 154 HB3 TRP 41 HB3 TRP 41 -8.187 -18.264 0.554 155 HD1 TRP 41 HD1 TRP 41 -10.272 -16.782 3.111 156 HE1 TRP 41 HE1 TRP 41 -8.866 -15.417 4.774 157 HE3 TRP 41 HE3 TRP 41 -5.654 -18.685 2.023 158 HZ2 TRP 41 HZ2 TRP 41 -6.161 -15.189 5.541 159 HZ3 TRP 41 HZ3 TRP 41 -3.705 -17.854 3.272 160 HH2 TRP 41 HH2 TRP 41 -3.957 -16.141 4.993 161 H THR 42 H THR 42 -9.673 -17.642 -1.054 162 HA THR 42 HA THR 42 -9.833 -20.006 -2.766 163 HB THR 42 HB THR 42 -12.133 -19.053 -2.866 164 HG1 THR 42 HG1 THR 42 -11.252 -19.998 -4.760 165 HG21 THR 42 HG21 THR 42 -12.547 -16.833 -3.857 166 HG22 THR 42 HG22 THR 42 -10.813 -16.515 -3.910 167 HG23 THR 42 HG23 THR 42 -11.634 -16.690 -2.355 168 H VAL 43 H VAL 43 -8.539 -19.787 -4.620 169 HA VAL 43 HA VAL 43 -6.974 -17.277 -4.899 170 HB VAL 43 HB VAL 43 -5.436 -19.047 -4.450 171 HG11 VAL 43 HG11 VAL 43 -6.765 -20.749 -6.596 172 HG12 VAL 43 HG12 VAL 43 -6.841 -21.019 -4.853 173 HG13 VAL 43 HG13 VAL 43 -5.303 -21.182 -5.703 174 HG21 VAL 43 HG21 VAL 43 -5.438 -18.596 -7.460 175 HG22 VAL 43 HG22 VAL 43 -4.054 -19.111 -6.493 176 HG23 VAL 43 HG23 VAL 43 -4.750 -17.509 -6.251 177 H ILE 44 H ILE 44 -7.916 -16.054 -6.388 178 HA ILE 44 HA ILE 44 -8.846 -17.223 -8.950 179 HB ILE 44 HB ILE 44 -10.053 -14.808 -7.507 180 HG12 ILE 44 HG12 ILE 44 -11.217 -17.607 -7.930 181 HG13 ILE 44 HG13 ILE 44 -10.663 -16.947 -6.396 182 HG21 ILE 44 HG21 ILE 44 -10.155 -14.550 -9.961 183 HG22 ILE 44 HG22 ILE 44 -11.764 -14.816 -9.298 184 HG23 ILE 44 HG23 ILE 44 -10.925 -16.136 -10.113 185 HD11 ILE 44 HD11 ILE 44 -13.055 -16.931 -6.508 186 HD12 ILE 44 HD12 ILE 44 -13.024 -16.001 -8.002 187 HD13 ILE 44 HD13 ILE 44 -12.459 -15.272 -6.499 188 H ASP 45 H ASP 45 -7.658 -16.536 -10.587 189 HA ASP 45 HA ASP 45 -6.437 -15.312 -12.040 190 HB2 ASP 45 HB2 ASP 45 -8.389 -13.753 -11.798 191 HB3 ASP 45 HB3 ASP 45 -7.559 -12.926 -10.490 192 H GLY 46 H GLY 46 -5.203 -16.326 -9.664 193 HA2 GLY 46 HA2 GLY 46 -3.030 -16.442 -8.902 194 HA3 GLY 46 HA3 GLY 46 -2.652 -14.973 -9.785 195 H LYS 47 H LYS 47 -5.334 -14.326 -7.918 196 HA LYS 47 HA LYS 47 -3.758 -13.208 -5.667 197 HB2 LYS 47 HB2 LYS 47 -6.494 -12.361 -6.734 198 HB3 LYS 47 HB3 LYS 47 -5.647 -11.611 -5.386 199 HG2 LYS 47 HG2 LYS 47 -4.688 -11.633 -8.262 200 HG3 LYS 47 HG3 LYS 47 -5.540 -10.295 -7.483 201 HD2 LYS 47 HD2 LYS 47 -3.648 -10.178 -5.812 202 HD3 LYS 47 HD3 LYS 47 -2.783 -11.381 -6.779 203 HE2 LYS 47 HE2 LYS 47 -3.611 -8.584 -7.642 204 HE3 LYS 47 HE3 LYS 47 -1.971 -9.167 -7.353 205 HZ1 LYS 47 HZ1 LYS 47 -3.798 -10.005 -9.539 206 HZ2 LYS 47 HZ2 LYS 47 -2.315 -10.735 -9.211 207 HZ3 LYS 47 HZ3 LYS 47 -2.363 -9.118 -9.693 208 H VAL 48 H VAL 48 -4.520 -13.574 -3.550 209 HA VAL 48 HA VAL 48 -6.563 -15.675 -3.218 210 HB VAL 48 HB VAL 48 -4.556 -14.688 -1.141 211 HG11 VAL 48 HG11 VAL 48 -5.206 -16.704 0.154 212 HG12 VAL 48 HG12 VAL 48 -6.425 -17.098 -1.063 213 HG13 VAL 48 HG13 VAL 48 -6.584 -15.628 -0.099 214 HG21 VAL 48 HG21 VAL 48 -4.461 -17.209 -2.836 215 HG22 VAL 48 HG22 VAL 48 -3.343 -16.806 -1.528 216 HG23 VAL 48 HG23 VAL 48 -3.394 -15.811 -2.984 217 H TYR 49 H TYR 49 -8.471 -15.173 -2.454 218 HA TYR 49 HA TYR 49 -8.963 -12.709 -0.871 219 HB2 TYR 49 HB2 TYR 49 -10.872 -14.109 -2.818 220 HB3 TYR 49 HB3 TYR 49 -11.258 -12.694 -1.847 221 HD1 TYR 49 HD1 TYR 49 -9.184 -13.908 -4.697 222 HD2 TYR 49 HD2 TYR 49 -10.693 -10.485 -2.628 223 HE1 TYR 49 HE1 TYR 49 -8.391 -12.456 -6.514 224 HE2 TYR 49 HE2 TYR 49 -9.907 -9.042 -4.452 225 HH TYR 49 HH TYR 49 -8.209 -9.077 -6.203 226 H ASP 50 H ASP 50 -10.916 -12.982 0.600 227 HA ASP 50 HA ASP 50 -11.188 -15.745 1.611 228 HB2 ASP 50 HB2 ASP 50 -12.375 -14.788 3.530 229 HB3 ASP 50 HB3 ASP 50 -10.847 -13.955 3.304 230 H ILE 51 H ILE 51 -13.220 -16.656 1.888 231 HA ILE 51 HA ILE 51 -15.499 -15.640 0.313 232 HB ILE 51 HB ILE 51 -14.563 -18.515 0.718 233 HG12 ILE 51 HG12 ILE 51 -13.465 -17.332 -1.142 234 HG13 ILE 51 HG13 ILE 51 -14.520 -18.592 -1.776 235 HG21 ILE 51 HG21 ILE 51 -17.234 -17.673 -0.469 236 HG22 ILE 51 HG22 ILE 51 -16.984 -18.567 1.030 237 HG23 ILE 51 HG23 ILE 51 -16.566 -19.311 -0.511 238 HD11 ILE 51 HD11 ILE 51 -16.224 -16.873 -2.276 239 HD12 ILE 51 HD12 ILE 51 -14.694 -16.595 -3.105 240 HD13 ILE 51 HD13 ILE 51 -15.110 -15.630 -1.690 241 H LYS 52 H LYS 52 -14.298 -17.043 3.299 242 HA LYS 52 HA LYS 52 -16.624 -17.754 4.657 243 HB2 LYS 52 HB2 LYS 52 -14.360 -18.247 5.525 244 HB3 LYS 52 HB3 LYS 52 -14.053 -16.527 5.763 245 HG2 LYS 52 HG2 LYS 52 -15.997 -16.521 7.422 246 HG3 LYS 52 HG3 LYS 52 -16.019 -18.277 7.281 247 HD2 LYS 52 HD2 LYS 52 -14.783 -17.611 9.282 248 HD3 LYS 52 HD3 LYS 52 -13.689 -18.369 8.128 249 HE2 LYS 52 HE2 LYS 52 -12.836 -16.170 7.449 250 HE3 LYS 52 HE3 LYS 52 -14.005 -15.367 8.498 251 HZ1 LYS 52 HZ1 LYS 52 -12.934 -16.421 10.402 252 HZ2 LYS 52 HZ2 LYS 52 -11.860 -15.445 9.537 253 HZ3 LYS 52 HZ3 LYS 52 -11.786 -17.124 9.379 254 H ASP 53 H ASP 53 -14.888 -14.618 4.844 255 HA ASP 53 HA ASP 53 -16.941 -13.318 6.386 256 HB2 ASP 53 HB2 ASP 53 -14.512 -12.717 6.628 257 HB3 ASP 53 HB3 ASP 53 -14.508 -12.119 4.976 258 H PHE 54 H PHE 54 -15.940 -13.386 2.997 259 HA PHE 54 HA PHE 54 -17.385 -11.356 1.810 260 HB2 PHE 54 HB2 PHE 54 -15.715 -12.831 0.677 261 HB3 PHE 54 HB3 PHE 54 -16.863 -14.159 0.710 262 HD1 PHE 54 HD1 PHE 54 -18.961 -14.024 -0.724 263 HD2 PHE 54 HD2 PHE 54 -15.794 -11.172 -1.054 264 HE1 PHE 54 HE1 PHE 54 -19.820 -13.314 -2.915 265 HE2 PHE 54 HE2 PHE 54 -16.667 -10.473 -3.241 266 HZ PHE 54 HZ PHE 54 -18.675 -11.541 -4.172 267 H GLN 55 H GLN 55 -18.479 -14.709 2.259 268 HA GLN 55 HA GLN 55 -21.077 -14.328 1.164 269 HB2 GLN 55 HB2 GLN 55 -21.526 -16.618 1.782 270 HB3 GLN 55 HB3 GLN 55 -19.878 -16.512 1.172 271 HG2 GLN 55 HG2 GLN 55 -19.072 -16.468 3.558 272 HG3 GLN 55 HG3 GLN 55 -20.732 -16.764 4.072 273 HE21 GLN 55 HE21 GLN 55 -17.903 -18.144 2.595 274 HE22 GLN 55 HE22 GLN 55 -18.426 -19.787 2.639 275 H THR 56 H THR 56 -19.750 -14.042 4.397 276 HA THR 56 HA THR 56 -22.197 -13.889 5.849 277 HB THR 56 HB THR 56 -19.516 -12.571 6.490 278 HG1 THR 56 HG1 THR 56 -19.909 -15.070 6.273 279 HG21 THR 56 HG21 THR 56 -20.285 -12.611 8.854 280 HG22 THR 56 HG22 THR 56 -21.859 -13.217 8.331 281 HG23 THR 56 HG23 THR 56 -21.332 -11.603 7.850 282 H GLN 57 H GLN 57 -20.130 -11.433 4.271 283 HA GLN 57 HA GLN 57 -21.733 -9.177 5.044 284 HB2 GLN 57 HB2 GLN 57 -19.421 -9.379 3.072 285 HB3 GLN 57 HB3 GLN 57 -20.136 -7.877 3.643 286 HG2 GLN 57 HG2 GLN 57 -18.574 -9.897 5.283 287 HG3 GLN 57 HG3 GLN 57 -18.071 -8.271 4.819 288 HE21 GLN 57 HE21 GLN 57 -20.040 -10.152 6.990 289 HE22 GLN 57 HE22 GLN 57 -20.438 -8.867 8.074 290 H SER 58 H SER 58 -22.002 -11.442 2.495 291 HA SER 58 HA SER 58 -22.957 -9.732 0.439 292 HB2 SER 58 HB2 SER 58 -23.695 -11.778 -0.728 293 HB3 SER 58 HB3 SER 58 -22.058 -11.950 -0.096 294 HG SER 58 HG SER 58 -23.604 -12.832 1.806 295 H LEU 59 H LEU 59 -24.497 -10.904 3.276 296 HA LEU 59 HA LEU 59 -27.205 -10.459 2.223 297 HB2 LEU 59 HB2 LEU 59 -26.230 -11.453 4.926 298 HB3 LEU 59 HB3 LEU 59 -27.919 -11.175 4.553 299 HG LEU 59 HG LEU 59 -27.603 -13.513 4.357 300 HD11 LEU 59 HD11 LEU 59 -28.957 -12.573 2.551 301 HD12 LEU 59 HD12 LEU 59 -28.123 -14.036 2.041 302 HD13 LEU 59 HD13 LEU 59 -27.531 -12.457 1.516 303 HD21 LEU 59 HD21 LEU 59 -25.172 -13.599 4.295 304 HD22 LEU 59 HD22 LEU 59 -25.166 -13.057 2.616 305 HD23 LEU 59 HD23 LEU 59 -25.870 -14.620 3.039 306 H THR 60 H THR 60 -24.830 -8.461 3.382 307 HA THR 60 HA THR 60 -26.411 -6.697 5.034 308 HB THR 60 HB THR 60 -23.844 -5.995 3.537 309 HG1 THR 60 HG1 THR 60 -23.899 -7.891 5.118 310 HG21 THR 60 HG21 THR 60 -23.533 -4.309 5.325 311 HG22 THR 60 HG22 THR 60 -25.056 -4.796 6.072 312 HG23 THR 60 HG23 THR 60 -25.062 -4.034 4.482 313 H GLU 61 H GLU 61 -27.745 -5.123 4.354 314 HA GLU 61 HA GLU 61 -28.935 -5.275 1.830 315 HB2 GLU 61 HB2 GLU 61 -30.025 -4.479 3.964 316 HB3 GLU 61 HB3 GLU 61 -29.134 -2.972 3.820 317 HG2 GLU 61 HG2 GLU 61 -31.346 -2.552 3.045 318 HG3 GLU 61 HG3 GLU 61 -30.306 -2.563 1.623 319 H ASN 62 H ASN 62 -26.741 -2.781 3.141 320 HA ASN 62 HA ASN 62 -26.882 -1.153 0.745 321 HB2 ASN 62 HB2 ASN 62 -26.813 -0.140 3.006 322 HB3 ASN 62 HB3 ASN 62 -25.213 -0.820 3.270 323 HD21 ASN 62 HD21 ASN 62 -27.046 1.513 1.353 324 HD22 ASN 62 HD22 ASN 62 -25.703 2.524 0.954 325 H SER 63 H SER 63 -24.954 -3.812 1.668 326 HA SER 63 HA SER 63 -22.433 -3.080 0.529 327 HB2 SER 63 HB2 SER 63 -23.632 -5.820 1.138 328 HB3 SER 63 HB3 SER 63 -21.984 -5.584 0.545 329 HG SER 63 HG SER 63 -21.568 -5.424 2.604 330 H ILE 64 H ILE 64 -21.506 -3.693 -1.420 331 HA ILE 64 HA ILE 64 -22.991 -3.635 -3.814 332 HB ILE 64 HB ILE 64 -20.878 -4.332 -4.947 333 HG12 ILE 64 HG12 ILE 64 -19.649 -4.592 -2.157 334 HG13 ILE 64 HG13 ILE 64 -20.165 -5.970 -3.116 335 HG21 ILE 64 HG21 ILE 64 -21.180 -1.962 -4.386 336 HG22 ILE 64 HG22 ILE 64 -19.479 -2.410 -4.277 337 HG23 ILE 64 HG23 ILE 64 -20.434 -2.215 -2.804 338 HD11 ILE 64 HD11 ILE 64 -18.024 -4.008 -3.886 339 HD12 ILE 64 HD12 ILE 64 -18.529 -5.424 -4.813 340 HD13 ILE 64 HD13 ILE 64 -17.781 -5.625 -3.230 341 H LEU 65 H LEU 65 -22.224 -6.235 -1.694 342 HA LEU 65 HA LEU 65 -22.469 -8.389 -3.624 343 HB2 LEU 65 HB2 LEU 65 -22.188 -8.492 -0.606 344 HB3 LEU 65 HB3 LEU 65 -21.987 -9.843 -1.713 345 HG LEU 65 HG LEU 65 -20.155 -7.441 -1.406 346 HD11 LEU 65 HD11 LEU 65 -19.710 -10.380 -0.750 347 HD12 LEU 65 HD12 LEU 65 -19.956 -9.071 0.410 348 HD13 LEU 65 HD13 LEU 65 -18.511 -9.089 -0.598 349 HD21 LEU 65 HD21 LEU 65 -18.684 -8.517 -3.075 350 HD22 LEU 65 HD22 LEU 65 -20.233 -8.047 -3.768 351 HD23 LEU 65 HD23 LEU 65 -19.919 -9.741 -3.380 352 H ALA 66 H ALA 66 -24.746 -6.499 -2.100 353 HA ALA 66 HA ALA 66 -26.616 -8.441 -1.123 354 HB1 ALA 66 HB1 ALA 66 -28.225 -6.587 -1.046 355 HB2 ALA 66 HB2 ALA 66 -27.135 -5.576 -1.999 356 HB3 ALA 66 HB3 ALA 66 -26.669 -6.091 -0.378 357 H GLN 67 H GLN 67 -26.104 -6.888 -4.252 358 HA GLN 67 HA GLN 67 -28.332 -8.108 -5.615 359 HB2 GLN 67 HB2 GLN 67 -27.233 -7.292 -7.682 360 HB3 GLN 67 HB3 GLN 67 -27.306 -6.031 -6.452 361 HG2 GLN 67 HG2 GLN 67 -24.916 -6.589 -5.859 362 HG3 GLN 67 HG3 GLN 67 -24.880 -7.667 -7.252 363 HE21 GLN 67 HE21 GLN 67 -25.066 -4.344 -6.197 364 HE22 GLN 67 HE22 GLN 67 -24.641 -3.627 -7.710 365 H PHE 68 H PHE 68 -25.110 -9.081 -4.785 366 HA PHE 68 HA PHE 68 -25.088 -11.445 -6.531 367 HB2 PHE 68 HB2 PHE 68 -22.976 -10.311 -4.638 368 HB3 PHE 68 HB3 PHE 68 -22.752 -11.706 -5.678 369 HD1 PHE 68 HD1 PHE 68 -23.618 -11.026 -8.290 370 HD2 PHE 68 HD2 PHE 68 -21.748 -8.466 -5.414 371 HE1 PHE 68 HE1 PHE 68 -22.770 -9.591 -10.105 372 HE2 PHE 68 HE2 PHE 68 -20.909 -7.035 -7.241 373 HZ PHE 68 HZ PHE 68 -21.421 -7.597 -9.586 374 H ALA 69 H ALA 69 -26.476 -10.756 -3.649 375 HA ALA 69 HA ALA 69 -25.622 -12.800 -1.871 376 HB1 ALA 69 HB1 ALA 69 -28.298 -11.373 -1.976 377 HB2 ALA 69 HB2 ALA 69 -26.859 -10.790 -1.141 378 HB3 ALA 69 HB3 ALA 69 -27.653 -12.270 -0.594 379 H GLY 70 H GLY 70 -27.939 -12.726 -4.514 380 HA2 GLY 70 HA2 GLY 70 -28.986 -15.410 -3.962 381 HA3 GLY 70 HA3 GLY 70 -29.470 -14.334 -5.262 382 H GLU 71 H GLU 71 -26.089 -14.882 -4.729 383 HA GLU 71 HA GLU 71 -25.878 -16.857 -6.909 384 HB2 GLU 71 HB2 GLU 71 -25.534 -14.547 -7.848 385 HB3 GLU 71 HB3 GLU 71 -24.251 -14.261 -6.684 386 HG2 GLU 71 HG2 GLU 71 -23.397 -14.775 -8.950 387 HG3 GLU 71 HG3 GLU 71 -22.840 -15.933 -7.737 388 H ASP 72 H ASP 72 -23.912 -18.071 -6.835 389 HA ASP 72 HA ASP 72 -22.914 -18.919 -4.362 390 HB2 ASP 72 HB2 ASP 72 -22.733 -20.312 -6.365 391 HB3 ASP 72 HB3 ASP 72 -21.733 -19.112 -7.169 392 HA PRO 73 HA PRO 73 -20.370 -15.433 -3.133 393 HB2 PRO 73 HB2 PRO 73 -18.503 -16.796 -1.527 394 HB3 PRO 73 HB3 PRO 73 -20.107 -16.263 -1.005 395 HG2 PRO 73 HG2 PRO 73 -19.240 -18.968 -2.025 396 HG3 PRO 73 HG3 PRO 73 -20.281 -18.574 -0.636 397 HD2 PRO 73 HD2 PRO 73 -21.372 -19.386 -2.921 398 HD3 PRO 73 HD3 PRO 73 -22.131 -18.055 -2.015 399 H VAL 74 H VAL 74 -18.680 -18.282 -4.497 400 HA VAL 74 HA VAL 74 -16.197 -16.874 -4.965 401 HB VAL 74 HB VAL 74 -17.155 -19.518 -6.157 402 HG11 VAL 74 HG11 VAL 74 -14.344 -18.356 -6.019 403 HG12 VAL 74 HG12 VAL 74 -15.323 -18.540 -7.476 404 HG13 VAL 74 HG13 VAL 74 -14.758 -19.969 -6.606 405 HG21 VAL 74 HG21 VAL 74 -17.087 -19.613 -3.695 406 HG22 VAL 74 HG22 VAL 74 -15.424 -19.023 -3.699 407 HG23 VAL 74 HG23 VAL 74 -15.801 -20.604 -4.387 408 H VAL 75 H VAL 75 -18.933 -17.926 -7.010 409 HA VAL 75 HA VAL 75 -18.039 -16.813 -9.476 410 HB VAL 75 HB VAL 75 -20.886 -17.430 -8.545 411 HG11 VAL 75 HG11 VAL 75 -20.956 -15.881 -10.462 412 HG12 VAL 75 HG12 VAL 75 -21.519 -17.481 -10.942 413 HG13 VAL 75 HG13 VAL 75 -19.895 -16.947 -11.390 414 HG21 VAL 75 HG21 VAL 75 -19.432 -19.406 -8.501 415 HG22 VAL 75 HG22 VAL 75 -18.933 -19.111 -10.169 416 HG23 VAL 75 HG23 VAL 75 -20.606 -19.550 -9.813 417 H ALA 76 H ALA 76 -19.860 -15.538 -6.806 418 HA ALA 76 HA ALA 76 -20.739 -13.057 -7.864 419 HB1 ALA 76 HB1 ALA 76 -21.124 -12.472 -5.470 420 HB2 ALA 76 HB2 ALA 76 -20.288 -13.952 -4.994 421 HB3 ALA 76 HB3 ALA 76 -21.800 -14.045 -5.901 422 H LEU 77 H LEU 77 -17.879 -14.123 -6.104 423 HA LEU 77 HA LEU 77 -16.608 -11.615 -5.733 424 HB2 LEU 77 HB2 LEU 77 -16.058 -13.622 -4.421 425 HB3 LEU 77 HB3 LEU 77 -15.486 -14.438 -5.865 426 HG LEU 77 HG LEU 77 -13.583 -12.836 -6.016 427 HD11 LEU 77 HD11 LEU 77 -14.578 -11.707 -3.389 428 HD12 LEU 77 HD12 LEU 77 -14.569 -10.872 -4.944 429 HD13 LEU 77 HD13 LEU 77 -13.047 -11.324 -4.183 430 HD21 LEU 77 HD21 LEU 77 -13.803 -14.179 -3.307 431 HD22 LEU 77 HD22 LEU 77 -12.316 -13.728 -4.147 432 HD23 LEU 77 HD23 LEU 77 -13.352 -14.982 -4.814 433 H GLU 78 H GLU 78 -16.357 -14.119 -8.263 434 HA GLU 78 HA GLU 78 -14.338 -12.921 -9.863 435 HB2 GLU 78 HB2 GLU 78 -16.559 -14.863 -10.637 436 HB3 GLU 78 HB3 GLU 78 -15.166 -14.478 -11.653 437 HG2 GLU 78 HG2 GLU 78 -13.650 -15.481 -10.053 438 HG3 GLU 78 HG3 GLU 78 -14.953 -15.710 -8.887 439 H ALA 79 H ALA 79 -17.857 -12.640 -9.859 440 HA ALA 79 HA ALA 79 -18.135 -10.974 -12.174 441 HB1 ALA 79 HB1 ALA 79 -20.028 -11.387 -9.833 442 HB2 ALA 79 HB2 ALA 79 -19.994 -12.349 -11.310 443 HB3 ALA 79 HB3 ALA 79 -20.449 -10.645 -11.381 444 H ALA 80 H ALA 80 -17.632 -10.428 -8.743 445 HA ALA 80 HA ALA 80 -18.010 -7.577 -8.786 446 HB1 ALA 80 HB1 ALA 80 -17.224 -7.653 -6.463 447 HB2 ALA 80 HB2 ALA 80 -16.738 -9.340 -6.672 448 HB3 ALA 80 HB3 ALA 80 -18.443 -8.895 -6.763 449 H LEU 81 H LEU 81 -15.294 -9.739 -9.314 450 HA LEU 81 HA LEU 81 -13.233 -7.742 -9.315 451 HB2 LEU 81 HB2 LEU 81 -13.389 -10.467 -10.671 452 HB3 LEU 81 HB3 LEU 81 -11.947 -9.459 -10.687 453 HG LEU 81 HG LEU 81 -13.233 -10.682 -8.206 454 HD11 LEU 81 HD11 LEU 81 -10.631 -11.413 -9.587 455 HD12 LEU 81 HD12 LEU 81 -12.110 -12.376 -9.567 456 HD13 LEU 81 HD13 LEU 81 -11.228 -12.095 -8.068 457 HD21 LEU 81 HD21 LEU 81 -12.221 -8.519 -7.682 458 HD22 LEU 81 HD22 LEU 81 -10.702 -9.024 -8.426 459 HD23 LEU 81 HD23 LEU 81 -11.293 -9.835 -6.973 460 H GLN 82 H GLN 82 -15.438 -9.080 -11.708 461 HA GLN 82 HA GLN 82 -14.297 -7.913 -14.031 462 HB2 GLN 82 HB2 GLN 82 -15.796 -9.924 -14.038 463 HB3 GLN 82 HB3 GLN 82 -17.153 -8.891 -13.596 464 HG2 GLN 82 HG2 GLN 82 -16.791 -7.620 -15.739 465 HG3 GLN 82 HG3 GLN 82 -15.559 -8.801 -16.181 466 HE21 GLN 82 HE21 GLN 82 -16.632 -9.584 -17.983 467 HE22 GLN 82 HE22 GLN 82 -18.110 -10.473 -17.895 468 H PHE 83 H PHE 83 -16.949 -6.913 -11.869 469 HA PHE 83 HA PHE 83 -17.662 -4.641 -13.537 470 HB2 PHE 83 HB2 PHE 83 -19.362 -6.022 -12.301 471 HB3 PHE 83 HB3 PHE 83 -18.720 -5.406 -10.786 472 HD1 PHE 83 HD1 PHE 83 -19.156 -3.293 -13.830 473 HD2 PHE 83 HD2 PHE 83 -20.804 -4.419 -10.045 474 HE1 PHE 83 HE1 PHE 83 -20.777 -1.446 -13.980 475 HE2 PHE 83 HE2 PHE 83 -22.415 -2.565 -10.200 476 HZ PHE 83 HZ PHE 83 -22.405 -1.080 -12.166 477 H GLU 84 H GLU 84 -16.885 -2.665 -13.335 478 HA GLU 84 HA GLU 84 -14.508 -2.149 -11.917 479 HB2 GLU 84 HB2 GLU 84 -14.660 0.106 -12.932 480 HB3 GLU 84 HB3 GLU 84 -14.960 -1.177 -14.100 481 HG2 GLU 84 HG2 GLU 84 -17.419 -0.771 -13.875 482 HG3 GLU 84 HG3 GLU 84 -17.078 0.562 -12.775 483 H ASP 85 H ASP 85 -17.826 -1.420 -11.183 484 HA ASP 85 HA ASP 85 -17.426 0.589 -9.198 485 HB2 ASP 85 HB2 ASP 85 -19.575 0.332 -10.360 486 HB3 ASP 85 HB3 ASP 85 -19.756 -1.299 -9.733 487 H THR 86 H THR 86 -17.508 -2.912 -9.171 488 HA THR 86 HA THR 86 -17.738 -3.085 -6.251 489 HB THR 86 HB THR 86 -18.026 -5.569 -6.778 490 HG1 THR 86 HG1 THR 86 -16.978 -5.226 -8.941 491 HG21 THR 86 HG21 THR 86 -19.993 -4.085 -6.459 492 HG22 THR 86 HG22 THR 86 -20.314 -5.345 -7.648 493 HG23 THR 86 HG23 THR 86 -19.972 -3.698 -8.181 494 H ARG 87 H ARG 87 -15.290 -3.335 -8.702 495 HA ARG 87 HA ARG 87 -13.604 -5.330 -7.569 496 HB2 ARG 87 HB2 ARG 87 -11.925 -4.655 -9.183 497 HB3 ARG 87 HB3 ARG 87 -13.506 -4.612 -9.966 498 HG2 ARG 87 HG2 ARG 87 -13.587 -2.169 -9.715 499 HG3 ARG 87 HG3 ARG 87 -12.040 -2.190 -8.865 500 HD2 ARG 87 HD2 ARG 87 -10.944 -3.067 -10.911 501 HD3 ARG 87 HD3 ARG 87 -12.502 -3.003 -11.753 502 HE ARG 87 HE ARG 87 -11.618 -0.507 -10.559 503 HH11 ARG 87 HH11 ARG 87 -11.715 -2.420 -13.508 504 HH12 ARG 87 HH12 ARG 87 -11.358 -1.065 -14.529 505 HH21 ARG 87 HH21 ARG 87 -11.173 1.238 -11.895 506 HH22 ARG 87 HH22 ARG 87 -11.054 1.017 -13.610 507 H GLU 88 H GLU 88 -13.987 -1.967 -6.887 508 HA GLU 88 HA GLU 88 -11.509 -1.397 -5.638 509 HB2 GLU 88 HB2 GLU 88 -12.751 0.553 -4.638 510 HB3 GLU 88 HB3 GLU 88 -12.898 0.418 -6.388 511 HG2 GLU 88 HG2 GLU 88 -15.140 -0.462 -6.215 512 HG3 GLU 88 HG3 GLU 88 -15.012 -0.599 -4.463 513 H SER 89 H SER 89 -14.542 -2.740 -4.415 514 HA SER 89 HA SER 89 -13.790 -2.703 -1.627 515 HB2 SER 89 HB2 SER 89 -16.155 -2.583 -2.326 516 HB3 SER 89 HB3 SER 89 -16.033 -4.179 -3.057 517 HG SER 89 HG SER 89 -15.576 -3.681 -0.295 518 H MET 90 H MET 90 -13.355 -4.874 -4.302 519 HA MET 90 HA MET 90 -12.956 -7.339 -2.977 520 HB2 MET 90 HB2 MET 90 -11.722 -6.374 -5.581 521 HB3 MET 90 HB3 MET 90 -11.808 -8.049 -5.044 522 HG2 MET 90 HG2 MET 90 -14.229 -6.326 -5.633 523 HG3 MET 90 HG3 MET 90 -13.481 -7.431 -6.782 524 HE1 MET 90 HE1 MET 90 -15.118 -7.337 -3.129 525 HE2 MET 90 HE2 MET 90 -16.335 -8.583 -3.406 526 HE3 MET 90 HE3 MET 90 -16.356 -7.100 -4.362 527 H HIS 91 H HIS 91 -10.949 -4.534 -3.205 528 HA HIS 91 HA HIS 91 -8.379 -5.644 -2.729 529 HB2 HIS 91 HB2 HIS 91 -9.450 -2.888 -1.970 530 HB3 HIS 91 HB3 HIS 91 -7.748 -3.337 -2.013 531 HD1 HIS 91 HD1 HIS 91 -9.385 -1.133 -3.775 532 HD2 HIS 91 HD2 HIS 91 -7.860 -4.782 -5.052 533 HE1 HIS 91 HE1 HIS 91 -9.017 -0.876 -6.240 534 HE2 HIS 91 HE2 HIS 91 -7.953 -3.045 -6.959 535 H ALA 92 H ALA 92 -11.048 -4.782 -0.607 536 HA ALA 92 HA ALA 92 -9.738 -5.106 1.904 537 HB1 ALA 92 HB1 ALA 92 -12.015 -5.198 2.855 538 HB2 ALA 92 HB2 ALA 92 -12.686 -5.384 1.231 539 HB3 ALA 92 HB3 ALA 92 -11.871 -3.886 1.681 540 H PHE 93 H PHE 93 -11.630 -7.296 -0.167 541 HA PHE 93 HA PHE 93 -11.517 -9.553 1.605 542 HB2 PHE 93 HB2 PHE 93 -12.213 -9.420 -1.365 543 HB3 PHE 93 HB3 PHE 93 -12.469 -10.824 -0.327 544 HD1 PHE 93 HD1 PHE 93 -14.179 -10.737 1.499 545 HD2 PHE 93 HD2 PHE 93 -13.739 -7.534 -1.291 546 HE1 PHE 93 HE1 PHE 93 -16.373 -9.847 2.161 547 HE2 PHE 93 HE2 PHE 93 -15.941 -6.656 -0.630 548 HZ PHE 93 HZ PHE 93 -17.258 -7.815 1.104 549 H CYS 94 H CYS 94 -9.391 -8.272 -0.821 550 HA CYS 94 HA CYS 94 -7.931 -10.679 -1.396 551 HB2 CYS 94 HB2 CYS 94 -8.050 -8.707 -2.968 552 HB3 CYS 94 HB3 CYS 94 -7.047 -7.795 -1.841 553 HG CYS 94 HG CYS 94 -5.832 -10.772 -2.868 554 H VAL 95 H VAL 95 -7.022 -11.634 0.331 555 HA VAL 95 HA VAL 95 -5.641 -10.189 2.432 556 HB VAL 95 HB VAL 95 -5.162 -12.381 3.414 557 HG11 VAL 95 HG11 VAL 95 -8.027 -12.282 2.367 558 HG12 VAL 95 HG12 VAL 95 -7.421 -11.455 3.804 559 HG13 VAL 95 HG13 VAL 95 -7.468 -13.218 3.758 560 HG21 VAL 95 HG21 VAL 95 -6.282 -13.598 0.855 561 HG22 VAL 95 HG22 VAL 95 -5.835 -14.504 2.304 562 HG23 VAL 95 HG23 VAL 95 -4.598 -13.648 1.382 563 H GLY 96 H GLY 96 -4.823 -11.253 -0.687 564 HA2 GLY 96 HA2 GLY 96 -2.493 -9.935 -0.957 565 HA3 GLY 96 HA3 GLY 96 -1.952 -11.464 -0.270 566 H GLN 97 H GLN 97 -0.774 -11.462 -2.363 567 HA GLN 97 HA GLN 97 -2.282 -12.605 -4.626 568 HB2 GLN 97 HB2 GLN 97 -0.596 -10.897 -5.186 569 HB3 GLN 97 HB3 GLN 97 0.641 -11.789 -4.311 570 HG2 GLN 97 HG2 GLN 97 0.342 -13.663 -5.979 571 HG3 GLN 97 HG3 GLN 97 -0.713 -12.594 -6.898 572 HE21 GLN 97 HE21 GLN 97 1.804 -13.836 -7.676 573 HE22 GLN 97 HE22 GLN 97 2.867 -12.548 -8.127 574 H TYR 98 H TYR 98 -2.048 -14.766 -5.175 575 HA TYR 98 HA TYR 98 -0.887 -16.641 -3.338 576 HB2 TYR 98 HB2 TYR 98 -2.893 -17.172 -4.685 577 HB3 TYR 98 HB3 TYR 98 -1.951 -17.048 -6.163 578 HD1 TYR 98 HD1 TYR 98 -1.763 -18.890 -2.868 579 HD2 TYR 98 HD2 TYR 98 -1.306 -19.116 -7.112 580 HE1 TYR 98 HE1 TYR 98 -1.270 -21.289 -2.700 581 HE2 TYR 98 HE2 TYR 98 -0.818 -21.511 -6.930 582 HH TYR 98 HH TYR 98 -1.413 -23.318 -4.190 583 H LEU 99 H LEU 99 1.042 -17.675 -3.472 584 HA LEU 99 HA LEU 99 2.780 -17.318 -5.816 585 HB2 LEU 99 HB2 LEU 99 3.320 -15.618 -4.035 586 HB3 LEU 99 HB3 LEU 99 3.655 -16.924 -2.919 587 HG LEU 99 HG LEU 99 5.661 -15.724 -3.987 588 HD11 LEU 99 HD11 LEU 99 5.616 -18.729 -4.244 589 HD12 LEU 99 HD12 LEU 99 5.936 -17.811 -2.774 590 HD13 LEU 99 HD13 LEU 99 7.050 -17.705 -4.132 591 HD21 LEU 99 HD21 LEU 99 4.844 -15.599 -6.293 592 HD22 LEU 99 HD22 LEU 99 4.932 -17.359 -6.432 593 HD23 LEU 99 HD23 LEU 99 6.404 -16.413 -6.201 594 H GLU 100 H GLU 100 3.242 -19.269 -6.533 595 HA GLU 100 HA GLU 100 3.107 -21.672 -4.944 596 HB2 GLU 100 HB2 GLU 100 3.960 -21.126 -7.816 597 HB3 GLU 100 HB3 GLU 100 3.896 -22.736 -7.122 598 HG2 GLU 100 HG2 GLU 100 1.461 -22.439 -6.729 599 HG3 GLU 100 HG3 GLU 100 1.557 -20.844 -7.475 600 HA PRO 101 HA PRO 101 7.363 -21.617 -3.547 601 HB2 PRO 101 HB2 PRO 101 7.927 -24.291 -3.264 602 HB3 PRO 101 HB3 PRO 101 6.821 -23.428 -2.185 603 HG2 PRO 101 HG2 PRO 101 6.170 -25.150 -4.582 604 HG3 PRO 101 HG3 PRO 101 5.433 -25.166 -2.964 605 HD2 PRO 101 HD2 PRO 101 4.258 -23.899 -5.045 606 HD3 PRO 101 HD3 PRO 101 4.145 -23.262 -3.389 607 H ASP 102 H ASP 102 6.555 -23.489 -6.399 608 HA ASP 102 HA ASP 102 9.253 -23.620 -7.460 609 HB2 ASP 102 HB2 ASP 102 7.639 -25.445 -7.917 610 HB3 ASP 102 HB3 ASP 102 6.548 -24.308 -8.702 611 H GLN 103 H GLN 103 6.486 -21.465 -7.649 612 HA GLN 103 HA GLN 103 7.039 -20.255 -10.159 613 HB2 GLN 103 HB2 GLN 103 4.811 -20.163 -9.060 614 HB3 GLN 103 HB3 GLN 103 5.468 -19.112 -7.803 615 HG2 GLN 103 HG2 GLN 103 4.200 -17.846 -9.479 616 HG3 GLN 103 HG3 GLN 103 5.896 -17.358 -9.464 617 HE21 GLN 103 HE21 GLN 103 6.019 -16.622 -11.555 618 HE22 GLN 103 HE22 GLN 103 5.779 -17.607 -12.956 619 H GLU 104 H GLU 104 8.031 -19.483 -6.853 620 HA GLU 104 HA GLU 104 9.505 -17.116 -7.702 621 HB2 GLU 104 HB2 GLU 104 8.327 -17.231 -5.504 622 HB3 GLU 104 HB3 GLU 104 9.455 -18.478 -4.987 623 HG2 GLU 104 HG2 GLU 104 11.313 -16.904 -5.105 624 HG3 GLU 104 HG3 GLU 104 10.262 -15.659 -5.782 625 H GLY 105 H GLY 105 10.128 -20.483 -6.835 626 HA2 GLY 105 HA2 GLY 105 12.941 -20.480 -6.701 627 HA3 GLY 105 HA3 GLY 105 11.941 -21.862 -7.120 628 H VAL 106 H VAL 106 10.767 -20.726 -9.453 629 HA VAL 106 HA VAL 106 12.799 -19.762 -11.255 630 HB VAL 106 HB VAL 106 13.117 -22.213 -11.511 631 HG11 VAL 106 HG11 VAL 106 10.192 -22.373 -12.320 632 HG12 VAL 106 HG12 VAL 106 10.891 -23.015 -10.834 633 HG13 VAL 106 HG13 VAL 106 11.355 -23.699 -12.393 634 HG21 VAL 106 HG21 VAL 106 13.473 -20.791 -13.496 635 HG22 VAL 106 HG22 VAL 106 11.778 -20.975 -13.956 636 HG23 VAL 106 HG23 VAL 106 12.853 -22.373 -13.973 637 H THR 107 H THR 107 11.856 -18.321 -12.613 638 HA THR 107 HA THR 107 8.924 -18.276 -12.907 639 HB THR 107 HB THR 107 9.535 -16.663 -11.110 640 HG1 THR 107 HG1 THR 107 7.792 -16.204 -12.556 641 HG21 THR 107 HG21 THR 107 10.826 -14.624 -11.581 642 HG22 THR 107 HG22 THR 107 11.147 -15.181 -13.223 643 HG23 THR 107 HG23 THR 107 11.833 -16.052 -11.851 644 H ILE 108 H ILE 108 8.194 -17.404 -14.851 645 HA ILE 108 HA ILE 108 10.071 -17.595 -17.059 646 HB ILE 108 HB ILE 108 7.053 -17.108 -17.135 647 HG12 ILE 108 HG12 ILE 108 8.549 -19.773 -17.375 648 HG13 ILE 108 HG13 ILE 108 7.630 -19.259 -15.966 649 HG21 ILE 108 HG21 ILE 108 8.201 -16.476 -19.231 650 HG22 ILE 108 HG22 ILE 108 7.187 -17.897 -19.471 651 HG23 ILE 108 HG23 ILE 108 8.935 -18.084 -19.325 652 HD11 ILE 108 HD11 ILE 108 6.506 -19.836 -18.716 653 HD12 ILE 108 HD12 ILE 108 5.573 -19.269 -17.328 654 HD13 ILE 108 HD13 ILE 108 6.364 -20.842 -17.276 655 HA PRO 109 HA PRO 109 10.343 -13.046 -16.914 656 HB2 PRO 109 HB2 PRO 109 12.561 -12.738 -18.395 657 HB3 PRO 109 HB3 PRO 109 12.643 -13.539 -16.817 658 HG2 PRO 109 HG2 PRO 109 12.568 -14.765 -19.577 659 HG3 PRO 109 HG3 PRO 109 13.612 -15.185 -18.198 660 HD2 PRO 109 HD2 PRO 109 11.273 -16.537 -18.865 661 HD3 PRO 109 HD3 PRO 109 11.989 -16.528 -17.240 662 H ASP 110 H ASP 110 8.240 -13.854 -18.448 663 HA ASP 110 HA ASP 110 6.875 -13.434 -20.202 664 HB2 ASP 110 HB2 ASP 110 7.496 -11.066 -19.639 665 HB3 ASP 110 HB3 ASP 110 8.824 -11.155 -20.783 666 H LEU 111 H LEU 111 9.142 -15.254 -20.455 667 HA LEU 111 HA LEU 111 10.195 -15.226 -23.114 668 HB2 LEU 111 HB2 LEU 111 11.199 -16.330 -21.019 669 HB3 LEU 111 HB3 LEU 111 10.026 -17.614 -21.220 670 HG LEU 111 HG LEU 111 12.062 -16.936 -23.387 671 HD11 LEU 111 HD11 LEU 111 13.316 -17.430 -21.339 672 HD12 LEU 111 HD12 LEU 111 13.506 -18.733 -22.509 673 HD13 LEU 111 HD13 LEU 111 12.426 -18.939 -21.125 674 HD21 LEU 111 HD21 LEU 111 10.188 -18.323 -24.151 675 HD22 LEU 111 HD22 LEU 111 10.483 -19.479 -22.853 676 HD23 LEU 111 HD23 LEU 111 11.679 -19.263 -24.134 677 H GLY 112 H GLY 112 7.549 -16.916 -21.479 678 HA2 GLY 112 HA2 GLY 112 6.131 -17.322 -24.012 679 HA3 GLY 112 HA3 GLY 112 6.507 -18.757 -23.058 Start of MODEL 17 1 H GLU 21 H GLU 21 7.098 -0.473 -1.368 2 HA GLU 21 HA GLU 21 4.933 -1.296 0.464 3 HB2 GLU 21 HB2 GLU 21 4.849 -0.614 -2.493 4 HB3 GLU 21 HB3 GLU 21 3.684 -1.731 -1.804 5 HG2 GLU 21 HG2 GLU 21 2.756 0.526 -2.014 6 HG3 GLU 21 HG3 GLU 21 2.813 -0.013 -0.333 7 H LYS 22 H LYS 22 4.466 -3.447 0.464 8 HA LYS 22 HA LYS 22 5.805 -5.322 -1.317 9 HB2 LYS 22 HB2 LYS 22 6.622 -6.721 0.640 10 HB3 LYS 22 HB3 LYS 22 7.481 -5.214 0.401 11 HG2 LYS 22 HG2 LYS 22 7.270 -5.108 2.678 12 HG3 LYS 22 HG3 LYS 22 5.765 -4.315 2.231 13 HD2 LYS 22 HD2 LYS 22 5.326 -5.884 4.022 14 HD3 LYS 22 HD3 LYS 22 4.560 -6.489 2.552 15 HE2 LYS 22 HE2 LYS 22 6.400 -8.086 2.225 16 HE3 LYS 22 HE3 LYS 22 7.238 -7.445 3.637 17 HZ1 LYS 22 HZ1 LYS 22 5.365 -8.173 5.000 18 HZ2 LYS 22 HZ2 LYS 22 6.095 -9.460 4.187 19 HZ3 LYS 22 HZ3 LYS 22 4.624 -8.843 3.639 20 H VAL 23 H VAL 23 4.693 -7.285 -1.516 21 HA VAL 23 HA VAL 23 1.952 -7.288 -0.391 22 HB VAL 23 HB VAL 23 2.092 -6.879 -2.862 23 HG11 VAL 23 HG11 VAL 23 3.242 -9.686 -3.059 24 HG12 VAL 23 HG12 VAL 23 4.110 -8.186 -3.387 25 HG13 VAL 23 HG13 VAL 23 2.763 -8.670 -4.423 26 HG21 VAL 23 HG21 VAL 23 0.056 -7.884 -1.916 27 HG22 VAL 23 HG22 VAL 23 0.739 -9.502 -2.108 28 HG23 VAL 23 HG23 VAL 23 0.360 -8.529 -3.532 29 H THR 24 H THR 24 1.052 -9.282 0.231 30 HA THR 24 HA THR 24 2.857 -11.224 1.353 31 HB THR 24 HB THR 24 -0.197 -11.234 1.235 32 HG1 THR 24 HG1 THR 24 0.269 -10.462 3.529 33 HG21 THR 24 HG21 THR 24 -0.058 -12.691 3.235 34 HG22 THR 24 HG22 THR 24 1.701 -12.702 3.115 35 HG23 THR 24 HG23 THR 24 0.734 -13.450 1.844 36 H LEU 25 H LEU 25 3.775 -12.687 -0.049 37 HA LEU 25 HA LEU 25 2.321 -13.894 -2.264 38 HB2 LEU 25 HB2 LEU 25 5.047 -14.587 -1.074 39 HB3 LEU 25 HB3 LEU 25 4.381 -15.283 -2.548 40 HG LEU 25 HG LEU 25 5.196 -12.370 -2.133 41 HD11 LEU 25 HD11 LEU 25 6.949 -12.829 -3.783 42 HD12 LEU 25 HD12 LEU 25 6.444 -14.519 -3.882 43 HD13 LEU 25 HD13 LEU 25 7.110 -13.879 -2.375 44 HD21 LEU 25 HD21 LEU 25 3.243 -12.465 -3.608 45 HD22 LEU 25 HD22 LEU 25 4.038 -13.663 -4.632 46 HD23 LEU 25 HD23 LEU 25 4.685 -12.024 -4.519 47 H VAL 26 H VAL 26 0.706 -15.207 -1.647 48 HA VAL 26 HA VAL 26 0.907 -16.940 0.718 49 HB VAL 26 HB VAL 26 -1.463 -16.335 -1.121 50 HG11 VAL 26 HG11 VAL 26 -1.448 -17.926 1.470 51 HG12 VAL 26 HG12 VAL 26 -1.708 -18.578 -0.149 52 HG13 VAL 26 HG13 VAL 26 -2.885 -17.467 0.554 53 HG21 VAL 26 HG21 VAL 26 -0.810 -14.363 0.207 54 HG22 VAL 26 HG22 VAL 26 -0.904 -15.311 1.696 55 HG23 VAL 26 HG23 VAL 26 -2.365 -14.997 0.756 56 H ARG 27 H ARG 27 1.583 -18.956 0.445 57 HA ARG 27 HA ARG 27 1.816 -20.196 -2.189 58 HB2 ARG 27 HB2 ARG 27 3.512 -20.163 -0.095 59 HB3 ARG 27 HB3 ARG 27 2.580 -21.564 0.399 60 HG2 ARG 27 HG2 ARG 27 3.205 -22.724 -1.697 61 HG3 ARG 27 HG3 ARG 27 4.111 -21.292 -2.211 62 HD2 ARG 27 HD2 ARG 27 5.502 -21.526 -0.105 63 HD3 ARG 27 HD3 ARG 27 4.682 -23.069 0.187 64 HE ARG 27 HE ARG 27 6.195 -22.611 -2.319 65 HH11 ARG 27 HH11 ARG 27 5.753 -24.485 0.626 66 HH12 ARG 27 HH12 ARG 27 7.011 -25.611 0.238 67 HH21 ARG 27 HH21 ARG 27 7.860 -24.068 -2.802 68 HH22 ARG 27 HH22 ARG 27 8.213 -25.370 -1.706 69 H ILE 28 H ILE 28 1.103 -22.554 -2.386 70 HA ILE 28 HA ILE 28 -1.658 -22.828 -2.072 71 HB ILE 28 HB ILE 28 -0.548 -24.102 -3.784 72 HG12 ILE 28 HG12 ILE 28 -1.803 -25.972 -1.717 73 HG13 ILE 28 HG13 ILE 28 -2.646 -25.103 -2.994 74 HG21 ILE 28 HG21 ILE 28 0.899 -25.663 -1.623 75 HG22 ILE 28 HG22 ILE 28 1.617 -24.471 -2.710 76 HG23 ILE 28 HG23 ILE 28 0.978 -25.978 -3.361 77 HD11 ILE 28 HD11 ILE 28 -2.425 -27.440 -3.527 78 HD12 ILE 28 HD12 ILE 28 -0.673 -27.354 -3.364 79 HD13 ILE 28 HD13 ILE 28 -1.485 -26.473 -4.662 80 H ALA 29 H ALA 29 0.931 -23.938 0.038 81 HA ALA 29 HA ALA 29 -0.452 -25.705 1.711 82 HB1 ALA 29 HB1 ALA 29 1.889 -23.899 2.428 83 HB2 ALA 29 HB2 ALA 29 2.002 -25.512 1.725 84 HB3 ALA 29 HB3 ALA 29 1.356 -25.310 3.353 85 H ASP 30 H ASP 30 -0.108 -22.166 1.888 86 HA ASP 30 HA ASP 30 -1.305 -21.726 4.424 87 HB2 ASP 30 HB2 ASP 30 -1.140 -19.823 2.046 88 HB3 ASP 30 HB3 ASP 30 -1.501 -19.356 3.709 89 H LEU 31 H LEU 31 -2.652 -21.939 1.147 90 HA LEU 31 HA LEU 31 -5.316 -21.135 1.655 91 HB2 LEU 31 HB2 LEU 31 -4.387 -23.281 -0.305 92 HB3 LEU 31 HB3 LEU 31 -5.943 -22.458 -0.343 93 HG LEU 31 HG LEU 31 -3.215 -21.234 -0.939 94 HD11 LEU 31 HD11 LEU 31 -5.605 -21.739 -2.751 95 HD12 LEU 31 HD12 LEU 31 -4.097 -22.658 -2.729 96 HD13 LEU 31 HD13 LEU 31 -4.084 -20.966 -3.217 97 HD21 LEU 31 HD21 LEU 31 -4.574 -19.573 0.219 98 HD22 LEU 31 HD22 LEU 31 -5.926 -19.857 -0.882 99 HD23 LEU 31 HD23 LEU 31 -4.421 -19.154 -1.486 100 H GLU 32 H GLU 32 -3.731 -24.306 1.812 101 HA GLU 32 HA GLU 32 -5.997 -25.866 2.471 102 HB2 GLU 32 HB2 GLU 32 -3.079 -26.514 3.125 103 HB3 GLU 32 HB3 GLU 32 -4.407 -27.666 2.973 104 HG2 GLU 32 HG2 GLU 32 -3.049 -26.080 0.772 105 HG3 GLU 32 HG3 GLU 32 -3.059 -27.826 1.004 106 H ASN 33 H ASN 33 -3.445 -24.385 4.449 107 HA ASN 33 HA ASN 33 -4.200 -25.418 6.962 108 HB2 ASN 33 HB2 ASN 33 -2.447 -23.113 6.097 109 HB3 ASN 33 HB3 ASN 33 -2.906 -23.227 7.796 110 HD21 ASN 33 HD21 ASN 33 -1.024 -24.667 5.237 111 HD22 ASN 33 HD22 ASN 33 -0.134 -25.760 6.220 112 H HIS 34 H HIS 34 -4.993 -22.304 5.383 113 HA HIS 34 HA HIS 34 -6.426 -21.258 7.626 114 HB2 HIS 34 HB2 HIS 34 -5.320 -19.984 5.576 115 HB3 HIS 34 HB3 HIS 34 -6.890 -20.215 4.814 116 HD1 HIS 34 HD1 HIS 34 -5.085 -18.124 7.198 117 HD2 HIS 34 HD2 HIS 34 -9.067 -18.884 6.287 118 HE1 HIS 34 HE1 HIS 34 -6.380 -16.263 8.277 119 HE2 HIS 34 HE2 HIS 34 -8.757 -16.643 7.540 120 H ASN 35 H ASN 35 -7.343 -23.006 4.703 121 HA ASN 35 HA ASN 35 -10.158 -22.916 4.953 122 HB2 ASN 35 HB2 ASN 35 -9.001 -23.681 2.887 123 HB3 ASN 35 HB3 ASN 35 -8.393 -25.096 3.738 124 HD21 ASN 35 HD21 ASN 35 -9.390 -26.561 2.342 125 HD22 ASN 35 HD22 ASN 35 -11.102 -26.783 2.273 126 H ASN 36 H ASN 36 -7.715 -25.148 6.219 127 HA ASN 36 HA ASN 36 -9.453 -26.950 7.565 128 HB2 ASN 36 HB2 ASN 36 -7.146 -27.561 6.946 129 HB3 ASN 36 HB3 ASN 36 -6.500 -26.327 8.021 130 HD21 ASN 36 HD21 ASN 36 -8.142 -29.422 7.855 131 HD22 ASN 36 HD22 ASN 36 -7.761 -29.929 9.464 132 H ASP 37 H ASP 37 -7.954 -23.898 8.479 133 HA ASP 37 HA ASP 37 -8.563 -23.995 11.284 134 HB2 ASP 37 HB2 ASP 37 -7.877 -21.655 9.457 135 HB3 ASP 37 HB3 ASP 37 -8.105 -21.485 11.195 136 H GLY 38 H GLY 38 -10.431 -23.305 8.469 137 HA2 GLY 38 HA2 GLY 38 -12.828 -23.453 8.633 138 HA3 GLY 38 HA3 GLY 38 -12.763 -22.608 10.171 139 H GLY 39 H GLY 39 -10.953 -21.658 7.320 140 HA2 GLY 39 HA2 GLY 39 -12.829 -19.472 6.679 141 HA3 GLY 39 HA3 GLY 39 -11.139 -19.087 7.007 142 H PHE 40 H PHE 40 -13.348 -19.986 4.603 143 HA PHE 40 HA PHE 40 -11.671 -21.742 3.060 144 HB2 PHE 40 HB2 PHE 40 -14.159 -21.944 3.094 145 HB3 PHE 40 HB3 PHE 40 -14.300 -20.382 2.295 146 HD1 PHE 40 HD1 PHE 40 -12.730 -23.769 1.813 147 HD2 PHE 40 HD2 PHE 40 -14.457 -20.343 -0.069 148 HE1 PHE 40 HE1 PHE 40 -12.625 -24.907 -0.367 149 HE2 PHE 40 HE2 PHE 40 -14.346 -21.484 -2.246 150 HZ PHE 40 HZ PHE 40 -13.435 -23.768 -2.394 151 H TRP 41 H TRP 41 -9.958 -20.972 2.050 152 HA TRP 41 HA TRP 41 -9.931 -18.310 0.794 153 HB2 TRP 41 HB2 TRP 41 -7.775 -20.160 1.838 154 HB3 TRP 41 HB3 TRP 41 -7.355 -19.030 0.553 155 HD1 TRP 41 HD1 TRP 41 -9.853 -17.658 3.002 156 HE1 TRP 41 HE1 TRP 41 -8.728 -15.922 4.511 157 HE3 TRP 41 HE3 TRP 41 -4.975 -18.589 1.810 158 HZ2 TRP 41 HZ2 TRP 41 -6.130 -15.043 5.125 159 HZ3 TRP 41 HZ3 TRP 41 -3.222 -17.257 2.910 160 HH2 TRP 41 HH2 TRP 41 -3.788 -15.519 4.535 161 H THR 42 H THR 42 -9.459 -18.006 -1.310 162 HA THR 42 HA THR 42 -9.056 -20.283 -3.132 163 HB THR 42 HB THR 42 -11.524 -19.799 -3.094 164 HG1 THR 42 HG1 THR 42 -11.705 -19.865 -5.306 165 HG21 THR 42 HG21 THR 42 -11.464 -17.364 -2.622 166 HG22 THR 42 HG22 THR 42 -12.402 -17.716 -4.074 167 HG23 THR 42 HG23 THR 42 -10.766 -17.071 -4.221 168 H VAL 43 H VAL 43 -7.988 -19.702 -5.061 169 HA VAL 43 HA VAL 43 -6.796 -17.006 -5.142 170 HB VAL 43 HB VAL 43 -5.033 -18.611 -5.146 171 HG11 VAL 43 HG11 VAL 43 -6.404 -20.110 -7.406 172 HG12 VAL 43 HG12 VAL 43 -6.270 -20.649 -5.732 173 HG13 VAL 43 HG13 VAL 43 -4.819 -20.499 -6.726 174 HG21 VAL 43 HG21 VAL 43 -5.458 -17.707 -8.020 175 HG22 VAL 43 HG22 VAL 43 -3.916 -18.196 -7.316 176 HG23 VAL 43 HG23 VAL 43 -4.733 -16.745 -6.728 177 H ILE 44 H ILE 44 -7.661 -15.620 -6.481 178 HA ILE 44 HA ILE 44 -8.792 -16.432 -9.093 179 HB ILE 44 HB ILE 44 -9.933 -14.259 -7.256 180 HG12 ILE 44 HG12 ILE 44 -11.269 -16.910 -7.986 181 HG13 ILE 44 HG13 ILE 44 -10.427 -16.629 -6.468 182 HG21 ILE 44 HG21 ILE 44 -10.951 -15.253 -9.949 183 HG22 ILE 44 HG22 ILE 44 -10.191 -13.691 -9.635 184 HG23 ILE 44 HG23 ILE 44 -11.759 -14.068 -8.921 185 HD11 ILE 44 HD11 ILE 44 -12.866 -15.112 -7.401 186 HD12 ILE 44 HD12 ILE 44 -12.046 -14.931 -5.848 187 HD13 ILE 44 HD13 ILE 44 -12.849 -16.447 -6.251 188 H ASP 45 H ASP 45 -7.684 -15.434 -10.677 189 HA ASP 45 HA ASP 45 -6.516 -13.963 -11.940 190 HB2 ASP 45 HB2 ASP 45 -8.499 -12.512 -11.376 191 HB3 ASP 45 HB3 ASP 45 -7.598 -11.838 -10.027 192 H GLY 46 H GLY 46 -5.173 -15.283 -9.759 193 HA2 GLY 46 HA2 GLY 46 -2.973 -15.428 -9.052 194 HA3 GLY 46 HA3 GLY 46 -2.666 -13.852 -9.762 195 H LYS 47 H LYS 47 -5.337 -13.694 -7.760 196 HA LYS 47 HA LYS 47 -3.830 -12.638 -5.437 197 HB2 LYS 47 HB2 LYS 47 -6.725 -12.069 -6.242 198 HB3 LYS 47 HB3 LYS 47 -5.792 -11.248 -4.991 199 HG2 LYS 47 HG2 LYS 47 -5.135 -11.126 -7.946 200 HG3 LYS 47 HG3 LYS 47 -6.189 -9.961 -7.132 201 HD2 LYS 47 HD2 LYS 47 -4.313 -9.354 -5.625 202 HD3 LYS 47 HD3 LYS 47 -3.264 -10.495 -6.477 203 HE2 LYS 47 HE2 LYS 47 -3.560 -9.180 -8.563 204 HE3 LYS 47 HE3 LYS 47 -4.589 -8.038 -7.691 205 HZ1 LYS 47 HZ1 LYS 47 -1.727 -8.595 -7.136 206 HZ2 LYS 47 HZ2 LYS 47 -2.699 -7.511 -6.271 207 HZ3 LYS 47 HZ3 LYS 47 -2.350 -7.223 -7.900 208 H VAL 48 H VAL 48 -4.816 -13.150 -3.313 209 HA VAL 48 HA VAL 48 -6.567 -15.549 -3.308 210 HB VAL 48 HB VAL 48 -4.556 -14.725 -1.158 211 HG11 VAL 48 HG11 VAL 48 -6.368 -17.178 -1.283 212 HG12 VAL 48 HG12 VAL 48 -6.518 -15.836 -0.146 213 HG13 VAL 48 HG13 VAL 48 -5.112 -16.899 -0.074 214 HG21 VAL 48 HG21 VAL 48 -3.321 -16.773 -1.831 215 HG22 VAL 48 HG22 VAL 48 -3.431 -15.606 -3.152 216 HG23 VAL 48 HG23 VAL 48 -4.477 -17.030 -3.140 217 H TYR 49 H TYR 49 -8.372 -15.539 -2.013 218 HA TYR 49 HA TYR 49 -9.135 -13.069 -0.580 219 HB2 TYR 49 HB2 TYR 49 -10.888 -14.565 -2.593 220 HB3 TYR 49 HB3 TYR 49 -11.396 -13.193 -1.618 221 HD1 TYR 49 HD1 TYR 49 -9.442 -14.243 -4.566 222 HD2 TYR 49 HD2 TYR 49 -10.671 -10.898 -2.203 223 HE1 TYR 49 HE1 TYR 49 -8.682 -12.706 -6.328 224 HE2 TYR 49 HE2 TYR 49 -9.905 -9.371 -3.971 225 HH TYR 49 HH TYR 49 -9.056 -10.426 -7.089 226 H ASP 50 H ASP 50 -10.789 -13.391 1.036 227 HA ASP 50 HA ASP 50 -11.170 -16.188 1.938 228 HB2 ASP 50 HB2 ASP 50 -10.200 -14.493 3.569 229 HB3 ASP 50 HB3 ASP 50 -11.730 -13.629 3.508 230 H ILE 51 H ILE 51 -12.909 -17.005 1.040 231 HA ILE 51 HA ILE 51 -15.134 -15.599 -0.023 232 HB ILE 51 HB ILE 51 -14.582 -18.543 0.498 233 HG12 ILE 51 HG12 ILE 51 -13.201 -17.504 -1.249 234 HG13 ILE 51 HG13 ILE 51 -14.322 -18.653 -1.973 235 HG21 ILE 51 HG21 ILE 51 -17.027 -17.441 -0.924 236 HG22 ILE 51 HG22 ILE 51 -17.009 -18.348 0.589 237 HG23 ILE 51 HG23 ILE 51 -16.530 -19.137 -0.914 238 HD11 ILE 51 HD11 ILE 51 -14.640 -15.651 -1.945 239 HD12 ILE 51 HD12 ILE 51 -15.767 -16.804 -2.670 240 HD13 ILE 51 HD13 ILE 51 -14.131 -16.646 -3.308 241 H LYS 52 H LYS 52 -14.573 -17.226 3.046 242 HA LYS 52 HA LYS 52 -17.214 -17.473 3.984 243 HB2 LYS 52 HB2 LYS 52 -15.257 -18.576 5.047 244 HB3 LYS 52 HB3 LYS 52 -14.653 -17.004 5.568 245 HG2 LYS 52 HG2 LYS 52 -16.761 -16.731 6.935 246 HG3 LYS 52 HG3 LYS 52 -17.185 -18.390 6.506 247 HD2 LYS 52 HD2 LYS 52 -16.161 -18.357 8.712 248 HD3 LYS 52 HD3 LYS 52 -15.084 -19.185 7.584 249 HE2 LYS 52 HE2 LYS 52 -13.719 -17.125 7.384 250 HE3 LYS 52 HE3 LYS 52 -14.799 -16.299 8.513 251 HZ1 LYS 52 HZ1 LYS 52 -13.158 -18.694 9.132 252 HZ2 LYS 52 HZ2 LYS 52 -14.181 -17.887 10.206 253 HZ3 LYS 52 HZ3 LYS 52 -12.813 -17.106 9.598 254 H ASP 53 H ASP 53 -14.867 -14.819 4.228 255 HA ASP 53 HA ASP 53 -16.442 -13.018 5.776 256 HB2 ASP 53 HB2 ASP 53 -13.987 -12.776 5.652 257 HB3 ASP 53 HB3 ASP 53 -14.077 -12.485 3.921 258 H PHE 54 H PHE 54 -15.810 -13.335 2.286 259 HA PHE 54 HA PHE 54 -17.124 -11.208 1.173 260 HB2 PHE 54 HB2 PHE 54 -15.823 -12.770 -0.182 261 HB3 PHE 54 HB3 PHE 54 -16.965 -14.070 0.133 262 HD1 PHE 54 HD1 PHE 54 -16.411 -10.932 -1.751 263 HD2 PHE 54 HD2 PHE 54 -19.065 -14.225 -1.126 264 HE1 PHE 54 HE1 PHE 54 -17.673 -10.314 -3.768 265 HE2 PHE 54 HE2 PHE 54 -20.324 -13.588 -3.142 266 HZ PHE 54 HZ PHE 54 -19.630 -11.630 -4.460 267 H GLN 55 H GLN 55 -18.636 -14.395 1.682 268 HA GLN 55 HA GLN 55 -21.246 -13.596 0.962 269 HB2 GLN 55 HB2 GLN 55 -21.972 -15.765 1.909 270 HB3 GLN 55 HB3 GLN 55 -20.585 -15.924 0.839 271 HG2 GLN 55 HG2 GLN 55 -19.095 -16.090 2.795 272 HG3 GLN 55 HG3 GLN 55 -20.481 -15.942 3.869 273 HE21 GLN 55 HE21 GLN 55 -22.229 -17.659 2.272 274 HE22 GLN 55 HE22 GLN 55 -21.645 -19.267 2.477 275 H THR 56 H THR 56 -19.533 -13.487 4.038 276 HA THR 56 HA THR 56 -21.792 -13.049 5.728 277 HB THR 56 HB THR 56 -18.859 -12.358 6.163 278 HG1 THR 56 HG1 THR 56 -19.634 -14.644 5.916 279 HG21 THR 56 HG21 THR 56 -19.395 -12.260 8.581 280 HG22 THR 56 HG22 THR 56 -21.112 -12.456 8.215 281 HG23 THR 56 HG23 THR 56 -20.256 -11.008 7.683 282 H GLN 57 H GLN 57 -19.708 -10.842 3.827 283 HA GLN 57 HA GLN 57 -20.658 -8.416 5.018 284 HB2 GLN 57 HB2 GLN 57 -19.321 -8.808 2.309 285 HB3 GLN 57 HB3 GLN 57 -19.518 -7.277 3.148 286 HG2 GLN 57 HG2 GLN 57 -17.689 -9.580 3.848 287 HG3 GLN 57 HG3 GLN 57 -17.257 -7.921 3.456 288 HE21 GLN 57 HE21 GLN 57 -18.336 -10.091 5.951 289 HE22 GLN 57 HE22 GLN 57 -18.135 -8.998 7.273 290 H SER 58 H SER 58 -22.023 -10.574 2.748 291 HA SER 58 HA SER 58 -23.903 -8.711 1.544 292 HB2 SER 58 HB2 SER 58 -22.972 -10.715 0.348 293 HB3 SER 58 HB3 SER 58 -23.836 -11.759 1.475 294 HG SER 58 HG SER 58 -25.786 -10.795 0.687 295 H LEU 59 H LEU 59 -23.737 -9.569 4.644 296 HA LEU 59 HA LEU 59 -26.243 -10.711 5.309 297 HB2 LEU 59 HB2 LEU 59 -25.764 -10.261 7.574 298 HB3 LEU 59 HB3 LEU 59 -24.198 -10.525 6.837 299 HG LEU 59 HG LEU 59 -25.347 -7.793 7.581 300 HD11 LEU 59 HD11 LEU 59 -23.742 -7.765 9.414 301 HD12 LEU 59 HD12 LEU 59 -23.199 -9.394 9.000 302 HD13 LEU 59 HD13 LEU 59 -24.853 -9.127 9.564 303 HD21 LEU 59 HD21 LEU 59 -22.528 -8.441 6.636 304 HD22 LEU 59 HD22 LEU 59 -23.122 -6.864 7.168 305 HD23 LEU 59 HD23 LEU 59 -23.764 -7.598 5.701 306 H THR 60 H THR 60 -25.308 -7.455 4.556 307 HA THR 60 HA THR 60 -27.787 -6.233 5.479 308 HB THR 60 HB THR 60 -25.479 -4.949 3.942 309 HG1 THR 60 HG1 THR 60 -25.652 -5.818 6.563 310 HG21 THR 60 HG21 THR 60 -27.577 -3.711 5.789 311 HG22 THR 60 HG22 THR 60 -27.555 -3.572 4.027 312 HG23 THR 60 HG23 THR 60 -26.262 -2.849 4.985 313 H GLU 61 H GLU 61 -29.476 -5.777 4.193 314 HA GLU 61 HA GLU 61 -29.739 -6.881 1.590 315 HB2 GLU 61 HB2 GLU 61 -31.982 -5.989 1.562 316 HB3 GLU 61 HB3 GLU 61 -31.653 -6.596 3.176 317 HG2 GLU 61 HG2 GLU 61 -31.586 -3.662 2.383 318 HG3 GLU 61 HG3 GLU 61 -32.965 -4.470 3.123 319 H ASN 62 H ASN 62 -28.890 -3.670 2.748 320 HA ASN 62 HA ASN 62 -28.540 -2.675 -0.016 321 HB2 ASN 62 HB2 ASN 62 -28.551 -1.227 2.672 322 HB3 ASN 62 HB3 ASN 62 -28.113 -0.443 1.158 323 HD21 ASN 62 HD21 ASN 62 -29.722 -0.104 -0.426 324 HD22 ASN 62 HD22 ASN 62 -31.402 -0.143 -0.024 325 H SER 63 H SER 63 -26.751 -3.890 -0.520 326 HA SER 63 HA SER 63 -24.194 -2.853 0.444 327 HB2 SER 63 HB2 SER 63 -23.227 -5.121 0.746 328 HB3 SER 63 HB3 SER 63 -24.579 -4.888 1.853 329 HG SER 63 HG SER 63 -25.567 -6.487 0.922 330 H ILE 64 H ILE 64 -22.405 -3.627 -1.020 331 HA ILE 64 HA ILE 64 -23.050 -3.463 -3.789 332 HB ILE 64 HB ILE 64 -20.677 -3.953 -4.235 333 HG12 ILE 64 HG12 ILE 64 -20.304 -4.390 -1.237 334 HG13 ILE 64 HG13 ILE 64 -20.369 -5.688 -2.417 335 HG21 ILE 64 HG21 ILE 64 -21.009 -1.992 -1.941 336 HG22 ILE 64 HG22 ILE 64 -21.274 -1.651 -3.654 337 HG23 ILE 64 HG23 ILE 64 -19.650 -2.033 -3.073 338 HD11 ILE 64 HD11 ILE 64 -18.102 -5.194 -1.767 339 HD12 ILE 64 HD12 ILE 64 -18.282 -3.524 -2.298 340 HD13 ILE 64 HD13 ILE 64 -18.344 -4.839 -3.477 341 H LEU 65 H LEU 65 -22.919 -6.079 -1.545 342 HA LEU 65 HA LEU 65 -22.721 -8.179 -3.606 343 HB2 LEU 65 HB2 LEU 65 -22.589 -8.421 -0.576 344 HB3 LEU 65 HB3 LEU 65 -22.278 -9.712 -1.735 345 HG LEU 65 HG LEU 65 -20.588 -7.219 -1.293 346 HD11 LEU 65 HD11 LEU 65 -19.940 -10.132 -0.761 347 HD12 LEU 65 HD12 LEU 65 -20.305 -8.900 0.454 348 HD13 LEU 65 HD13 LEU 65 -18.852 -8.756 -0.533 349 HD21 LEU 65 HD21 LEU 65 -19.040 -8.142 -2.974 350 HD22 LEU 65 HD22 LEU 65 -20.604 -7.744 -3.670 351 HD23 LEU 65 HD23 LEU 65 -20.191 -9.428 -3.338 352 H ALA 66 H ALA 66 -25.131 -6.420 -2.273 353 HA ALA 66 HA ALA 66 -27.138 -8.306 -1.585 354 HB1 ALA 66 HB1 ALA 66 -27.339 -5.893 -1.100 355 HB2 ALA 66 HB2 ALA 66 -28.737 -6.477 -2.007 356 HB3 ALA 66 HB3 ALA 66 -27.475 -5.548 -2.826 357 H GLN 67 H GLN 67 -25.946 -7.105 -4.645 358 HA GLN 67 HA GLN 67 -27.904 -8.388 -6.345 359 HB2 GLN 67 HB2 GLN 67 -26.405 -7.648 -8.197 360 HB3 GLN 67 HB3 GLN 67 -26.806 -6.329 -7.101 361 HG2 GLN 67 HG2 GLN 67 -24.599 -6.604 -5.995 362 HG3 GLN 67 HG3 GLN 67 -24.200 -7.886 -7.131 363 HE21 GLN 67 HE21 GLN 67 -24.530 -4.448 -6.685 364 HE22 GLN 67 HE22 GLN 67 -23.816 -3.982 -8.187 365 H PHE 68 H PHE 68 -24.939 -9.313 -4.809 366 HA PHE 68 HA PHE 68 -24.485 -11.663 -6.534 367 HB2 PHE 68 HB2 PHE 68 -22.764 -10.338 -4.382 368 HB3 PHE 68 HB3 PHE 68 -22.304 -11.797 -5.242 369 HD1 PHE 68 HD1 PHE 68 -22.570 -11.514 -7.953 370 HD2 PHE 68 HD2 PHE 68 -21.744 -8.362 -5.185 371 HE1 PHE 68 HE1 PHE 68 -21.556 -10.190 -9.756 372 HE2 PHE 68 HE2 PHE 68 -20.732 -7.039 -7.002 373 HZ PHE 68 HZ PHE 68 -20.641 -7.953 -9.290 374 H ALA 69 H ALA 69 -26.287 -10.983 -3.875 375 HA ALA 69 HA ALA 69 -25.671 -13.038 -2.003 376 HB1 ALA 69 HB1 ALA 69 -26.931 -11.006 -1.409 377 HB2 ALA 69 HB2 ALA 69 -27.841 -12.459 -0.987 378 HB3 ALA 69 HB3 ALA 69 -28.274 -11.528 -2.427 379 H GLY 70 H GLY 70 -27.474 -13.035 -4.998 380 HA2 GLY 70 HA2 GLY 70 -28.746 -15.654 -4.444 381 HA3 GLY 70 HA3 GLY 70 -29.162 -14.544 -5.741 382 H GLU 71 H GLU 71 -25.818 -15.233 -5.074 383 HA GLU 71 HA GLU 71 -25.579 -17.056 -7.393 384 HB2 GLU 71 HB2 GLU 71 -25.221 -14.701 -8.162 385 HB3 GLU 71 HB3 GLU 71 -23.977 -14.476 -6.942 386 HG2 GLU 71 HG2 GLU 71 -23.006 -14.793 -9.166 387 HG3 GLU 71 HG3 GLU 71 -22.534 -16.090 -8.072 388 H ASP 72 H ASP 72 -23.540 -18.248 -7.415 389 HA ASP 72 HA ASP 72 -22.610 -19.317 -4.995 390 HB2 ASP 72 HB2 ASP 72 -22.302 -20.445 -7.182 391 HB3 ASP 72 HB3 ASP 72 -21.208 -19.175 -7.712 392 HA PRO 73 HA PRO 73 -20.376 -15.832 -3.403 393 HB2 PRO 73 HB2 PRO 73 -18.655 -17.071 -1.611 394 HB3 PRO 73 HB3 PRO 73 -20.375 -16.809 -1.312 395 HG2 PRO 73 HG2 PRO 73 -18.988 -19.286 -2.355 396 HG3 PRO 73 HG3 PRO 73 -20.227 -19.154 -1.084 397 HD2 PRO 73 HD2 PRO 73 -20.901 -19.907 -3.562 398 HD3 PRO 73 HD3 PRO 73 -21.967 -18.821 -2.641 399 H VAL 74 H VAL 74 -18.388 -18.505 -4.706 400 HA VAL 74 HA VAL 74 -15.974 -16.924 -4.902 401 HB VAL 74 HB VAL 74 -16.568 -19.547 -6.353 402 HG11 VAL 74 HG11 VAL 74 -14.082 -19.753 -6.466 403 HG12 VAL 74 HG12 VAL 74 -13.924 -18.161 -5.720 404 HG13 VAL 74 HG13 VAL 74 -14.661 -18.316 -7.317 405 HG21 VAL 74 HG21 VAL 74 -16.827 -19.843 -3.907 406 HG22 VAL 74 HG22 VAL 74 -15.231 -19.140 -3.644 407 HG23 VAL 74 HG23 VAL 74 -15.385 -20.681 -4.490 408 H VAL 75 H VAL 75 -18.364 -18.161 -7.267 409 HA VAL 75 HA VAL 75 -17.263 -16.974 -9.594 410 HB VAL 75 HB VAL 75 -20.174 -17.763 -9.083 411 HG11 VAL 75 HG11 VAL 75 -18.744 -17.312 -11.744 412 HG12 VAL 75 HG12 VAL 75 -20.020 -16.300 -11.061 413 HG13 VAL 75 HG13 VAL 75 -20.381 -17.951 -11.560 414 HG21 VAL 75 HG21 VAL 75 -18.638 -19.648 -8.702 415 HG22 VAL 75 HG22 VAL 75 -17.899 -19.396 -10.287 416 HG23 VAL 75 HG23 VAL 75 -19.582 -19.915 -10.170 417 H ALA 76 H ALA 76 -19.564 -15.812 -7.245 418 HA ALA 76 HA ALA 76 -20.467 -13.436 -8.508 419 HB1 ALA 76 HB1 ALA 76 -21.681 -14.519 -6.642 420 HB2 ALA 76 HB2 ALA 76 -21.323 -12.830 -6.296 421 HB3 ALA 76 HB3 ALA 76 -20.363 -14.103 -5.542 422 H LEU 77 H LEU 77 -17.799 -14.184 -6.312 423 HA LEU 77 HA LEU 77 -16.861 -11.531 -5.901 424 HB2 LEU 77 HB2 LEU 77 -16.286 -13.322 -4.364 425 HB3 LEU 77 HB3 LEU 77 -15.498 -14.230 -5.642 426 HG LEU 77 HG LEU 77 -13.677 -12.589 -5.756 427 HD11 LEU 77 HD11 LEU 77 -15.087 -11.064 -3.544 428 HD12 LEU 77 HD12 LEU 77 -14.863 -10.524 -5.211 429 HD13 LEU 77 HD13 LEU 77 -13.466 -10.738 -4.162 430 HD21 LEU 77 HD21 LEU 77 -14.224 -13.503 -2.918 431 HD22 LEU 77 HD22 LEU 77 -12.660 -13.031 -3.581 432 HD23 LEU 77 HD23 LEU 77 -13.473 -14.461 -4.201 433 H GLU 78 H GLU 78 -16.091 -14.048 -8.289 434 HA GLU 78 HA GLU 78 -13.931 -12.737 -9.601 435 HB2 GLU 78 HB2 GLU 78 -15.899 -14.745 -10.790 436 HB3 GLU 78 HB3 GLU 78 -14.296 -14.347 -11.420 437 HG2 GLU 78 HG2 GLU 78 -13.320 -15.222 -9.279 438 HG3 GLU 78 HG3 GLU 78 -14.931 -15.736 -8.805 439 H ALA 79 H ALA 79 -17.424 -12.786 -10.159 440 HA ALA 79 HA ALA 79 -17.566 -11.056 -12.401 441 HB1 ALA 79 HB1 ALA 79 -19.665 -11.634 -10.275 442 HB2 ALA 79 HB2 ALA 79 -19.411 -12.564 -11.752 443 HB3 ALA 79 HB3 ALA 79 -19.971 -10.893 -11.854 444 H ALA 80 H ALA 80 -17.460 -10.520 -8.925 445 HA ALA 80 HA ALA 80 -18.125 -7.740 -8.904 446 HB1 ALA 80 HB1 ALA 80 -16.644 -9.374 -6.812 447 HB2 ALA 80 HB2 ALA 80 -18.395 -9.187 -6.927 448 HB3 ALA 80 HB3 ALA 80 -17.386 -7.786 -6.567 449 H LEU 81 H LEU 81 -15.081 -9.539 -9.125 450 HA LEU 81 HA LEU 81 -13.283 -7.334 -8.905 451 HB2 LEU 81 HB2 LEU 81 -12.969 -10.044 -10.249 452 HB3 LEU 81 HB3 LEU 81 -11.645 -8.904 -10.038 453 HG LEU 81 HG LEU 81 -13.201 -10.207 -7.764 454 HD11 LEU 81 HD11 LEU 81 -10.411 -10.836 -8.767 455 HD12 LEU 81 HD12 LEU 81 -11.845 -11.850 -8.958 456 HD13 LEU 81 HD13 LEU 81 -11.198 -11.540 -7.349 457 HD21 LEU 81 HD21 LEU 81 -10.736 -8.436 -7.675 458 HD22 LEU 81 HD22 LEU 81 -11.473 -9.258 -6.296 459 HD23 LEU 81 HD23 LEU 81 -12.363 -7.996 -7.142 460 H GLN 82 H GLN 82 -14.885 -8.954 -11.608 461 HA GLN 82 HA GLN 82 -13.727 -7.327 -13.668 462 HB2 GLN 82 HB2 GLN 82 -16.199 -9.113 -13.747 463 HB3 GLN 82 HB3 GLN 82 -15.409 -8.408 -15.156 464 HG2 GLN 82 HG2 GLN 82 -14.101 -10.375 -13.254 465 HG3 GLN 82 HG3 GLN 82 -14.883 -10.818 -14.766 466 HE21 GLN 82 HE21 GLN 82 -12.995 -11.727 -15.583 467 HE22 GLN 82 HE22 GLN 82 -11.645 -10.782 -16.101 468 H PHE 83 H PHE 83 -16.467 -6.987 -11.530 469 HA PHE 83 HA PHE 83 -17.818 -4.968 -13.094 470 HB2 PHE 83 HB2 PHE 83 -18.987 -6.538 -11.480 471 HB3 PHE 83 HB3 PHE 83 -18.241 -5.654 -10.154 472 HD1 PHE 83 HD1 PHE 83 -19.311 -3.633 -13.023 473 HD2 PHE 83 HD2 PHE 83 -20.600 -5.348 -9.318 474 HE1 PHE 83 HE1 PHE 83 -21.258 -2.133 -13.003 475 HE2 PHE 83 HE2 PHE 83 -22.538 -3.834 -9.309 476 HZ PHE 83 HZ PHE 83 -22.868 -2.232 -11.145 477 H GLU 84 H GLU 84 -17.073 -3.029 -13.286 478 HA GLU 84 HA GLU 84 -14.866 -1.851 -12.127 479 HB2 GLU 84 HB2 GLU 84 -15.670 0.230 -13.265 480 HB3 GLU 84 HB3 GLU 84 -15.710 -1.202 -14.291 481 HG2 GLU 84 HG2 GLU 84 -18.204 -1.405 -13.665 482 HG3 GLU 84 HG3 GLU 84 -18.060 0.220 -12.997 483 H ASP 85 H ASP 85 -18.201 -1.727 -11.088 484 HA ASP 85 HA ASP 85 -17.992 0.453 -9.267 485 HB2 ASP 85 HB2 ASP 85 -20.170 -0.226 -10.156 486 HB3 ASP 85 HB3 ASP 85 -20.007 -1.822 -9.446 487 H THR 86 H THR 86 -18.053 -3.107 -8.766 488 HA THR 86 HA THR 86 -17.790 -2.773 -5.876 489 HB THR 86 HB THR 86 -18.238 -5.250 -5.832 490 HG1 THR 86 HG1 THR 86 -17.372 -5.247 -8.249 491 HG21 THR 86 HG21 THR 86 -20.560 -5.152 -6.576 492 HG22 THR 86 HG22 THR 86 -20.210 -3.757 -7.602 493 HG23 THR 86 HG23 THR 86 -20.136 -3.599 -5.850 494 H ARG 87 H ARG 87 -15.569 -3.172 -8.394 495 HA ARG 87 HA ARG 87 -13.897 -5.284 -7.437 496 HB2 ARG 87 HB2 ARG 87 -12.249 -4.478 -9.092 497 HB3 ARG 87 HB3 ARG 87 -13.864 -4.588 -9.789 498 HG2 ARG 87 HG2 ARG 87 -14.146 -2.164 -9.600 499 HG3 ARG 87 HG3 ARG 87 -12.573 -2.018 -8.813 500 HD2 ARG 87 HD2 ARG 87 -11.473 -2.829 -10.868 501 HD3 ARG 87 HD3 ARG 87 -13.054 -2.973 -11.657 502 HE ARG 87 HE ARG 87 -13.035 -0.386 -10.861 503 HH11 ARG 87 HH11 ARG 87 -10.674 -2.239 -12.717 504 HH12 ARG 87 HH12 ARG 87 -10.122 -0.851 -13.595 505 HH21 ARG 87 HH21 ARG 87 -12.289 1.396 -12.027 506 HH22 ARG 87 HH22 ARG 87 -11.023 1.194 -13.195 507 H GLU 88 H GLU 88 -14.045 -1.887 -6.766 508 HA GLU 88 HA GLU 88 -11.364 -1.535 -5.832 509 HB2 GLU 88 HB2 GLU 88 -12.394 0.724 -4.974 510 HB3 GLU 88 HB3 GLU 88 -12.222 0.444 -6.697 511 HG2 GLU 88 HG2 GLU 88 -14.359 1.458 -6.353 512 HG3 GLU 88 HG3 GLU 88 -14.633 -0.215 -6.792 513 H SER 89 H SER 89 -14.408 -2.383 -4.314 514 HA SER 89 HA SER 89 -13.571 -2.009 -1.586 515 HB2 SER 89 HB2 SER 89 -15.966 -1.997 -2.260 516 HB3 SER 89 HB3 SER 89 -15.850 -3.693 -2.725 517 HG SER 89 HG SER 89 -15.109 -2.973 -0.111 518 H MET 90 H MET 90 -13.139 -4.495 -3.950 519 HA MET 90 HA MET 90 -12.754 -6.732 -2.188 520 HB2 MET 90 HB2 MET 90 -12.056 -6.382 -5.119 521 HB3 MET 90 HB3 MET 90 -12.014 -7.918 -4.248 522 HG2 MET 90 HG2 MET 90 -14.447 -6.205 -4.826 523 HG3 MET 90 HG3 MET 90 -14.076 -7.806 -5.481 524 HE1 MET 90 HE1 MET 90 -16.731 -8.242 -4.616 525 HE2 MET 90 HE2 MET 90 -16.768 -6.681 -3.796 526 HE3 MET 90 HE3 MET 90 -17.172 -8.153 -2.914 527 H HIS 91 H HIS 91 -10.822 -4.087 -2.692 528 HA HIS 91 HA HIS 91 -8.209 -5.126 -2.538 529 HB2 HIS 91 HB2 HIS 91 -7.523 -2.930 -1.934 530 HB3 HIS 91 HB3 HIS 91 -8.944 -2.678 -2.924 531 HD1 HIS 91 HD1 HIS 91 -7.454 -1.424 0.017 532 HD2 HIS 91 HD2 HIS 91 -11.372 -2.357 -1.021 533 HE1 HIS 91 HE1 HIS 91 -8.907 -0.202 1.671 534 HE2 HIS 91 HE2 HIS 91 -11.263 -0.759 1.007 535 H ALA 92 H ALA 92 -10.738 -4.754 -0.152 536 HA ALA 92 HA ALA 92 -9.114 -5.220 2.201 537 HB1 ALA 92 HB1 ALA 92 -11.275 -5.184 3.401 538 HB2 ALA 92 HB2 ALA 92 -12.137 -5.188 1.856 539 HB3 ALA 92 HB3 ALA 92 -11.134 -3.807 2.304 540 H PHE 93 H PHE 93 -11.093 -7.114 0.006 541 HA PHE 93 HA PHE 93 -11.165 -9.521 1.628 542 HB2 PHE 93 HB2 PHE 93 -11.944 -9.029 -1.287 543 HB3 PHE 93 HB3 PHE 93 -12.258 -10.516 -0.398 544 HD1 PHE 93 HD1 PHE 93 -13.074 -6.865 -0.472 545 HD2 PHE 93 HD2 PHE 93 -14.218 -10.722 0.965 546 HE1 PHE 93 HE1 PHE 93 -15.216 -5.938 0.297 547 HE2 PHE 93 HE2 PHE 93 -16.347 -9.774 1.746 548 HZ PHE 93 HZ PHE 93 -16.853 -7.405 1.412 549 H CYS 94 H CYS 94 -9.121 -8.143 -0.842 550 HA CYS 94 HA CYS 94 -7.681 -10.557 -1.507 551 HB2 CYS 94 HB2 CYS 94 -7.866 -8.675 -3.121 552 HB3 CYS 94 HB3 CYS 94 -6.942 -7.643 -2.033 553 HG CYS 94 HG CYS 94 -5.725 -10.509 -3.443 554 H VAL 95 H VAL 95 -6.546 -11.501 0.061 555 HA VAL 95 HA VAL 95 -5.235 -10.047 2.192 556 HB VAL 95 HB VAL 95 -6.305 -12.288 2.535 557 HG11 VAL 95 HG11 VAL 95 -5.179 -14.363 1.851 558 HG12 VAL 95 HG12 VAL 95 -3.968 -13.429 0.970 559 HG13 VAL 95 HG13 VAL 95 -5.654 -13.399 0.449 560 HG21 VAL 95 HG21 VAL 95 -4.590 -13.230 4.047 561 HG22 VAL 95 HG22 VAL 95 -4.670 -11.474 4.191 562 HG23 VAL 95 HG23 VAL 95 -3.353 -12.224 3.286 563 H GLY 96 H GLY 96 -4.375 -11.149 -0.981 564 HA2 GLY 96 HA2 GLY 96 -2.193 -9.648 -1.434 565 HA3 GLY 96 HA3 GLY 96 -1.491 -11.019 -0.577 566 H GLN 97 H GLN 97 -0.294 -11.410 -2.480 567 HA GLN 97 HA GLN 97 -1.487 -12.376 -4.921 568 HB2 GLN 97 HB2 GLN 97 1.354 -12.461 -3.823 569 HB3 GLN 97 HB3 GLN 97 0.919 -13.126 -5.397 570 HG2 GLN 97 HG2 GLN 97 0.624 -10.224 -4.585 571 HG3 GLN 97 HG3 GLN 97 1.959 -10.885 -5.529 572 HE21 GLN 97 HE21 GLN 97 1.512 -11.698 -7.651 573 HE22 GLN 97 HE22 GLN 97 0.135 -11.140 -8.528 574 H TYR 98 H TYR 98 -1.212 -14.549 -5.714 575 HA TYR 98 HA TYR 98 -0.644 -16.669 -3.723 576 HB2 TYR 98 HB2 TYR 98 -2.813 -16.981 -4.852 577 HB3 TYR 98 HB3 TYR 98 -2.059 -16.818 -6.429 578 HD1 TYR 98 HD1 TYR 98 -1.792 -18.981 -3.336 579 HD2 TYR 98 HD2 TYR 98 -1.578 -18.810 -7.597 580 HE1 TYR 98 HE1 TYR 98 -1.422 -21.403 -3.433 581 HE2 TYR 98 HE2 TYR 98 -1.204 -21.232 -7.681 582 HH TYR 98 HH TYR 98 -1.732 -23.260 -5.087 583 H LEU 99 H LEU 99 1.053 -18.070 -4.158 584 HA LEU 99 HA LEU 99 2.658 -17.709 -6.600 585 HB2 LEU 99 HB2 LEU 99 3.423 -16.447 -4.286 586 HB3 LEU 99 HB3 LEU 99 4.161 -18.005 -3.994 587 HG LEU 99 HG LEU 99 5.803 -16.504 -4.942 588 HD11 LEU 99 HD11 LEU 99 6.601 -17.706 -6.902 589 HD12 LEU 99 HD12 LEU 99 5.032 -18.494 -7.087 590 HD13 LEU 99 HD13 LEU 99 6.024 -18.820 -5.664 591 HD21 LEU 99 HD21 LEU 99 4.331 -14.894 -6.019 592 HD22 LEU 99 HD22 LEU 99 3.922 -16.062 -7.278 593 HD23 LEU 99 HD23 LEU 99 5.570 -15.441 -7.148 594 H GLU 100 H GLU 100 2.973 -19.666 -7.483 595 HA GLU 100 HA GLU 100 2.268 -22.109 -6.185 596 HB2 GLU 100 HB2 GLU 100 3.672 -21.633 -8.844 597 HB3 GLU 100 HB3 GLU 100 3.128 -23.189 -8.294 598 HG2 GLU 100 HG2 GLU 100 1.444 -22.611 -9.731 599 HG3 GLU 100 HG3 GLU 100 0.768 -22.070 -8.198 600 HA PRO 101 HA PRO 101 6.224 -23.214 -4.288 601 HB2 PRO 101 HB2 PRO 101 6.039 -25.998 -4.559 602 HB3 PRO 101 HB3 PRO 101 5.276 -25.061 -3.270 603 HG2 PRO 101 HG2 PRO 101 4.090 -26.045 -5.861 604 HG3 PRO 101 HG3 PRO 101 3.391 -26.088 -4.226 605 HD2 PRO 101 HD2 PRO 101 2.619 -24.221 -5.972 606 HD3 PRO 101 HD3 PRO 101 2.857 -23.790 -4.261 607 H ASP 102 H ASP 102 5.323 -24.546 -7.474 608 HA ASP 102 HA ASP 102 8.057 -25.216 -8.207 609 HB2 ASP 102 HB2 ASP 102 7.166 -26.177 -10.181 610 HB3 ASP 102 HB3 ASP 102 5.908 -26.463 -8.990 611 H GLN 103 H GLN 103 5.839 -22.533 -8.595 612 HA GLN 103 HA GLN 103 7.047 -21.245 -10.823 613 HB2 GLN 103 HB2 GLN 103 4.707 -20.808 -9.952 614 HB3 GLN 103 HB3 GLN 103 5.417 -19.932 -8.604 615 HG2 GLN 103 HG2 GLN 103 4.622 -18.361 -10.250 616 HG3 GLN 103 HG3 GLN 103 6.386 -18.298 -10.215 617 HE21 GLN 103 HE21 GLN 103 6.577 -17.461 -12.315 618 HE22 GLN 103 HE22 GLN 103 6.205 -18.391 -13.725 619 H GLU 104 H GLU 104 7.802 -21.343 -7.439 620 HA GLU 104 HA GLU 104 9.442 -19.059 -7.157 621 HB2 GLU 104 HB2 GLU 104 9.625 -21.739 -5.710 622 HB3 GLU 104 HB3 GLU 104 10.371 -20.232 -5.174 623 HG2 GLU 104 HG2 GLU 104 8.131 -19.224 -4.910 624 HG3 GLU 104 HG3 GLU 104 7.389 -20.737 -5.436 625 H GLY 105 H GLY 105 10.093 -22.276 -8.464 626 HA2 GLY 105 HA2 GLY 105 12.881 -21.482 -9.142 627 HA3 GLY 105 HA3 GLY 105 12.490 -23.070 -8.492 628 H VAL 106 H VAL 106 10.419 -21.403 -10.824 629 HA VAL 106 HA VAL 106 10.763 -23.605 -12.703 630 HB VAL 106 HB VAL 106 8.471 -22.717 -12.247 631 HG11 VAL 106 HG11 VAL 106 9.341 -20.213 -13.720 632 HG12 VAL 106 HG12 VAL 106 8.959 -20.325 -12.002 633 HG13 VAL 106 HG13 VAL 106 7.692 -20.583 -13.204 634 HG21 VAL 106 HG21 VAL 106 9.321 -22.463 -15.163 635 HG22 VAL 106 HG22 VAL 106 7.667 -22.713 -14.598 636 HG23 VAL 106 HG23 VAL 106 8.885 -23.962 -14.335 637 H THR 107 H THR 107 11.988 -23.570 -14.455 638 HA THR 107 HA THR 107 12.806 -21.031 -15.712 639 HB THR 107 HB THR 107 14.789 -21.730 -14.489 640 HG1 THR 107 HG1 THR 107 15.525 -20.987 -16.371 641 HG21 THR 107 HG21 THR 107 14.279 -24.125 -14.135 642 HG22 THR 107 HG22 THR 107 15.898 -23.918 -14.808 643 HG23 THR 107 HG23 THR 107 14.572 -24.446 -15.847 644 H ILE 108 H ILE 108 12.498 -21.020 -17.860 645 HA ILE 108 HA ILE 108 11.675 -23.500 -19.257 646 HB ILE 108 HB ILE 108 10.891 -20.599 -19.844 647 HG12 ILE 108 HG12 ILE 108 9.217 -22.931 -18.788 648 HG13 ILE 108 HG13 ILE 108 9.742 -21.539 -17.848 649 HG21 ILE 108 HG21 ILE 108 10.035 -23.127 -21.319 650 HG22 ILE 108 HG22 ILE 108 11.083 -21.856 -21.955 651 HG23 ILE 108 HG23 ILE 108 9.391 -21.509 -21.601 652 HD11 ILE 108 HD11 ILE 108 7.810 -21.490 -20.169 653 HD12 ILE 108 HD12 ILE 108 8.337 -20.085 -19.238 654 HD13 ILE 108 HD13 ILE 108 7.408 -21.363 -18.458 655 HA PRO 109 HA PRO 109 15.565 -22.747 -21.450 656 HB2 PRO 109 HB2 PRO 109 14.919 -25.069 -23.167 657 HB3 PRO 109 HB3 PRO 109 16.192 -24.906 -21.952 658 HG2 PRO 109 HG2 PRO 109 14.026 -26.525 -21.604 659 HG3 PRO 109 HG3 PRO 109 14.858 -25.735 -20.249 660 HD2 PRO 109 HD2 PRO 109 12.309 -24.911 -21.650 661 HD3 PRO 109 HD3 PRO 109 12.676 -24.960 -19.908 662 H ASP 110 H ASP 110 16.280 -22.105 -23.552 663 HA ASP 110 HA ASP 110 14.324 -20.819 -25.241 664 HB2 ASP 110 HB2 ASP 110 17.352 -21.134 -25.569 665 HB3 ASP 110 HB3 ASP 110 16.335 -20.203 -26.665 666 H LEU 111 H LEU 111 13.043 -22.526 -25.908 667 HA LEU 111 HA LEU 111 14.190 -24.609 -27.661 668 HB2 LEU 111 HB2 LEU 111 12.693 -25.317 -25.801 669 HB3 LEU 111 HB3 LEU 111 11.411 -24.311 -26.450 670 HG LEU 111 HG LEU 111 11.296 -25.758 -28.477 671 HD11 LEU 111 HD11 LEU 111 13.380 -27.484 -27.097 672 HD12 LEU 111 HD12 LEU 111 13.610 -26.550 -28.579 673 HD13 LEU 111 HD13 LEU 111 12.489 -27.907 -28.561 674 HD21 LEU 111 HD21 LEU 111 10.252 -27.713 -27.397 675 HD22 LEU 111 HD22 LEU 111 9.801 -26.216 -26.584 676 HD23 LEU 111 HD23 LEU 111 11.011 -27.281 -25.861 677 H GLY 112 H GLY 112 11.381 -22.411 -27.564 678 HA2 GLY 112 HA2 GLY 112 11.649 -20.800 -29.656 679 HA3 GLY 112 HA3 GLY 112 11.173 -22.281 -30.483 Start of MODEL 18 1 H GLU 21 H GLU 21 1.840 -2.443 3.045 2 HA GLU 21 HA GLU 21 1.770 -1.899 0.746 3 HB2 GLU 21 HB2 GLU 21 3.482 -0.058 0.885 4 HB3 GLU 21 HB3 GLU 21 4.747 -1.280 0.998 5 HG2 GLU 21 HG2 GLU 21 4.078 -2.137 -1.243 6 HG3 GLU 21 HG3 GLU 21 2.852 -0.877 -1.346 7 H LYS 22 H LYS 22 4.308 -3.464 2.646 8 HA LYS 22 HA LYS 22 5.208 -5.468 0.935 9 HB2 LYS 22 HB2 LYS 22 4.894 -5.563 3.974 10 HB3 LYS 22 HB3 LYS 22 5.864 -6.696 3.033 11 HG2 LYS 22 HG2 LYS 22 6.374 -3.705 3.220 12 HG3 LYS 22 HG3 LYS 22 7.206 -4.936 4.178 13 HD2 LYS 22 HD2 LYS 22 7.253 -4.768 1.135 14 HD3 LYS 22 HD3 LYS 22 8.520 -4.144 2.196 15 HE2 LYS 22 HE2 LYS 22 7.670 -7.061 1.990 16 HE3 LYS 22 HE3 LYS 22 9.112 -6.358 1.259 17 HZ1 LYS 22 HZ1 LYS 22 9.903 -5.807 3.494 18 HZ2 LYS 22 HZ2 LYS 22 9.669 -7.468 3.304 19 HZ3 LYS 22 HZ3 LYS 22 8.542 -6.552 4.169 20 H VAL 23 H VAL 23 3.827 -6.723 -0.197 21 HA VAL 23 HA VAL 23 1.246 -7.519 0.780 22 HB VAL 23 HB VAL 23 1.627 -6.866 -1.603 23 HG11 VAL 23 HG11 VAL 23 2.635 -8.440 -3.233 24 HG12 VAL 23 HG12 VAL 23 3.092 -9.522 -1.915 25 HG13 VAL 23 HG13 VAL 23 3.817 -7.917 -2.028 26 HG21 VAL 23 HG21 VAL 23 0.483 -9.669 -1.260 27 HG22 VAL 23 HG22 VAL 23 0.152 -8.588 -2.616 28 HG23 VAL 23 HG23 VAL 23 -0.384 -8.154 -0.991 29 H THR 24 H THR 24 0.575 -9.495 1.434 30 HA THR 24 HA THR 24 2.461 -11.464 2.333 31 HB THR 24 HB THR 24 -0.594 -11.560 2.233 32 HG1 THR 24 HG1 THR 24 -0.556 -10.435 4.056 33 HG21 THR 24 HG21 THR 24 1.353 -13.177 3.933 34 HG22 THR 24 HG22 THR 24 0.391 -13.811 2.596 35 HG23 THR 24 HG23 THR 24 -0.407 -13.227 4.058 36 H LEU 25 H LEU 25 3.425 -12.781 0.830 37 HA LEU 25 HA LEU 25 2.044 -13.704 -1.567 38 HB2 LEU 25 HB2 LEU 25 4.826 -14.291 -0.486 39 HB3 LEU 25 HB3 LEU 25 4.202 -14.935 -2.002 40 HG LEU 25 HG LEU 25 4.658 -11.984 -1.363 41 HD11 LEU 25 HD11 LEU 25 6.752 -13.192 -1.745 42 HD12 LEU 25 HD12 LEU 25 6.420 -12.073 -3.062 43 HD13 LEU 25 HD13 LEU 25 6.145 -13.802 -3.288 44 HD21 LEU 25 HD21 LEU 25 4.047 -11.531 -3.715 45 HD22 LEU 25 HD22 LEU 25 2.698 -12.218 -2.819 46 HD23 LEU 25 HD23 LEU 25 3.614 -13.229 -3.939 47 H VAL 26 H VAL 26 0.607 -15.245 -1.335 48 HA VAL 26 HA VAL 26 0.640 -17.060 0.944 49 HB VAL 26 HB VAL 26 -1.578 -16.461 -1.065 50 HG11 VAL 26 HG11 VAL 26 -3.097 -17.512 0.581 51 HG12 VAL 26 HG12 VAL 26 -1.713 -17.934 1.590 52 HG13 VAL 26 HG13 VAL 26 -1.886 -18.652 -0.013 53 HG21 VAL 26 HG21 VAL 26 -1.013 -14.429 0.213 54 HG22 VAL 26 HG22 VAL 26 -1.200 -15.309 1.732 55 HG23 VAL 26 HG23 VAL 26 -2.600 -15.042 0.689 56 H ARG 27 H ARG 27 1.157 -19.096 0.722 57 HA ARG 27 HA ARG 27 1.991 -20.343 -1.733 58 HB2 ARG 27 HB2 ARG 27 1.592 -21.488 1.069 59 HB3 ARG 27 HB3 ARG 27 2.496 -22.261 -0.229 60 HG2 ARG 27 HG2 ARG 27 4.302 -20.791 -0.061 61 HG3 ARG 27 HG3 ARG 27 3.333 -19.502 0.653 62 HD2 ARG 27 HD2 ARG 27 4.109 -22.070 2.085 63 HD3 ARG 27 HD3 ARG 27 4.952 -20.521 2.244 64 HE ARG 27 HE ARG 27 2.146 -20.273 2.801 65 HH11 ARG 27 HH11 ARG 27 5.172 -21.269 4.277 66 HH12 ARG 27 HH12 ARG 27 4.615 -20.962 5.888 67 HH21 ARG 27 HH21 ARG 27 1.446 -19.879 4.890 68 HH22 ARG 27 HH22 ARG 27 2.498 -20.171 6.240 69 H ILE 28 H ILE 28 1.109 -22.585 -2.392 70 HA ILE 28 HA ILE 28 -1.701 -22.410 -2.892 71 HB ILE 28 HB ILE 28 -0.270 -23.475 -4.539 72 HG12 ILE 28 HG12 ILE 28 -2.243 -25.527 -3.406 73 HG13 ILE 28 HG13 ILE 28 -2.657 -24.196 -4.482 74 HG21 ILE 28 HG21 ILE 28 1.435 -24.480 -3.112 75 HG22 ILE 28 HG22 ILE 28 0.785 -25.681 -4.227 76 HG23 ILE 28 HG23 ILE 28 0.279 -25.683 -2.536 77 HD11 ILE 28 HD11 ILE 28 -0.896 -26.553 -5.166 78 HD12 ILE 28 HD12 ILE 28 -1.282 -25.209 -6.246 79 HD13 ILE 28 HD13 ILE 28 -2.561 -26.285 -5.686 80 H ALA 29 H ALA 29 0.203 -24.468 -0.715 81 HA ALA 29 HA ALA 29 -1.969 -25.958 0.381 82 HB1 ALA 29 HB1 ALA 29 -0.376 -26.635 2.145 83 HB2 ALA 29 HB2 ALA 29 0.763 -25.402 1.594 84 HB3 ALA 29 HB3 ALA 29 0.355 -26.758 0.543 85 H ASP 30 H ASP 30 -0.629 -22.828 1.026 86 HA ASP 30 HA ASP 30 -1.340 -22.363 3.693 87 HB2 ASP 30 HB2 ASP 30 0.208 -21.045 2.095 88 HB3 ASP 30 HB3 ASP 30 -1.240 -20.239 1.521 89 H LEU 31 H LEU 31 -3.151 -21.800 0.670 90 HA LEU 31 HA LEU 31 -5.495 -20.609 1.658 91 HB2 LEU 31 HB2 LEU 31 -5.090 -22.502 -0.694 92 HB3 LEU 31 HB3 LEU 31 -6.672 -21.856 -0.302 93 HG LEU 31 HG LEU 31 -5.707 -19.525 -0.635 94 HD11 LEU 31 HD11 LEU 31 -3.389 -20.991 -1.910 95 HD12 LEU 31 HD12 LEU 31 -3.325 -20.038 -0.425 96 HD13 LEU 31 HD13 LEU 31 -3.691 -19.252 -1.959 97 HD21 LEU 31 HD21 LEU 31 -7.139 -20.595 -2.311 98 HD22 LEU 31 HD22 LEU 31 -5.732 -21.369 -3.047 99 HD23 LEU 31 HD23 LEU 31 -5.897 -19.609 -3.084 100 H GLU 32 H GLU 32 -4.628 -24.024 1.349 101 HA GLU 32 HA GLU 32 -7.171 -25.135 1.985 102 HB2 GLU 32 HB2 GLU 32 -4.463 -26.526 2.194 103 HB3 GLU 32 HB3 GLU 32 -6.040 -27.288 1.945 104 HG2 GLU 32 HG2 GLU 32 -6.167 -26.192 -0.292 105 HG3 GLU 32 HG3 GLU 32 -4.566 -25.499 -0.025 106 H ASN 33 H ASN 33 -4.213 -24.588 3.885 107 HA ASN 33 HA ASN 33 -5.097 -25.908 6.271 108 HB2 ASN 33 HB2 ASN 33 -2.775 -24.000 5.764 109 HB3 ASN 33 HB3 ASN 33 -3.091 -24.718 7.338 110 HD21 ASN 33 HD21 ASN 33 -1.787 -25.249 4.190 111 HD22 ASN 33 HD22 ASN 33 -1.251 -26.868 4.442 112 H HIS 34 H HIS 34 -5.007 -22.504 5.210 113 HA HIS 34 HA HIS 34 -6.009 -21.362 7.628 114 HB2 HIS 34 HB2 HIS 34 -4.855 -20.066 5.771 115 HB3 HIS 34 HB3 HIS 34 -6.323 -20.214 4.811 116 HD1 HIS 34 HD1 HIS 34 -8.281 -18.652 5.422 117 HD2 HIS 34 HD2 HIS 34 -5.064 -18.337 8.019 118 HE1 HIS 34 HE1 HIS 34 -8.779 -16.662 6.861 119 HE2 HIS 34 HE2 HIS 34 -6.736 -16.396 8.304 120 H ASN 35 H ASN 35 -7.515 -22.740 4.771 121 HA ASN 35 HA ASN 35 -10.233 -22.117 5.262 122 HB2 ASN 35 HB2 ASN 35 -9.563 -22.862 3.063 123 HB3 ASN 35 HB3 ASN 35 -8.899 -24.358 3.698 124 HD21 ASN 35 HD21 ASN 35 -10.289 -26.080 4.147 125 HD22 ASN 35 HD22 ASN 35 -11.949 -26.094 3.674 126 H ASN 36 H ASN 36 -8.231 -24.922 6.180 127 HA ASN 36 HA ASN 36 -10.228 -26.440 7.510 128 HB2 ASN 36 HB2 ASN 36 -8.030 -27.380 6.753 129 HB3 ASN 36 HB3 ASN 36 -7.209 -26.432 7.990 130 HD21 ASN 36 HD21 ASN 36 -6.372 -28.209 9.083 131 HD22 ASN 36 HD22 ASN 36 -7.344 -29.340 9.954 132 H ASP 37 H ASP 37 -8.133 -23.819 8.530 133 HA ASP 37 HA ASP 37 -8.558 -23.877 11.345 134 HB2 ASP 37 HB2 ASP 37 -6.683 -22.647 10.269 135 HB3 ASP 37 HB3 ASP 37 -7.819 -21.566 9.483 136 H GLY 38 H GLY 38 -10.316 -22.427 8.653 137 HA2 GLY 38 HA2 GLY 38 -12.803 -22.336 9.046 138 HA3 GLY 38 HA3 GLY 38 -12.429 -21.391 10.478 139 H GLY 39 H GLY 39 -10.617 -20.991 7.521 140 HA2 GLY 39 HA2 GLY 39 -12.007 -18.451 6.879 141 HA3 GLY 39 HA3 GLY 39 -10.257 -18.495 7.083 142 H PHE 40 H PHE 40 -12.849 -19.016 4.904 143 HA PHE 40 HA PHE 40 -11.596 -21.016 3.252 144 HB2 PHE 40 HB2 PHE 40 -14.130 -20.650 3.563 145 HB3 PHE 40 HB3 PHE 40 -13.981 -19.246 2.521 146 HD1 PHE 40 HD1 PHE 40 -12.689 -19.836 0.145 147 HD2 PHE 40 HD2 PHE 40 -14.877 -22.627 2.544 148 HE1 PHE 40 HE1 PHE 40 -13.031 -21.269 -1.826 149 HE2 PHE 40 HE2 PHE 40 -15.207 -24.052 0.561 150 HZ PHE 40 HZ PHE 40 -14.289 -23.374 -1.617 151 H TRP 41 H TRP 41 -9.789 -20.412 2.190 152 HA TRP 41 HA TRP 41 -9.629 -17.800 0.828 153 HB2 TRP 41 HB2 TRP 41 -7.530 -19.732 1.860 154 HB3 TRP 41 HB3 TRP 41 -7.115 -18.610 0.572 155 HD1 TRP 41 HD1 TRP 41 -9.455 -16.856 2.790 156 HE1 TRP 41 HE1 TRP 41 -8.210 -15.310 4.400 157 HE3 TRP 41 HE3 TRP 41 -4.713 -18.671 2.173 158 HZ2 TRP 41 HZ2 TRP 41 -5.586 -14.875 5.297 159 HZ3 TRP 41 HZ3 TRP 41 -2.884 -17.626 3.454 160 HH2 TRP 41 HH2 TRP 41 -3.313 -15.766 4.987 161 H THR 42 H THR 42 -9.678 -17.669 -1.272 162 HA THR 42 HA THR 42 -9.303 -20.034 -3.013 163 HB THR 42 HB THR 42 -11.734 -19.469 -2.851 164 HG1 THR 42 HG1 THR 42 -11.360 -20.285 -4.808 165 HG21 THR 42 HG21 THR 42 -11.586 -17.040 -2.414 166 HG22 THR 42 HG22 THR 42 -12.604 -17.369 -3.815 167 HG23 THR 42 HG23 THR 42 -10.959 -16.773 -4.046 168 H VAL 43 H VAL 43 -8.182 -19.632 -4.927 169 HA VAL 43 HA VAL 43 -6.819 -17.024 -5.118 170 HB VAL 43 HB VAL 43 -5.198 -18.750 -5.154 171 HG11 VAL 43 HG11 VAL 43 -5.186 -20.686 -6.692 172 HG12 VAL 43 HG12 VAL 43 -6.768 -20.203 -7.314 173 HG13 VAL 43 HG13 VAL 43 -6.598 -20.701 -5.630 174 HG21 VAL 43 HG21 VAL 43 -4.815 -16.955 -6.807 175 HG22 VAL 43 HG22 VAL 43 -5.640 -17.904 -8.047 176 HG23 VAL 43 HG23 VAL 43 -4.120 -18.479 -7.362 177 H ILE 44 H ILE 44 -7.798 -15.574 -6.323 178 HA ILE 44 HA ILE 44 -9.014 -16.328 -8.921 179 HB ILE 44 HB ILE 44 -9.885 -14.022 -7.107 180 HG12 ILE 44 HG12 ILE 44 -11.361 -16.641 -7.669 181 HG13 ILE 44 HG13 ILE 44 -10.537 -16.255 -6.163 182 HG21 ILE 44 HG21 ILE 44 -11.757 -13.738 -8.695 183 HG22 ILE 44 HG22 ILE 44 -11.105 -15.030 -9.705 184 HG23 ILE 44 HG23 ILE 44 -10.199 -13.529 -9.499 185 HD11 ILE 44 HD11 ILE 44 -12.952 -14.833 -7.283 186 HD12 ILE 44 HD12 ILE 44 -12.126 -14.426 -5.775 187 HD13 ILE 44 HD13 ILE 44 -12.925 -15.988 -5.951 188 H ASP 45 H ASP 45 -7.752 -15.617 -10.505 189 HA ASP 45 HA ASP 45 -6.581 -14.314 -11.927 190 HB2 ASP 45 HB2 ASP 45 -8.551 -12.798 -11.504 191 HB3 ASP 45 HB3 ASP 45 -7.609 -11.973 -10.267 192 H GLY 46 H GLY 46 -5.168 -15.380 -9.653 193 HA2 GLY 46 HA2 GLY 46 -2.898 -15.417 -9.123 194 HA3 GLY 46 HA3 GLY 46 -2.697 -13.846 -9.873 195 H LYS 47 H LYS 47 -5.268 -13.756 -7.744 196 HA LYS 47 HA LYS 47 -3.648 -12.789 -5.450 197 HB2 LYS 47 HB2 LYS 47 -6.444 -11.913 -6.325 198 HB3 LYS 47 HB3 LYS 47 -5.565 -11.294 -4.926 199 HG2 LYS 47 HG2 LYS 47 -4.598 -11.006 -7.784 200 HG3 LYS 47 HG3 LYS 47 -5.621 -9.807 -6.980 201 HD2 LYS 47 HD2 LYS 47 -3.897 -9.409 -5.292 202 HD3 LYS 47 HD3 LYS 47 -2.876 -10.684 -5.977 203 HE2 LYS 47 HE2 LYS 47 -2.164 -8.391 -6.650 204 HE3 LYS 47 HE3 LYS 47 -2.585 -9.405 -8.030 205 HZ1 LYS 47 HZ1 LYS 47 -3.488 -7.156 -8.205 206 HZ2 LYS 47 HZ2 LYS 47 -4.384 -7.394 -6.795 207 HZ3 LYS 47 HZ3 LYS 47 -4.715 -8.321 -8.169 208 H VAL 48 H VAL 48 -4.692 -13.146 -3.348 209 HA VAL 48 HA VAL 48 -6.519 -15.476 -3.297 210 HB VAL 48 HB VAL 48 -4.496 -14.632 -1.165 211 HG11 VAL 48 HG11 VAL 48 -5.126 -16.728 0.018 212 HG12 VAL 48 HG12 VAL 48 -6.381 -17.034 -1.184 213 HG13 VAL 48 HG13 VAL 48 -6.505 -15.633 -0.117 214 HG21 VAL 48 HG21 VAL 48 -4.494 -17.007 -3.067 215 HG22 VAL 48 HG22 VAL 48 -3.333 -16.750 -1.766 216 HG23 VAL 48 HG23 VAL 48 -3.399 -15.622 -3.119 217 H TYR 49 H TYR 49 -8.464 -15.080 -2.584 218 HA TYR 49 HA TYR 49 -9.076 -12.711 -0.910 219 HB2 TYR 49 HB2 TYR 49 -10.882 -14.113 -2.947 220 HB3 TYR 49 HB3 TYR 49 -11.324 -12.720 -1.964 221 HD1 TYR 49 HD1 TYR 49 -9.256 -13.861 -4.815 222 HD2 TYR 49 HD2 TYR 49 -10.605 -10.457 -2.608 223 HE1 TYR 49 HE1 TYR 49 -8.392 -12.374 -6.564 224 HE2 TYR 49 HE2 TYR 49 -9.735 -8.980 -4.374 225 HH TYR 49 HH TYR 49 -8.654 -10.161 -7.410 226 H ASP 50 H ASP 50 -10.744 -13.026 0.699 227 HA ASP 50 HA ASP 50 -11.129 -15.836 1.516 228 HB2 ASP 50 HB2 ASP 50 -10.271 -14.036 3.159 229 HB3 ASP 50 HB3 ASP 50 -11.904 -13.387 3.162 230 H ILE 51 H ILE 51 -13.221 -16.627 1.990 231 HA ILE 51 HA ILE 51 -15.334 -15.438 0.307 232 HB ILE 51 HB ILE 51 -14.562 -18.336 0.802 233 HG12 ILE 51 HG12 ILE 51 -13.351 -17.207 -1.011 234 HG13 ILE 51 HG13 ILE 51 -14.429 -18.420 -1.689 235 HG21 ILE 51 HG21 ILE 51 -16.528 -19.078 -0.525 236 HG22 ILE 51 HG22 ILE 51 -17.159 -17.431 -0.483 237 HG23 ILE 51 HG23 ILE 51 -16.989 -18.346 1.015 238 HD11 ILE 51 HD11 ILE 51 -14.921 -15.438 -1.637 239 HD12 ILE 51 HD12 ILE 51 -16.020 -16.650 -2.309 240 HD13 ILE 51 HD13 ILE 51 -14.427 -16.408 -3.024 241 H LYS 52 H LYS 52 -14.695 -16.960 3.476 242 HA LYS 52 HA LYS 52 -17.480 -16.835 4.231 243 HB2 LYS 52 HB2 LYS 52 -16.725 -17.392 6.541 244 HB3 LYS 52 HB3 LYS 52 -16.177 -18.526 5.328 245 HG2 LYS 52 HG2 LYS 52 -14.335 -18.332 6.739 246 HG3 LYS 52 HG3 LYS 52 -13.933 -17.252 5.406 247 HD2 LYS 52 HD2 LYS 52 -14.725 -15.320 6.812 248 HD3 LYS 52 HD3 LYS 52 -14.982 -16.447 8.149 249 HE2 LYS 52 HE2 LYS 52 -12.555 -17.006 8.096 250 HE3 LYS 52 HE3 LYS 52 -12.326 -15.825 6.800 251 HZ1 LYS 52 HZ1 LYS 52 -13.234 -15.275 9.567 252 HZ2 LYS 52 HZ2 LYS 52 -13.160 -14.129 8.329 253 HZ3 LYS 52 HZ3 LYS 52 -11.747 -14.861 8.877 254 H ASP 53 H ASP 53 -14.735 -14.654 4.434 255 HA ASP 53 HA ASP 53 -15.965 -12.578 5.957 256 HB2 ASP 53 HB2 ASP 53 -13.625 -12.608 4.013 257 HB3 ASP 53 HB3 ASP 53 -14.137 -11.133 4.806 258 H PHE 54 H PHE 54 -15.696 -13.262 2.483 259 HA PHE 54 HA PHE 54 -17.101 -11.146 1.337 260 HB2 PHE 54 HB2 PHE 54 -15.952 -12.864 0.011 261 HB3 PHE 54 HB3 PHE 54 -17.031 -14.107 0.607 262 HD1 PHE 54 HD1 PHE 54 -19.543 -13.958 -0.090 263 HD2 PHE 54 HD2 PHE 54 -16.432 -11.768 -2.044 264 HE1 PHE 54 HE1 PHE 54 -20.970 -13.700 -2.071 265 HE2 PHE 54 HE2 PHE 54 -17.871 -11.524 -4.023 266 HZ PHE 54 HZ PHE 54 -20.134 -12.478 -4.037 267 H GLN 55 H GLN 55 -18.376 -14.226 2.584 268 HA GLN 55 HA GLN 55 -21.096 -13.721 1.973 269 HB2 GLN 55 HB2 GLN 55 -19.808 -15.768 3.793 270 HB3 GLN 55 HB3 GLN 55 -21.522 -15.761 3.380 271 HG2 GLN 55 HG2 GLN 55 -20.960 -16.057 1.009 272 HG3 GLN 55 HG3 GLN 55 -19.246 -16.045 1.400 273 HE21 GLN 55 HE21 GLN 55 -22.202 -17.888 1.563 274 HE22 GLN 55 HE22 GLN 55 -21.477 -19.400 1.976 275 H THR 56 H THR 56 -19.176 -13.115 4.852 276 HA THR 56 HA THR 56 -21.177 -12.420 6.694 277 HB THR 56 HB THR 56 -18.420 -11.153 6.342 278 HG1 THR 56 HG1 THR 56 -17.699 -12.753 7.642 279 HG21 THR 56 HG21 THR 56 -18.575 -10.540 8.744 280 HG22 THR 56 HG22 THR 56 -20.233 -11.136 8.792 281 HG23 THR 56 HG23 THR 56 -19.831 -9.733 7.799 282 H GLN 57 H GLN 57 -19.538 -10.412 4.238 283 HA GLN 57 HA GLN 57 -21.172 -8.078 4.663 284 HB2 GLN 57 HB2 GLN 57 -19.196 -8.775 2.452 285 HB3 GLN 57 HB3 GLN 57 -19.941 -7.196 2.668 286 HG2 GLN 57 HG2 GLN 57 -18.050 -8.564 4.615 287 HG3 GLN 57 HG3 GLN 57 -17.642 -7.232 3.533 288 HE21 GLN 57 HE21 GLN 57 -17.454 -7.372 6.434 289 HE22 GLN 57 HE22 GLN 57 -18.422 -6.084 7.054 290 H SER 58 H SER 58 -21.503 -10.975 2.791 291 HA SER 58 HA SER 58 -23.305 -9.912 0.808 292 HB2 SER 58 HB2 SER 58 -21.952 -11.936 0.365 293 HB3 SER 58 HB3 SER 58 -22.859 -12.816 1.597 294 HG SER 58 HG SER 58 -23.972 -11.632 -0.743 295 H LEU 59 H LEU 59 -23.632 -11.078 4.067 296 HA LEU 59 HA LEU 59 -26.537 -11.223 3.985 297 HB2 LEU 59 HB2 LEU 59 -24.607 -11.256 6.350 298 HB3 LEU 59 HB3 LEU 59 -26.337 -11.581 6.448 299 HG LEU 59 HG LEU 59 -24.252 -13.291 5.016 300 HD11 LEU 59 HD11 LEU 59 -24.758 -15.000 6.693 301 HD12 LEU 59 HD12 LEU 59 -25.893 -13.909 7.494 302 HD13 LEU 59 HD13 LEU 59 -24.171 -13.521 7.452 303 HD21 LEU 59 HD21 LEU 59 -26.069 -14.894 4.545 304 HD22 LEU 59 HD22 LEU 59 -26.336 -13.350 3.743 305 HD23 LEU 59 HD23 LEU 59 -27.251 -13.753 5.197 306 H THR 60 H THR 60 -24.609 -8.644 3.631 307 HA THR 60 HA THR 60 -26.151 -6.785 5.341 308 HB THR 60 HB THR 60 -23.568 -6.289 3.792 309 HG1 THR 60 HG1 THR 60 -24.059 -7.394 6.291 310 HG21 THR 60 HG21 THR 60 -24.851 -4.216 4.256 311 HG22 THR 60 HG22 THR 60 -23.351 -4.275 5.186 312 HG23 THR 60 HG23 THR 60 -24.891 -4.625 5.973 313 H GLU 61 H GLU 61 -27.480 -5.267 4.377 314 HA GLU 61 HA GLU 61 -28.405 -5.818 1.719 315 HB2 GLU 61 HB2 GLU 61 -30.137 -4.083 2.224 316 HB3 GLU 61 HB3 GLU 61 -30.033 -5.347 3.444 317 HG2 GLU 61 HG2 GLU 61 -28.816 -3.865 4.950 318 HG3 GLU 61 HG3 GLU 61 -28.748 -2.609 3.716 319 H ASN 62 H ASN 62 -26.659 -3.080 3.201 320 HA ASN 62 HA ASN 62 -26.731 -1.469 0.771 321 HB2 ASN 62 HB2 ASN 62 -25.536 -1.013 3.532 322 HB3 ASN 62 HB3 ASN 62 -25.179 0.081 2.197 323 HD21 ASN 62 HD21 ASN 62 -27.706 -1.121 4.322 324 HD22 ASN 62 HD22 ASN 62 -28.845 0.134 4.007 325 H SER 63 H SER 63 -24.909 -4.097 1.616 326 HA SER 63 HA SER 63 -22.438 -3.324 0.312 327 HB2 SER 63 HB2 SER 63 -23.537 -6.065 1.110 328 HB3 SER 63 HB3 SER 63 -21.922 -5.785 0.466 329 HG SER 63 HG SER 63 -22.165 -5.889 2.820 330 H ILE 64 H ILE 64 -21.808 -3.935 -1.755 331 HA ILE 64 HA ILE 64 -23.548 -4.187 -3.914 332 HB ILE 64 HB ILE 64 -21.557 -5.176 -5.173 333 HG12 ILE 64 HG12 ILE 64 -20.043 -4.756 -2.551 334 HG13 ILE 64 HG13 ILE 64 -20.601 -6.331 -3.095 335 HG21 ILE 64 HG21 ILE 64 -20.202 -3.106 -5.101 336 HG22 ILE 64 HG22 ILE 64 -21.029 -2.616 -3.620 337 HG23 ILE 64 HG23 ILE 64 -21.933 -2.756 -5.128 338 HD11 ILE 64 HD11 ILE 64 -18.612 -4.571 -4.482 339 HD12 ILE 64 HD12 ILE 64 -19.193 -6.129 -5.077 340 HD13 ILE 64 HD13 ILE 64 -18.284 -6.040 -3.569 341 H LEU 65 H LEU 65 -22.388 -6.618 -1.691 342 HA LEU 65 HA LEU 65 -22.815 -8.939 -3.319 343 HB2 LEU 65 HB2 LEU 65 -22.416 -8.741 -0.324 344 HB3 LEU 65 HB3 LEU 65 -22.214 -10.187 -1.311 345 HG LEU 65 HG LEU 65 -20.476 -7.691 -1.324 346 HD11 LEU 65 HD11 LEU 65 -20.045 -9.173 0.556 347 HD12 LEU 65 HD12 LEU 65 -18.695 -9.208 -0.574 348 HD13 LEU 65 HD13 LEU 65 -19.842 -10.552 -0.529 349 HD21 LEU 65 HD21 LEU 65 -19.084 -8.827 -3.019 350 HD22 LEU 65 HD22 LEU 65 -20.688 -8.440 -3.621 351 HD23 LEU 65 HD23 LEU 65 -20.298 -10.100 -3.165 352 H ALA 66 H ALA 66 -25.027 -6.958 -1.828 353 HA ALA 66 HA ALA 66 -27.036 -8.731 -0.937 354 HB1 ALA 66 HB1 ALA 66 -27.062 -6.305 -0.478 355 HB2 ALA 66 HB2 ALA 66 -28.564 -6.821 -1.248 356 HB3 ALA 66 HB3 ALA 66 -27.332 -5.976 -2.192 357 H GLN 67 H GLN 67 -26.271 -7.401 -4.159 358 HA GLN 67 HA GLN 67 -28.500 -8.656 -5.521 359 HB2 GLN 67 HB2 GLN 67 -27.572 -7.732 -7.564 360 HB3 GLN 67 HB3 GLN 67 -27.435 -6.512 -6.304 361 HG2 GLN 67 HG2 GLN 67 -25.017 -7.296 -6.005 362 HG3 GLN 67 HG3 GLN 67 -25.230 -8.221 -7.482 363 HE21 GLN 67 HE21 GLN 67 -25.056 -4.998 -6.112 364 HE22 GLN 67 HE22 GLN 67 -24.720 -4.172 -7.594 365 H PHE 68 H PHE 68 -25.324 -9.645 -4.576 366 HA PHE 68 HA PHE 68 -25.120 -11.865 -6.493 367 HB2 PHE 68 HB2 PHE 68 -23.216 -10.874 -4.312 368 HB3 PHE 68 HB3 PHE 68 -22.877 -12.230 -5.380 369 HD1 PHE 68 HD1 PHE 68 -22.984 -11.702 -7.977 370 HD2 PHE 68 HD2 PHE 68 -22.415 -8.722 -4.967 371 HE1 PHE 68 HE1 PHE 68 -21.981 -10.188 -9.643 372 HE2 PHE 68 HE2 PHE 68 -21.417 -7.220 -6.637 373 HZ PHE 68 HZ PHE 68 -21.200 -7.952 -8.978 374 H ALA 69 H ALA 69 -26.793 -11.421 -3.687 375 HA ALA 69 HA ALA 69 -26.214 -13.753 -2.147 376 HB1 ALA 69 HB1 ALA 69 -28.349 -13.280 -1.020 377 HB2 ALA 69 HB2 ALA 69 -28.783 -12.128 -2.286 378 HB3 ALA 69 HB3 ALA 69 -27.416 -11.795 -1.217 379 H GLY 70 H GLY 70 -26.467 -15.792 -2.890 380 HA2 GLY 70 HA2 GLY 70 -28.007 -17.585 -3.505 381 HA3 GLY 70 HA3 GLY 70 -28.763 -16.496 -4.665 382 H GLU 71 H GLU 71 -26.165 -15.406 -5.507 383 HA GLU 71 HA GLU 71 -25.345 -17.399 -7.455 384 HB2 GLU 71 HB2 GLU 71 -25.537 -14.933 -7.981 385 HB3 GLU 71 HB3 GLU 71 -24.201 -14.611 -6.884 386 HG2 GLU 71 HG2 GLU 71 -23.447 -14.601 -9.206 387 HG3 GLU 71 HG3 GLU 71 -22.690 -15.919 -8.312 388 H ASP 72 H ASP 72 -23.135 -18.230 -7.615 389 HA ASP 72 HA ASP 72 -22.093 -19.228 -5.189 390 HB2 ASP 72 HB2 ASP 72 -21.736 -20.400 -7.325 391 HB3 ASP 72 HB3 ASP 72 -20.811 -19.055 -7.943 392 HA PRO 73 HA PRO 73 -20.059 -15.560 -3.596 393 HB2 PRO 73 HB2 PRO 73 -18.226 -17.512 -2.195 394 HB3 PRO 73 HB3 PRO 73 -19.167 -16.166 -1.528 395 HG2 PRO 73 HG2 PRO 73 -20.003 -18.668 -1.190 396 HG3 PRO 73 HG3 PRO 73 -21.171 -17.377 -1.551 397 HD2 PRO 73 HD2 PRO 73 -20.041 -19.485 -3.392 398 HD3 PRO 73 HD3 PRO 73 -21.703 -18.863 -3.275 399 H VAL 74 H VAL 74 -18.038 -18.140 -4.923 400 HA VAL 74 HA VAL 74 -15.662 -16.540 -5.180 401 HB VAL 74 HB VAL 74 -16.320 -19.204 -6.523 402 HG11 VAL 74 HG11 VAL 74 -13.863 -19.438 -6.829 403 HG12 VAL 74 HG12 VAL 74 -13.626 -17.823 -6.154 404 HG13 VAL 74 HG13 VAL 74 -14.490 -18.022 -7.680 405 HG21 VAL 74 HG21 VAL 74 -15.006 -20.257 -4.699 406 HG22 VAL 74 HG22 VAL 74 -16.403 -19.391 -4.057 407 HG23 VAL 74 HG23 VAL 74 -14.793 -18.678 -3.932 408 H VAL 75 H VAL 75 -18.166 -17.717 -7.500 409 HA VAL 75 HA VAL 75 -16.981 -16.495 -9.801 410 HB VAL 75 HB VAL 75 -18.692 -18.454 -9.749 411 HG11 VAL 75 HG11 VAL 75 -20.713 -16.194 -9.838 412 HG12 VAL 75 HG12 VAL 75 -20.469 -17.285 -8.478 413 HG13 VAL 75 HG13 VAL 75 -21.059 -17.919 -10.012 414 HG21 VAL 75 HG21 VAL 75 -19.058 -16.282 -11.838 415 HG22 VAL 75 HG22 VAL 75 -19.514 -17.980 -12.012 416 HG23 VAL 75 HG23 VAL 75 -17.813 -17.537 -11.848 417 H ALA 76 H ALA 76 -19.209 -15.408 -7.387 418 HA ALA 76 HA ALA 76 -20.228 -13.065 -8.658 419 HB1 ALA 76 HB1 ALA 76 -20.987 -12.473 -6.371 420 HB2 ALA 76 HB2 ALA 76 -20.014 -13.791 -5.709 421 HB3 ALA 76 HB3 ALA 76 -21.379 -14.147 -6.770 422 H LEU 77 H LEU 77 -17.488 -13.819 -6.581 423 HA LEU 77 HA LEU 77 -16.467 -11.171 -6.273 424 HB2 LEU 77 HB2 LEU 77 -16.095 -13.330 -4.855 425 HB3 LEU 77 HB3 LEU 77 -14.848 -13.730 -6.016 426 HG LEU 77 HG LEU 77 -14.836 -11.175 -4.354 427 HD11 LEU 77 HD11 LEU 77 -13.256 -12.256 -2.830 428 HD12 LEU 77 HD12 LEU 77 -13.423 -13.782 -3.704 429 HD13 LEU 77 HD13 LEU 77 -14.806 -13.098 -2.842 430 HD21 LEU 77 HD21 LEU 77 -12.563 -12.501 -5.877 431 HD22 LEU 77 HD22 LEU 77 -12.440 -11.045 -4.884 432 HD23 LEU 77 HD23 LEU 77 -13.411 -11.027 -6.353 433 H GLU 78 H GLU 78 -15.904 -13.818 -8.573 434 HA GLU 78 HA GLU 78 -13.642 -12.801 -9.961 435 HB2 GLU 78 HB2 GLU 78 -15.831 -14.730 -10.869 436 HB3 GLU 78 HB3 GLU 78 -14.357 -14.415 -11.788 437 HG2 GLU 78 HG2 GLU 78 -13.019 -15.288 -9.889 438 HG3 GLU 78 HG3 GLU 78 -14.501 -15.646 -9.016 439 H ALA 79 H ALA 79 -17.118 -12.679 -10.720 440 HA ALA 79 HA ALA 79 -16.969 -11.024 -13.030 441 HB1 ALA 79 HB1 ALA 79 -19.410 -10.803 -12.782 442 HB2 ALA 79 HB2 ALA 79 -19.317 -11.491 -11.157 443 HB3 ALA 79 HB3 ALA 79 -18.906 -12.480 -12.558 444 H ALA 80 H ALA 80 -17.133 -10.376 -9.595 445 HA ALA 80 HA ALA 80 -17.769 -7.598 -9.711 446 HB1 ALA 80 HB1 ALA 80 -17.101 -7.533 -7.357 447 HB2 ALA 80 HB2 ALA 80 -16.403 -9.153 -7.498 448 HB3 ALA 80 HB3 ALA 80 -18.142 -8.919 -7.688 449 H LEU 81 H LEU 81 -14.697 -9.402 -9.724 450 HA LEU 81 HA LEU 81 -12.925 -7.202 -9.466 451 HB2 LEU 81 HB2 LEU 81 -12.590 -9.921 -10.768 452 HB3 LEU 81 HB3 LEU 81 -11.276 -8.753 -10.698 453 HG LEU 81 HG LEU 81 -12.638 -10.078 -8.316 454 HD11 LEU 81 HD11 LEU 81 -10.465 -11.146 -7.944 455 HD12 LEU 81 HD12 LEU 81 -9.815 -10.373 -9.393 456 HD13 LEU 81 HD13 LEU 81 -11.115 -11.561 -9.529 457 HD21 LEU 81 HD21 LEU 81 -10.969 -8.906 -6.915 458 HD22 LEU 81 HD22 LEU 81 -12.055 -7.779 -7.723 459 HD23 LEU 81 HD23 LEU 81 -10.410 -8.005 -8.329 460 H GLN 82 H GLN 82 -14.540 -8.649 -12.231 461 HA GLN 82 HA GLN 82 -13.330 -7.097 -14.274 462 HB2 GLN 82 HB2 GLN 82 -14.542 -9.168 -14.784 463 HB3 GLN 82 HB3 GLN 82 -16.036 -8.494 -14.145 464 HG2 GLN 82 HG2 GLN 82 -16.022 -6.803 -15.982 465 HG3 GLN 82 HG3 GLN 82 -14.569 -7.562 -16.637 466 HE21 GLN 82 HE21 GLN 82 -15.621 -8.037 -18.588 467 HE22 GLN 82 HE22 GLN 82 -16.801 -9.294 -18.720 468 H PHE 83 H PHE 83 -16.318 -6.662 -12.340 469 HA PHE 83 HA PHE 83 -17.061 -4.257 -13.777 470 HB2 PHE 83 HB2 PHE 83 -18.741 -5.931 -13.002 471 HB3 PHE 83 HB3 PHE 83 -18.369 -5.509 -11.334 472 HD1 PHE 83 HD1 PHE 83 -19.030 -3.495 -14.457 473 HD2 PHE 83 HD2 PHE 83 -20.137 -4.280 -10.410 474 HE1 PHE 83 HE1 PHE 83 -20.749 -1.745 -14.584 475 HE2 PHE 83 HE2 PHE 83 -21.857 -2.530 -10.542 476 HZ PHE 83 HZ PHE 83 -22.168 -1.268 -12.631 477 H GLU 84 H GLU 84 -16.468 -2.312 -13.278 478 HA GLU 84 HA GLU 84 -14.388 -1.655 -11.599 479 HB2 GLU 84 HB2 GLU 84 -15.007 0.744 -12.195 480 HB3 GLU 84 HB3 GLU 84 -14.762 -0.363 -13.543 481 HG2 GLU 84 HG2 GLU 84 -17.198 -0.606 -13.823 482 HG3 GLU 84 HG3 GLU 84 -17.477 0.454 -12.437 483 H ASP 85 H ASP 85 -17.845 -1.331 -10.902 484 HA ASP 85 HA ASP 85 -17.484 0.356 -8.577 485 HB2 ASP 85 HB2 ASP 85 -19.944 -1.130 -9.602 486 HB3 ASP 85 HB3 ASP 85 -19.960 0.020 -8.265 487 H THR 86 H THR 86 -17.835 -3.078 -9.178 488 HA THR 86 HA THR 86 -18.367 -3.709 -6.363 489 HB THR 86 HB THR 86 -18.636 -6.076 -7.297 490 HG1 THR 86 HG1 THR 86 -17.396 -5.369 -9.296 491 HG21 THR 86 HG21 THR 86 -20.603 -4.634 -6.878 492 HG22 THR 86 HG22 THR 86 -20.841 -5.642 -8.304 493 HG23 THR 86 HG23 THR 86 -20.437 -3.933 -8.493 494 H ARG 87 H ARG 87 -15.634 -3.545 -8.446 495 HA ARG 87 HA ARG 87 -14.018 -5.620 -7.234 496 HB2 ARG 87 HB2 ARG 87 -12.151 -4.692 -8.506 497 HB3 ARG 87 HB3 ARG 87 -13.578 -4.703 -9.545 498 HG2 ARG 87 HG2 ARG 87 -13.913 -2.312 -9.167 499 HG3 ARG 87 HG3 ARG 87 -12.566 -2.273 -8.031 500 HD2 ARG 87 HD2 ARG 87 -11.042 -2.938 -9.905 501 HD3 ARG 87 HD3 ARG 87 -12.417 -2.796 -11.010 502 HE ARG 87 HE ARG 87 -12.060 -0.418 -9.462 503 HH11 ARG 87 HH11 ARG 87 -10.875 -2.063 -12.337 504 HH12 ARG 87 HH12 ARG 87 -10.191 -0.622 -13.016 505 HH21 ARG 87 HH21 ARG 87 -11.139 1.449 -10.373 506 HH22 ARG 87 HH22 ARG 87 -10.342 1.356 -11.911 507 H GLU 88 H GLU 88 -14.962 -2.472 -6.349 508 HA GLU 88 HA GLU 88 -12.729 -1.481 -4.953 509 HB2 GLU 88 HB2 GLU 88 -15.677 -0.842 -4.507 510 HB3 GLU 88 HB3 GLU 88 -14.305 0.165 -4.031 511 HG2 GLU 88 HG2 GLU 88 -15.074 -0.536 -6.893 512 HG3 GLU 88 HG3 GLU 88 -15.452 0.978 -6.083 513 H SER 89 H SER 89 -15.496 -3.452 -3.920 514 HA SER 89 HA SER 89 -14.761 -3.523 -1.124 515 HB2 SER 89 HB2 SER 89 -17.126 -3.785 -1.927 516 HB3 SER 89 HB3 SER 89 -16.685 -5.329 -2.648 517 HG SER 89 HG SER 89 -16.821 -4.630 0.087 518 H MET 90 H MET 90 -14.151 -5.469 -3.991 519 HA MET 90 HA MET 90 -13.108 -7.802 -2.691 520 HB2 MET 90 HB2 MET 90 -12.607 -6.838 -5.536 521 HB3 MET 90 HB3 MET 90 -12.331 -8.476 -4.923 522 HG2 MET 90 HG2 MET 90 -14.961 -7.052 -5.344 523 HG3 MET 90 HG3 MET 90 -14.384 -8.544 -6.103 524 HE1 MET 90 HE1 MET 90 -16.931 -9.446 -5.353 525 HE2 MET 90 HE2 MET 90 -17.210 -7.925 -4.500 526 HE3 MET 90 HE3 MET 90 -17.442 -9.462 -3.667 527 H HIS 91 H HIS 91 -11.783 -4.713 -3.531 528 HA HIS 91 HA HIS 91 -9.018 -5.191 -3.372 529 HB2 HIS 91 HB2 HIS 91 -10.248 -3.029 -4.047 530 HB3 HIS 91 HB3 HIS 91 -10.436 -2.702 -2.333 531 HD1 HIS 91 HD1 HIS 91 -7.887 -2.817 -1.039 532 HD2 HIS 91 HD2 HIS 91 -8.057 -1.798 -5.065 533 HE1 HIS 91 HE1 HIS 91 -5.746 -1.607 -1.516 534 HE2 HIS 91 HE2 HIS 91 -5.787 -1.190 -3.992 535 H ALA 92 H ALA 92 -11.494 -4.754 -0.884 536 HA ALA 92 HA ALA 92 -9.703 -4.833 1.384 537 HB1 ALA 92 HB1 ALA 92 -11.763 -4.909 2.735 538 HB2 ALA 92 HB2 ALA 92 -12.725 -5.144 1.268 539 HB3 ALA 92 HB3 ALA 92 -11.846 -3.635 1.516 540 H PHE 93 H PHE 93 -11.790 -7.179 -0.335 541 HA PHE 93 HA PHE 93 -11.401 -9.337 1.528 542 HB2 PHE 93 HB2 PHE 93 -12.398 -9.375 -1.352 543 HB3 PHE 93 HB3 PHE 93 -12.413 -10.775 -0.282 544 HD1 PHE 93 HD1 PHE 93 -13.391 -9.809 2.251 545 HD2 PHE 93 HD2 PHE 93 -14.614 -8.670 -1.679 546 HE1 PHE 93 HE1 PHE 93 -15.593 -9.149 3.120 547 HE2 PHE 93 HE2 PHE 93 -16.816 -8.011 -0.802 548 HZ PHE 93 HZ PHE 93 -17.301 -8.246 1.596 549 H CYS 94 H CYS 94 -9.405 -8.027 -0.953 550 HA CYS 94 HA CYS 94 -7.860 -10.329 -1.628 551 HB2 CYS 94 HB2 CYS 94 -7.857 -8.277 -3.024 552 HB3 CYS 94 HB3 CYS 94 -7.084 -7.380 -1.724 553 HG CYS 94 HG CYS 94 -4.902 -9.477 -1.903 554 H VAL 95 H VAL 95 -7.555 -11.343 0.365 555 HA VAL 95 HA VAL 95 -6.258 -10.137 2.626 556 HB VAL 95 HB VAL 95 -6.242 -12.468 3.568 557 HG11 VAL 95 HG11 VAL 95 -8.220 -11.037 3.907 558 HG12 VAL 95 HG12 VAL 95 -8.711 -12.721 3.726 559 HG13 VAL 95 HG13 VAL 95 -8.914 -11.595 2.380 560 HG21 VAL 95 HG21 VAL 95 -7.331 -14.313 2.308 561 HG22 VAL 95 HG22 VAL 95 -5.885 -13.743 1.475 562 HG23 VAL 95 HG23 VAL 95 -7.482 -13.265 0.892 563 H GLY 96 H GLY 96 -5.104 -11.584 -0.273 564 HA2 GLY 96 HA2 GLY 96 -2.416 -10.816 0.284 565 HA3 GLY 96 HA3 GLY 96 -2.594 -12.571 0.381 566 H GLN 97 H GLN 97 -0.929 -12.014 -1.411 567 HA GLN 97 HA GLN 97 -2.289 -12.207 -4.039 568 HB2 GLN 97 HB2 GLN 97 -0.824 -10.197 -3.823 569 HB3 GLN 97 HB3 GLN 97 0.540 -11.232 -3.418 570 HG2 GLN 97 HG2 GLN 97 0.490 -12.230 -5.658 571 HG3 GLN 97 HG3 GLN 97 -0.951 -11.292 -6.063 572 HE21 GLN 97 HE21 GLN 97 2.504 -11.152 -5.518 573 HE22 GLN 97 HE22 GLN 97 2.746 -9.587 -6.208 574 H TYR 98 H TYR 98 -1.800 -14.017 -5.232 575 HA TYR 98 HA TYR 98 -0.923 -16.289 -3.701 576 HB2 TYR 98 HB2 TYR 98 -2.914 -16.298 -5.196 577 HB3 TYR 98 HB3 TYR 98 -1.868 -16.102 -6.591 578 HD1 TYR 98 HD1 TYR 98 -2.257 -18.401 -3.634 579 HD2 TYR 98 HD2 TYR 98 -1.372 -18.058 -7.802 580 HE1 TYR 98 HE1 TYR 98 -2.182 -20.846 -3.825 581 HE2 TYR 98 HE2 TYR 98 -1.294 -20.501 -7.987 582 HH TYR 98 HH TYR 98 -0.920 -22.428 -6.564 583 H LEU 99 H LEU 99 0.805 -17.586 -4.026 584 HA LEU 99 HA LEU 99 2.723 -17.116 -6.190 585 HB2 LEU 99 HB2 LEU 99 3.568 -15.805 -4.243 586 HB3 LEU 99 HB3 LEU 99 3.493 -17.244 -3.239 587 HG LEU 99 HG LEU 99 5.254 -18.324 -4.642 588 HD11 LEU 99 HD11 LEU 99 5.415 -15.677 -6.129 589 HD12 LEU 99 HD12 LEU 99 4.861 -17.219 -6.791 590 HD13 LEU 99 HD13 LEU 99 6.539 -17.030 -6.292 591 HD21 LEU 99 HD21 LEU 99 5.901 -17.119 -2.614 592 HD22 LEU 99 HD22 LEU 99 6.074 -15.622 -3.530 593 HD23 LEU 99 HD23 LEU 99 7.153 -16.984 -3.849 594 H GLU 100 H GLU 100 3.348 -19.002 -7.046 595 HA GLU 100 HA GLU 100 2.377 -21.506 -5.915 596 HB2 GLU 100 HB2 GLU 100 3.598 -20.842 -8.626 597 HB3 GLU 100 HB3 GLU 100 2.974 -22.421 -8.183 598 HG2 GLU 100 HG2 GLU 100 0.717 -21.408 -7.870 599 HG3 GLU 100 HG3 GLU 100 1.372 -19.848 -8.365 600 HA PRO 101 HA PRO 101 6.528 -22.814 -4.530 601 HB2 PRO 101 HB2 PRO 101 6.099 -25.556 -4.569 602 HB3 PRO 101 HB3 PRO 101 5.553 -24.486 -3.270 603 HG2 PRO 101 HG2 PRO 101 3.998 -25.520 -5.648 604 HG3 PRO 101 HG3 PRO 101 3.512 -25.455 -3.939 605 HD2 PRO 101 HD2 PRO 101 2.653 -23.603 -5.668 606 HD3 PRO 101 HD3 PRO 101 3.101 -23.138 -4.012 607 H ASP 102 H ASP 102 4.988 -24.024 -7.486 608 HA ASP 102 HA ASP 102 7.420 -25.052 -8.695 609 HB2 ASP 102 HB2 ASP 102 5.165 -25.990 -9.271 610 HB3 ASP 102 HB3 ASP 102 4.716 -24.446 -9.984 611 H GLN 103 H GLN 103 5.812 -21.998 -8.460 612 HA GLN 103 HA GLN 103 6.951 -20.718 -10.766 613 HB2 GLN 103 HB2 GLN 103 4.759 -20.084 -9.598 614 HB3 GLN 103 HB3 GLN 103 5.733 -19.359 -8.327 615 HG2 GLN 103 HG2 GLN 103 4.920 -17.679 -9.913 616 HG3 GLN 103 HG3 GLN 103 6.683 -17.770 -9.926 617 HE21 GLN 103 HE21 GLN 103 6.899 -16.928 -12.003 618 HE22 GLN 103 HE22 GLN 103 6.390 -17.763 -13.422 619 H GLU 104 H GLU 104 8.240 -21.599 -7.758 620 HA GLU 104 HA GLU 104 10.202 -19.618 -7.320 621 HB2 GLU 104 HB2 GLU 104 10.316 -22.614 -6.750 622 HB3 GLU 104 HB3 GLU 104 11.435 -21.415 -6.091 623 HG2 GLU 104 HG2 GLU 104 8.455 -21.614 -5.559 624 HG3 GLU 104 HG3 GLU 104 9.752 -22.003 -4.432 625 H GLY 105 H GLY 105 9.947 -22.106 -9.747 626 HA2 GLY 105 HA2 GLY 105 12.145 -21.031 -11.267 627 HA3 GLY 105 HA3 GLY 105 12.517 -22.617 -10.587 628 H VAL 106 H VAL 106 9.858 -20.959 -12.324 629 HA VAL 106 HA VAL 106 9.115 -23.395 -13.730 630 HB VAL 106 HB VAL 106 7.351 -21.790 -12.941 631 HG11 VAL 106 HG11 VAL 106 8.367 -19.943 -15.134 632 HG12 VAL 106 HG12 VAL 106 8.490 -19.651 -13.399 633 HG13 VAL 106 HG13 VAL 106 6.905 -19.694 -14.173 634 HG21 VAL 106 HG21 VAL 106 5.932 -21.902 -14.971 635 HG22 VAL 106 HG22 VAL 106 6.817 -23.410 -14.732 636 HG23 VAL 106 HG23 VAL 106 7.355 -22.254 -15.954 637 H THR 107 H THR 107 9.419 -23.792 -15.923 638 HA THR 107 HA THR 107 11.273 -21.995 -17.381 639 HB THR 107 HB THR 107 12.547 -23.937 -16.782 640 HG1 THR 107 HG1 THR 107 13.263 -23.827 -18.749 641 HG21 THR 107 HG21 THR 107 10.338 -25.695 -17.906 642 HG22 THR 107 HG22 THR 107 10.742 -25.505 -16.198 643 HG23 THR 107 HG23 THR 107 11.897 -26.260 -17.299 644 H ILE 108 H ILE 108 10.388 -21.123 -19.134 645 HA ILE 108 HA ILE 108 8.194 -22.519 -20.570 646 HB ILE 108 HB ILE 108 8.490 -19.492 -20.242 647 HG12 ILE 108 HG12 ILE 108 6.452 -21.346 -18.900 648 HG13 ILE 108 HG13 ILE 108 7.828 -20.606 -18.090 649 HG21 ILE 108 HG21 ILE 108 6.238 -21.111 -21.510 650 HG22 ILE 108 HG22 ILE 108 7.414 -20.116 -22.372 651 HG23 ILE 108 HG23 ILE 108 6.242 -19.359 -21.294 652 HD11 ILE 108 HD11 ILE 108 5.478 -19.130 -19.290 653 HD12 ILE 108 HD12 ILE 108 6.859 -18.385 -18.481 654 HD13 ILE 108 HD13 ILE 108 5.770 -19.435 -17.577 655 HA PRO 109 HA PRO 109 11.513 -22.147 -23.820 656 HB2 PRO 109 HB2 PRO 109 9.552 -24.042 -25.112 657 HB3 PRO 109 HB3 PRO 109 11.315 -24.151 -24.998 658 HG2 PRO 109 HG2 PRO 109 9.788 -25.693 -23.459 659 HG3 PRO 109 HG3 PRO 109 11.253 -24.942 -22.784 660 HD2 PRO 109 HD2 PRO 109 8.366 -24.086 -22.460 661 HD3 PRO 109 HD3 PRO 109 9.659 -24.182 -21.244 662 H ASP 110 H ASP 110 11.510 -20.953 -25.717 663 HA ASP 110 HA ASP 110 9.245 -19.331 -26.396 664 HB2 ASP 110 HB2 ASP 110 11.393 -18.285 -26.657 665 HB3 ASP 110 HB3 ASP 110 12.020 -19.621 -27.620 666 H LEU 111 H LEU 111 7.571 -20.381 -27.251 667 HA LEU 111 HA LEU 111 7.951 -22.032 -29.693 668 HB2 LEU 111 HB2 LEU 111 5.663 -22.090 -27.672 669 HB3 LEU 111 HB3 LEU 111 5.803 -23.114 -29.097 670 HG LEU 111 HG LEU 111 7.676 -23.175 -26.686 671 HD11 LEU 111 HD11 LEU 111 5.474 -24.080 -26.134 672 HD12 LEU 111 HD12 LEU 111 6.695 -25.347 -26.159 673 HD13 LEU 111 HD13 LEU 111 5.561 -25.191 -27.504 674 HD21 LEU 111 HD21 LEU 111 7.649 -24.963 -29.148 675 HD22 LEU 111 HD22 LEU 111 8.667 -25.185 -27.721 676 HD23 LEU 111 HD23 LEU 111 8.876 -23.762 -28.736 677 H GLY 112 H GLY 112 7.799 -19.066 -29.397 678 HA2 GLY 112 HA2 GLY 112 5.441 -18.512 -31.118 679 HA3 GLY 112 HA3 GLY 112 5.818 -17.494 -29.729 Start of MODEL 19 1 H GLU 21 H GLU 21 3.656 -3.707 3.321 2 HA GLU 21 HA GLU 21 4.052 -2.223 0.799 3 HB2 GLU 21 HB2 GLU 21 6.013 -2.832 3.057 4 HB3 GLU 21 HB3 GLU 21 6.447 -2.077 1.521 5 HG2 GLU 21 HG2 GLU 21 4.945 -0.168 2.070 6 HG3 GLU 21 HG3 GLU 21 4.589 -0.911 3.628 7 H LYS 22 H LYS 22 5.570 -4.846 2.711 8 HA LYS 22 HA LYS 22 6.099 -6.511 0.427 9 HB2 LYS 22 HB2 LYS 22 6.132 -7.246 3.398 10 HB3 LYS 22 HB3 LYS 22 6.865 -8.172 2.086 11 HG2 LYS 22 HG2 LYS 22 7.722 -5.410 3.020 12 HG3 LYS 22 HG3 LYS 22 8.550 -6.928 3.377 13 HD2 LYS 22 HD2 LYS 22 8.159 -5.769 0.582 14 HD3 LYS 22 HD3 LYS 22 9.632 -5.604 1.541 15 HE2 LYS 22 HE2 LYS 22 8.451 -8.256 0.628 16 HE3 LYS 22 HE3 LYS 22 9.780 -7.416 -0.173 17 HZ1 LYS 22 HZ1 LYS 22 11.104 -7.642 1.811 18 HZ2 LYS 22 HZ2 LYS 22 10.545 -9.168 1.343 19 HZ3 LYS 22 HZ3 LYS 22 9.823 -8.366 2.642 20 H VAL 23 H VAL 23 4.230 -7.037 -0.627 21 HA VAL 23 HA VAL 23 1.785 -7.746 0.626 22 HB VAL 23 HB VAL 23 1.898 -6.870 -1.707 23 HG11 VAL 23 HG11 VAL 23 3.887 -8.071 -2.543 24 HG12 VAL 23 HG12 VAL 23 2.510 -8.312 -3.620 25 HG13 VAL 23 HG13 VAL 23 2.996 -9.596 -2.511 26 HG21 VAL 23 HG21 VAL 23 -0.131 -8.031 -0.936 27 HG22 VAL 23 HG22 VAL 23 0.521 -9.577 -1.480 28 HG23 VAL 23 HG23 VAL 23 0.122 -8.325 -2.660 29 H THR 24 H THR 24 1.040 -9.686 1.318 30 HA THR 24 HA THR 24 2.867 -11.734 1.987 31 HB THR 24 HB THR 24 -0.186 -11.819 2.050 32 HG1 THR 24 HG1 THR 24 0.034 -10.994 4.108 33 HG21 THR 24 HG21 THR 24 0.839 -14.075 2.329 34 HG22 THR 24 HG22 THR 24 0.097 -13.510 3.828 35 HG23 THR 24 HG23 THR 24 1.849 -13.446 3.635 36 H LEU 25 H LEU 25 3.741 -13.102 0.529 37 HA LEU 25 HA LEU 25 2.372 -14.010 -1.851 38 HB2 LEU 25 HB2 LEU 25 5.020 -14.835 -0.597 39 HB3 LEU 25 HB3 LEU 25 4.417 -15.482 -2.118 40 HG LEU 25 HG LEU 25 5.132 -12.563 -1.594 41 HD11 LEU 25 HD11 LEU 25 6.573 -14.664 -3.255 42 HD12 LEU 25 HD12 LEU 25 7.126 -13.972 -1.728 43 HD13 LEU 25 HD13 LEU 25 7.003 -12.952 -3.158 44 HD21 LEU 25 HD21 LEU 25 3.269 -12.706 -3.187 45 HD22 LEU 25 HD22 LEU 25 4.159 -13.876 -4.166 46 HD23 LEU 25 HD23 LEU 25 4.745 -12.218 -4.020 47 H VAL 26 H VAL 26 0.675 -15.249 -1.466 48 HA VAL 26 HA VAL 26 0.702 -17.383 0.547 49 HB VAL 26 HB VAL 26 -1.619 -16.351 -1.138 50 HG11 VAL 26 HG11 VAL 26 -1.642 -18.095 1.347 51 HG12 VAL 26 HG12 VAL 26 -1.987 -18.625 -0.301 52 HG13 VAL 26 HG13 VAL 26 -3.068 -17.485 0.503 53 HG21 VAL 26 HG21 VAL 26 -0.796 -14.526 0.299 54 HG22 VAL 26 HG22 VAL 26 -0.917 -15.565 1.722 55 HG23 VAL 26 HG23 VAL 26 -2.377 -15.088 0.851 56 H ARG 27 H ARG 27 0.536 -19.505 -0.028 57 HA ARG 27 HA ARG 27 0.634 -20.233 -2.903 58 HB2 ARG 27 HB2 ARG 27 1.918 -22.233 -2.255 59 HB3 ARG 27 HB3 ARG 27 2.760 -20.760 -1.804 60 HG2 ARG 27 HG2 ARG 27 1.115 -22.338 0.206 61 HG3 ARG 27 HG3 ARG 27 2.798 -22.737 -0.145 62 HD2 ARG 27 HD2 ARG 27 3.491 -20.479 0.573 63 HD3 ARG 27 HD3 ARG 27 1.803 -20.058 0.889 64 HE ARG 27 HE ARG 27 2.524 -22.376 2.354 65 HH11 ARG 27 HH11 ARG 27 3.012 -18.888 2.415 66 HH12 ARG 27 HH12 ARG 27 3.293 -18.855 4.124 67 HH21 ARG 27 HH21 ARG 27 2.925 -22.296 4.580 68 HH22 ARG 27 HH22 ARG 27 3.255 -20.774 5.344 69 H ILE 28 H ILE 28 -0.311 -22.441 -3.370 70 HA ILE 28 HA ILE 28 -3.019 -22.502 -2.680 71 HB ILE 28 HB ILE 28 -2.265 -23.502 -4.761 72 HG12 ILE 28 HG12 ILE 28 -3.572 -25.633 -2.990 73 HG13 ILE 28 HG13 ILE 28 -4.421 -24.339 -3.830 74 HG21 ILE 28 HG21 ILE 28 -1.045 -25.652 -4.885 75 HG22 ILE 28 HG22 ILE 28 -0.889 -25.664 -3.128 76 HG23 ILE 28 HG23 ILE 28 -0.093 -24.403 -4.074 77 HD11 ILE 28 HD11 ILE 28 -2.942 -26.639 -5.107 78 HD12 ILE 28 HD12 ILE 28 -3.747 -25.332 -5.979 79 HD13 ILE 28 HD13 ILE 28 -4.690 -26.439 -4.983 80 H ALA 29 H ALA 29 -0.329 -24.331 -1.309 81 HA ALA 29 HA ALA 29 -1.712 -26.139 0.339 82 HB1 ALA 29 HB1 ALA 29 0.411 -26.330 1.594 83 HB2 ALA 29 HB2 ALA 29 1.014 -24.871 0.799 84 HB3 ALA 29 HB3 ALA 29 0.697 -26.325 -0.149 85 H ASP 30 H ASP 30 -0.791 -22.770 0.847 86 HA ASP 30 HA ASP 30 -1.378 -22.627 3.643 87 HB2 ASP 30 HB2 ASP 30 0.218 -21.093 2.453 88 HB3 ASP 30 HB3 ASP 30 -1.148 -20.342 1.639 89 H LEU 31 H LEU 31 -3.237 -21.893 0.671 90 HA LEU 31 HA LEU 31 -5.608 -20.889 1.839 91 HB2 LEU 31 HB2 LEU 31 -5.176 -22.499 -0.707 92 HB3 LEU 31 HB3 LEU 31 -6.791 -22.064 -0.185 93 HG LEU 31 HG LEU 31 -5.990 -19.611 -0.263 94 HD11 LEU 31 HD11 LEU 31 -4.161 -19.081 -1.782 95 HD12 LEU 31 HD12 LEU 31 -3.786 -20.797 -1.961 96 HD13 LEU 31 HD13 LEU 31 -3.581 -20.006 -0.395 97 HD21 LEU 31 HD21 LEU 31 -6.238 -21.159 -2.866 98 HD22 LEU 31 HD22 LEU 31 -6.504 -19.426 -2.656 99 HD23 LEU 31 HD23 LEU 31 -7.580 -20.581 -1.873 100 H GLU 32 H GLU 32 -4.565 -24.213 1.195 101 HA GLU 32 HA GLU 32 -6.976 -25.550 1.810 102 HB2 GLU 32 HB2 GLU 32 -4.095 -26.538 1.766 103 HB3 GLU 32 HB3 GLU 32 -5.490 -27.609 1.905 104 HG2 GLU 32 HG2 GLU 32 -6.278 -26.892 -0.307 105 HG3 GLU 32 HG3 GLU 32 -4.938 -25.756 -0.441 106 H ASN 33 H ASN 33 -4.080 -24.920 3.806 107 HA ASN 33 HA ASN 33 -5.027 -26.263 6.149 108 HB2 ASN 33 HB2 ASN 33 -2.829 -24.188 5.800 109 HB3 ASN 33 HB3 ASN 33 -3.226 -24.900 7.359 110 HD21 ASN 33 HD21 ASN 33 -1.557 -25.343 4.386 111 HD22 ASN 33 HD22 ASN 33 -0.941 -26.921 4.706 112 H HIS 34 H HIS 34 -5.134 -22.880 5.047 113 HA HIS 34 HA HIS 34 -6.286 -21.760 7.399 114 HB2 HIS 34 HB2 HIS 34 -5.100 -20.436 5.579 115 HB3 HIS 34 HB3 HIS 34 -6.524 -20.646 4.563 116 HD1 HIS 34 HD1 HIS 34 -8.580 -19.219 5.107 117 HD2 HIS 34 HD2 HIS 34 -5.441 -18.667 7.769 118 HE1 HIS 34 HE1 HIS 34 -9.224 -17.239 6.499 119 HE2 HIS 34 HE2 HIS 34 -7.239 -16.822 7.985 120 H ASN 35 H ASN 35 -7.624 -23.383 4.625 121 HA ASN 35 HA ASN 35 -10.363 -22.708 4.884 122 HB2 ASN 35 HB2 ASN 35 -9.479 -23.698 2.822 123 HB3 ASN 35 HB3 ASN 35 -9.009 -25.159 3.678 124 HD21 ASN 35 HD21 ASN 35 -10.590 -26.717 4.152 125 HD22 ASN 35 HD22 ASN 35 -12.185 -26.649 3.494 126 H ASN 36 H ASN 36 -8.453 -25.501 6.068 127 HA ASN 36 HA ASN 36 -10.613 -26.678 7.558 128 HB2 ASN 36 HB2 ASN 36 -7.629 -27.295 7.603 129 HB3 ASN 36 HB3 ASN 36 -8.867 -28.265 8.389 130 HD21 ASN 36 HD21 ASN 36 -7.172 -29.405 6.579 131 HD22 ASN 36 HD22 ASN 36 -8.028 -29.827 5.139 132 H ASP 37 H ASP 37 -8.329 -24.198 8.222 133 HA ASP 37 HA ASP 37 -8.398 -24.198 11.073 134 HB2 ASP 37 HB2 ASP 37 -6.693 -22.909 9.950 135 HB3 ASP 37 HB3 ASP 37 -7.876 -22.046 8.984 136 H GLY 38 H GLY 38 -10.534 -22.965 8.560 137 HA2 GLY 38 HA2 GLY 38 -12.951 -22.942 9.094 138 HA3 GLY 38 HA3 GLY 38 -12.547 -22.107 10.587 139 H GLY 39 H GLY 39 -11.133 -21.504 7.406 140 HA2 GLY 39 HA2 GLY 39 -12.753 -19.098 6.952 141 HA3 GLY 39 HA3 GLY 39 -11.013 -18.877 7.152 142 H PHE 40 H PHE 40 -13.470 -19.572 4.914 143 HA PHE 40 HA PHE 40 -11.982 -21.299 3.157 144 HB2 PHE 40 HB2 PHE 40 -14.549 -21.190 3.317 145 HB3 PHE 40 HB3 PHE 40 -14.472 -19.677 2.424 146 HD1 PHE 40 HD1 PHE 40 -13.428 -19.728 0.039 147 HD2 PHE 40 HD2 PHE 40 -14.500 -23.289 2.157 148 HE1 PHE 40 HE1 PHE 40 -13.385 -20.998 -2.067 149 HE2 PHE 40 HE2 PHE 40 -14.446 -24.550 0.041 150 HZ PHE 40 HZ PHE 40 -13.891 -23.408 -2.068 151 H TRP 41 H TRP 41 -10.509 -20.684 1.733 152 HA TRP 41 HA TRP 41 -10.289 -17.860 0.873 153 HB2 TRP 41 HB2 TRP 41 -8.199 -19.859 1.738 154 HB3 TRP 41 HB3 TRP 41 -7.758 -18.748 0.449 155 HD1 TRP 41 HD1 TRP 41 -10.006 -17.084 2.930 156 HE1 TRP 41 HE1 TRP 41 -8.631 -15.512 4.413 157 HE3 TRP 41 HE3 TRP 41 -5.308 -18.699 1.718 158 HZ2 TRP 41 HZ2 TRP 41 -5.948 -15.016 5.024 159 HZ3 TRP 41 HZ3 TRP 41 -3.387 -17.616 2.810 160 HH2 TRP 41 HH2 TRP 41 -3.701 -15.813 4.427 161 H THR 42 H THR 42 -9.643 -17.460 -1.225 162 HA THR 42 HA THR 42 -9.630 -19.612 -3.221 163 HB THR 42 HB THR 42 -12.015 -18.823 -3.048 164 HG1 THR 42 HG1 THR 42 -11.677 -19.499 -5.060 165 HG21 THR 42 HG21 THR 42 -11.625 -16.463 -2.391 166 HG22 THR 42 HG22 THR 42 -12.623 -16.561 -3.841 167 HG23 THR 42 HG23 THR 42 -10.917 -16.133 -3.976 168 H VAL 43 H VAL 43 -8.930 -18.753 -5.366 169 HA VAL 43 HA VAL 43 -7.161 -16.370 -5.164 170 HB VAL 43 HB VAL 43 -6.751 -18.910 -6.822 171 HG11 VAL 43 HG11 VAL 43 -6.044 -16.938 -8.133 172 HG12 VAL 43 HG12 VAL 43 -4.634 -17.860 -7.617 173 HG13 VAL 43 HG13 VAL 43 -5.064 -16.365 -6.781 174 HG21 VAL 43 HG21 VAL 43 -4.685 -19.176 -5.475 175 HG22 VAL 43 HG22 VAL 43 -6.138 -19.208 -4.479 176 HG23 VAL 43 HG23 VAL 43 -5.134 -17.759 -4.521 177 H ILE 44 H ILE 44 -8.203 -14.774 -6.180 178 HA ILE 44 HA ILE 44 -9.599 -15.282 -8.738 179 HB ILE 44 HB ILE 44 -9.801 -12.720 -7.090 180 HG12 ILE 44 HG12 ILE 44 -10.568 -14.587 -5.636 181 HG13 ILE 44 HG13 ILE 44 -11.901 -13.542 -6.093 182 HG21 ILE 44 HG21 ILE 44 -11.904 -12.392 -8.360 183 HG22 ILE 44 HG22 ILE 44 -11.604 -13.890 -9.243 184 HG23 ILE 44 HG23 ILE 44 -10.503 -12.522 -9.428 185 HD11 ILE 44 HD11 ILE 44 -11.294 -16.230 -7.318 186 HD12 ILE 44 HD12 ILE 44 -12.670 -15.190 -7.701 187 HD13 ILE 44 HD13 ILE 44 -12.519 -15.893 -6.095 188 H ASP 45 H ASP 45 -7.989 -15.149 -10.234 189 HA ASP 45 HA ASP 45 -6.595 -14.249 -11.752 190 HB2 ASP 45 HB2 ASP 45 -8.492 -12.575 -11.820 191 HB3 ASP 45 HB3 ASP 45 -7.576 -11.550 -10.720 192 H GLY 46 H GLY 46 -5.344 -15.021 -9.392 193 HA2 GLY 46 HA2 GLY 46 -3.089 -15.092 -8.819 194 HA3 GLY 46 HA3 GLY 46 -2.823 -13.586 -9.681 195 H LYS 47 H LYS 47 -5.437 -13.332 -7.532 196 HA LYS 47 HA LYS 47 -3.762 -12.457 -5.241 197 HB2 LYS 47 HB2 LYS 47 -6.404 -11.256 -6.200 198 HB3 LYS 47 HB3 LYS 47 -5.596 -10.816 -4.697 199 HG2 LYS 47 HG2 LYS 47 -4.502 -10.384 -7.491 200 HG3 LYS 47 HG3 LYS 47 -5.265 -9.150 -6.476 201 HD2 LYS 47 HD2 LYS 47 -3.445 -9.513 -4.785 202 HD3 LYS 47 HD3 LYS 47 -2.654 -10.620 -5.918 203 HE2 LYS 47 HE2 LYS 47 -3.185 -7.655 -6.334 204 HE3 LYS 47 HE3 LYS 47 -1.619 -8.423 -6.069 205 HZ1 LYS 47 HZ1 LYS 47 -1.975 -7.920 -8.399 206 HZ2 LYS 47 HZ2 LYS 47 -3.380 -8.862 -8.422 207 HZ3 LYS 47 HZ3 LYS 47 -1.881 -9.594 -8.168 208 H VAL 48 H VAL 48 -4.492 -13.120 -3.207 209 HA VAL 48 HA VAL 48 -6.576 -15.205 -3.181 210 HB VAL 48 HB VAL 48 -4.525 -14.571 -1.013 211 HG11 VAL 48 HG11 VAL 48 -6.381 -16.970 -1.316 212 HG12 VAL 48 HG12 VAL 48 -6.522 -15.697 -0.101 213 HG13 VAL 48 HG13 VAL 48 -5.136 -16.789 -0.074 214 HG21 VAL 48 HG21 VAL 48 -3.393 -15.340 -3.044 215 HG22 VAL 48 HG22 VAL 48 -4.473 -16.733 -3.150 216 HG23 VAL 48 HG23 VAL 48 -3.335 -16.599 -1.810 217 H TYR 49 H TYR 49 -8.371 -15.049 -1.933 218 HA TYR 49 HA TYR 49 -8.933 -12.530 -0.472 219 HB2 TYR 49 HB2 TYR 49 -10.714 -13.987 -2.486 220 HB3 TYR 49 HB3 TYR 49 -11.297 -12.727 -1.409 221 HD1 TYR 49 HD1 TYR 49 -8.755 -13.320 -4.110 222 HD2 TYR 49 HD2 TYR 49 -11.250 -10.477 -2.135 223 HE1 TYR 49 HE1 TYR 49 -8.108 -11.608 -5.742 224 HE2 TYR 49 HE2 TYR 49 -10.604 -8.774 -3.775 225 HH TYR 49 HH TYR 49 -8.765 -8.304 -5.291 226 H ASP 50 H ASP 50 -10.513 -12.703 1.187 227 HA ASP 50 HA ASP 50 -10.841 -15.394 2.344 228 HB2 ASP 50 HB2 ASP 50 -9.942 -13.339 3.674 229 HB3 ASP 50 HB3 ASP 50 -11.602 -12.768 3.695 230 H ILE 51 H ILE 51 -12.545 -16.344 1.355 231 HA ILE 51 HA ILE 51 -14.911 -15.104 0.415 232 HB ILE 51 HB ILE 51 -14.144 -17.995 0.928 233 HG12 ILE 51 HG12 ILE 51 -13.230 -16.862 -1.080 234 HG13 ILE 51 HG13 ILE 51 -14.288 -18.200 -1.522 235 HG21 ILE 51 HG21 ILE 51 -16.910 -17.176 -0.042 236 HG22 ILE 51 HG22 ILE 51 -16.531 -18.026 1.456 237 HG23 ILE 51 HG23 ILE 51 -16.256 -18.816 -0.096 238 HD11 ILE 51 HD11 ILE 51 -14.629 -16.272 -2.954 239 HD12 ILE 51 HD12 ILE 51 -15.049 -15.276 -1.563 240 HD13 ILE 51 HD13 ILE 51 -16.086 -16.630 -2.032 241 H LYS 52 H LYS 52 -14.083 -16.449 3.560 242 HA LYS 52 HA LYS 52 -16.719 -16.740 4.583 243 HB2 LYS 52 HB2 LYS 52 -14.756 -17.818 5.636 244 HB3 LYS 52 HB3 LYS 52 -14.108 -16.235 6.066 245 HG2 LYS 52 HG2 LYS 52 -16.121 -15.849 7.517 246 HG3 LYS 52 HG3 LYS 52 -16.668 -17.484 7.134 247 HD2 LYS 52 HD2 LYS 52 -15.547 -17.436 9.318 248 HD3 LYS 52 HD3 LYS 52 -14.623 -18.414 8.172 249 HE2 LYS 52 HE2 LYS 52 -13.072 -16.530 7.802 250 HE3 LYS 52 HE3 LYS 52 -14.007 -15.531 8.920 251 HZ1 LYS 52 HZ1 LYS 52 -13.447 -17.020 10.694 252 HZ2 LYS 52 HZ2 LYS 52 -12.030 -16.509 9.925 253 HZ3 LYS 52 HZ3 LYS 52 -12.638 -18.060 9.637 254 H ASP 53 H ASP 53 -14.360 -14.083 4.723 255 HA ASP 53 HA ASP 53 -15.902 -12.220 6.221 256 HB2 ASP 53 HB2 ASP 53 -13.394 -12.086 5.884 257 HB3 ASP 53 HB3 ASP 53 -13.674 -11.638 4.208 258 H PHE 54 H PHE 54 -15.470 -12.834 2.770 259 HA PHE 54 HA PHE 54 -16.895 -10.761 1.571 260 HB2 PHE 54 HB2 PHE 54 -15.472 -12.262 0.295 261 HB3 PHE 54 HB3 PHE 54 -16.450 -13.651 0.728 262 HD1 PHE 54 HD1 PHE 54 -16.212 -10.700 -1.469 263 HD2 PHE 54 HD2 PHE 54 -18.555 -14.134 -0.464 264 HE1 PHE 54 HE1 PHE 54 -17.494 -10.450 -3.554 265 HE2 PHE 54 HE2 PHE 54 -19.828 -13.869 -2.552 266 HZ PHE 54 HZ PHE 54 -19.298 -12.027 -4.099 267 H GLN 55 H GLN 55 -18.113 -14.000 2.452 268 HA GLN 55 HA GLN 55 -20.805 -13.480 1.673 269 HB2 GLN 55 HB2 GLN 55 -21.330 -15.704 2.594 270 HB3 GLN 55 HB3 GLN 55 -19.905 -15.743 1.563 271 HG2 GLN 55 HG2 GLN 55 -18.510 -15.673 3.681 272 HG3 GLN 55 HG3 GLN 55 -20.001 -15.911 4.585 273 HE21 GLN 55 HE21 GLN 55 -21.159 -17.763 2.609 274 HE22 GLN 55 HE22 GLN 55 -20.273 -19.238 2.741 275 H THR 56 H THR 56 -19.043 -13.114 4.694 276 HA THR 56 HA THR 56 -21.208 -12.645 6.449 277 HB THR 56 HB THR 56 -18.421 -11.396 6.528 278 HG1 THR 56 HG1 THR 56 -17.821 -13.295 7.205 279 HG21 THR 56 HG21 THR 56 -19.963 -10.151 8.004 280 HG22 THR 56 HG22 THR 56 -18.818 -11.093 8.957 281 HG23 THR 56 HG23 THR 56 -20.474 -11.664 8.763 282 H GLN 57 H GLN 57 -19.473 -10.435 4.227 283 HA GLN 57 HA GLN 57 -20.882 -8.051 4.955 284 HB2 GLN 57 HB2 GLN 57 -19.347 -8.721 2.407 285 HB3 GLN 57 HB3 GLN 57 -19.857 -7.108 2.893 286 HG2 GLN 57 HG2 GLN 57 -17.848 -8.861 4.341 287 HG3 GLN 57 HG3 GLN 57 -17.477 -7.477 3.323 288 HE21 GLN 57 HE21 GLN 57 -18.620 -8.519 6.433 289 HE22 GLN 57 HE22 GLN 57 -18.583 -6.968 7.197 290 H SER 58 H SER 58 -21.505 -10.710 2.787 291 HA SER 58 HA SER 58 -23.587 -9.462 1.224 292 HB2 SER 58 HB2 SER 58 -22.130 -11.321 0.359 293 HB3 SER 58 HB3 SER 58 -22.882 -12.420 1.512 294 HG SER 58 HG SER 58 -24.820 -12.189 0.431 295 H LEU 59 H LEU 59 -23.635 -10.123 4.418 296 HA LEU 59 HA LEU 59 -26.138 -11.384 4.852 297 HB2 LEU 59 HB2 LEU 59 -24.382 -11.018 6.612 298 HB3 LEU 59 HB3 LEU 59 -24.720 -9.296 6.565 299 HG LEU 59 HG LEU 59 -27.054 -9.759 7.373 300 HD11 LEU 59 HD11 LEU 59 -27.612 -11.971 8.305 301 HD12 LEU 59 HD12 LEU 59 -26.105 -12.628 7.663 302 HD13 LEU 59 HD13 LEU 59 -27.355 -12.039 6.562 303 HD21 LEU 59 HD21 LEU 59 -25.315 -9.118 8.983 304 HD22 LEU 59 HD22 LEU 59 -24.866 -10.811 9.202 305 HD23 LEU 59 HD23 LEU 59 -26.460 -10.247 9.711 306 H THR 60 H THR 60 -25.210 -8.009 4.240 307 HA THR 60 HA THR 60 -28.005 -7.087 4.475 308 HB THR 60 HB THR 60 -26.392 -5.783 5.753 309 HG1 THR 60 HG1 THR 60 -27.763 -4.264 5.234 310 HG21 THR 60 HG21 THR 60 -24.636 -4.433 4.702 311 HG22 THR 60 HG22 THR 60 -25.041 -5.113 3.123 312 HG23 THR 60 HG23 THR 60 -24.362 -6.149 4.383 313 H GLU 61 H GLU 61 -29.062 -6.041 2.870 314 HA GLU 61 HA GLU 61 -28.338 -6.536 0.125 315 HB2 GLU 61 HB2 GLU 61 -30.494 -5.688 -0.459 316 HB3 GLU 61 HB3 GLU 61 -30.704 -6.632 1.008 317 HG2 GLU 61 HG2 GLU 61 -30.550 -3.596 0.925 318 HG3 GLU 61 HG3 GLU 61 -32.051 -4.521 0.922 319 H ASN 62 H ASN 62 -27.940 -3.958 2.391 320 HA ASN 62 HA ASN 62 -27.628 -1.740 0.668 321 HB2 ASN 62 HB2 ASN 62 -27.861 -1.601 3.170 322 HB3 ASN 62 HB3 ASN 62 -26.242 -2.272 3.339 323 HD21 ASN 62 HD21 ASN 62 -25.533 -0.421 4.459 324 HD22 ASN 62 HD22 ASN 62 -25.239 1.084 3.662 325 H SER 63 H SER 63 -25.540 -4.420 1.484 326 HA SER 63 HA SER 63 -23.071 -3.455 0.461 327 HB2 SER 63 HB2 SER 63 -23.258 -5.456 1.950 328 HB3 SER 63 HB3 SER 63 -24.067 -6.332 0.663 329 HG SER 63 HG SER 63 -21.382 -5.584 0.908 330 H ILE 64 H ILE 64 -22.091 -3.871 -1.522 331 HA ILE 64 HA ILE 64 -23.558 -3.880 -3.949 332 HB ILE 64 HB ILE 64 -21.304 -4.328 -5.021 333 HG12 ILE 64 HG12 ILE 64 -20.323 -4.435 -2.115 334 HG13 ILE 64 HG13 ILE 64 -20.371 -5.798 -3.224 335 HG21 ILE 64 HG21 ILE 64 -22.013 -2.016 -4.561 336 HG22 ILE 64 HG22 ILE 64 -20.269 -2.183 -4.358 337 HG23 ILE 64 HG23 ILE 64 -21.317 -2.106 -2.938 338 HD11 ILE 64 HD11 ILE 64 -18.653 -3.348 -3.504 339 HD12 ILE 64 HD12 ILE 64 -18.691 -4.721 -4.612 340 HD13 ILE 64 HD13 ILE 64 -18.139 -4.941 -2.955 341 H LEU 65 H LEU 65 -22.674 -6.425 -1.850 342 HA LEU 65 HA LEU 65 -22.616 -8.598 -3.782 343 HB2 LEU 65 HB2 LEU 65 -22.582 -8.701 -0.739 344 HB3 LEU 65 HB3 LEU 65 -22.119 -9.996 -1.841 345 HG LEU 65 HG LEU 65 -20.650 -7.359 -1.437 346 HD11 LEU 65 HD11 LEU 65 -19.800 -10.179 -0.703 347 HD12 LEU 65 HD12 LEU 65 -20.316 -8.917 0.420 348 HD13 LEU 65 HD13 LEU 65 -18.834 -8.712 -0.511 349 HD21 LEU 65 HD21 LEU 65 -18.959 -8.231 -3.003 350 HD22 LEU 65 HD22 LEU 65 -20.516 -8.013 -3.789 351 HD23 LEU 65 HD23 LEU 65 -19.973 -9.633 -3.339 352 H ALA 66 H ALA 66 -25.085 -6.831 -2.735 353 HA ALA 66 HA ALA 66 -27.099 -8.607 -1.890 354 HB1 ALA 66 HB1 ALA 66 -28.649 -6.835 -2.554 355 HB2 ALA 66 HB2 ALA 66 -27.382 -6.059 -3.510 356 HB3 ALA 66 HB3 ALA 66 -27.232 -6.140 -1.753 357 H GLN 67 H GLN 67 -26.041 -7.605 -5.104 358 HA GLN 67 HA GLN 67 -27.925 -9.162 -6.624 359 HB2 GLN 67 HB2 GLN 67 -26.572 -8.502 -8.565 360 HB3 GLN 67 HB3 GLN 67 -26.826 -7.114 -7.507 361 HG2 GLN 67 HG2 GLN 67 -24.539 -7.516 -6.536 362 HG3 GLN 67 HG3 GLN 67 -24.297 -8.776 -7.740 363 HE21 GLN 67 HE21 GLN 67 -24.503 -5.367 -7.162 364 HE22 GLN 67 HE22 GLN 67 -23.906 -4.855 -8.702 365 H PHE 68 H PHE 68 -25.155 -9.976 -4.863 366 HA PHE 68 HA PHE 68 -24.515 -12.402 -6.434 367 HB2 PHE 68 HB2 PHE 68 -22.869 -10.793 -4.427 368 HB3 PHE 68 HB3 PHE 68 -22.338 -12.306 -5.141 369 HD1 PHE 68 HD1 PHE 68 -22.959 -12.095 -7.963 370 HD2 PHE 68 HD2 PHE 68 -21.531 -9.056 -5.311 371 HE1 PHE 68 HE1 PHE 68 -21.956 -10.899 -9.862 372 HE2 PHE 68 HE2 PHE 68 -20.528 -7.867 -7.224 373 HZ PHE 68 HZ PHE 68 -20.742 -8.788 -9.501 374 H ALA 69 H ALA 69 -26.473 -11.659 -3.984 375 HA ALA 69 HA ALA 69 -25.590 -13.092 -1.710 376 HB1 ALA 69 HB1 ALA 69 -27.873 -12.758 -0.860 377 HB2 ALA 69 HB2 ALA 69 -28.414 -12.308 -2.482 378 HB3 ALA 69 HB3 ALA 69 -27.259 -11.288 -1.625 379 H GLY 70 H GLY 70 -27.602 -14.078 -4.468 380 HA2 GLY 70 HA2 GLY 70 -28.025 -16.794 -3.353 381 HA3 GLY 70 HA3 GLY 70 -28.904 -16.070 -4.692 382 H GLU 71 H GLU 71 -25.671 -15.373 -5.075 383 HA GLU 71 HA GLU 71 -25.219 -17.547 -7.025 384 HB2 GLU 71 HB2 GLU 71 -24.998 -15.227 -7.855 385 HB3 GLU 71 HB3 GLU 71 -23.841 -14.840 -6.593 386 HG2 GLU 71 HG2 GLU 71 -22.723 -15.117 -8.736 387 HG3 GLU 71 HG3 GLU 71 -22.201 -16.361 -7.603 388 H ASP 72 H ASP 72 -23.265 -18.762 -6.962 389 HA ASP 72 HA ASP 72 -22.135 -19.581 -4.548 390 HB2 ASP 72 HB2 ASP 72 -21.913 -20.862 -6.658 391 HB3 ASP 72 HB3 ASP 72 -20.901 -19.603 -7.348 392 HA PRO 73 HA PRO 73 -20.065 -15.801 -3.356 393 HB2 PRO 73 HB2 PRO 73 -18.204 -16.830 -1.528 394 HB3 PRO 73 HB3 PRO 73 -19.911 -16.525 -1.170 395 HG2 PRO 73 HG2 PRO 73 -18.572 -19.101 -1.992 396 HG3 PRO 73 HG3 PRO 73 -19.767 -18.825 -0.704 397 HD2 PRO 73 HD2 PRO 73 -20.531 -19.861 -3.041 398 HD3 PRO 73 HD3 PRO 73 -21.558 -18.653 -2.234 399 H VAL 74 H VAL 74 -18.044 -18.497 -4.490 400 HA VAL 74 HA VAL 74 -15.640 -16.934 -4.848 401 HB VAL 74 HB VAL 74 -16.365 -19.674 -5.994 402 HG11 VAL 74 HG11 VAL 74 -13.919 -19.974 -6.335 403 HG12 VAL 74 HG12 VAL 74 -13.646 -18.310 -5.809 404 HG13 VAL 74 HG13 VAL 74 -14.552 -18.628 -7.289 405 HG21 VAL 74 HG21 VAL 74 -14.767 -18.974 -3.491 406 HG22 VAL 74 HG22 VAL 74 -15.014 -20.603 -4.125 407 HG23 VAL 74 HG23 VAL 74 -16.388 -19.674 -3.524 408 H VAL 75 H VAL 75 -18.145 -18.257 -7.019 409 HA VAL 75 HA VAL 75 -17.150 -17.215 -9.474 410 HB VAL 75 HB VAL 75 -20.048 -17.903 -8.764 411 HG11 VAL 75 HG11 VAL 75 -19.939 -16.576 -10.835 412 HG12 VAL 75 HG12 VAL 75 -20.367 -18.243 -11.214 413 HG13 VAL 75 HG13 VAL 75 -18.724 -17.668 -11.505 414 HG21 VAL 75 HG21 VAL 75 -18.553 -19.804 -8.331 415 HG22 VAL 75 HG22 VAL 75 -17.881 -19.677 -9.958 416 HG23 VAL 75 HG23 VAL 75 -19.571 -20.134 -9.736 417 H ALA 76 H ALA 76 -19.348 -15.996 -7.079 418 HA ALA 76 HA ALA 76 -20.328 -13.646 -8.275 419 HB1 ALA 76 HB1 ALA 76 -20.896 -13.004 -5.942 420 HB2 ALA 76 HB2 ALA 76 -19.934 -14.355 -5.345 421 HB3 ALA 76 HB3 ALA 76 -21.381 -14.658 -6.310 422 H LEU 77 H LEU 77 -17.529 -14.333 -6.253 423 HA LEU 77 HA LEU 77 -16.600 -11.656 -5.972 424 HB2 LEU 77 HB2 LEU 77 -16.104 -13.427 -4.352 425 HB3 LEU 77 HB3 LEU 77 -15.209 -14.323 -5.568 426 HG LEU 77 HG LEU 77 -13.454 -12.611 -5.605 427 HD11 LEU 77 HD11 LEU 77 -13.427 -10.718 -4.050 428 HD12 LEU 77 HD12 LEU 77 -15.060 -11.111 -3.512 429 HD13 LEU 77 HD13 LEU 77 -14.777 -10.589 -5.175 430 HD21 LEU 77 HD21 LEU 77 -12.562 -12.968 -3.357 431 HD22 LEU 77 HD22 LEU 77 -13.279 -14.445 -3.987 432 HD23 LEU 77 HD23 LEU 77 -14.147 -13.484 -2.782 433 H GLU 78 H GLU 78 -15.835 -14.310 -8.237 434 HA GLU 78 HA GLU 78 -13.707 -13.098 -9.656 435 HB2 GLU 78 HB2 GLU 78 -15.825 -15.068 -10.622 436 HB3 GLU 78 HB3 GLU 78 -14.401 -14.617 -11.563 437 HG2 GLU 78 HG2 GLU 78 -12.953 -15.551 -9.795 438 HG3 GLU 78 HG3 GLU 78 -14.379 -16.015 -8.870 439 H ALA 79 H ALA 79 -17.214 -13.060 -10.208 440 HA ALA 79 HA ALA 79 -17.285 -11.311 -12.438 441 HB1 ALA 79 HB1 ALA 79 -19.160 -12.793 -11.830 442 HB2 ALA 79 HB2 ALA 79 -19.691 -11.115 -11.943 443 HB3 ALA 79 HB3 ALA 79 -19.434 -11.856 -10.359 444 H ALA 80 H ALA 80 -17.205 -10.778 -8.970 445 HA ALA 80 HA ALA 80 -17.850 -7.997 -8.967 446 HB1 ALA 80 HB1 ALA 80 -18.155 -9.411 -6.983 447 HB2 ALA 80 HB2 ALA 80 -17.118 -8.028 -6.627 448 HB3 ALA 80 HB3 ALA 80 -16.409 -9.632 -6.855 449 H LEU 81 H LEU 81 -14.820 -9.796 -9.345 450 HA LEU 81 HA LEU 81 -13.135 -7.464 -9.158 451 HB2 LEU 81 HB2 LEU 81 -12.692 -10.343 -9.827 452 HB3 LEU 81 HB3 LEU 81 -11.544 -9.224 -10.529 453 HG LEU 81 HG LEU 81 -10.628 -10.094 -8.466 454 HD11 LEU 81 HD11 LEU 81 -11.486 -7.216 -8.028 455 HD12 LEU 81 HD12 LEU 81 -10.114 -7.752 -9.002 456 HD13 LEU 81 HD13 LEU 81 -10.123 -8.041 -7.266 457 HD21 LEU 81 HD21 LEU 81 -13.116 -9.076 -7.065 458 HD22 LEU 81 HD22 LEU 81 -11.685 -9.744 -6.271 459 HD23 LEU 81 HD23 LEU 81 -12.663 -10.763 -7.323 460 H GLN 82 H GLN 82 -14.968 -8.984 -11.678 461 HA GLN 82 HA GLN 82 -13.641 -7.672 -13.884 462 HB2 GLN 82 HB2 GLN 82 -16.319 -9.131 -13.770 463 HB3 GLN 82 HB3 GLN 82 -15.475 -8.647 -15.245 464 HG2 GLN 82 HG2 GLN 82 -13.639 -10.171 -14.752 465 HG3 GLN 82 HG3 GLN 82 -14.343 -10.573 -13.188 466 HE21 GLN 82 HE21 GLN 82 -14.535 -12.748 -13.560 467 HE22 GLN 82 HE22 GLN 82 -15.615 -13.429 -14.722 468 H PHE 83 H PHE 83 -16.634 -7.185 -12.007 469 HA PHE 83 HA PHE 83 -17.452 -4.871 -13.538 470 HB2 PHE 83 HB2 PHE 83 -19.096 -6.438 -12.463 471 HB3 PHE 83 HB3 PHE 83 -18.539 -5.896 -10.885 472 HD1 PHE 83 HD1 PHE 83 -19.375 -3.991 -14.023 473 HD2 PHE 83 HD2 PHE 83 -20.317 -4.680 -9.909 474 HE1 PHE 83 HE1 PHE 83 -21.072 -2.213 -14.108 475 HE2 PHE 83 HE2 PHE 83 -22.011 -2.897 -10.006 476 HZ PHE 83 HZ PHE 83 -22.387 -1.664 -12.103 477 H GLU 84 H GLU 84 -16.855 -2.829 -13.168 478 HA GLU 84 HA GLU 84 -14.525 -2.325 -11.716 479 HB2 GLU 84 HB2 GLU 84 -14.840 0.049 -12.396 480 HB3 GLU 84 HB3 GLU 84 -14.980 -1.103 -13.720 481 HG2 GLU 84 HG2 GLU 84 -17.439 -0.893 -13.671 482 HG3 GLU 84 HG3 GLU 84 -17.330 0.219 -12.306 483 H ASP 85 H ASP 85 -17.883 -1.515 -10.902 484 HA ASP 85 HA ASP 85 -17.290 0.260 -8.756 485 HB2 ASP 85 HB2 ASP 85 -19.842 -1.296 -9.347 486 HB3 ASP 85 HB3 ASP 85 -19.712 0.016 -8.177 487 H THR 86 H THR 86 -17.801 -3.207 -8.943 488 HA THR 86 HA THR 86 -18.082 -3.568 -6.089 489 HB THR 86 HB THR 86 -18.070 -6.075 -6.796 490 HG1 THR 86 HG1 THR 86 -17.113 -5.482 -8.925 491 HG21 THR 86 HG21 THR 86 -20.223 -4.253 -7.928 492 HG22 THR 86 HG22 THR 86 -20.160 -4.878 -6.278 493 HG23 THR 86 HG23 THR 86 -20.390 -5.983 -7.633 494 H ARG 87 H ARG 87 -15.454 -3.809 -8.467 495 HA ARG 87 HA ARG 87 -13.767 -5.402 -6.764 496 HB2 ARG 87 HB2 ARG 87 -11.966 -5.077 -8.437 497 HB3 ARG 87 HB3 ARG 87 -13.454 -5.688 -9.122 498 HG2 ARG 87 HG2 ARG 87 -12.694 -4.187 -10.730 499 HG3 ARG 87 HG3 ARG 87 -13.932 -3.276 -9.874 500 HD2 ARG 87 HD2 ARG 87 -12.273 -1.966 -8.714 501 HD3 ARG 87 HD3 ARG 87 -10.973 -3.024 -9.264 502 HE ARG 87 HE ARG 87 -11.292 -2.190 -11.519 503 HH11 ARG 87 HH11 ARG 87 -12.904 -0.293 -9.054 504 HH12 ARG 87 HH12 ARG 87 -12.861 1.164 -9.988 505 HH21 ARG 87 HH21 ARG 87 -11.256 -0.267 -12.723 506 HH22 ARG 87 HH22 ARG 87 -11.947 1.185 -12.062 507 H GLU 88 H GLU 88 -14.530 -2.124 -6.778 508 HA GLU 88 HA GLU 88 -12.140 -0.985 -5.719 509 HB2 GLU 88 HB2 GLU 88 -15.011 -0.065 -5.239 510 HB3 GLU 88 HB3 GLU 88 -13.544 0.905 -5.072 511 HG2 GLU 88 HG2 GLU 88 -13.136 0.572 -7.536 512 HG3 GLU 88 HG3 GLU 88 -14.701 -0.231 -7.629 513 H SER 89 H SER 89 -14.918 -2.619 -4.276 514 HA SER 89 HA SER 89 -14.083 -2.234 -1.543 515 HB2 SER 89 HB2 SER 89 -16.479 -2.526 -2.206 516 HB3 SER 89 HB3 SER 89 -16.130 -4.187 -2.673 517 HG SER 89 HG SER 89 -15.344 -3.507 -0.107 518 H MET 90 H MET 90 -13.536 -4.602 -4.064 519 HA MET 90 HA MET 90 -12.681 -6.787 -2.409 520 HB2 MET 90 HB2 MET 90 -12.190 -6.325 -5.373 521 HB3 MET 90 HB3 MET 90 -11.957 -7.854 -4.515 522 HG2 MET 90 HG2 MET 90 -14.542 -6.401 -5.071 523 HG3 MET 90 HG3 MET 90 -14.062 -8.020 -5.597 524 HE1 MET 90 HE1 MET 90 -16.734 -6.794 -3.846 525 HE2 MET 90 HE2 MET 90 -17.077 -8.221 -2.865 526 HE3 MET 90 HE3 MET 90 -16.727 -8.398 -4.582 527 H HIS 91 H HIS 91 -11.178 -3.908 -3.296 528 HA HIS 91 HA HIS 91 -8.441 -4.538 -3.225 529 HB2 HIS 91 HB2 HIS 91 -9.541 -2.310 -3.830 530 HB3 HIS 91 HB3 HIS 91 -9.752 -2.019 -2.111 531 HD1 HIS 91 HD1 HIS 91 -7.388 -1.987 -0.709 532 HD2 HIS 91 HD2 HIS 91 -7.172 -1.416 -4.821 533 HE1 HIS 91 HE1 HIS 91 -5.116 -1.011 -1.130 534 HE2 HIS 91 HE2 HIS 91 -5.058 -0.565 -3.602 535 H ALA 92 H ALA 92 -10.843 -4.198 -0.668 536 HA ALA 92 HA ALA 92 -8.957 -4.360 1.536 537 HB1 ALA 92 HB1 ALA 92 -10.959 -4.359 2.969 538 HB2 ALA 92 HB2 ALA 92 -11.996 -4.534 1.548 539 HB3 ALA 92 HB3 ALA 92 -11.044 -3.065 1.772 540 H PHE 93 H PHE 93 -11.055 -6.582 -0.262 541 HA PHE 93 HA PHE 93 -11.027 -8.704 1.700 542 HB2 PHE 93 HB2 PHE 93 -11.975 -8.631 -1.193 543 HB3 PHE 93 HB3 PHE 93 -12.120 -10.052 -0.164 544 HD1 PHE 93 HD1 PHE 93 -13.407 -6.669 -0.813 545 HD2 PHE 93 HD2 PHE 93 -13.754 -10.114 1.675 546 HE1 PHE 93 HE1 PHE 93 -15.556 -5.841 0.023 547 HE2 PHE 93 HE2 PHE 93 -15.911 -9.272 2.509 548 HZ PHE 93 HZ PHE 93 -16.812 -7.142 1.683 549 H CYS 94 H CYS 94 -8.983 -7.797 -0.993 550 HA CYS 94 HA CYS 94 -7.722 -10.341 -1.368 551 HB2 CYS 94 HB2 CYS 94 -6.006 -9.054 -2.634 552 HB3 CYS 94 HB3 CYS 94 -7.643 -8.697 -3.161 553 HG CYS 94 HG CYS 94 -6.378 -6.592 -0.859 554 H VAL 95 H VAL 95 -6.927 -11.242 0.424 555 HA VAL 95 HA VAL 95 -5.707 -9.862 2.598 556 HB VAL 95 HB VAL 95 -5.219 -12.117 3.519 557 HG11 VAL 95 HG11 VAL 95 -8.018 -11.897 2.323 558 HG12 VAL 95 HG12 VAL 95 -7.477 -11.182 3.845 559 HG13 VAL 95 HG13 VAL 95 -7.561 -12.937 3.679 560 HG21 VAL 95 HG21 VAL 95 -4.579 -13.292 1.437 561 HG22 VAL 95 HG22 VAL 95 -6.242 -13.201 0.854 562 HG23 VAL 95 HG23 VAL 95 -5.858 -14.176 2.273 563 H GLY 96 H GLY 96 -4.447 -11.388 -0.303 564 HA2 GLY 96 HA2 GLY 96 -1.900 -10.117 -0.114 565 HA3 GLY 96 HA3 GLY 96 -1.769 -11.825 0.309 566 H GLN 97 H GLN 97 -0.316 -11.256 -1.731 567 HA GLN 97 HA GLN 97 -1.731 -11.671 -4.263 568 HB2 GLN 97 HB2 GLN 97 0.228 -10.090 -4.139 569 HB3 GLN 97 HB3 GLN 97 1.264 -11.442 -3.688 570 HG2 GLN 97 HG2 GLN 97 0.592 -12.512 -5.914 571 HG3 GLN 97 HG3 GLN 97 -0.117 -10.960 -6.347 572 HE21 GLN 97 HE21 GLN 97 1.298 -9.150 -6.619 573 HE22 GLN 97 HE22 GLN 97 2.978 -9.375 -6.950 574 H TYR 98 H TYR 98 -1.799 -13.642 -5.272 575 HA TYR 98 HA TYR 98 -0.794 -16.003 -3.923 576 HB2 TYR 98 HB2 TYR 98 -3.032 -15.996 -5.024 577 HB3 TYR 98 HB3 TYR 98 -2.260 -15.746 -6.584 578 HD1 TYR 98 HD1 TYR 98 -2.055 -18.106 -3.659 579 HD2 TYR 98 HD2 TYR 98 -1.914 -17.683 -7.908 580 HE1 TYR 98 HE1 TYR 98 -1.834 -20.537 -3.896 581 HE2 TYR 98 HE2 TYR 98 -1.696 -20.117 -8.138 582 HH TYR 98 HH TYR 98 -1.010 -22.026 -6.877 583 H LEU 99 H LEU 99 0.885 -17.246 -4.566 584 HA LEU 99 HA LEU 99 2.164 -16.821 -7.185 585 HB2 LEU 99 HB2 LEU 99 3.421 -15.726 -5.128 586 HB3 LEU 99 HB3 LEU 99 3.868 -17.374 -4.720 587 HG LEU 99 HG LEU 99 4.542 -16.005 -7.371 588 HD11 LEU 99 HD11 LEU 99 5.704 -14.881 -5.551 589 HD12 LEU 99 HD12 LEU 99 6.844 -15.799 -6.536 590 HD13 LEU 99 HD13 LEU 99 6.334 -16.422 -4.961 591 HD21 LEU 99 HD21 LEU 99 5.609 -18.621 -6.245 592 HD22 LEU 99 HD22 LEU 99 6.144 -17.842 -7.737 593 HD23 LEU 99 HD23 LEU 99 4.498 -18.452 -7.605 594 H GLU 100 H GLU 100 1.830 -18.675 -8.209 595 HA GLU 100 HA GLU 100 1.010 -21.089 -6.904 596 HB2 GLU 100 HB2 GLU 100 0.274 -20.168 -9.212 597 HB3 GLU 100 HB3 GLU 100 1.798 -20.783 -9.836 598 HG2 GLU 100 HG2 GLU 100 1.140 -23.064 -9.181 599 HG3 GLU 100 HG3 GLU 100 -0.374 -22.445 -8.532 600 HA PRO 101 HA PRO 101 4.930 -23.212 -6.028 601 HB2 PRO 101 HB2 PRO 101 3.537 -25.473 -7.489 602 HB3 PRO 101 HB3 PRO 101 4.475 -25.522 -5.987 603 HG2 PRO 101 HG2 PRO 101 1.793 -25.492 -5.970 604 HG3 PRO 101 HG3 PRO 101 2.730 -24.651 -4.720 605 HD2 PRO 101 HD2 PRO 101 1.125 -23.527 -6.946 606 HD3 PRO 101 HD3 PRO 101 1.615 -22.765 -5.422 607 H ASP 102 H ASP 102 3.616 -24.264 -9.192 608 HA ASP 102 HA ASP 102 6.266 -24.638 -10.322 609 HB2 ASP 102 HB2 ASP 102 4.421 -26.268 -10.667 610 HB3 ASP 102 HB3 ASP 102 3.506 -25.051 -11.550 611 H GLN 103 H GLN 103 4.171 -21.984 -10.154 612 HA GLN 103 HA GLN 103 4.425 -20.587 -12.572 613 HB2 GLN 103 HB2 GLN 103 2.999 -19.807 -10.701 614 HB3 GLN 103 HB3 GLN 103 4.420 -19.502 -9.719 615 HG2 GLN 103 HG2 GLN 103 3.660 -17.384 -10.467 616 HG3 GLN 103 HG3 GLN 103 5.112 -17.742 -11.403 617 HE21 GLN 103 HE21 GLN 103 4.511 -16.302 -13.032 618 HE22 GLN 103 HE22 GLN 103 3.216 -16.616 -14.127 619 H GLU 104 H GLU 104 6.698 -21.036 -9.951 620 HA GLU 104 HA GLU 104 8.617 -19.052 -10.567 621 HB2 GLU 104 HB2 GLU 104 8.984 -21.663 -9.026 622 HB3 GLU 104 HB3 GLU 104 10.081 -20.278 -8.989 623 HG2 GLU 104 HG2 GLU 104 8.253 -18.894 -8.025 624 HG3 GLU 104 HG3 GLU 104 7.206 -20.313 -8.008 625 H GLY 105 H GLY 105 8.110 -22.300 -11.809 626 HA2 GLY 105 HA2 GLY 105 10.661 -22.569 -13.158 627 HA3 GLY 105 HA3 GLY 105 9.238 -23.577 -13.379 628 H VAL 106 H VAL 106 7.697 -23.041 -14.928 629 HA VAL 106 HA VAL 106 7.824 -20.501 -16.323 630 HB VAL 106 HB VAL 106 9.348 -21.801 -17.734 631 HG11 VAL 106 HG11 VAL 106 7.134 -23.852 -18.091 632 HG12 VAL 106 HG12 VAL 106 8.643 -24.093 -17.210 633 HG13 VAL 106 HG13 VAL 106 8.676 -23.847 -18.957 634 HG21 VAL 106 HG21 VAL 106 8.222 -21.554 -19.936 635 HG22 VAL 106 HG22 VAL 106 7.877 -20.183 -18.879 636 HG23 VAL 106 HG23 VAL 106 6.659 -21.435 -19.121 637 H THR 107 H THR 107 5.818 -19.767 -16.452 638 HA THR 107 HA THR 107 3.524 -21.518 -16.134 639 HB THR 107 HB THR 107 3.497 -19.421 -14.902 640 HG1 THR 107 HG1 THR 107 1.470 -19.946 -15.322 641 HG21 THR 107 HG21 THR 107 4.809 -17.958 -16.377 642 HG22 THR 107 HG22 THR 107 3.261 -17.218 -15.970 643 HG23 THR 107 HG23 THR 107 3.495 -17.949 -17.561 644 H ILE 108 H ILE 108 2.436 -22.381 -17.778 645 HA ILE 108 HA ILE 108 3.141 -21.656 -20.532 646 HB ILE 108 HB ILE 108 1.653 -24.091 -19.455 647 HG12 ILE 108 HG12 ILE 108 4.022 -24.066 -18.694 648 HG13 ILE 108 HG13 ILE 108 3.768 -25.352 -19.872 649 HG21 ILE 108 HG21 ILE 108 1.014 -23.629 -21.775 650 HG22 ILE 108 HG22 ILE 108 2.012 -25.081 -21.703 651 HG23 ILE 108 HG23 ILE 108 2.712 -23.560 -22.261 652 HD11 ILE 108 HD11 ILE 108 5.069 -22.678 -20.406 653 HD12 ILE 108 HD12 ILE 108 4.812 -23.952 -21.603 654 HD13 ILE 108 HD13 ILE 108 5.882 -24.233 -20.232 655 HA PRO 109 HA PRO 109 -1.059 -19.805 -20.710 656 HB2 PRO 109 HB2 PRO 109 -0.648 -18.157 -22.813 657 HB3 PRO 109 HB3 PRO 109 0.039 -17.804 -21.220 658 HG2 PRO 109 HG2 PRO 109 1.371 -18.981 -23.647 659 HG3 PRO 109 HG3 PRO 109 1.995 -17.775 -22.504 660 HD2 PRO 109 HD2 PRO 109 2.599 -20.501 -22.419 661 HD3 PRO 109 HD3 PRO 109 2.746 -19.398 -21.036 662 H ASP 110 H ASP 110 -2.680 -19.618 -22.500 663 HA ASP 110 HA ASP 110 -2.670 -22.071 -24.164 664 HB2 ASP 110 HB2 ASP 110 -4.317 -22.203 -22.398 665 HB3 ASP 110 HB3 ASP 110 -4.908 -20.579 -22.735 666 H LEU 111 H LEU 111 -2.163 -21.518 -26.193 667 HA LEU 111 HA LEU 111 -3.000 -18.987 -27.404 668 HB2 LEU 111 HB2 LEU 111 -1.238 -21.232 -28.485 669 HB3 LEU 111 HB3 LEU 111 -1.629 -19.768 -29.371 670 HG LEU 111 HG LEU 111 -0.473 -18.466 -27.467 671 HD11 LEU 111 HD11 LEU 111 1.176 -19.662 -26.102 672 HD12 LEU 111 HD12 LEU 111 0.619 -21.205 -26.749 673 HD13 LEU 111 HD13 LEU 111 -0.458 -20.225 -25.751 674 HD21 LEU 111 HD21 LEU 111 1.781 -18.824 -28.404 675 HD22 LEU 111 HD22 LEU 111 0.565 -18.767 -29.678 676 HD23 LEU 111 HD23 LEU 111 1.234 -20.319 -29.171 677 H GLY 112 H GLY 112 -3.099 -22.432 -28.427 678 HA2 GLY 112 HA2 GLY 112 -5.844 -22.636 -28.910 679 HA3 GLY 112 HA3 GLY 112 -5.100 -22.086 -30.411 Start of MODEL 20 1 H GLU 21 H GLU 21 2.682 -0.372 0.546 2 HA GLU 21 HA GLU 21 2.750 -1.111 -1.728 3 HB2 GLU 21 HB2 GLU 21 4.791 0.070 -2.424 4 HB3 GLU 21 HB3 GLU 21 4.002 0.912 -1.093 5 HG2 GLU 21 HG2 GLU 21 5.664 -0.168 0.474 6 HG3 GLU 21 HG3 GLU 21 6.503 -0.805 -0.942 7 H LYS 22 H LYS 22 4.759 -2.932 0.418 8 HA LYS 22 HA LYS 22 6.074 -4.477 -1.625 9 HB2 LYS 22 HB2 LYS 22 6.802 -5.941 0.318 10 HB3 LYS 22 HB3 LYS 22 7.293 -4.266 0.406 11 HG2 LYS 22 HG2 LYS 22 6.707 -4.764 2.611 12 HG3 LYS 22 HG3 LYS 22 5.282 -3.930 2.001 13 HD2 LYS 22 HD2 LYS 22 4.656 -5.876 3.366 14 HD3 LYS 22 HD3 LYS 22 4.130 -6.087 1.698 15 HE2 LYS 22 HE2 LYS 22 6.068 -7.558 1.270 16 HE3 LYS 22 HE3 LYS 22 6.596 -7.346 2.941 17 HZ1 LYS 22 HZ1 LYS 22 4.028 -8.556 2.088 18 HZ2 LYS 22 HZ2 LYS 22 4.563 -8.397 3.681 19 HZ3 LYS 22 HZ3 LYS 22 5.390 -9.408 2.611 20 H VAL 23 H VAL 23 5.594 -6.573 -2.290 21 HA VAL 23 HA VAL 23 2.770 -7.264 -2.183 22 HB VAL 23 HB VAL 23 3.822 -7.314 -4.370 23 HG11 VAL 23 HG11 VAL 23 6.151 -7.785 -3.769 24 HG12 VAL 23 HG12 VAL 23 5.596 -8.900 -5.019 25 HG13 VAL 23 HG13 VAL 23 5.728 -9.448 -3.345 26 HG21 VAL 23 HG21 VAL 23 1.998 -8.917 -3.976 27 HG22 VAL 23 HG22 VAL 23 3.160 -10.146 -3.475 28 HG23 VAL 23 HG23 VAL 23 3.154 -9.565 -5.142 29 H THR 24 H THR 24 2.004 -8.497 -0.584 30 HA THR 24 HA THR 24 3.667 -10.327 0.947 31 HB THR 24 HB THR 24 0.660 -9.798 1.133 32 HG1 THR 24 HG1 THR 24 1.296 -8.001 2.037 33 HG21 THR 24 HG21 THR 24 1.286 -11.953 2.196 34 HG22 THR 24 HG22 THR 24 0.844 -10.759 3.414 35 HG23 THR 24 HG23 THR 24 2.545 -11.138 3.135 36 H LEU 25 H LEU 25 4.178 -12.217 0.051 37 HA LEU 25 HA LEU 25 2.491 -13.537 -1.921 38 HB2 LEU 25 HB2 LEU 25 5.249 -14.211 -0.832 39 HB3 LEU 25 HB3 LEU 25 4.424 -15.157 -2.069 40 HG LEU 25 HG LEU 25 5.295 -12.241 -2.354 41 HD11 LEU 25 HD11 LEU 25 7.208 -13.780 -2.401 42 HD12 LEU 25 HD12 LEU 25 6.926 -13.078 -3.991 43 HD13 LEU 25 HD13 LEU 25 6.431 -14.741 -3.662 44 HD21 LEU 25 HD21 LEU 25 3.235 -12.642 -3.623 45 HD22 LEU 25 HD22 LEU 25 3.948 -14.066 -4.389 46 HD23 LEU 25 HD23 LEU 25 4.601 -12.460 -4.723 47 H VAL 26 H VAL 26 0.863 -14.714 -1.187 48 HA VAL 26 HA VAL 26 1.049 -16.352 1.241 49 HB VAL 26 HB VAL 26 -1.318 -15.944 -0.641 50 HG11 VAL 26 HG11 VAL 26 -1.258 -17.114 2.168 51 HG12 VAL 26 HG12 VAL 26 -1.525 -18.010 0.670 52 HG13 VAL 26 HG13 VAL 26 -2.712 -16.820 1.204 53 HG21 VAL 26 HG21 VAL 26 -0.682 -13.783 0.356 54 HG22 VAL 26 HG22 VAL 26 -0.752 -14.486 1.974 55 HG23 VAL 26 HG23 VAL 26 -2.225 -14.338 1.011 56 H ARG 27 H ARG 27 1.514 -18.461 1.108 57 HA ARG 27 HA ARG 27 1.871 -19.740 -1.516 58 HB2 ARG 27 HB2 ARG 27 3.147 -21.448 -0.252 59 HB3 ARG 27 HB3 ARG 27 3.760 -19.822 0.037 60 HG2 ARG 27 HG2 ARG 27 2.492 -19.796 2.211 61 HG3 ARG 27 HG3 ARG 27 2.039 -21.481 1.923 62 HD2 ARG 27 HD2 ARG 27 3.972 -21.313 3.443 63 HD3 ARG 27 HD3 ARG 27 4.411 -22.136 1.941 64 HE ARG 27 HE ARG 27 4.978 -19.399 1.651 65 HH11 ARG 27 HH11 ARG 27 6.198 -22.083 3.568 66 HH12 ARG 27 HH12 ARG 27 7.806 -21.434 3.631 67 HH21 ARG 27 HH21 ARG 27 7.058 -18.581 1.755 68 HH22 ARG 27 HH22 ARG 27 8.290 -19.450 2.612 69 H ILE 28 H ILE 28 1.322 -22.161 -1.618 70 HA ILE 28 HA ILE 28 -1.497 -22.437 -1.322 71 HB ILE 28 HB ILE 28 -0.204 -23.492 -3.192 72 HG12 ILE 28 HG12 ILE 28 -1.941 -25.444 -1.591 73 HG13 ILE 28 HG13 ILE 28 -2.546 -24.190 -2.669 74 HG21 ILE 28 HG21 ILE 28 0.935 -25.662 -2.869 75 HG22 ILE 28 HG22 ILE 28 0.675 -25.547 -1.126 76 HG23 ILE 28 HG23 ILE 28 1.718 -24.380 -1.942 77 HD11 ILE 28 HD11 ILE 28 -2.638 -26.351 -3.724 78 HD12 ILE 28 HD12 ILE 28 -0.909 -26.588 -3.475 79 HD13 ILE 28 HD13 ILE 28 -1.481 -25.319 -4.562 80 H ALA 29 H ALA 29 1.250 -23.624 0.526 81 HA ALA 29 HA ALA 29 0.000 -25.517 2.199 82 HB1 ALA 29 HB1 ALA 29 1.921 -25.165 3.723 83 HB2 ALA 29 HB2 ALA 29 2.362 -23.700 2.840 84 HB3 ALA 29 HB3 ALA 29 2.457 -25.270 2.043 85 H ASP 30 H ASP 30 0.153 -21.993 2.346 86 HA ASP 30 HA ASP 30 -0.943 -21.701 4.977 87 HB2 ASP 30 HB2 ASP 30 0.421 -19.924 3.779 88 HB3 ASP 30 HB3 ASP 30 -0.954 -19.645 2.726 89 H LEU 31 H LEU 31 -2.272 -21.587 1.668 90 HA LEU 31 HA LEU 31 -4.920 -20.840 2.173 91 HB2 LEU 31 HB2 LEU 31 -3.897 -22.721 0.013 92 HB3 LEU 31 HB3 LEU 31 -5.470 -21.929 -0.003 93 HG LEU 31 HG LEU 31 -2.782 -20.498 -0.169 94 HD11 LEU 31 HD11 LEU 31 -3.360 -20.093 -2.519 95 HD12 LEU 31 HD12 LEU 31 -4.833 -21.050 -2.341 96 HD13 LEU 31 HD13 LEU 31 -3.251 -21.820 -2.180 97 HD21 LEU 31 HD21 LEU 31 -4.487 -19.080 0.897 98 HD22 LEU 31 HD22 LEU 31 -5.598 -19.378 -0.444 99 HD23 LEU 31 HD23 LEU 31 -4.097 -18.489 -0.717 100 H GLU 32 H GLU 32 -3.563 -24.122 1.877 101 HA GLU 32 HA GLU 32 -5.987 -25.548 2.069 102 HB2 GLU 32 HB2 GLU 32 -3.163 -26.517 2.675 103 HB3 GLU 32 HB3 GLU 32 -4.561 -27.550 2.375 104 HG2 GLU 32 HG2 GLU 32 -3.123 -25.746 0.409 105 HG3 GLU 32 HG3 GLU 32 -3.217 -27.504 0.392 106 H ASN 33 H ASN 33 -3.452 -24.936 4.492 107 HA ASN 33 HA ASN 33 -4.661 -26.291 6.665 108 HB2 ASN 33 HB2 ASN 33 -2.480 -24.193 6.450 109 HB3 ASN 33 HB3 ASN 33 -3.064 -24.703 8.032 110 HD21 ASN 33 HD21 ASN 33 -1.605 -25.939 5.022 111 HD22 ASN 33 HD22 ASN 33 -0.793 -27.263 5.768 112 H HIS 34 H HIS 34 -5.005 -22.998 5.438 113 HA HIS 34 HA HIS 34 -6.494 -21.947 7.665 114 HB2 HIS 34 HB2 HIS 34 -5.146 -20.538 6.027 115 HB3 HIS 34 HB3 HIS 34 -6.387 -20.852 4.816 116 HD1 HIS 34 HD1 HIS 34 -5.832 -19.071 8.081 117 HD2 HIS 34 HD2 HIS 34 -8.643 -19.251 5.049 118 HE1 HIS 34 HE1 HIS 34 -7.449 -17.217 8.558 119 HE2 HIS 34 HE2 HIS 34 -8.970 -17.212 6.576 120 H ASN 35 H ASN 35 -7.289 -23.465 4.597 121 HA ASN 35 HA ASN 35 -10.075 -23.087 4.493 122 HB2 ASN 35 HB2 ASN 35 -8.882 -23.898 2.539 123 HB3 ASN 35 HB3 ASN 35 -8.275 -25.298 3.410 124 HD21 ASN 35 HD21 ASN 35 -9.639 -27.097 3.700 125 HD22 ASN 35 HD22 ASN 35 -11.132 -27.273 2.843 126 H ASN 36 H ASN 36 -8.056 -25.515 6.074 127 HA ASN 36 HA ASN 36 -10.123 -27.253 6.972 128 HB2 ASN 36 HB2 ASN 36 -7.251 -26.937 7.952 129 HB3 ASN 36 HB3 ASN 36 -8.309 -28.293 8.339 130 HD21 ASN 36 HD21 ASN 36 -5.740 -28.327 6.965 131 HD22 ASN 36 HD22 ASN 36 -6.019 -29.038 5.417 132 H ASP 37 H ASP 37 -8.682 -24.340 8.295 133 HA ASP 37 HA ASP 37 -9.722 -24.534 10.958 134 HB2 ASP 37 HB2 ASP 37 -8.917 -22.090 9.322 135 HB3 ASP 37 HB3 ASP 37 -9.332 -22.028 11.033 136 H GLY 38 H GLY 38 -11.193 -23.855 7.935 137 HA2 GLY 38 HA2 GLY 38 -13.632 -23.808 7.804 138 HA3 GLY 38 HA3 GLY 38 -13.646 -22.751 9.211 139 H GLY 39 H GLY 39 -11.175 -21.417 8.013 140 HA2 GLY 39 HA2 GLY 39 -12.510 -19.250 6.691 141 HA3 GLY 39 HA3 GLY 39 -10.782 -19.421 6.964 142 H PHE 40 H PHE 40 -13.414 -20.086 4.763 143 HA PHE 40 HA PHE 40 -11.801 -21.479 2.823 144 HB2 PHE 40 HB2 PHE 40 -14.340 -21.770 3.128 145 HB3 PHE 40 HB3 PHE 40 -14.533 -20.219 2.320 146 HD1 PHE 40 HD1 PHE 40 -13.526 -23.740 1.889 147 HD2 PHE 40 HD2 PHE 40 -14.102 -20.007 -0.112 148 HE1 PHE 40 HE1 PHE 40 -13.383 -24.877 -0.289 149 HE2 PHE 40 HE2 PHE 40 -13.968 -21.156 -2.282 150 HZ PHE 40 HZ PHE 40 -13.605 -23.589 -2.370 151 H TRP 41 H TRP 41 -10.229 -20.373 1.870 152 HA TRP 41 HA TRP 41 -10.732 -17.730 0.638 153 HB2 TRP 41 HB2 TRP 41 -8.149 -19.215 1.314 154 HB3 TRP 41 HB3 TRP 41 -8.167 -17.831 0.229 155 HD1 TRP 41 HD1 TRP 41 -10.540 -16.573 2.492 156 HE1 TRP 41 HE1 TRP 41 -9.497 -15.229 4.415 157 HE3 TRP 41 HE3 TRP 41 -5.734 -18.286 2.157 158 HZ2 TRP 41 HZ2 TRP 41 -6.975 -14.934 5.639 159 HZ3 TRP 41 HZ3 TRP 41 -4.059 -17.430 3.740 160 HH2 TRP 41 HH2 TRP 41 -4.668 -15.782 5.449 161 H THR 42 H THR 42 -9.590 -17.522 -1.535 162 HA THR 42 HA THR 42 -9.215 -19.942 -3.116 163 HB THR 42 HB THR 42 -11.668 -19.356 -3.419 164 HG1 THR 42 HG1 THR 42 -11.071 -20.402 -5.185 165 HG21 THR 42 HG21 THR 42 -11.521 -16.886 -3.292 166 HG22 THR 42 HG22 THR 42 -12.276 -17.407 -4.800 167 HG23 THR 42 HG23 THR 42 -10.598 -16.862 -4.797 168 H VAL 43 H VAL 43 -8.181 -19.407 -5.211 169 HA VAL 43 HA VAL 43 -6.778 -16.790 -5.227 170 HB VAL 43 HB VAL 43 -5.709 -19.513 -6.104 171 HG11 VAL 43 HG11 VAL 43 -5.003 -17.818 -7.752 172 HG12 VAL 43 HG12 VAL 43 -3.630 -18.309 -6.764 173 HG13 VAL 43 HG13 VAL 43 -4.426 -16.765 -6.456 174 HG21 VAL 43 HG21 VAL 43 -4.764 -17.572 -3.961 175 HG22 VAL 43 HG22 VAL 43 -3.973 -19.088 -4.396 176 HG23 VAL 43 HG23 VAL 43 -5.586 -19.110 -3.682 177 H ILE 44 H ILE 44 -7.616 -15.584 -6.762 178 HA ILE 44 HA ILE 44 -8.006 -16.662 -9.490 179 HB ILE 44 HB ILE 44 -9.970 -14.772 -8.093 180 HG12 ILE 44 HG12 ILE 44 -10.322 -17.694 -8.940 181 HG13 ILE 44 HG13 ILE 44 -10.254 -17.098 -7.289 182 HG21 ILE 44 HG21 ILE 44 -11.322 -14.927 -10.166 183 HG22 ILE 44 HG22 ILE 44 -10.068 -15.915 -10.920 184 HG23 ILE 44 HG23 ILE 44 -9.732 -14.237 -10.487 185 HD11 ILE 44 HD11 ILE 44 -12.374 -15.843 -7.775 186 HD12 ILE 44 HD12 ILE 44 -12.494 -17.598 -7.783 187 HD13 ILE 44 HD13 ILE 44 -12.443 -16.716 -9.305 188 H ASP 45 H ASP 45 -7.153 -15.318 -11.027 189 HA ASP 45 HA ASP 45 -5.810 -13.778 -12.004 190 HB2 ASP 45 HB2 ASP 45 -7.747 -12.265 -11.533 191 HB3 ASP 45 HB3 ASP 45 -7.062 -11.867 -9.967 192 H GLY 46 H GLY 46 -4.803 -15.410 -9.888 193 HA2 GLY 46 HA2 GLY 46 -2.966 -15.784 -8.587 194 HA3 GLY 46 HA3 GLY 46 -2.236 -14.387 -9.362 195 H LYS 47 H LYS 47 -5.235 -14.109 -7.591 196 HA LYS 47 HA LYS 47 -3.872 -12.701 -5.362 197 HB2 LYS 47 HB2 LYS 47 -6.655 -12.085 -6.443 198 HB3 LYS 47 HB3 LYS 47 -5.781 -11.187 -5.205 199 HG2 LYS 47 HG2 LYS 47 -4.993 -11.390 -8.119 200 HG3 LYS 47 HG3 LYS 47 -5.890 -10.044 -7.401 201 HD2 LYS 47 HD2 LYS 47 -3.961 -9.574 -5.923 202 HD3 LYS 47 HD3 LYS 47 -3.062 -10.908 -6.667 203 HE2 LYS 47 HE2 LYS 47 -4.016 -8.365 -8.030 204 HE3 LYS 47 HE3 LYS 47 -2.348 -8.814 -7.663 205 HZ1 LYS 47 HZ1 LYS 47 -4.164 -10.177 -9.584 206 HZ2 LYS 47 HZ2 LYS 47 -2.618 -10.724 -9.173 207 HZ3 LYS 47 HZ3 LYS 47 -2.803 -9.241 -9.960 208 H VAL 48 H VAL 48 -4.391 -13.402 -3.403 209 HA VAL 48 HA VAL 48 -6.284 -15.573 -3.001 210 HB VAL 48 HB VAL 48 -4.478 -14.118 -1.018 211 HG11 VAL 48 HG11 VAL 48 -4.893 -16.020 0.513 212 HG12 VAL 48 HG12 VAL 48 -6.064 -16.685 -0.628 213 HG13 VAL 48 HG13 VAL 48 -6.380 -15.137 0.159 214 HG21 VAL 48 HG21 VAL 48 -4.100 -16.774 -2.450 215 HG22 VAL 48 HG22 VAL 48 -3.046 -16.139 -1.188 216 HG23 VAL 48 HG23 VAL 48 -3.179 -15.293 -2.729 217 H TYR 49 H TYR 49 -8.371 -15.020 -2.845 218 HA TYR 49 HA TYR 49 -9.185 -12.540 -1.459 219 HB2 TYR 49 HB2 TYR 49 -10.696 -14.240 -3.491 220 HB3 TYR 49 HB3 TYR 49 -11.401 -12.879 -2.626 221 HD1 TYR 49 HD1 TYR 49 -10.306 -10.546 -2.947 222 HD2 TYR 49 HD2 TYR 49 -9.559 -13.852 -5.556 223 HE1 TYR 49 HE1 TYR 49 -9.535 -8.994 -4.695 224 HE2 TYR 49 HE2 TYR 49 -8.790 -12.294 -7.292 225 HH TYR 49 HH TYR 49 -9.006 -9.989 -7.939 226 H ASP 50 H ASP 50 -10.822 -12.617 0.071 227 HA ASP 50 HA ASP 50 -11.205 -15.147 1.470 228 HB2 ASP 50 HB2 ASP 50 -10.705 -12.825 2.561 229 HB3 ASP 50 HB3 ASP 50 -12.405 -12.468 2.291 230 H ILE 51 H ILE 51 -13.168 -16.178 1.671 231 HA ILE 51 HA ILE 51 -15.313 -15.340 -0.207 232 HB ILE 51 HB ILE 51 -14.234 -18.113 0.431 233 HG12 ILE 51 HG12 ILE 51 -12.934 -16.889 -1.261 234 HG13 ILE 51 HG13 ILE 51 -13.804 -18.211 -2.034 235 HG21 ILE 51 HG21 ILE 51 -15.941 -19.073 -1.079 236 HG22 ILE 51 HG22 ILE 51 -16.724 -17.494 -1.193 237 HG23 ILE 51 HG23 ILE 51 -16.661 -18.340 0.354 238 HD11 ILE 51 HD11 ILE 51 -13.880 -16.237 -3.408 239 HD12 ILE 51 HD12 ILE 51 -14.566 -15.284 -2.096 240 HD13 ILE 51 HD13 ILE 51 -15.503 -16.596 -2.824 241 H LYS 52 H LYS 52 -14.628 -16.929 2.910 242 HA LYS 52 HA LYS 52 -17.377 -17.340 3.587 243 HB2 LYS 52 HB2 LYS 52 -16.452 -17.763 5.952 244 HB3 LYS 52 HB3 LYS 52 -15.921 -18.826 4.668 245 HG2 LYS 52 HG2 LYS 52 -13.966 -18.455 5.887 246 HG3 LYS 52 HG3 LYS 52 -13.808 -17.364 4.514 247 HD2 LYS 52 HD2 LYS 52 -13.077 -16.184 6.475 248 HD3 LYS 52 HD3 LYS 52 -14.618 -15.494 5.987 249 HE2 LYS 52 HE2 LYS 52 -15.755 -16.819 7.751 250 HE3 LYS 52 HE3 LYS 52 -14.190 -17.463 8.260 251 HZ1 LYS 52 HZ1 LYS 52 -14.720 -15.657 9.666 252 HZ2 LYS 52 HZ2 LYS 52 -15.119 -14.652 8.373 253 HZ3 LYS 52 HZ3 LYS 52 -13.509 -15.097 8.630 254 H ASP 53 H ASP 53 -15.117 -14.698 4.155 255 HA ASP 53 HA ASP 53 -16.928 -13.102 5.735 256 HB2 ASP 53 HB2 ASP 53 -14.454 -12.774 5.836 257 HB3 ASP 53 HB3 ASP 53 -14.453 -12.261 4.154 258 H PHE 54 H PHE 54 -16.127 -13.414 2.304 259 HA PHE 54 HA PHE 54 -17.294 -11.134 1.196 260 HB2 PHE 54 HB2 PHE 54 -15.814 -12.773 0.009 261 HB3 PHE 54 HB3 PHE 54 -17.136 -13.928 -0.021 262 HD1 PHE 54 HD1 PHE 54 -15.812 -10.815 -1.466 263 HD2 PHE 54 HD2 PHE 54 -19.007 -13.646 -1.606 264 HE1 PHE 54 HE1 PHE 54 -16.548 -9.899 -3.617 265 HE2 PHE 54 HE2 PHE 54 -19.729 -12.720 -3.764 266 HZ PHE 54 HZ PHE 54 -18.501 -10.840 -4.774 267 H GLN 55 H GLN 55 -18.751 -14.317 1.735 268 HA GLN 55 HA GLN 55 -21.353 -13.658 0.770 269 HB2 GLN 55 HB2 GLN 55 -22.027 -15.844 1.703 270 HB3 GLN 55 HB3 GLN 55 -20.566 -15.940 0.725 271 HG2 GLN 55 HG2 GLN 55 -19.224 -15.897 2.862 272 HG3 GLN 55 HG3 GLN 55 -20.743 -16.025 3.752 273 HE21 GLN 55 HE21 GLN 55 -18.463 -17.686 1.690 274 HE22 GLN 55 HE22 GLN 55 -19.095 -19.277 1.922 275 H THR 56 H THR 56 -19.828 -13.409 3.937 276 HA THR 56 HA THR 56 -22.144 -12.865 5.497 277 HB THR 56 HB THR 56 -19.299 -11.837 5.944 278 HG1 THR 56 HG1 THR 56 -18.852 -13.858 6.321 279 HG21 THR 56 HG21 THR 56 -19.898 -11.748 8.333 280 HG22 THR 56 HG22 THR 56 -21.535 -12.291 7.968 281 HG23 THR 56 HG23 THR 56 -20.985 -10.715 7.397 282 H GLN 57 H GLN 57 -19.984 -10.811 3.539 283 HA GLN 57 HA GLN 57 -21.313 -8.330 4.149 284 HB2 GLN 57 HB2 GLN 57 -19.438 -8.919 1.821 285 HB3 GLN 57 HB3 GLN 57 -19.831 -7.345 2.498 286 HG2 GLN 57 HG2 GLN 57 -18.135 -9.527 3.731 287 HG3 GLN 57 HG3 GLN 57 -17.622 -7.922 3.224 288 HE21 GLN 57 HE21 GLN 57 -17.311 -9.245 5.801 289 HE22 GLN 57 HE22 GLN 57 -18.068 -8.224 6.972 290 H SER 58 H SER 58 -21.941 -10.947 2.039 291 HA SER 58 HA SER 58 -23.714 -9.470 0.240 292 HB2 SER 58 HB2 SER 58 -22.318 -11.257 -0.694 293 HB3 SER 58 HB3 SER 58 -22.997 -12.431 0.428 294 HG SER 58 HG SER 58 -24.782 -11.045 -1.197 295 H LEU 59 H LEU 59 -23.912 -10.845 3.312 296 HA LEU 59 HA LEU 59 -26.636 -11.848 3.207 297 HB2 LEU 59 HB2 LEU 59 -24.854 -12.887 4.626 298 HB3 LEU 59 HB3 LEU 59 -24.756 -11.409 5.568 299 HG LEU 59 HG LEU 59 -27.080 -11.775 6.380 300 HD11 LEU 59 HD11 LEU 59 -26.999 -14.410 4.888 301 HD12 LEU 59 HD12 LEU 59 -28.012 -13.017 4.494 302 HD13 LEU 59 HD13 LEU 59 -28.254 -13.878 6.011 303 HD21 LEU 59 HD21 LEU 59 -25.203 -12.587 7.731 304 HD22 LEU 59 HD22 LEU 59 -25.246 -14.142 6.892 305 HD23 LEU 59 HD23 LEU 59 -26.606 -13.639 7.899 306 H THR 60 H THR 60 -25.404 -8.776 3.273 307 HA THR 60 HA THR 60 -27.581 -7.642 4.935 308 HB THR 60 HB THR 60 -25.564 -7.264 6.153 309 HG1 THR 60 HG1 THR 60 -25.276 -4.820 5.635 310 HG21 THR 60 HG21 THR 60 -24.295 -6.188 3.627 311 HG22 THR 60 HG22 THR 60 -23.915 -7.729 4.402 312 HG23 THR 60 HG23 THR 60 -23.548 -6.209 5.224 313 H GLU 61 H GLU 61 -28.386 -5.598 4.312 314 HA GLU 61 HA GLU 61 -29.001 -5.471 1.507 315 HB2 GLU 61 HB2 GLU 61 -30.737 -5.067 3.200 316 HB3 GLU 61 HB3 GLU 61 -29.839 -3.701 3.846 317 HG2 GLU 61 HG2 GLU 61 -31.726 -2.929 2.502 318 HG3 GLU 61 HG3 GLU 61 -30.199 -2.447 1.761 319 H ASN 62 H ASN 62 -27.437 -3.188 3.800 320 HA ASN 62 HA ASN 62 -26.731 -1.294 1.730 321 HB2 ASN 62 HB2 ASN 62 -27.306 -0.530 4.029 322 HB3 ASN 62 HB3 ASN 62 -25.898 -1.362 4.669 323 HD21 ASN 62 HD21 ASN 62 -23.828 -0.440 4.329 324 HD22 ASN 62 HD22 ASN 62 -23.616 1.173 3.744 325 H SER 63 H SER 63 -25.642 -2.930 0.456 326 HA SER 63 HA SER 63 -22.797 -2.924 0.690 327 HB2 SER 63 HB2 SER 63 -24.321 -5.505 1.249 328 HB3 SER 63 HB3 SER 63 -22.711 -5.557 0.526 329 HG SER 63 HG SER 63 -22.505 -5.703 2.730 330 H ILE 64 H ILE 64 -21.853 -3.400 -1.236 331 HA ILE 64 HA ILE 64 -23.304 -3.210 -3.667 332 HB ILE 64 HB ILE 64 -21.094 -3.654 -4.757 333 HG12 ILE 64 HG12 ILE 64 -20.058 -4.043 -1.897 334 HG13 ILE 64 HG13 ILE 64 -20.203 -5.311 -3.105 335 HG21 ILE 64 HG21 ILE 64 -19.924 -1.636 -3.921 336 HG22 ILE 64 HG22 ILE 64 -20.959 -1.623 -2.491 337 HG23 ILE 64 HG23 ILE 64 -21.659 -1.353 -4.090 338 HD11 ILE 64 HD11 ILE 64 -18.350 -2.940 -3.220 339 HD12 ILE 64 HD12 ILE 64 -18.512 -4.175 -4.469 340 HD13 ILE 64 HD13 ILE 64 -17.922 -4.612 -2.870 341 H LEU 65 H LEU 65 -22.484 -5.888 -1.674 342 HA LEU 65 HA LEU 65 -22.674 -7.926 -3.765 343 HB2 LEU 65 HB2 LEU 65 -22.193 -8.237 -0.780 344 HB3 LEU 65 HB3 LEU 65 -22.018 -9.494 -2.000 345 HG LEU 65 HG LEU 65 -20.260 -7.027 -1.668 346 HD11 LEU 65 HD11 LEU 65 -19.632 -9.972 -1.242 347 HD12 LEU 65 HD12 LEU 65 -19.850 -8.753 0.016 348 HD13 LEU 65 HD13 LEU 65 -18.488 -8.629 -1.095 349 HD21 LEU 65 HD21 LEU 65 -20.052 -9.208 -3.781 350 HD22 LEU 65 HD22 LEU 65 -18.869 -7.928 -3.501 351 HD23 LEU 65 HD23 LEU 65 -20.488 -7.517 -4.059 352 H ALA 66 H ALA 66 -24.948 -6.193 -2.209 353 HA ALA 66 HA ALA 66 -26.777 -8.181 -1.260 354 HB1 ALA 66 HB1 ALA 66 -26.966 -5.817 -0.586 355 HB2 ALA 66 HB2 ALA 66 -28.467 -6.386 -1.319 356 HB3 ALA 66 HB3 ALA 66 -27.364 -5.365 -2.246 357 H GLN 67 H GLN 67 -25.968 -6.968 -4.440 358 HA GLN 67 HA GLN 67 -28.172 -8.153 -5.867 359 HB2 GLN 67 HB2 GLN 67 -26.870 -7.658 -7.917 360 HB3 GLN 67 HB3 GLN 67 -26.945 -6.262 -6.848 361 HG2 GLN 67 HG2 GLN 67 -24.652 -6.631 -6.118 362 HG3 GLN 67 HG3 GLN 67 -24.563 -8.132 -7.031 363 HE21 GLN 67 HE21 GLN 67 -24.525 -4.648 -7.236 364 HE22 GLN 67 HE22 GLN 67 -23.979 -4.547 -8.871 365 H PHE 68 H PHE 68 -25.443 -9.474 -4.355 366 HA PHE 68 HA PHE 68 -25.519 -11.972 -5.960 367 HB2 PHE 68 HB2 PHE 68 -23.304 -10.868 -4.159 368 HB3 PHE 68 HB3 PHE 68 -23.235 -12.408 -5.009 369 HD1 PHE 68 HD1 PHE 68 -23.885 -12.080 -7.688 370 HD2 PHE 68 HD2 PHE 68 -22.000 -9.186 -5.161 371 HE1 PHE 68 HE1 PHE 68 -22.883 -10.998 -9.661 372 HE2 PHE 68 HE2 PHE 68 -21.005 -8.110 -7.145 373 HZ PHE 68 HZ PHE 68 -21.449 -9.014 -9.395 374 H ALA 69 H ALA 69 -27.301 -11.048 -3.675 375 HA ALA 69 HA ALA 69 -26.626 -12.303 -1.234 376 HB1 ALA 69 HB1 ALA 69 -28.251 -10.459 -1.420 377 HB2 ALA 69 HB2 ALA 69 -28.944 -11.847 -0.574 378 HB3 ALA 69 HB3 ALA 69 -29.374 -11.531 -2.259 379 H GLY 70 H GLY 70 -28.158 -13.588 -4.128 380 HA2 GLY 70 HA2 GLY 70 -28.695 -16.192 -2.780 381 HA3 GLY 70 HA3 GLY 70 -29.511 -15.619 -4.226 382 H GLU 71 H GLU 71 -26.269 -14.840 -4.417 383 HA GLU 71 HA GLU 71 -25.750 -16.993 -6.358 384 HB2 GLU 71 HB2 GLU 71 -25.523 -14.646 -7.138 385 HB3 GLU 71 HB3 GLU 71 -24.344 -14.310 -5.883 386 HG2 GLU 71 HG2 GLU 71 -23.211 -14.559 -7.995 387 HG3 GLU 71 HG3 GLU 71 -22.771 -15.902 -6.945 388 H ASP 72 H ASP 72 -23.830 -18.219 -6.291 389 HA ASP 72 HA ASP 72 -22.641 -18.913 -3.806 390 HB2 ASP 72 HB2 ASP 72 -22.673 -20.488 -5.706 391 HB3 ASP 72 HB3 ASP 72 -21.688 -19.398 -6.670 392 HA PRO 73 HA PRO 73 -20.124 -15.226 -3.295 393 HB2 PRO 73 HB2 PRO 73 -18.169 -16.279 -1.565 394 HB3 PRO 73 HB3 PRO 73 -19.759 -15.683 -1.074 395 HG2 PRO 73 HG2 PRO 73 -18.877 -18.508 -1.639 396 HG3 PRO 73 HG3 PRO 73 -19.893 -17.894 -0.316 397 HD2 PRO 73 HD2 PRO 73 -20.996 -19.123 -2.415 398 HD3 PRO 73 HD3 PRO 73 -21.789 -17.700 -1.700 399 H VAL 74 H VAL 74 -18.415 -18.243 -4.241 400 HA VAL 74 HA VAL 74 -15.989 -16.887 -5.057 401 HB VAL 74 HB VAL 74 -16.826 -19.697 -5.906 402 HG11 VAL 74 HG11 VAL 74 -14.885 -18.789 -7.116 403 HG12 VAL 74 HG12 VAL 74 -14.381 -20.105 -6.057 404 HG13 VAL 74 HG13 VAL 74 -14.074 -18.430 -5.591 405 HG21 VAL 74 HG21 VAL 74 -17.010 -19.562 -3.451 406 HG22 VAL 74 HG22 VAL 74 -15.369 -18.925 -3.346 407 HG23 VAL 74 HG23 VAL 74 -15.639 -20.573 -3.917 408 H VAL 75 H VAL 75 -18.884 -18.131 -6.693 409 HA VAL 75 HA VAL 75 -18.100 -17.539 -9.387 410 HB VAL 75 HB VAL 75 -20.908 -17.867 -8.215 411 HG11 VAL 75 HG11 VAL 75 -20.044 -17.947 -11.142 412 HG12 VAL 75 HG12 VAL 75 -21.052 -16.713 -10.382 413 HG13 VAL 75 HG13 VAL 75 -21.656 -18.361 -10.542 414 HG21 VAL 75 HG21 VAL 75 -19.505 -19.862 -7.867 415 HG22 VAL 75 HG22 VAL 75 -19.111 -19.912 -9.587 416 HG23 VAL 75 HG23 VAL 75 -20.769 -20.198 -9.052 417 H ALA 76 H ALA 76 -19.903 -15.820 -6.933 418 HA ALA 76 HA ALA 76 -20.638 -13.469 -8.303 419 HB1 ALA 76 HB1 ALA 76 -21.672 -14.166 -6.179 420 HB2 ALA 76 HB2 ALA 76 -21.016 -12.535 -6.054 421 HB3 ALA 76 HB3 ALA 76 -20.147 -13.892 -5.332 422 H LEU 77 H LEU 77 -17.740 -14.475 -6.617 423 HA LEU 77 HA LEU 77 -16.448 -12.037 -6.208 424 HB2 LEU 77 HB2 LEU 77 -15.781 -14.233 -5.213 425 HB3 LEU 77 HB3 LEU 77 -15.190 -14.738 -6.787 426 HG LEU 77 HG LEU 77 -13.535 -12.796 -6.689 427 HD11 LEU 77 HD11 LEU 77 -14.382 -12.651 -3.776 428 HD12 LEU 77 HD12 LEU 77 -14.650 -11.409 -5.003 429 HD13 LEU 77 HD13 LEU 77 -13.008 -11.815 -4.510 430 HD21 LEU 77 HD21 LEU 77 -13.246 -14.895 -4.521 431 HD22 LEU 77 HD22 LEU 77 -11.948 -13.989 -5.298 432 HD23 LEU 77 HD23 LEU 77 -12.896 -15.136 -6.229 433 H GLU 78 H GLU 78 -16.105 -14.341 -8.971 434 HA GLU 78 HA GLU 78 -14.201 -12.831 -10.447 435 HB2 GLU 78 HB2 GLU 78 -16.195 -14.890 -11.493 436 HB3 GLU 78 HB3 GLU 78 -14.826 -14.248 -12.407 437 HG2 GLU 78 HG2 GLU 78 -13.316 -15.181 -10.603 438 HG3 GLU 78 HG3 GLU 78 -14.737 -15.974 -9.922 439 H ALA 79 H ALA 79 -17.737 -12.911 -10.570 440 HA ALA 79 HA ALA 79 -18.168 -11.190 -12.772 441 HB1 ALA 79 HB1 ALA 79 -20.462 -10.936 -11.864 442 HB2 ALA 79 HB2 ALA 79 -19.942 -11.678 -10.347 443 HB3 ALA 79 HB3 ALA 79 -19.940 -12.624 -11.835 444 H ALA 80 H ALA 80 -17.793 -10.583 -9.311 445 HA ALA 80 HA ALA 80 -18.219 -7.726 -9.471 446 HB1 ALA 80 HB1 ALA 80 -17.312 -9.469 -7.163 447 HB2 ALA 80 HB2 ALA 80 -18.976 -9.015 -7.528 448 HB3 ALA 80 HB3 ALA 80 -17.812 -7.780 -7.043 449 H LEU 81 H LEU 81 -15.493 -9.833 -9.738 450 HA LEU 81 HA LEU 81 -13.386 -7.962 -9.226 451 HB2 LEU 81 HB2 LEU 81 -13.638 -10.727 -10.241 452 HB3 LEU 81 HB3 LEU 81 -12.413 -9.852 -11.130 453 HG LEU 81 HG LEU 81 -11.148 -9.430 -9.069 454 HD11 LEU 81 HD11 LEU 81 -13.315 -10.962 -7.611 455 HD12 LEU 81 HD12 LEU 81 -12.965 -9.239 -7.455 456 HD13 LEU 81 HD13 LEU 81 -11.781 -10.428 -6.921 457 HD21 LEU 81 HD21 LEU 81 -10.441 -11.735 -8.595 458 HD22 LEU 81 HD22 LEU 81 -10.696 -11.500 -10.321 459 HD23 LEU 81 HD23 LEU 81 -11.905 -12.360 -9.361 460 H GLN 82 H GLN 82 -15.133 -9.071 -12.072 461 HA GLN 82 HA GLN 82 -13.773 -7.417 -13.984 462 HB2 GLN 82 HB2 GLN 82 -14.845 -9.670 -14.469 463 HB3 GLN 82 HB3 GLN 82 -16.418 -8.911 -14.281 464 HG2 GLN 82 HG2 GLN 82 -15.997 -9.078 -16.621 465 HG3 GLN 82 HG3 GLN 82 -15.823 -7.379 -16.194 466 HE21 GLN 82 HE21 GLN 82 -14.780 -8.710 -18.517 467 HE22 GLN 82 HE22 GLN 82 -13.061 -8.542 -18.486 468 H PHE 83 H PHE 83 -16.599 -7.072 -11.940 469 HA PHE 83 HA PHE 83 -17.719 -4.820 -13.382 470 HB2 PHE 83 HB2 PHE 83 -19.114 -6.521 -12.133 471 HB3 PHE 83 HB3 PHE 83 -18.472 -5.882 -10.627 472 HD1 PHE 83 HD1 PHE 83 -19.299 -3.602 -13.425 473 HD2 PHE 83 HD2 PHE 83 -20.739 -5.388 -9.813 474 HE1 PHE 83 HE1 PHE 83 -21.158 -2.009 -13.372 475 HE2 PHE 83 HE2 PHE 83 -22.610 -3.791 -9.778 476 HZ PHE 83 HZ PHE 83 -22.825 -2.099 -11.558 477 H GLU 84 H GLU 84 -16.881 -2.864 -13.233 478 HA GLU 84 HA GLU 84 -14.692 -2.211 -11.588 479 HB2 GLU 84 HB2 GLU 84 -14.739 -0.031 -12.671 480 HB3 GLU 84 HB3 GLU 84 -15.006 -1.313 -13.850 481 HG2 GLU 84 HG2 GLU 84 -17.457 -0.824 -13.775 482 HG3 GLU 84 HG3 GLU 84 -17.131 0.523 -12.684 483 H ASP 85 H ASP 85 -18.099 -1.664 -11.191 484 HA ASP 85 HA ASP 85 -18.062 0.387 -9.239 485 HB2 ASP 85 HB2 ASP 85 -20.092 -0.260 -10.511 486 HB3 ASP 85 HB3 ASP 85 -20.104 -1.827 -9.721 487 H THR 86 H THR 86 -17.880 -3.139 -9.032 488 HA THR 86 HA THR 86 -18.033 -3.145 -6.098 489 HB THR 86 HB THR 86 -18.171 -5.693 -6.499 490 HG1 THR 86 HG1 THR 86 -17.279 -5.380 -8.712 491 HG21 THR 86 HG21 THR 86 -20.327 -3.970 -7.781 492 HG22 THR 86 HG22 THR 86 -20.210 -4.357 -6.068 493 HG23 THR 86 HG23 THR 86 -20.524 -5.639 -7.233 494 H ARG 87 H ARG 87 -15.617 -3.407 -8.577 495 HA ARG 87 HA ARG 87 -13.804 -5.227 -7.387 496 HB2 ARG 87 HB2 ARG 87 -12.134 -4.469 -8.954 497 HB3 ARG 87 HB3 ARG 87 -13.687 -4.513 -9.787 498 HG2 ARG 87 HG2 ARG 87 -13.881 -2.115 -9.730 499 HG3 ARG 87 HG3 ARG 87 -12.517 -1.961 -8.624 500 HD2 ARG 87 HD2 ARG 87 -12.376 -2.900 -11.512 501 HD3 ARG 87 HD3 ARG 87 -11.849 -1.328 -10.898 502 HE ARG 87 HE ARG 87 -10.466 -3.864 -10.692 503 HH11 ARG 87 HH11 ARG 87 -10.606 -0.579 -9.440 504 HH12 ARG 87 HH12 ARG 87 -9.067 -0.690 -8.657 505 HH21 ARG 87 HH21 ARG 87 -8.444 -3.977 -9.688 506 HH22 ARG 87 HH22 ARG 87 -7.833 -2.612 -8.810 507 H GLU 88 H GLU 88 -14.462 -1.916 -6.648 508 HA GLU 88 HA GLU 88 -12.143 -0.979 -5.443 509 HB2 GLU 88 HB2 GLU 88 -13.697 0.439 -4.033 510 HB3 GLU 88 HB3 GLU 88 -13.999 0.517 -5.763 511 HG2 GLU 88 HG2 GLU 88 -16.006 -0.687 -5.614 512 HG3 GLU 88 HG3 GLU 88 -15.592 -1.401 -4.062 513 H SER 89 H SER 89 -14.719 -2.979 -3.980 514 HA SER 89 HA SER 89 -13.665 -2.844 -1.316 515 HB2 SER 89 HB2 SER 89 -16.106 -3.096 -1.866 516 HB3 SER 89 HB3 SER 89 -15.782 -4.746 -2.394 517 HG SER 89 HG SER 89 -15.111 -5.229 -0.259 518 H MET 90 H MET 90 -12.926 -4.775 -4.028 519 HA MET 90 HA MET 90 -12.186 -7.240 -2.839 520 HB2 MET 90 HB2 MET 90 -11.175 -5.937 -5.397 521 HB3 MET 90 HB3 MET 90 -10.872 -7.616 -4.935 522 HG2 MET 90 HG2 MET 90 -13.565 -6.361 -5.500 523 HG3 MET 90 HG3 MET 90 -12.687 -7.512 -6.519 524 HE1 MET 90 HE1 MET 90 -15.736 -9.564 -5.142 525 HE2 MET 90 HE2 MET 90 -15.007 -8.813 -6.555 526 HE3 MET 90 HE3 MET 90 -15.783 -7.812 -5.325 527 H HIS 91 H HIS 91 -10.638 -4.154 -2.812 528 HA HIS 91 HA HIS 91 -7.952 -4.865 -2.348 529 HB2 HIS 91 HB2 HIS 91 -7.625 -2.626 -1.679 530 HB3 HIS 91 HB3 HIS 91 -9.021 -2.508 -2.720 531 HD1 HIS 91 HD1 HIS 91 -7.835 -1.337 0.420 532 HD2 HIS 91 HD2 HIS 91 -11.549 -2.528 -1.013 533 HE1 HIS 91 HE1 HIS 91 -9.506 -0.411 2.036 534 HE2 HIS 91 HE2 HIS 91 -11.750 -1.136 1.139 535 H ALA 92 H ALA 92 -10.754 -5.005 -0.299 536 HA ALA 92 HA ALA 92 -9.310 -5.403 2.203 537 HB1 ALA 92 HB1 ALA 92 -11.554 -5.496 3.207 538 HB2 ALA 92 HB2 ALA 92 -12.289 -5.474 1.600 539 HB3 ALA 92 HB3 ALA 92 -11.385 -4.071 2.175 540 H PHE 93 H PHE 93 -11.053 -7.323 -0.221 541 HA PHE 93 HA PHE 93 -11.106 -9.752 1.368 542 HB2 PHE 93 HB2 PHE 93 -11.700 -9.305 -1.596 543 HB3 PHE 93 HB3 PHE 93 -11.965 -10.822 -0.740 544 HD1 PHE 93 HD1 PHE 93 -13.454 -10.560 1.492 545 HD2 PHE 93 HD2 PHE 93 -13.573 -7.907 -1.861 546 HE1 PHE 93 HE1 PHE 93 -15.711 -9.827 2.142 547 HE2 PHE 93 HE2 PHE 93 -15.832 -7.181 -1.203 548 HZ PHE 93 HZ PHE 93 -16.900 -8.139 0.801 549 H CYS 94 H CYS 94 -8.907 -8.248 -0.912 550 HA CYS 94 HA CYS 94 -7.457 -10.666 -1.543 551 HB2 CYS 94 HB2 CYS 94 -5.913 -9.189 -2.791 552 HB3 CYS 94 HB3 CYS 94 -7.588 -8.877 -3.219 553 HG CYS 94 HG CYS 94 -6.548 -6.886 -0.780 554 H VAL 95 H VAL 95 -6.511 -11.571 0.141 555 HA VAL 95 HA VAL 95 -5.292 -10.309 2.366 556 HB VAL 95 HB VAL 95 -4.873 -13.152 1.319 557 HG11 VAL 95 HG11 VAL 95 -4.435 -12.050 4.127 558 HG12 VAL 95 HG12 VAL 95 -3.175 -12.548 2.995 559 HG13 VAL 95 HG13 VAL 95 -4.289 -13.746 3.652 560 HG21 VAL 95 HG21 VAL 95 -7.275 -12.671 1.639 561 HG22 VAL 95 HG22 VAL 95 -6.966 -12.156 3.300 562 HG23 VAL 95 HG23 VAL 95 -6.700 -13.838 2.832 563 H GLY 96 H GLY 96 -4.099 -11.551 -0.709 564 HA2 GLY 96 HA2 GLY 96 -1.961 -9.779 -0.995 565 HA3 GLY 96 HA3 GLY 96 -1.306 -11.262 -0.293 566 H GLN 97 H GLN 97 -0.145 -11.046 -2.478 567 HA GLN 97 HA GLN 97 -1.613 -12.203 -4.741 568 HB2 GLN 97 HB2 GLN 97 0.115 -10.431 -5.136 569 HB3 GLN 97 HB3 GLN 97 1.343 -11.487 -4.448 570 HG2 GLN 97 HG2 GLN 97 0.777 -13.136 -6.314 571 HG3 GLN 97 HG3 GLN 97 -0.176 -11.855 -7.050 572 HE21 GLN 97 HE21 GLN 97 0.928 -9.988 -7.849 573 HE22 GLN 97 HE22 GLN 97 2.610 -10.041 -8.227 574 H TYR 98 H TYR 98 -1.472 -14.340 -5.256 575 HA TYR 98 HA TYR 98 -0.318 -16.229 -3.416 576 HB2 TYR 98 HB2 TYR 98 -2.462 -16.747 -4.419 577 HB3 TYR 98 HB3 TYR 98 -1.814 -16.554 -6.040 578 HD1 TYR 98 HD1 TYR 98 -1.158 -18.634 -2.951 579 HD2 TYR 98 HD2 TYR 98 -1.334 -18.549 -7.221 580 HE1 TYR 98 HE1 TYR 98 -0.688 -21.040 -3.039 581 HE2 TYR 98 HE2 TYR 98 -0.871 -20.951 -7.292 582 HH TYR 98 HH TYR 98 -1.089 -22.948 -4.634 583 H LEU 99 H LEU 99 1.688 -17.023 -3.532 584 HA LEU 99 HA LEU 99 3.088 -17.202 -6.126 585 HB2 LEU 99 HB2 LEU 99 4.393 -16.103 -4.320 586 HB3 LEU 99 HB3 LEU 99 4.183 -17.517 -3.298 587 HG LEU 99 HG LEU 99 5.479 -18.883 -4.974 588 HD11 LEU 99 HD11 LEU 99 6.036 -16.224 -6.338 589 HD12 LEU 99 HD12 LEU 99 5.088 -17.560 -7.000 590 HD13 LEU 99 HD13 LEU 99 6.812 -17.768 -6.710 591 HD21 LEU 99 HD21 LEU 99 6.988 -16.495 -3.869 592 HD22 LEU 99 HD22 LEU 99 7.695 -18.031 -4.376 593 HD23 LEU 99 HD23 LEU 99 6.606 -17.979 -2.992 594 H GLU 100 H GLU 100 2.752 -19.096 -7.110 595 HA GLU 100 HA GLU 100 1.985 -21.519 -5.783 596 HB2 GLU 100 HB2 GLU 100 1.291 -20.992 -8.104 597 HB3 GLU 100 HB3 GLU 100 2.965 -21.044 -8.626 598 HG2 GLU 100 HG2 GLU 100 3.071 -23.446 -8.066 599 HG3 GLU 100 HG3 GLU 100 1.387 -23.383 -7.535 600 HA PRO 101 HA PRO 101 6.008 -22.679 -4.210 601 HB2 PRO 101 HB2 PRO 101 5.743 -25.480 -4.266 602 HB3 PRO 101 HB3 PRO 101 5.118 -24.419 -2.996 603 HG2 PRO 101 HG2 PRO 101 3.689 -25.543 -5.407 604 HG3 PRO 101 HG3 PRO 101 3.132 -25.443 -3.720 605 HD2 PRO 101 HD2 PRO 101 2.263 -23.675 -5.503 606 HD3 PRO 101 HD3 PRO 101 2.703 -23.120 -3.871 607 H ASP 102 H ASP 102 4.987 -24.503 -7.133 608 HA ASP 102 HA ASP 102 7.770 -25.093 -7.837 609 HB2 ASP 102 HB2 ASP 102 5.795 -26.758 -8.049 610 HB3 ASP 102 HB3 ASP 102 5.302 -25.836 -9.467 611 H GLN 103 H GLN 103 5.622 -22.565 -8.380 612 HA GLN 103 HA GLN 103 6.495 -21.698 -10.999 613 HB2 GLN 103 HB2 GLN 103 4.294 -21.030 -10.150 614 HB3 GLN 103 HB3 GLN 103 5.011 -20.283 -8.732 615 HG2 GLN 103 HG2 GLN 103 4.270 -18.577 -10.278 616 HG3 GLN 103 HG3 GLN 103 6.032 -18.548 -10.167 617 HE21 GLN 103 HE21 GLN 103 6.367 -17.582 -12.155 618 HE22 GLN 103 HE22 GLN 103 6.014 -18.347 -13.660 619 H GLU 104 H GLU 104 7.773 -21.578 -7.819 620 HA GLU 104 HA GLU 104 9.016 -19.127 -7.521 621 HB2 GLU 104 HB2 GLU 104 8.778 -21.110 -5.862 622 HB3 GLU 104 HB3 GLU 104 10.244 -21.756 -6.579 623 HG2 GLU 104 HG2 GLU 104 10.009 -19.090 -5.138 624 HG3 GLU 104 HG3 GLU 104 10.596 -20.581 -4.415 625 H GLY 105 H GLY 105 10.481 -22.088 -8.887 626 HA2 GLY 105 HA2 GLY 105 13.004 -20.959 -9.550 627 HA3 GLY 105 HA3 GLY 105 12.350 -22.480 -10.128 628 H VAL 106 H VAL 106 11.133 -22.533 -12.068 629 HA VAL 106 HA VAL 106 10.662 -20.190 -13.659 630 HB VAL 106 HB VAL 106 13.071 -20.390 -14.098 631 HG11 VAL 106 HG11 VAL 106 12.557 -23.226 -15.073 632 HG12 VAL 106 HG12 VAL 106 13.422 -22.770 -13.607 633 HG13 VAL 106 HG13 VAL 106 14.095 -22.362 -15.187 634 HG21 VAL 106 HG21 VAL 106 11.464 -21.275 -16.531 635 HG22 VAL 106 HG22 VAL 106 13.056 -20.511 -16.575 636 HG23 VAL 106 HG23 VAL 106 11.664 -19.615 -15.964 637 H THR 107 H THR 107 8.960 -20.579 -14.968 638 HA THR 107 HA THR 107 8.144 -23.358 -15.557 639 HB THR 107 HB THR 107 6.369 -22.204 -14.413 640 HG1 THR 107 HG1 THR 107 5.808 -22.250 -17.213 641 HG21 THR 107 HG21 THR 107 6.569 -19.969 -16.464 642 HG22 THR 107 HG22 THR 107 7.027 -19.863 -14.762 643 HG23 THR 107 HG23 THR 107 5.337 -20.105 -15.211 644 H ILE 108 H ILE 108 9.352 -23.846 -17.354 645 HA ILE 108 HA ILE 108 9.720 -22.116 -19.605 646 HB ILE 108 HB ILE 108 10.046 -25.144 -19.408 647 HG12 ILE 108 HG12 ILE 108 12.161 -22.939 -19.160 648 HG13 ILE 108 HG13 ILE 108 11.540 -23.912 -17.831 649 HG21 ILE 108 HG21 ILE 108 11.445 -24.989 -21.448 650 HG22 ILE 108 HG22 ILE 108 11.069 -23.270 -21.575 651 HG23 ILE 108 HG23 ILE 108 9.787 -24.468 -21.756 652 HD11 ILE 108 HD11 ILE 108 12.526 -25.922 -18.850 653 HD12 ILE 108 HD12 ILE 108 13.729 -24.678 -18.523 654 HD13 ILE 108 HD13 ILE 108 13.163 -24.934 -20.171 655 HA PRO 109 HA PRO 109 5.537 -22.883 -21.243 656 HB2 PRO 109 HB2 PRO 109 5.679 -21.354 -23.486 657 HB3 PRO 109 HB3 PRO 109 5.605 -20.634 -21.868 658 HG2 PRO 109 HG2 PRO 109 8.020 -21.116 -23.624 659 HG3 PRO 109 HG3 PRO 109 7.578 -19.652 -22.717 660 HD2 PRO 109 HD2 PRO 109 9.391 -21.479 -21.783 661 HD3 PRO 109 HD3 PRO 109 8.366 -20.522 -20.694 662 H ASP 110 H ASP 110 4.539 -23.779 -23.241 663 HA ASP 110 HA ASP 110 6.041 -25.944 -24.414 664 HB2 ASP 110 HB2 ASP 110 3.219 -24.932 -24.967 665 HB3 ASP 110 HB3 ASP 110 3.898 -26.401 -25.660 666 H LEU 111 H LEU 111 7.682 -24.541 -25.302 667 HA LEU 111 HA LEU 111 7.182 -22.494 -27.202 668 HB2 LEU 111 HB2 LEU 111 9.547 -22.247 -27.398 669 HB3 LEU 111 HB3 LEU 111 9.201 -22.584 -25.714 670 HG LEU 111 HG LEU 111 10.309 -24.642 -27.686 671 HD11 LEU 111 HD11 LEU 111 11.804 -23.048 -25.578 672 HD12 LEU 111 HD12 LEU 111 11.929 -22.841 -27.328 673 HD13 LEU 111 HD13 LEU 111 12.474 -24.341 -26.581 674 HD21 LEU 111 HD21 LEU 111 10.836 -25.990 -25.689 675 HD22 LEU 111 HD22 LEU 111 9.103 -25.716 -25.838 676 HD23 LEU 111 HD23 LEU 111 10.042 -24.794 -24.659 677 H GLY 112 H GLY 112 7.845 -25.926 -27.532 678 HA2 GLY 112 HA2 GLY 112 7.253 -25.835 -30.398 679 HA3 GLY 112 HA3 GLY 112 8.865 -26.404 -29.960
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