NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
554389 | 2lls | 18087 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 -11.898 5.915 9.644 2 HA2 GLY 1 HA3 GLY 1 -10.011 7.066 10.799 3 HA3 GLY 1 HA2 GLY 1 -11.004 7.010 12.252 4 H SER 2 H SER 2 -10.801 4.464 9.818 5 HA SER 2 HA SER 2 -10.297 2.437 11.738 6 HB2 SER 2 HB3 SER 2 -9.714 2.221 8.798 7 HB3 SER 2 HB2 SER 2 -10.246 0.972 9.880 8 HG SER 2 HG SER 2 -11.688 2.300 8.348 9 H GLU 3 H GLU 3 -8.331 1.080 11.826 10 HA GLU 3 HA GLU 3 -5.977 2.541 12.202 11 HB2 GLU 3 HB3 GLU 3 -6.216 -0.389 11.496 12 HB3 GLU 3 HB2 GLU 3 -4.843 0.393 12.282 13 HG2 GLU 3 HG3 GLU 3 -5.886 -0.340 14.158 14 HG3 GLU 3 HG2 GLU 3 -6.779 1.155 13.994 15 H LEU 4 H LEU 4 -7.106 0.610 9.481 16 HA LEU 4 HA LEU 4 -4.849 0.900 7.776 17 HB2 LEU 4 HB3 LEU 4 -7.762 0.408 7.369 18 HB3 LEU 4 HB2 LEU 4 -6.727 0.664 5.980 19 HG LEU 4 HG LEU 4 -7.173 -1.796 7.003 20 HD11 LEU 4 HD11 LEU 4 -4.760 -2.293 6.100 21 HD12 LEU 4 HD12 LEU 4 -4.903 -0.617 5.526 22 HD13 LEU 4 HD13 LEU 4 -6.087 -1.817 5.051 23 HD21 LEU 4 HD21 LEU 4 -4.610 -0.914 8.437 24 HD22 LEU 4 HD22 LEU 4 -5.315 -2.525 8.331 25 HD23 LEU 4 HD23 LEU 4 -6.175 -1.278 9.202 26 H GLU 5 H GLU 5 -7.809 2.753 8.179 27 HA GLU 5 HA GLU 5 -7.303 4.617 6.158 28 HB2 GLU 5 HB3 GLU 5 -8.920 4.854 8.727 29 HB3 GLU 5 HB2 GLU 5 -8.915 6.037 7.420 30 HG2 GLU 5 HG3 GLU 5 -9.790 4.468 5.851 31 HG3 GLU 5 HG2 GLU 5 -9.610 3.122 6.963 32 H THR 6 H THR 6 -6.601 4.607 9.608 33 HA THR 6 HA THR 6 -5.232 7.105 9.631 34 HB THR 6 HB THR 6 -4.731 4.800 11.524 35 HG1 THR 6 HG2 THR 6 -6.933 5.083 11.438 36 HG21 THR 6 HG21 THR 6 -3.383 6.352 12.419 37 HG22 THR 6 HG22 THR 6 -4.823 7.252 12.873 38 HG23 THR 6 HG23 THR 6 -3.988 7.620 11.364 39 H ALA 7 H ALA 7 -4.065 3.746 9.412 40 HA ALA 7 HA ALA 7 -1.332 4.323 9.237 41 HB1 ALA 7 HB1 ALA 7 -2.965 2.015 8.172 42 HB2 ALA 7 HB2 ALA 7 -1.954 2.053 9.624 43 HB3 ALA 7 HB3 ALA 7 -1.212 2.074 8.038 44 H MET 8 H MET 8 -3.739 3.864 6.661 45 HA MET 8 HA MET 8 -1.912 4.293 4.552 46 HB2 MET 8 HB3 MET 8 -4.924 4.625 4.585 47 HB3 MET 8 HB2 MET 8 -3.929 4.629 3.127 48 HG2 MET 8 HG3 MET 8 -4.216 2.304 5.092 49 HG3 MET 8 HG2 MET 8 -4.862 2.385 3.461 50 HE1 MET 8 HE1 MET 8 -2.000 2.092 1.146 51 HE2 MET 8 HE2 MET 8 -2.361 3.715 1.747 52 HE3 MET 8 HE3 MET 8 -3.675 2.567 1.486 53 H GLU 9 H GLU 9 -4.037 6.515 6.332 54 HA GLU 9 HA GLU 9 -3.372 8.752 4.755 55 HB2 GLU 9 HB3 GLU 9 -4.411 8.530 7.567 56 HB3 GLU 9 HB2 GLU 9 -4.109 10.100 6.794 57 HG2 GLU 9 HG3 GLU 9 -5.667 9.542 5.006 58 HG3 GLU 9 HG2 GLU 9 -5.954 7.940 5.677 59 H THR 10 H THR 10 -1.908 7.259 7.557 60 HA THR 10 HA THR 10 -0.010 9.263 8.135 61 HB THR 10 HB THR 10 0.409 6.274 8.475 62 HG1 THR 10 HG2 THR 10 -1.613 6.902 9.364 63 HG21 THR 10 HG21 THR 10 1.946 6.849 10.138 64 HG22 THR 10 HG22 THR 10 1.296 8.462 10.341 65 HG23 THR 10 HG23 THR 10 2.266 8.076 8.915 66 H LEU 11 H LEU 11 0.007 6.545 5.867 67 HA LEU 11 HA LEU 11 2.627 6.975 4.797 68 HB2 LEU 11 HB3 LEU 11 0.119 5.759 3.594 69 HB3 LEU 11 HB2 LEU 11 1.687 5.755 2.800 70 HG LEU 11 HG LEU 11 1.217 4.558 5.551 71 HD11 LEU 11 HD11 LEU 11 -0.128 3.339 3.901 72 HD12 LEU 11 HD12 LEU 11 1.269 2.383 4.391 73 HD13 LEU 11 HD13 LEU 11 1.276 3.199 2.840 74 HD21 LEU 11 HD21 LEU 11 3.627 5.196 4.855 75 HD22 LEU 11 HD22 LEU 11 3.433 4.064 3.529 76 HD23 LEU 11 HD23 LEU 11 3.350 3.490 5.186 77 H ILE 12 H ILE 12 -0.577 8.244 4.058 78 HA ILE 12 HA ILE 12 0.142 9.766 1.771 79 HB ILE 12 HB ILE 12 -2.044 10.172 3.835 80 HG12 ILE 12 HG13 ILE 12 -2.160 8.101 2.327 81 HG13 ILE 12 HG12 ILE 12 -3.530 9.206 2.228 82 HG21 ILE 12 HG21 ILE 12 -3.101 11.679 2.266 83 HG22 ILE 12 HG22 ILE 12 -1.659 11.667 1.234 84 HG23 ILE 12 HG23 ILE 12 -1.585 12.309 2.868 85 HD11 ILE 12 HD11 ILE 12 -2.506 8.337 0.010 86 HD12 ILE 12 HD12 ILE 12 -1.222 9.510 0.279 87 HD13 ILE 12 HD13 ILE 12 -2.899 10.034 0.153 88 H ASN 13 H ASN 13 0.052 10.546 5.207 89 HA ASN 13 HA ASN 13 0.685 13.278 4.997 90 HB2 ASN 13 HB3 ASN 13 1.129 11.250 7.182 91 HB3 ASN 13 HB2 ASN 13 1.731 12.897 7.323 92 HD21 ASN 13 HD21 ASN 13 -1.303 11.048 6.785 93 HD22 ASN 13 HD22 ASN 13 -2.295 12.277 7.409 94 H VAL 14 H VAL 14 2.789 10.444 5.382 95 HA VAL 14 HA VAL 14 5.245 11.872 5.249 96 HB VAL 14 HB VAL 14 4.510 8.975 4.807 97 HG11 VAL 14 HG11 VAL 14 6.884 8.491 4.815 98 HG12 VAL 14 HG12 VAL 14 7.293 10.198 4.952 99 HG13 VAL 14 HG13 VAL 14 6.548 9.580 3.478 100 HG21 VAL 14 HG21 VAL 14 4.652 10.478 7.114 101 HG22 VAL 14 HG22 VAL 14 6.297 9.871 6.988 102 HG23 VAL 14 HG23 VAL 14 4.963 8.749 7.063 103 H PHE 15 H PHE 15 3.277 10.180 2.857 104 HA PHE 15 HA PHE 15 4.961 10.613 0.643 105 HB2 PHE 15 HB3 PHE 15 3.008 9.100 0.609 106 HB3 PHE 15 HB2 PHE 15 1.939 10.498 0.704 107 HD1 PHE 15 HD1 PHE 15 4.546 8.858 -1.377 108 HD2 PHE 15 HD2 PHE 15 1.436 11.835 -1.228 109 HE1 PHE 15 HE1 PHE 15 4.712 9.139 -3.779 110 HE2 PHE 15 HE2 PHE 15 1.589 12.123 -3.650 111 HZ PHE 15 HZ PHE 15 3.205 10.810 -4.964 112 H HIS 16 H HIS 16 2.276 12.520 1.940 113 HA HIS 16 HA HIS 16 2.392 14.675 0.123 114 HB2 HIS 16 HB3 HIS 16 1.298 14.313 2.886 115 HB3 HIS 16 HB2 HIS 16 1.590 15.949 2.335 116 HD1 HIS 16 HD1 HIS 16 0.866 15.184 -0.770 117 HD2 HIS 16 HD2 HIS 16 -1.534 14.655 2.614 118 HE1 HIS 16 HE1 HIS 16 -1.521 15.168 -1.573 119 HE2 HIS 16 HE2 HIS 16 -3.001 14.859 0.478 120 H ALA 17 H ALA 17 4.043 14.070 3.178 121 HA ALA 17 HA ALA 17 5.354 16.521 3.460 122 HB1 ALA 17 HB1 ALA 17 6.832 15.421 4.954 123 HB2 ALA 17 HB2 ALA 17 6.591 13.863 4.195 124 HB3 ALA 17 HB3 ALA 17 5.280 14.613 5.131 125 H HIS 18 H HIS 18 6.422 13.545 1.869 126 HA HIS 18 HA HIS 18 8.812 14.723 0.835 127 HB2 HIS 18 HB3 HIS 18 7.425 12.117 0.154 128 HB3 HIS 18 HB2 HIS 18 8.897 12.762 -0.612 129 HD1 HIS 18 HD1 HIS 18 11.082 12.980 0.796 130 HD2 HIS 18 HD2 HIS 18 7.882 11.193 2.842 131 HE1 HIS 18 HE1 HIS 18 12.029 11.985 2.897 132 HE2 HIS 18 HE2 HIS 18 10.109 10.868 4.167 133 H SER 19 H SER 19 5.581 14.194 -0.605 134 HA SER 19 HA SER 19 6.272 14.989 -3.200 135 HB2 SER 19 HB3 SER 19 3.695 15.234 -1.673 136 HB3 SER 19 HB2 SER 19 3.779 15.809 -3.325 137 HG SER 19 HG SER 19 4.636 13.639 -3.790 138 H GLY 20 H GLY 20 5.457 16.859 -0.358 139 HA2 GLY 20 HA3 GLY 20 5.452 19.427 -1.556 140 HA3 GLY 20 HA2 GLY 20 5.830 19.097 0.134 141 H LYS 21 H LYS 21 8.016 17.406 -0.178 142 HA LYS 21 HA LYS 21 10.117 19.291 -0.610 143 HB2 LYS 21 HB3 LYS 21 10.269 16.279 -0.251 144 HB3 LYS 21 HB2 LYS 21 11.622 17.390 -0.217 145 HG2 LYS 21 HG3 LYS 21 9.260 17.589 1.685 146 HG3 LYS 21 HG2 LYS 21 10.815 16.842 2.073 147 HD2 LYS 21 HD3 LYS 21 11.966 18.983 1.659 148 HD3 LYS 21 HD2 LYS 21 10.424 19.717 1.206 149 HE2 LYS 21 HE2 LYS 21 9.542 19.374 3.440 150 HE3 LYS 21 HE1 LYS 21 11.027 18.572 3.959 151 HZ1 LYS 21 HZ1 LYS 21 10.437 21.302 3.925 152 HZ2 LYS 21 HZ2 LYS 21 11.630 21.054 2.780 153 HZ3 LYS 21 HZ3 LYS 21 11.899 20.598 4.380 154 H GLU 22 H GLU 22 8.935 16.530 -2.509 155 HA GLU 22 HA GLU 22 10.940 16.893 -4.474 156 HB2 GLU 22 HB3 GLU 22 9.941 15.213 -5.744 157 HB3 GLU 22 HB2 GLU 22 9.558 14.757 -4.088 158 HG2 GLU 22 HG3 GLU 22 7.400 14.637 -4.791 159 HG3 GLU 22 HG2 GLU 22 7.397 16.377 -4.816 160 H GLY 23 H GLY 23 7.741 18.248 -4.081 161 HA2 GLY 23 HA3 GLY 23 7.607 20.549 -4.773 162 HA3 GLY 23 HA2 GLY 23 8.410 20.134 -6.279 163 H ASP 24 H ASP 24 6.609 17.615 -6.345 164 HA ASP 24 HA ASP 24 4.592 18.831 -7.954 165 HB2 ASP 24 HB3 ASP 24 5.506 16.474 -8.259 166 HB3 ASP 24 HB2 ASP 24 4.496 16.011 -6.908 167 H LYS 25 H LYS 25 2.371 18.856 -7.654 168 HA LYS 25 HA LYS 25 1.519 19.637 -5.072 169 HB2 LYS 25 HB3 LYS 25 -0.718 19.394 -5.961 170 HB3 LYS 25 HB2 LYS 25 0.298 20.464 -6.969 171 HG2 LYS 25 HG3 LYS 25 0.707 18.493 -8.493 172 HG3 LYS 25 HG2 LYS 25 -0.424 17.533 -7.540 173 HD2 LYS 25 HD3 LYS 25 -2.196 19.224 -8.036 174 HD3 LYS 25 HD2 LYS 25 -1.040 20.064 -9.072 175 HE2 LYS 25 HE2 LYS 25 -1.024 18.363 -10.680 176 HE3 LYS 25 HE1 LYS 25 -1.538 17.134 -9.537 177 HZ1 LYS 25 HZ1 LYS 25 -3.245 17.905 -11.157 178 HZ2 LYS 25 HZ2 LYS 25 -3.362 19.369 -10.269 179 HZ3 LYS 25 HZ3 LYS 25 -3.662 17.859 -9.542 180 H TYR 26 H TYR 26 1.533 16.619 -6.827 181 HA TYR 26 HA TYR 26 1.671 15.189 -4.471 182 HB2 TYR 26 HB3 TYR 26 -0.479 13.766 -4.986 183 HB3 TYR 26 HB2 TYR 26 -0.569 15.168 -3.954 184 HD1 TYR 26 HD2 TYR 26 -1.275 13.895 -7.349 185 HD2 TYR 26 HD1 TYR 26 -1.746 17.215 -4.668 186 HE1 TYR 26 HE2 TYR 26 -2.921 14.893 -8.884 187 HE2 TYR 26 HE1 TYR 26 -3.401 18.215 -6.186 188 HH TYR 26 HH TYR 26 -4.951 16.573 -8.545 189 H LYS 27 H LYS 27 3.385 14.450 -5.450 190 HA LYS 27 HA LYS 27 3.187 11.964 -6.732 191 HB2 LYS 27 HB3 LYS 27 4.442 14.243 -8.321 192 HB3 LYS 27 HB2 LYS 27 4.877 12.587 -8.608 193 HG2 LYS 27 HG3 LYS 27 2.090 13.784 -8.928 194 HG3 LYS 27 HG2 LYS 27 3.165 13.352 -10.223 195 HD2 LYS 27 HD3 LYS 27 1.866 11.410 -8.269 196 HD3 LYS 27 HD2 LYS 27 1.493 11.643 -9.953 197 HE2 LYS 27 HE2 LYS 27 3.774 10.959 -10.634 198 HE3 LYS 27 HE1 LYS 27 4.174 10.574 -8.963 199 HZ1 LYS 27 HZ1 LYS 27 2.585 9.088 -10.879 200 HZ2 LYS 27 HZ2 LYS 27 1.864 9.095 -9.362 201 HZ3 LYS 27 HZ3 LYS 27 3.358 8.447 -9.564 202 H LEU 28 H LEU 28 5.521 11.046 -6.817 203 HA LEU 28 HA LEU 28 7.253 12.572 -4.992 204 HB2 LEU 28 HB3 LEU 28 6.208 10.670 -3.823 205 HB3 LEU 28 HB2 LEU 28 6.854 9.540 -4.988 206 HG LEU 28 HG LEU 28 9.166 10.497 -4.412 207 HD11 LEU 28 HD11 LEU 28 9.143 11.361 -2.043 208 HD12 LEU 28 HD12 LEU 28 7.438 11.728 -2.292 209 HD13 LEU 28 HD13 LEU 28 8.672 12.527 -3.289 210 HD21 LEU 28 HD21 LEU 28 7.536 9.090 -2.289 211 HD22 LEU 28 HD22 LEU 28 9.312 9.130 -2.394 212 HD23 LEU 28 HD23 LEU 28 8.370 8.310 -3.640 213 H SER 29 H SER 29 9.167 13.001 -5.915 214 HA SER 29 HA SER 29 9.831 11.687 -8.435 215 HB2 SER 29 HB3 SER 29 11.744 13.587 -7.047 216 HB3 SER 29 HB2 SER 29 11.455 13.236 -8.725 217 HG SER 29 HG SER 29 9.149 14.178 -7.546 218 H LYS 30 H LYS 30 11.879 10.594 -8.739 219 HA LYS 30 HA LYS 30 12.341 8.656 -6.696 220 HB2 LYS 30 HB3 LYS 30 14.116 9.309 -9.073 221 HB3 LYS 30 HB2 LYS 30 14.158 7.843 -8.117 222 HG2 LYS 30 HG3 LYS 30 11.912 8.825 -9.849 223 HG3 LYS 30 HG2 LYS 30 12.904 7.396 -10.136 224 HD2 LYS 30 HD3 LYS 30 11.893 6.805 -7.576 225 HD3 LYS 30 HD2 LYS 30 10.662 7.835 -8.331 226 HE2 LYS 30 HE2 LYS 30 10.314 5.413 -8.598 227 HE3 LYS 30 HE1 LYS 30 10.280 6.366 -10.093 228 HZ1 LYS 30 HZ1 LYS 30 12.690 4.924 -9.076 229 HZ2 LYS 30 HZ2 LYS 30 12.529 5.607 -10.585 230 HZ3 LYS 30 HZ3 LYS 30 11.615 4.233 -10.161 231 H LYS 31 H LYS 31 13.202 11.802 -6.935 232 HA LYS 31 HA LYS 31 15.848 12.031 -5.993 233 HB2 LYS 31 HB3 LYS 31 13.421 13.743 -5.369 234 HB3 LYS 31 HB2 LYS 31 15.098 14.217 -5.243 235 HG2 LYS 31 HG3 LYS 31 15.409 13.880 -7.668 236 HG3 LYS 31 HG2 LYS 31 13.760 13.363 -7.821 237 HD2 LYS 31 HD3 LYS 31 13.007 15.594 -6.870 238 HD3 LYS 31 HD2 LYS 31 14.681 16.127 -7.005 239 HE2 LYS 31 HE2 LYS 31 13.203 14.902 -9.270 240 HE3 LYS 31 HE1 LYS 31 13.156 16.651 -9.029 241 HZ1 LYS 31 HZ1 LYS 31 15.775 15.235 -9.117 242 HZ2 LYS 31 HZ2 LYS 31 15.425 16.843 -9.558 243 HZ3 LYS 31 HZ3 LYS 31 14.972 15.569 -10.540 244 H GLU 32 H GLU 32 12.711 11.941 -4.453 245 HA GLU 32 HA GLU 32 13.705 11.986 -1.738 246 HB2 GLU 32 HB3 GLU 32 10.982 11.918 -3.004 247 HB3 GLU 32 HB2 GLU 32 11.252 11.980 -1.266 248 HG2 GLU 32 HG3 GLU 32 12.509 14.028 -3.129 249 HG3 GLU 32 HG2 GLU 32 10.883 14.217 -2.520 250 H LEU 33 H LEU 33 12.078 9.801 -3.917 251 HA LEU 33 HA LEU 33 11.044 8.019 -2.124 252 HB2 LEU 33 HB3 LEU 33 10.522 8.024 -4.551 253 HB3 LEU 33 HB2 LEU 33 12.109 7.345 -4.851 254 HG LEU 33 HG LEU 33 10.115 5.708 -4.788 255 HD11 LEU 33 HD11 LEU 33 12.014 4.546 -2.905 256 HD12 LEU 33 HD12 LEU 33 12.811 5.373 -4.242 257 HD13 LEU 33 HD13 LEU 33 11.634 4.116 -4.562 258 HD21 LEU 33 HD21 LEU 33 9.275 6.733 -2.548 259 HD22 LEU 33 HD22 LEU 33 10.562 5.804 -1.783 260 HD23 LEU 33 HD23 LEU 33 9.303 4.984 -2.691 261 H LYS 34 H LYS 34 14.278 7.774 -3.574 262 HA LYS 34 HA LYS 34 14.840 5.331 -2.215 263 HB2 LYS 34 HB3 LYS 34 17.354 6.561 -2.515 264 HB3 LYS 34 HB2 LYS 34 16.624 5.369 -3.562 265 HG2 LYS 34 HG3 LYS 34 15.607 7.112 -4.945 266 HG3 LYS 34 HG2 LYS 34 16.255 8.370 -3.868 267 HD2 LYS 34 HD3 LYS 34 18.547 7.546 -4.364 268 HD3 LYS 34 HD2 LYS 34 17.864 6.404 -5.525 269 HE2 LYS 34 HE2 LYS 34 17.621 9.421 -5.634 270 HE3 LYS 34 HE1 LYS 34 18.653 8.419 -6.665 271 HZ1 LYS 34 HZ1 LYS 34 15.738 8.717 -6.628 272 HZ2 LYS 34 HZ2 LYS 34 16.383 7.252 -7.217 273 HZ3 LYS 34 HZ3 LYS 34 16.772 8.717 -7.948 274 H GLU 35 H GLU 35 15.471 8.702 -1.449 275 HA GLU 35 HA GLU 35 16.831 8.266 1.010 276 HB2 GLU 35 HB3 GLU 35 15.139 10.598 0.052 277 HB3 GLU 35 HB2 GLU 35 16.142 10.621 1.483 278 HG2 GLU 35 HG3 GLU 35 18.164 10.223 0.162 279 HG3 GLU 35 HG2 GLU 35 17.209 10.074 -1.306 280 H LEU 36 H LEU 36 13.478 8.914 0.150 281 HA LEU 36 HA LEU 36 12.337 8.903 2.717 282 HB2 LEU 36 HB3 LEU 36 10.968 9.838 1.105 283 HB3 LEU 36 HB2 LEU 36 11.386 8.634 -0.099 284 HG LEU 36 HG LEU 36 10.036 6.977 1.022 285 HD11 LEU 36 HD11 LEU 36 9.551 7.298 3.225 286 HD12 LEU 36 HD12 LEU 36 8.377 8.512 2.716 287 HD13 LEU 36 HD13 LEU 36 10.024 8.992 3.131 288 HD21 LEU 36 HD21 LEU 36 7.769 8.343 0.775 289 HD22 LEU 36 HD22 LEU 36 8.798 7.946 -0.591 290 HD23 LEU 36 HD23 LEU 36 8.871 9.569 0.129 291 H LEU 37 H LEU 37 12.500 6.303 0.293 292 HA LEU 37 HA LEU 37 11.130 4.539 1.954 293 HB2 LEU 37 HB3 LEU 37 11.204 4.125 -0.435 294 HB3 LEU 37 HB2 LEU 37 12.951 3.946 -0.409 295 HG LEU 37 HG LEU 37 11.534 1.820 -0.537 296 HD11 LEU 37 HD11 LEU 37 13.218 1.348 1.816 297 HD12 LEU 37 HD12 LEU 37 14.021 2.308 0.565 298 HD13 LEU 37 HD13 LEU 37 13.360 0.740 0.169 299 HD21 LEU 37 HD21 LEU 37 11.332 1.823 2.433 300 HD22 LEU 37 HD22 LEU 37 10.290 1.091 1.241 301 HD23 LEU 37 HD23 LEU 37 10.137 2.809 1.592 302 H GLN 38 H GLN 38 14.618 4.895 1.476 303 HA GLN 38 HA GLN 38 15.293 2.789 3.265 304 HB2 GLN 38 HB3 GLN 38 17.555 3.595 3.157 305 HB3 GLN 38 HB2 GLN 38 16.860 3.787 1.543 306 HG2 GLN 38 HG3 GLN 38 16.299 6.174 2.228 307 HG3 GLN 38 HG2 GLN 38 17.329 5.943 3.631 308 HE21 GLN 38 HE21 GLN 38 17.377 5.709 0.073 309 HE22 GLN 38 HE22 GLN 38 19.016 6.066 -0.114 310 H THR 39 H THR 39 14.769 6.225 3.657 311 HA THR 39 HA THR 39 15.677 6.417 6.339 312 HB THR 39 HB THR 39 13.861 8.112 4.657 313 HG1 THR 39 HG2 THR 39 15.709 8.212 3.801 314 HG21 THR 39 HG21 THR 39 13.304 8.974 6.603 315 HG22 THR 39 HG22 THR 39 14.829 9.845 6.454 316 HG23 THR 39 HG23 THR 39 14.723 8.395 7.479 317 H GLU 40 H GLU 40 12.327 6.594 5.032 318 HA GLU 40 HA GLU 40 11.145 6.514 7.529 319 HB2 GLU 40 HB3 GLU 40 10.168 6.191 4.724 320 HB3 GLU 40 HB2 GLU 40 9.116 5.748 6.064 321 HG2 GLU 40 HG3 GLU 40 8.637 8.055 5.621 322 HG3 GLU 40 HG2 GLU 40 9.566 7.992 7.098 323 H LEU 41 H LEU 41 11.982 3.875 5.378 324 HA LEU 41 HA LEU 41 10.828 1.975 7.309 325 HB2 LEU 41 HB3 LEU 41 11.681 1.710 4.452 326 HB3 LEU 41 HB2 LEU 41 11.596 0.297 5.457 327 HG LEU 41 HG LEU 41 9.213 0.933 6.097 328 HD11 LEU 41 HD11 LEU 41 8.995 3.205 5.621 329 HD12 LEU 41 HD12 LEU 41 8.135 2.444 4.291 330 HD13 LEU 41 HD13 LEU 41 9.759 3.064 4.039 331 HD21 LEU 41 HD21 LEU 41 9.317 0.626 3.118 332 HD22 LEU 41 HD22 LEU 41 8.344 -0.239 4.299 333 HD23 LEU 41 HD23 LEU 41 10.045 -0.634 4.112 334 H SER 42 H SER 42 13.083 3.388 8.124 335 HA SER 42 HA SER 42 15.505 2.177 7.505 336 HB2 SER 42 HB3 SER 42 14.694 3.606 10.044 337 HB3 SER 42 HB2 SER 42 16.319 3.048 9.731 338 HG SER 42 HG SER 42 14.770 4.883 8.154 339 H GLY 43 H GLY 43 13.232 1.343 10.108 340 HA2 GLY 43 HA3 GLY 43 14.857 -0.702 11.211 341 HA3 GLY 43 HA2 GLY 43 13.127 -0.517 11.472 342 H PHE 44 H PHE 44 12.276 -0.693 8.811 343 HA PHE 44 HA PHE 44 12.177 -3.525 8.459 344 HB2 PHE 44 HB3 PHE 44 11.145 -1.174 6.938 345 HB3 PHE 44 HB2 PHE 44 11.310 -2.675 6.049 346 HD1 PHE 44 HD2 PHE 44 10.595 -4.768 7.932 347 HD2 PHE 44 HD1 PHE 44 8.888 -0.855 7.486 348 HE1 PHE 44 HE2 PHE 44 8.477 -5.591 8.875 349 HE2 PHE 44 HE1 PHE 44 6.745 -1.709 8.445 350 HZ PHE 44 HZ PHE 44 6.558 -4.073 9.126 351 H LEU 45 H LEU 45 13.797 -0.889 6.830 352 HA LEU 45 HA LEU 45 15.163 -2.422 4.928 353 HB2 LEU 45 HB3 LEU 45 14.960 -0.095 4.603 354 HB3 LEU 45 HB2 LEU 45 15.688 0.289 6.152 355 HG LEU 45 HG LEU 45 17.742 -0.691 5.472 356 HD11 LEU 45 HD11 LEU 45 17.033 -2.373 3.831 357 HD12 LEU 45 HD12 LEU 45 18.076 -1.238 2.972 358 HD13 LEU 45 HD13 LEU 45 16.331 -1.128 2.789 359 HD21 LEU 45 HD21 LEU 45 16.939 1.229 3.275 360 HD22 LEU 45 HD22 LEU 45 18.512 1.086 4.068 361 HD23 LEU 45 HD23 LEU 45 17.134 1.729 4.957 362 H ASP 46 H ASP 46 16.098 -1.275 8.174 363 HA ASP 46 HA ASP 46 18.709 -2.389 8.124 364 HB2 ASP 46 HB3 ASP 46 17.793 -0.663 9.786 365 HB3 ASP 46 HB2 ASP 46 17.059 -2.050 10.595 366 H ALA 47 H ALA 47 15.614 -3.685 9.018 367 HA ALA 47 HA ALA 47 16.557 -6.131 10.086 368 HB1 ALA 47 HB1 ALA 47 13.947 -5.120 9.096 369 HB2 ALA 47 HB2 ALA 47 14.360 -5.917 10.620 370 HB3 ALA 47 HB3 ALA 47 14.160 -6.869 9.164 371 H GLN 48 H GLN 48 16.249 -4.983 6.776 372 HA GLN 48 HA GLN 48 17.271 -7.566 5.847 373 HB2 GLN 48 HB3 GLN 48 15.547 -7.726 4.095 374 HB3 GLN 48 HB2 GLN 48 14.863 -7.854 5.697 375 HG2 GLN 48 HG3 GLN 48 13.551 -6.062 5.346 376 HG3 GLN 48 HG2 GLN 48 14.942 -5.061 4.927 377 HE21 GLN 48 HE21 GLN 48 15.867 -6.087 2.621 378 HE22 GLN 48 HE22 GLN 48 14.673 -6.104 1.411 379 H LYS 49 H LYS 49 18.771 -5.312 5.917 380 HA LYS 49 HA LYS 49 18.837 -3.781 3.511 381 HB2 LYS 49 HB3 LYS 49 21.037 -4.528 5.447 382 HB3 LYS 49 HB2 LYS 49 21.276 -3.469 4.073 383 HG2 LYS 49 HG3 LYS 49 19.567 -1.908 4.914 384 HG3 LYS 49 HG2 LYS 49 19.249 -3.006 6.259 385 HD2 LYS 49 HD3 LYS 49 21.471 -2.731 7.119 386 HD3 LYS 49 HD2 LYS 49 21.943 -1.734 5.742 387 HE2 LYS 49 HE2 LYS 49 20.689 0.081 6.436 388 HE3 LYS 49 HE1 LYS 49 19.568 -0.879 7.385 389 HZ1 LYS 49 HZ1 LYS 49 20.970 -0.990 9.121 390 HZ2 LYS 49 HZ2 LYS 49 21.409 0.521 8.552 391 HZ3 LYS 49 HZ3 LYS 49 22.404 -0.823 8.252 392 H ASP 50 H ASP 50 20.439 -6.754 4.482 393 HA ASP 50 HA ASP 50 21.827 -6.978 1.985 394 HB2 ASP 50 HB3 ASP 50 22.770 -7.751 4.171 395 HB3 ASP 50 HB2 ASP 50 21.644 -9.097 4.113 396 H VAL 51 H VAL 51 18.734 -7.757 2.888 397 HA VAL 51 HA VAL 51 18.429 -10.247 1.562 398 HB VAL 51 HB VAL 51 16.396 -8.145 2.339 399 HG11 VAL 51 HG11 VAL 51 15.167 -9.293 0.747 400 HG12 VAL 51 HG12 VAL 51 14.882 -10.303 2.146 401 HG13 VAL 51 HG13 VAL 51 16.080 -10.789 0.957 402 HG21 VAL 51 HG21 VAL 51 17.232 -10.803 3.544 403 HG22 VAL 51 HG22 VAL 51 15.894 -9.839 4.142 404 HG23 VAL 51 HG23 VAL 51 17.541 -9.219 4.245 405 H ASP 52 H ASP 52 17.974 -10.729 -0.485 406 HA ASP 52 HA ASP 52 18.777 -9.019 -2.532 407 HB2 ASP 52 HB3 ASP 52 18.770 -11.448 -2.751 408 HB3 ASP 52 HB2 ASP 52 17.009 -11.453 -2.705 409 H ALA 53 H ALA 53 15.598 -9.733 -1.307 410 HA ALA 53 HA ALA 53 14.023 -8.692 -3.296 411 HB1 ALA 53 HB1 ALA 53 12.254 -8.533 -1.761 412 HB2 ALA 53 HB2 ALA 53 13.314 -8.212 -0.398 413 HB3 ALA 53 HB3 ALA 53 13.264 -9.822 -1.120 414 H VAL 54 H VAL 54 15.614 -6.866 -0.672 415 HA VAL 54 HA VAL 54 14.360 -4.434 -1.315 416 HB VAL 54 HB VAL 54 15.494 -4.634 0.844 417 HG11 VAL 54 HG11 VAL 54 18.196 -4.229 0.340 418 HG12 VAL 54 HG12 VAL 54 17.769 -5.503 -0.784 419 HG13 VAL 54 HG13 VAL 54 17.467 -5.703 0.932 420 HG21 VAL 54 HG21 VAL 54 16.140 -2.454 0.953 421 HG22 VAL 54 HG22 VAL 54 15.470 -2.385 -0.678 422 HG23 VAL 54 HG23 VAL 54 17.205 -2.583 -0.438 423 H ASP 55 H ASP 55 17.254 -5.940 -2.656 424 HA ASP 55 HA ASP 55 18.199 -3.718 -4.142 425 HB2 ASP 55 HB3 ASP 55 19.476 -5.832 -3.864 426 HB3 ASP 55 HB2 ASP 55 18.252 -6.650 -4.841 427 H LYS 56 H LYS 56 16.188 -6.432 -5.050 428 HA LYS 56 HA LYS 56 15.525 -5.477 -7.630 429 HB2 LYS 56 HB3 LYS 56 14.233 -7.546 -5.858 430 HB3 LYS 56 HB2 LYS 56 13.716 -7.203 -7.505 431 HG2 LYS 56 HG3 LYS 56 15.951 -7.700 -8.373 432 HG3 LYS 56 HG2 LYS 56 16.547 -7.997 -6.743 433 HD2 LYS 56 HD3 LYS 56 15.099 -9.825 -6.436 434 HD3 LYS 56 HD2 LYS 56 14.260 -9.571 -7.983 435 HE2 LYS 56 HE2 LYS 56 15.912 -11.391 -8.195 436 HE3 LYS 56 HE1 LYS 56 16.437 -10.015 -9.163 437 HZ1 LYS 56 HZ1 LYS 56 17.378 -10.691 -6.414 438 HZ2 LYS 56 HZ2 LYS 56 17.905 -9.362 -7.324 439 HZ3 LYS 56 HZ3 LYS 56 18.262 -10.906 -7.835 440 H VAL 57 H VAL 57 13.914 -5.274 -4.517 441 HA VAL 57 HA VAL 57 11.516 -4.103 -5.473 442 HB VAL 57 HB VAL 57 12.858 -4.069 -2.755 443 HG11 VAL 57 HG11 VAL 57 10.385 -3.446 -2.111 444 HG12 VAL 57 HG12 VAL 57 10.361 -2.762 -3.739 445 HG13 VAL 57 HG13 VAL 57 11.562 -2.212 -2.557 446 HG21 VAL 57 HG21 VAL 57 10.274 -5.440 -3.484 447 HG22 VAL 57 HG22 VAL 57 11.397 -5.820 -2.182 448 HG23 VAL 57 HG23 VAL 57 11.810 -6.227 -3.846 449 H MET 58 H MET 58 14.539 -2.870 -4.187 450 HA MET 58 HA MET 58 13.922 -0.136 -4.325 451 HB2 MET 58 HB3 MET 58 15.818 -0.956 -3.079 452 HB3 MET 58 HB2 MET 58 16.555 -1.612 -4.539 453 HG2 MET 58 HG3 MET 58 16.633 0.522 -5.499 454 HG3 MET 58 HG2 MET 58 16.017 1.345 -4.038 455 HE1 MET 58 HE1 MET 58 17.963 -0.786 -1.793 456 HE2 MET 58 HE2 MET 58 16.847 0.586 -1.827 457 HE3 MET 58 HE3 MET 58 18.534 0.849 -1.416 458 H LYS 59 H LYS 59 15.539 -2.316 -6.647 459 HA LYS 59 HA LYS 59 15.798 -0.229 -8.542 460 HB2 LYS 59 HB3 LYS 59 17.416 -2.002 -8.542 461 HB3 LYS 59 HB2 LYS 59 16.196 -3.185 -9.040 462 HG2 LYS 59 HG3 LYS 59 15.787 -2.066 -11.087 463 HG3 LYS 59 HG2 LYS 59 16.681 -0.648 -10.566 464 HD2 LYS 59 HD3 LYS 59 18.569 -2.719 -10.400 465 HD3 LYS 59 HD2 LYS 59 17.631 -3.127 -11.837 466 HE2 LYS 59 HE2 LYS 59 19.246 -0.645 -11.299 467 HE3 LYS 59 HE1 LYS 59 19.299 -1.708 -12.700 468 HZ1 LYS 59 HZ1 LYS 59 18.030 -0.018 -13.571 469 HZ2 LYS 59 HZ2 LYS 59 17.387 0.469 -12.082 470 HZ3 LYS 59 HZ3 LYS 59 16.788 -0.892 -12.869 471 H GLU 60 H GLU 60 13.523 -2.910 -8.322 472 HA GLU 60 HA GLU 60 12.352 -2.710 -10.795 473 HB2 GLU 60 HB3 GLU 60 11.438 -3.394 -8.134 474 HB3 GLU 60 HB2 GLU 60 10.226 -3.516 -9.408 475 HG2 GLU 60 HG3 GLU 60 12.948 -4.907 -9.341 476 HG3 GLU 60 HG2 GLU 60 11.412 -5.688 -9.015 477 H LEU 61 H LEU 61 12.239 -0.393 -8.293 478 HA LEU 61 HA LEU 61 9.852 0.928 -9.296 479 HB2 LEU 61 HB3 LEU 61 11.772 1.487 -7.063 480 HB3 LEU 61 HB2 LEU 61 10.773 2.788 -7.684 481 HG LEU 61 HG LEU 61 9.814 1.391 -5.724 482 HD11 LEU 61 HD11 LEU 61 8.531 2.992 -7.204 483 HD12 LEU 61 HD12 LEU 61 7.583 1.692 -6.490 484 HD13 LEU 61 HD13 LEU 61 8.061 1.592 -8.178 485 HD21 LEU 61 HD21 LEU 61 8.766 -0.705 -6.249 486 HD22 LEU 61 HD22 LEU 61 10.389 -0.843 -6.898 487 HD23 LEU 61 HD23 LEU 61 9.034 -0.515 -7.969 488 H ASP 62 H ASP 62 13.022 0.704 -10.334 489 HA ASP 62 HA ASP 62 13.464 3.354 -11.293 490 HB2 ASP 62 HB3 ASP 62 14.520 0.638 -12.127 491 HB3 ASP 62 HB2 ASP 62 14.795 2.049 -13.124 492 H GLU 63 H GLU 63 11.680 0.607 -12.443 493 HA GLU 63 HA GLU 63 11.002 1.525 -15.032 494 HB2 GLU 63 HB3 GLU 63 9.465 -0.187 -13.066 495 HB3 GLU 63 HB2 GLU 63 9.019 0.038 -14.755 496 HG2 GLU 63 HG3 GLU 63 11.233 -0.888 -15.445 497 HG3 GLU 63 HG2 GLU 63 11.617 -1.093 -13.729 498 H ASN 64 H ASN 64 9.756 2.125 -11.824 499 HA ASN 64 HA ASN 64 7.684 3.901 -12.826 500 HB2 ASN 64 HB3 ASN 64 8.282 2.653 -10.242 501 HB3 ASN 64 HB2 ASN 64 7.735 4.322 -10.108 502 HD21 ASN 64 HD21 ASN 64 6.461 1.290 -10.066 503 HD22 ASN 64 HD22 ASN 64 4.939 1.634 -10.742 504 H GLY 65 H GLY 65 10.802 4.170 -12.893 505 HA2 GLY 65 HA3 GLY 65 11.099 6.895 -11.822 506 HA3 GLY 65 HA2 GLY 65 12.340 5.882 -12.577 507 H ASP 66 H ASP 66 9.408 5.646 -14.173 508 HA ASP 66 HA ASP 66 10.310 6.584 -16.642 509 HB2 ASP 66 HB3 ASP 66 8.169 5.196 -16.024 510 HB3 ASP 66 HB2 ASP 66 7.425 6.753 -15.793 511 H GLY 67 H GLY 67 8.449 8.133 -14.106 512 HA2 GLY 67 HA3 GLY 67 9.347 10.770 -15.035 513 HA3 GLY 67 HA2 GLY 67 7.621 10.529 -14.810 514 H GLU 68 H GLU 68 7.011 9.486 -12.694 515 HA GLU 68 HA GLU 68 8.828 10.063 -10.501 516 HB2 GLU 68 HB3 GLU 68 6.044 10.980 -10.027 517 HB3 GLU 68 HB2 GLU 68 7.567 11.633 -9.438 518 HG2 GLU 68 HG3 GLU 68 6.613 13.241 -10.910 519 HG3 GLU 68 HG2 GLU 68 8.003 12.551 -11.743 520 H VAL 69 H VAL 69 7.476 9.483 -8.425 521 HA VAL 69 HA VAL 69 5.972 6.986 -8.868 522 HB VAL 69 HB VAL 69 8.158 6.276 -8.175 523 HG11 VAL 69 HG11 VAL 69 9.354 7.250 -6.237 524 HG12 VAL 69 HG12 VAL 69 8.059 8.403 -6.028 525 HG13 VAL 69 HG13 VAL 69 9.061 8.470 -7.476 526 HG21 VAL 69 HG21 VAL 69 6.998 4.915 -6.757 527 HG22 VAL 69 HG22 VAL 69 6.062 6.246 -6.017 528 HG23 VAL 69 HG23 VAL 69 7.683 5.920 -5.511 529 H ASP 70 H ASP 70 4.049 6.993 -7.629 530 HA ASP 70 HA ASP 70 3.935 9.115 -5.642 531 HB2 ASP 70 HB3 ASP 70 1.761 9.849 -6.194 532 HB3 ASP 70 HB2 ASP 70 2.732 9.729 -7.662 533 H PHE 71 H PHE 71 1.293 8.619 -4.815 534 HA PHE 71 HA PHE 71 1.988 7.075 -2.633 535 HB2 PHE 71 HB3 PHE 71 0.050 8.728 -2.806 536 HB3 PHE 71 HB2 PHE 71 -0.840 7.432 -3.602 537 HD1 PHE 71 HD1 PHE 71 1.154 8.134 -0.527 538 HD2 PHE 71 HD2 PHE 71 -2.053 5.840 -2.263 539 HE1 PHE 71 HE1 PHE 71 0.603 7.229 1.675 540 HE2 PHE 71 HE2 PHE 71 -2.600 4.949 -0.017 541 HZ PHE 71 HZ PHE 71 -1.276 5.634 1.945 542 H GLN 72 H GLN 72 0.183 6.203 -5.543 543 HA GLN 72 HA GLN 72 -0.390 3.502 -4.804 544 HB2 GLN 72 HB3 GLN 72 -0.156 4.878 -7.481 545 HB3 GLN 72 HB2 GLN 72 -0.652 3.187 -7.331 546 HG2 GLN 72 HG3 GLN 72 -2.542 3.925 -5.915 547 HG3 GLN 72 HG2 GLN 72 -1.953 5.596 -6.087 548 HE21 GLN 72 HE21 GLN 72 -2.568 2.885 -8.400 549 HE22 GLN 72 HE22 GLN 72 -3.462 3.818 -9.488 550 H GLU 73 H GLU 73 2.277 4.976 -6.617 551 HA GLU 73 HA GLU 73 3.695 2.508 -6.956 552 HB2 GLU 73 HB3 GLU 73 4.689 5.368 -7.032 553 HB3 GLU 73 HB2 GLU 73 5.599 3.931 -7.539 554 HG2 GLU 73 HG3 GLU 73 4.764 4.601 -9.593 555 HG3 GLU 73 HG2 GLU 73 3.458 3.549 -9.080 556 H TYR 74 H TYR 74 3.835 5.132 -4.614 557 HA TYR 74 HA TYR 74 6.096 4.318 -3.185 558 HB2 TYR 74 HB3 TYR 74 5.308 6.580 -2.995 559 HB3 TYR 74 HB2 TYR 74 3.756 6.041 -2.400 560 HD1 TYR 74 HD1 TYR 74 7.368 5.313 -1.405 561 HD2 TYR 74 HD2 TYR 74 3.429 6.563 -0.159 562 HE1 TYR 74 HE1 TYR 74 8.148 5.495 0.909 563 HE2 TYR 74 HE2 TYR 74 4.230 6.748 2.162 564 HH TYR 74 HH TYR 74 7.527 6.679 3.006 565 H VAL 75 H VAL 75 2.661 3.683 -2.455 566 HA VAL 75 HA VAL 75 3.163 2.382 -0.050 567 HB VAL 75 HB VAL 75 0.899 1.289 -0.381 568 HG11 VAL 75 HG11 VAL 75 1.271 3.500 0.758 569 HG12 VAL 75 HG12 VAL 75 -0.280 3.399 -0.053 570 HG13 VAL 75 HG13 VAL 75 1.033 4.299 -0.794 571 HG21 VAL 75 HG21 VAL 75 1.384 2.171 -3.115 572 HG22 VAL 75 HG22 VAL 75 0.005 3.006 -2.502 573 HG23 VAL 75 HG23 VAL 75 0.039 1.240 -2.483 574 H VAL 76 H VAL 76 2.962 0.982 -3.306 575 HA VAL 76 HA VAL 76 3.139 -1.678 -2.413 576 HB VAL 76 HB VAL 76 2.351 -1.162 -4.682 577 HG11 VAL 76 HG11 VAL 76 4.073 -0.566 -6.426 578 HG12 VAL 76 HG12 VAL 76 5.159 -0.115 -5.134 579 HG13 VAL 76 HG13 VAL 76 3.609 0.722 -5.335 580 HG21 VAL 76 HG21 VAL 76 3.477 -2.913 -5.850 581 HG22 VAL 76 HG22 VAL 76 3.530 -3.389 -4.158 582 HG23 VAL 76 HG23 VAL 76 4.957 -2.693 -4.931 583 H LEU 77 H LEU 77 5.545 0.731 -3.232 584 HA LEU 77 HA LEU 77 7.793 -0.948 -3.234 585 HB2 LEU 77 HB3 LEU 77 7.854 1.353 -4.108 586 HB3 LEU 77 HB2 LEU 77 7.610 1.964 -2.470 587 HG LEU 77 HG LEU 77 9.749 0.974 -1.736 588 HD11 LEU 77 HD11 LEU 77 10.146 -0.890 -2.851 589 HD12 LEU 77 HD12 LEU 77 11.192 0.155 -3.821 590 HD13 LEU 77 HD13 LEU 77 9.597 -0.309 -4.414 591 HD21 LEU 77 HD21 LEU 77 10.350 3.069 -2.418 592 HD22 LEU 77 HD22 LEU 77 9.608 2.899 -4.016 593 HD23 LEU 77 HD23 LEU 77 11.183 2.185 -3.687 594 H VAL 78 H VAL 78 6.376 0.992 -0.601 595 HA VAL 78 HA VAL 78 8.235 -0.020 1.330 596 HB VAL 78 HB VAL 78 6.909 1.078 3.011 597 HG11 VAL 78 HG11 VAL 78 8.133 2.370 0.937 598 HG12 VAL 78 HG12 VAL 78 7.376 3.223 2.289 599 HG13 VAL 78 HG13 VAL 78 6.500 3.005 0.781 600 HG21 VAL 78 HG21 VAL 78 4.824 1.406 0.827 601 HG22 VAL 78 HG22 VAL 78 4.741 2.154 2.419 602 HG23 VAL 78 HG23 VAL 78 4.632 0.407 2.273 603 H ALA 79 H ALA 79 4.972 -0.906 0.359 604 HA ALA 79 HA ALA 79 4.579 -2.907 2.310 605 HB1 ALA 79 HB1 ALA 79 2.823 -3.711 0.964 606 HB2 ALA 79 HB2 ALA 79 3.454 -2.922 -0.486 607 HB3 ALA 79 HB3 ALA 79 2.783 -1.953 0.832 608 H ALA 80 H ALA 80 6.052 -2.974 -0.906 609 HA ALA 80 HA ALA 80 6.380 -5.729 -1.126 610 HB1 ALA 80 HB1 ALA 80 6.811 -4.270 -3.023 611 HB2 ALA 80 HB2 ALA 80 8.269 -5.176 -2.649 612 HB3 ALA 80 HB3 ALA 80 8.140 -3.487 -2.168 613 H LEU 81 H LEU 81 8.487 -3.274 0.265 614 HA LEU 81 HA LEU 81 10.502 -5.060 1.224 615 HB2 LEU 81 HB3 LEU 81 9.660 -2.305 2.133 616 HB3 LEU 81 HB2 LEU 81 11.068 -3.167 2.763 617 HG LEU 81 HG LEU 81 10.639 -2.560 -0.181 618 HD11 LEU 81 HD11 LEU 81 12.866 -1.157 0.917 619 HD12 LEU 81 HD12 LEU 81 11.459 -0.799 1.907 620 HD13 LEU 81 HD13 LEU 81 11.411 -0.516 0.161 621 HD21 LEU 81 HD21 LEU 81 12.143 -4.297 -0.205 622 HD22 LEU 81 HD22 LEU 81 12.739 -3.984 1.424 623 HD23 LEU 81 HD23 LEU 81 13.275 -2.985 0.077 624 H THR 82 H THR 82 7.542 -3.736 2.581 625 HA THR 82 HA THR 82 7.843 -4.676 5.194 626 HB THR 82 HB THR 82 5.231 -4.465 3.709 627 HG1 THR 82 HG2 THR 82 6.720 -2.546 3.582 628 HG21 THR 82 HG21 THR 82 5.155 -5.463 5.964 629 HG22 THR 82 HG22 THR 82 4.317 -3.921 5.920 630 HG23 THR 82 HG23 THR 82 5.924 -4.031 6.629 631 H VAL 83 H VAL 83 6.181 -6.210 2.426 632 HA VAL 83 HA VAL 83 5.572 -8.583 3.856 633 HB VAL 83 HB VAL 83 4.374 -7.974 1.798 634 HG11 VAL 83 HG11 VAL 83 6.984 -8.556 0.386 635 HG12 VAL 83 HG12 VAL 83 6.133 -7.004 0.482 636 HG13 VAL 83 HG13 VAL 83 5.419 -8.352 -0.384 637 HG21 VAL 83 HG21 VAL 83 5.134 -10.345 0.570 638 HG22 VAL 83 HG22 VAL 83 3.911 -10.187 1.795 639 HG23 VAL 83 HG23 VAL 83 5.564 -10.634 2.254 640 H ALA 84 H ALA 84 8.322 -7.670 1.824 641 HA ALA 84 HA ALA 84 9.659 -10.141 1.874 642 HB1 ALA 84 HB1 ALA 84 11.730 -8.798 1.500 643 HB2 ALA 84 HB2 ALA 84 10.789 -7.331 1.777 644 HB3 ALA 84 HB3 ALA 84 10.426 -8.356 0.403 645 H MET 85 H MET 85 9.948 -7.326 4.020 646 HA MET 85 HA MET 85 11.731 -8.641 5.790 647 HB2 MET 85 HB3 MET 85 11.316 -6.096 5.460 648 HB3 MET 85 HB2 MET 85 10.035 -6.329 6.648 649 HG2 MET 85 HG3 MET 85 12.813 -7.379 7.201 650 HG3 MET 85 HG2 MET 85 12.436 -5.696 7.474 651 HE1 MET 85 HE1 MET 85 12.869 -8.253 10.252 652 HE2 MET 85 HE2 MET 85 12.832 -8.862 8.600 653 HE3 MET 85 HE3 MET 85 11.582 -9.341 9.735 654 H ASN 86 H ASN 86 8.234 -7.955 5.945 655 HA ASN 86 HA ASN 86 7.905 -9.144 8.493 656 HB2 ASN 86 HB3 ASN 86 5.952 -8.276 6.384 657 HB3 ASN 86 HB2 ASN 86 5.416 -9.269 7.725 658 HD21 ASN 86 HD21 ASN 86 6.364 -8.431 9.990 659 HD22 ASN 86 HD22 ASN 86 6.241 -6.754 10.201 660 H ASN 87 H ASN 87 8.182 -10.503 5.365 661 HA ASN 87 HA ASN 87 6.895 -12.969 5.786 662 HB2 ASN 87 HB3 ASN 87 7.736 -12.471 3.589 663 HB3 ASN 87 HB2 ASN 87 9.385 -12.294 4.193 664 HD21 ASN 87 HD21 ASN 87 6.757 -14.738 3.957 665 HD22 ASN 87 HD22 ASN 87 7.826 -16.062 3.855 666 H PHE 88 H PHE 88 10.028 -11.717 6.777 667 HA PHE 88 HA PHE 88 11.000 -14.112 7.969 668 HB2 PHE 88 HB3 PHE 88 11.634 -11.202 8.575 669 HB3 PHE 88 HB2 PHE 88 12.467 -12.582 9.271 670 HD1 PHE 88 HD2 PHE 88 13.583 -14.285 7.713 671 HD2 PHE 88 HD1 PHE 88 12.214 -10.429 6.402 672 HE1 PHE 88 HE2 PHE 88 15.007 -14.459 5.719 673 HE2 PHE 88 HE1 PHE 88 13.654 -10.604 4.389 674 HZ PHE 88 HZ PHE 88 15.052 -12.609 4.042 675 H PHE 89 H PHE 89 8.963 -11.445 9.060 676 HA PHE 89 HA PHE 89 8.856 -12.046 11.824 677 HB2 PHE 89 HB3 PHE 89 7.029 -10.545 9.961 678 HB3 PHE 89 HB2 PHE 89 6.394 -11.095 11.485 679 HD1 PHE 89 HD2 PHE 89 9.324 -9.215 10.053 680 HD2 PHE 89 HD1 PHE 89 6.744 -9.877 13.441 681 HE1 PHE 89 HE2 PHE 89 10.365 -7.304 11.244 682 HE2 PHE 89 HE1 PHE 89 7.789 -7.975 14.603 683 HZ PHE 89 HZ PHE 89 9.598 -6.688 13.506 684 H TRP 90 H TRP 90 6.847 -13.140 9.175 685 HA TRP 90 HA TRP 90 5.143 -14.729 10.838 686 HB2 TRP 90 HB3 TRP 90 5.540 -15.281 7.912 687 HB3 TRP 90 HB2 TRP 90 4.064 -15.376 8.871 688 HD1 TRP 90 HD TRP 90 4.466 -12.487 10.277 689 HE1 TRP 90 HE1 TRP 90 3.972 -10.423 8.974 690 HE3 TRP 90 HE3 TRP 90 4.794 -14.413 5.581 691 HZ2 TRP 90 HZ2 TRP 90 3.704 -9.616 6.168 692 HZ3 TRP 90 HZ3 TRP 90 4.404 -12.967 3.603 693 HH2 TRP 90 HH TRP 90 3.859 -10.565 3.907 694 H GLU 91 H GLU 91 7.643 -15.535 8.540 695 HA GLU 91 HA GLU 91 7.573 -18.336 9.137 696 HB2 GLU 91 HB3 GLU 91 9.603 -16.700 7.693 697 HB3 GLU 91 HB2 GLU 91 9.669 -18.464 7.772 698 HG2 GLU 91 HG3 GLU 91 7.353 -18.580 6.794 699 HG3 GLU 91 HG2 GLU 91 7.354 -16.830 6.684 700 H ASN 92 H ASN 92 9.900 -15.800 10.081 701 HA ASN 92 HA ASN 92 11.115 -17.705 11.979 702 HB2 ASN 92 HB3 ASN 92 12.675 -16.357 10.587 703 HB3 ASN 92 HB2 ASN 92 11.968 -14.882 11.240 704 HD21 ASN 92 HD21 ASN 92 14.588 -14.979 11.788 705 HD22 ASN 92 HD22 ASN 92 14.896 -15.510 13.367 706 H SER 93 H SER 93 9.730 -17.880 13.596 707 HA SER 93 HA SER 93 9.387 -15.986 15.599 708 HB2 SER 93 HB3 SER 93 7.356 -15.939 13.396 709 HB3 SER 93 HB2 SER 93 6.779 -15.745 15.046 710 HG SER 93 HG SER 93 7.940 -14.053 13.404 711 H1 GLY 1 H GLY 1 11.018 1.261 14.828 712 HA2 GLY 1 HA3 GLY 1 11.285 1.202 12.034 713 HA3 GLY 1 HA2 GLY 1 9.855 0.285 12.440 714 H SER 2 H SER 2 10.185 2.877 11.072 715 HA SER 2 HA SER 2 9.320 5.022 12.730 716 HB2 SER 2 HB3 SER 2 8.926 4.762 9.756 717 HB3 SER 2 HB2 SER 2 9.141 6.239 10.661 718 HG SER 2 HG SER 2 10.899 4.453 9.643 719 H GLU 3 H GLU 3 7.242 6.257 11.987 720 HA GLU 3 HA GLU 3 5.012 4.860 12.875 721 HB2 GLU 3 HB3 GLU 3 5.034 7.235 11.004 722 HB3 GLU 3 HB2 GLU 3 3.696 6.710 12.013 723 HG2 GLU 3 HG3 GLU 3 4.612 8.357 13.351 724 HG3 GLU 3 HG2 GLU 3 5.460 6.950 13.982 725 H LEU 4 H LEU 4 6.202 5.470 9.614 726 HA LEU 4 HA LEU 4 4.032 4.264 8.201 727 HB2 LEU 4 HB3 LEU 4 6.967 4.465 7.366 728 HB3 LEU 4 HB2 LEU 4 5.645 4.016 6.340 729 HG LEU 4 HG LEU 4 5.805 6.244 5.808 730 HD11 LEU 4 HD11 LEU 4 3.883 7.314 6.565 731 HD12 LEU 4 HD12 LEU 4 3.999 6.680 8.192 732 HD13 LEU 4 HD13 LEU 4 3.496 5.637 6.853 733 HD21 LEU 4 HD21 LEU 4 7.413 6.461 8.038 734 HD22 LEU 4 HD22 LEU 4 6.038 7.460 8.515 735 HD23 LEU 4 HD23 LEU 4 6.904 7.793 7.031 736 H GLU 5 H GLU 5 7.081 3.006 9.455 737 HA GLU 5 HA GLU 5 6.748 0.422 8.448 738 HB2 GLU 5 HB3 GLU 5 8.199 1.337 10.951 739 HB3 GLU 5 HB2 GLU 5 8.429 -0.202 10.138 740 HG2 GLU 5 HG3 GLU 5 9.100 0.951 8.082 741 HG3 GLU 5 HG2 GLU 5 8.931 2.508 8.866 742 H THR 6 H THR 6 5.854 1.988 11.438 743 HA THR 6 HA THR 6 4.603 -0.210 12.722 744 HB THR 6 HB THR 6 3.707 2.670 12.952 745 HG1 THR 6 HG2 THR 6 6.057 2.478 13.097 746 HG21 THR 6 HG21 THR 6 2.557 1.914 14.725 747 HG22 THR 6 HG22 THR 6 3.997 1.156 15.395 748 HG23 THR 6 HG23 THR 6 2.988 0.269 14.272 749 H ALA 7 H ALA 7 3.404 2.381 10.598 750 HA ALA 7 HA ALA 7 0.717 1.648 10.478 751 HB1 ALA 7 HB1 ALA 7 0.554 3.069 8.603 752 HB2 ALA 7 HB2 ALA 7 2.221 2.809 8.132 753 HB3 ALA 7 HB3 ALA 7 1.846 3.772 9.570 754 H MET 8 H MET 8 3.460 0.737 8.423 755 HA MET 8 HA MET 8 1.989 -0.966 6.721 756 HB2 MET 8 HB3 MET 8 4.933 -1.014 7.405 757 HB3 MET 8 HB2 MET 8 4.208 -1.933 6.093 758 HG2 MET 8 HG3 MET 8 4.254 1.119 6.316 759 HG3 MET 8 HG2 MET 8 5.133 0.119 5.180 760 HE1 MET 8 HE1 MET 8 2.801 -1.220 2.738 761 HE2 MET 8 HE2 MET 8 2.763 -2.113 4.248 762 HE3 MET 8 HE3 MET 8 4.279 -1.413 3.705 763 H GLU 9 H GLU 9 3.729 -1.606 9.749 764 HA GLU 9 HA GLU 9 3.254 -4.398 9.723 765 HB2 GLU 9 HB3 GLU 9 3.635 -2.489 12.048 766 HB3 GLU 9 HB2 GLU 9 3.473 -4.228 12.252 767 HG2 GLU 9 HG3 GLU 9 5.464 -4.603 10.852 768 HG3 GLU 9 HG2 GLU 9 5.619 -2.868 10.587 769 H THR 10 H THR 10 1.426 -1.632 10.808 770 HA THR 10 HA THR 10 -0.724 -2.973 12.045 771 HB THR 10 HB THR 10 -1.035 -0.416 10.445 772 HG1 THR 10 HG2 THR 10 0.857 -0.286 11.815 773 HG21 THR 10 HG21 THR 10 -2.660 0.109 12.161 774 HG22 THR 10 HG22 THR 10 -2.262 -1.357 13.048 775 HG23 THR 10 HG23 THR 10 -3.047 -1.461 11.473 776 H LEU 11 H LEU 11 -0.086 -2.029 8.711 777 HA LEU 11 HA LEU 11 -2.487 -3.022 7.580 778 HB2 LEU 11 HB3 LEU 11 0.288 -2.720 6.418 779 HB3 LEU 11 HB2 LEU 11 -1.125 -3.114 5.449 780 HG LEU 11 HG LEU 11 -0.844 -0.600 7.137 781 HD11 LEU 11 HD11 LEU 11 -0.116 0.556 5.301 782 HD12 LEU 11 HD12 LEU 11 -0.852 -0.549 4.148 783 HD13 LEU 11 HD13 LEU 11 0.645 -0.991 4.953 784 HD21 LEU 11 HD21 LEU 11 -3.139 -1.015 6.853 785 HD22 LEU 11 HD22 LEU 11 -2.916 -1.628 5.194 786 HD23 LEU 11 HD23 LEU 11 -2.745 0.082 5.537 787 H ILE 12 H ILE 12 0.701 -4.457 8.205 788 HA ILE 12 HA ILE 12 0.261 -6.998 7.020 789 HB ILE 12 HB ILE 12 2.024 -6.186 9.361 790 HG12 ILE 12 HG13 ILE 12 2.460 -5.130 7.054 791 HG13 ILE 12 HG12 ILE 12 3.805 -6.018 7.758 792 HG21 ILE 12 HG21 ILE 12 3.299 -8.267 8.657 793 HG22 ILE 12 HG22 ILE 12 1.847 -8.772 7.812 794 HG23 ILE 12 HG23 ILE 12 1.821 -8.523 9.567 795 HD11 ILE 12 HD11 ILE 12 3.114 -6.380 5.268 796 HD12 ILE 12 HD12 ILE 12 1.924 -7.506 5.914 797 HD13 ILE 12 HD13 ILE 12 3.645 -7.716 6.241 798 H ASN 13 H ASN 13 -0.180 -5.792 10.290 799 HA ASN 13 HA ASN 13 -0.988 -8.203 11.490 800 HB2 ASN 13 HB3 ASN 13 -1.693 -5.348 12.203 801 HB3 ASN 13 HB2 ASN 13 -2.075 -6.740 13.206 802 HD21 ASN 13 HD21 ASN 13 0.146 -4.370 13.033 803 HD22 ASN 13 HD22 ASN 13 1.507 -5.161 13.652 804 H VAL 14 H VAL 14 -2.842 -5.638 9.937 805 HA VAL 14 HA VAL 14 -5.380 -6.855 10.320 806 HB VAL 14 HB VAL 14 -4.407 -4.829 8.294 807 HG11 VAL 14 HG11 VAL 14 -7.126 -6.041 8.780 808 HG12 VAL 14 HG12 VAL 14 -6.286 -5.740 7.247 809 HG13 VAL 14 HG13 VAL 14 -6.963 -4.398 8.152 810 HG21 VAL 14 HG21 VAL 14 -6.310 -3.737 10.066 811 HG22 VAL 14 HG22 VAL 14 -4.577 -3.439 10.100 812 HG23 VAL 14 HG23 VAL 14 -5.268 -4.721 11.084 813 H PHE 15 H PHE 15 -3.008 -6.916 7.697 814 HA PHE 15 HA PHE 15 -4.427 -8.546 5.892 815 HB2 PHE 15 HB3 PHE 15 -2.279 -7.374 5.382 816 HB3 PHE 15 HB2 PHE 15 -1.448 -8.506 6.438 817 HD1 PHE 15 HD1 PHE 15 -3.344 -8.177 3.266 818 HD2 PHE 15 HD2 PHE 15 -1.000 -10.797 5.757 819 HE1 PHE 15 HE1 PHE 15 -3.163 -9.799 1.407 820 HE2 PHE 15 HE2 PHE 15 -0.832 -12.400 3.897 821 HZ PHE 15 HZ PHE 15 -1.908 -11.909 1.722 822 H HIS 16 H HIS 16 -2.177 -9.329 8.477 823 HA HIS 16 HA HIS 16 -2.418 -12.159 8.283 824 HB2 HIS 16 HB3 HIS 16 -1.288 -10.270 10.282 825 HB3 HIS 16 HB2 HIS 16 -1.714 -11.870 10.864 826 HD1 HIS 16 HD1 HIS 16 -0.144 -13.738 10.348 827 HD2 HIS 16 HD2 HIS 16 0.494 -10.442 7.879 828 HE1 HIS 16 HE1 HIS 16 1.877 -14.286 8.932 829 HE2 HIS 16 HE2 HIS 16 2.290 -12.295 7.427 830 H ALA 17 H ALA 17 -4.188 -9.719 10.089 831 HA ALA 17 HA ALA 17 -5.680 -11.350 11.775 832 HB1 ALA 17 HB1 ALA 17 -6.836 -8.946 10.350 833 HB2 ALA 17 HB2 ALA 17 -5.709 -8.794 11.705 834 HB3 ALA 17 HB3 ALA 17 -7.252 -9.608 11.917 835 H HIS 18 H HIS 18 -6.022 -10.684 8.358 836 HA HIS 18 HA HIS 18 -8.493 -12.224 8.201 837 HB2 HIS 18 HB3 HIS 18 -6.939 -10.701 6.117 838 HB3 HIS 18 HB2 HIS 18 -8.380 -11.650 5.758 839 HD1 HIS 18 HD1 HIS 18 -10.655 -10.957 7.111 840 HD2 HIS 18 HD2 HIS 18 -7.497 -8.200 7.253 841 HE1 HIS 18 HE1 HIS 18 -11.599 -8.800 8.003 842 HE2 HIS 18 HE2 HIS 18 -9.712 -7.118 8.098 843 H SER 19 H SER 19 -5.089 -12.620 7.292 844 HA SER 19 HA SER 19 -5.348 -14.898 5.686 845 HB2 SER 19 HB3 SER 19 -3.135 -14.221 7.667 846 HB3 SER 19 HB2 SER 19 -3.024 -15.492 6.471 847 HG SER 19 HG SER 19 -3.694 -13.574 5.014 848 H GLY 20 H GLY 20 -5.287 -14.558 9.168 849 HA2 GLY 20 HA3 GLY 20 -5.299 -17.308 9.843 850 HA3 GLY 20 HA2 GLY 20 -5.864 -16.005 10.870 851 H LYS 21 H LYS 21 -7.858 -15.008 9.094 852 HA LYS 21 HA LYS 21 -10.067 -16.575 9.943 853 HB2 LYS 21 HB3 LYS 21 -10.014 -14.555 7.688 854 HB3 LYS 21 HB2 LYS 21 -11.410 -15.056 8.628 855 HG2 LYS 21 HG3 LYS 21 -8.968 -13.756 9.797 856 HG3 LYS 21 HG2 LYS 21 -10.430 -12.865 9.388 857 HD2 LYS 21 HD3 LYS 21 -11.714 -14.085 11.060 858 HD3 LYS 21 HD2 LYS 21 -10.410 -15.226 11.321 859 HE2 LYS 21 HE2 LYS 21 -10.781 -13.208 12.961 860 HE3 LYS 21 HE1 LYS 21 -9.150 -13.742 12.576 861 HZ1 LYS 21 HZ1 LYS 21 -9.624 -11.248 12.382 862 HZ2 LYS 21 HZ2 LYS 21 -10.541 -11.600 11.038 863 HZ3 LYS 21 HZ3 LYS 21 -8.858 -11.984 11.075 864 H GLU 22 H GLU 22 -8.567 -16.091 6.760 865 HA GLU 22 HA GLU 22 -10.230 -17.970 5.420 866 HB2 GLU 22 HB3 GLU 22 -7.562 -16.729 4.535 867 HB3 GLU 22 HB2 GLU 22 -8.638 -17.742 3.586 868 HG2 GLU 22 HG3 GLU 22 -10.440 -16.144 3.757 869 HG3 GLU 22 HG2 GLU 22 -9.521 -15.209 4.913 870 H GLY 23 H GLY 23 -7.021 -18.106 6.873 871 HA2 GLY 23 HA3 GLY 23 -6.440 -20.114 8.073 872 HA3 GLY 23 HA2 GLY 23 -7.185 -21.066 6.799 873 H ASP 24 H ASP 24 -4.852 -18.373 6.720 874 HA ASP 24 HA ASP 24 -2.868 -20.214 5.531 875 HB2 ASP 24 HB3 ASP 24 -4.028 -18.723 3.791 876 HB3 ASP 24 HB2 ASP 24 -3.163 -17.382 4.538 877 H LYS 25 H LYS 25 -0.733 -19.700 5.953 878 HA LYS 25 HA LYS 25 -0.252 -18.457 8.451 879 HB2 LYS 25 HB3 LYS 25 2.197 -18.536 7.672 880 HB3 LYS 25 HB2 LYS 25 1.379 -20.089 7.899 881 HG2 LYS 25 HG3 LYS 25 0.947 -20.114 5.412 882 HG3 LYS 25 HG2 LYS 25 1.876 -18.626 5.263 883 HD2 LYS 25 HD3 LYS 25 3.825 -19.780 6.324 884 HD3 LYS 25 HD2 LYS 25 2.919 -21.280 6.291 885 HE2 LYS 25 HE2 LYS 25 3.532 -19.604 3.838 886 HE3 LYS 25 HE1 LYS 25 4.444 -21.005 4.382 887 HZ1 LYS 25 HZ1 LYS 25 2.965 -22.237 3.190 888 HZ2 LYS 25 HZ2 LYS 25 1.973 -20.904 2.963 889 HZ3 LYS 25 HZ3 LYS 25 1.802 -21.838 4.347 890 H TYR 26 H TYR 26 0.027 -17.387 5.129 891 HA TYR 26 HA TYR 26 -0.476 -14.753 5.966 892 HB2 TYR 26 HB3 TYR 26 1.670 -13.833 4.702 893 HB3 TYR 26 HB2 TYR 26 1.672 -14.234 6.413 894 HD1 TYR 26 HD2 TYR 26 2.725 -15.419 3.043 895 HD2 TYR 26 HD1 TYR 26 2.797 -16.110 7.258 896 HE1 TYR 26 HE2 TYR 26 4.477 -17.088 2.700 897 HE2 TYR 26 HE1 TYR 26 4.606 -17.824 6.946 898 HH TYR 26 HH TYR 26 6.518 -18.083 4.722 899 H LYS 27 H LYS 27 -2.145 -14.855 4.560 900 HA LYS 27 HA LYS 27 -1.641 -13.997 1.936 901 HB2 LYS 27 HB3 LYS 27 -2.829 -16.757 2.234 902 HB3 LYS 27 HB2 LYS 27 -3.153 -15.736 0.831 903 HG2 LYS 27 HG3 LYS 27 -0.459 -16.813 1.731 904 HG3 LYS 27 HG2 LYS 27 -1.450 -17.288 0.352 905 HD2 LYS 27 HD3 LYS 27 -1.156 -14.491 -0.004 906 HD3 LYS 27 HD2 LYS 27 0.421 -15.029 0.536 907 HE2 LYS 27 HE2 LYS 27 -1.003 -15.594 -1.993 908 HE3 LYS 27 HE1 LYS 27 0.709 -15.390 -1.682 909 HZ1 LYS 27 HZ1 LYS 27 0.272 -17.746 -0.434 910 HZ2 LYS 27 HZ2 LYS 27 0.664 -17.607 -2.079 911 HZ3 LYS 27 HZ3 LYS 27 -0.948 -17.769 -1.624 912 H LEU 28 H LEU 28 -3.616 -13.329 0.888 913 HA LEU 28 HA LEU 28 -5.968 -13.334 2.631 914 HB2 LEU 28 HB3 LEU 28 -4.973 -11.148 2.766 915 HB3 LEU 28 HB2 LEU 28 -4.873 -11.026 1.005 916 HG LEU 28 HG LEU 28 -7.424 -11.321 0.975 917 HD11 LEU 28 HD11 LEU 28 -8.526 -10.661 3.122 918 HD12 LEU 28 HD12 LEU 28 -6.991 -10.946 3.937 919 HD13 LEU 28 HD13 LEU 28 -7.823 -12.275 3.126 920 HD21 LEU 28 HD21 LEU 28 -6.664 -9.103 0.582 921 HD22 LEU 28 HD22 LEU 28 -6.051 -8.944 2.233 922 HD23 LEU 28 HD23 LEU 28 -7.797 -9.007 1.929 923 H SER 29 H SER 29 -7.799 -13.914 1.543 924 HA SER 29 HA SER 29 -7.431 -14.441 -1.302 925 HB2 SER 29 HB3 SER 29 -9.654 -15.638 0.333 926 HB3 SER 29 HB2 SER 29 -8.922 -16.188 -1.178 927 HG SER 29 HG SER 29 -7.654 -15.982 1.336 928 H LYS 30 H LYS 30 -9.579 -14.216 -2.570 929 HA LYS 30 HA LYS 30 -10.372 -11.511 -2.249 930 HB2 LYS 30 HB3 LYS 30 -11.651 -13.605 -4.025 931 HB3 LYS 30 HB2 LYS 30 -11.873 -11.867 -4.163 932 HG2 LYS 30 HG3 LYS 30 -9.272 -13.384 -4.515 933 HG3 LYS 30 HG2 LYS 30 -10.192 -12.631 -5.799 934 HD2 LYS 30 HD3 LYS 30 -8.914 -11.109 -3.468 935 HD3 LYS 30 HD2 LYS 30 -8.191 -11.286 -5.040 936 HE2 LYS 30 HE2 LYS 30 -10.787 -9.807 -4.421 937 HE3 LYS 30 HE1 LYS 30 -9.248 -9.159 -4.988 938 HZ1 LYS 30 HZ1 LYS 30 -11.119 -9.518 -6.592 939 HZ2 LYS 30 HZ2 LYS 30 -10.789 -11.136 -6.609 940 HZ3 LYS 30 HZ3 LYS 30 -9.599 -9.965 -7.127 941 H LYS 31 H LYS 31 -11.336 -14.063 -0.450 942 HA LYS 31 HA LYS 31 -14.127 -13.320 -0.213 943 HB2 LYS 31 HB3 LYS 31 -14.317 -15.084 1.425 944 HB3 LYS 31 HB2 LYS 31 -13.490 -15.690 -0.005 945 HG2 LYS 31 HG3 LYS 31 -11.287 -15.116 1.306 946 HG3 LYS 31 HG2 LYS 31 -12.338 -15.026 2.709 947 HD2 LYS 31 HD3 LYS 31 -11.562 -17.235 2.707 948 HD3 LYS 31 HD2 LYS 31 -13.180 -17.382 2.101 949 HE2 LYS 31 HE2 LYS 31 -11.424 -16.892 -0.157 950 HE3 LYS 31 HE1 LYS 31 -10.729 -18.150 0.833 951 HZ1 LYS 31 HZ1 LYS 31 -12.308 -19.574 0.330 952 HZ2 LYS 31 HZ2 LYS 31 -12.661 -18.549 -0.972 953 HZ3 LYS 31 HZ3 LYS 31 -13.573 -18.457 0.457 954 H GLU 32 H GLU 32 -11.443 -13.300 2.230 955 HA GLU 32 HA GLU 32 -12.907 -11.623 4.017 956 HB2 GLU 32 HB3 GLU 32 -9.968 -12.325 3.779 957 HB3 GLU 32 HB2 GLU 32 -10.568 -11.187 4.972 958 HG2 GLU 32 HG3 GLU 32 -11.593 -14.031 4.713 959 HG3 GLU 32 HG2 GLU 32 -10.293 -13.552 5.786 960 H LEU 33 H LEU 33 -10.676 -11.144 1.401 961 HA LEU 33 HA LEU 33 -9.843 -8.574 1.875 962 HB2 LEU 33 HB3 LEU 33 -8.857 -9.977 0.132 963 HB3 LEU 33 HB2 LEU 33 -10.354 -9.924 -0.767 964 HG LEU 33 HG LEU 33 -8.426 -8.377 -1.519 965 HD11 LEU 33 HD11 LEU 33 -10.758 -6.612 -1.207 966 HD12 LEU 33 HD12 LEU 33 -11.159 -8.201 -1.845 967 HD13 LEU 33 HD13 LEU 33 -9.966 -7.189 -2.662 968 HD21 LEU 33 HD21 LEU 33 -8.413 -7.452 1.072 969 HD22 LEU 33 HD22 LEU 33 -9.491 -6.299 0.333 970 HD23 LEU 33 HD23 LEU 33 -7.867 -6.532 -0.318 971 H LYS 34 H LYS 34 -12.781 -9.528 0.063 972 HA LYS 34 HA LYS 34 -13.478 -6.907 -0.732 973 HB2 LYS 34 HB3 LYS 34 -15.279 -9.259 -0.086 974 HB3 LYS 34 HB2 LYS 34 -15.789 -7.808 -0.929 975 HG2 LYS 34 HG3 LYS 34 -14.190 -8.252 -2.733 976 HG3 LYS 34 HG2 LYS 34 -13.632 -9.710 -1.918 977 HD2 LYS 34 HD3 LYS 34 -16.032 -10.576 -2.003 978 HD3 LYS 34 HD2 LYS 34 -16.425 -9.170 -2.973 979 HE2 LYS 34 HE2 LYS 34 -15.995 -10.710 -4.633 980 HE3 LYS 34 HE1 LYS 34 -14.420 -9.942 -4.472 981 HZ1 LYS 34 HZ1 LYS 34 -15.289 -12.532 -3.288 982 HZ2 LYS 34 HZ2 LYS 34 -13.875 -11.814 -2.811 983 HZ3 LYS 34 HZ3 LYS 34 -14.097 -12.323 -4.433 984 H GLU 35 H GLU 35 -14.359 -8.861 2.046 985 HA GLU 35 HA GLU 35 -16.016 -6.929 3.314 986 HB2 GLU 35 HB3 GLU 35 -14.649 -9.444 4.296 987 HB3 GLU 35 HB2 GLU 35 -15.794 -8.515 5.256 988 HG2 GLU 35 HG3 GLU 35 -17.549 -8.804 3.624 989 HG3 GLU 35 HG2 GLU 35 -16.448 -9.573 2.489 990 H LEU 36 H LEU 36 -12.684 -7.964 3.669 991 HA LEU 36 HA LEU 36 -11.924 -6.378 5.855 992 HB2 LEU 36 HB3 LEU 36 -10.389 -8.024 5.355 993 HB3 LEU 36 HB2 LEU 36 -10.598 -7.835 3.635 994 HG LEU 36 HG LEU 36 -9.316 -5.788 3.630 995 HD11 LEU 36 HD11 LEU 36 -8.802 -4.641 5.457 996 HD12 LEU 36 HD12 LEU 36 -8.110 -6.049 6.265 997 HD13 LEU 36 HD13 LEU 36 -9.842 -5.704 6.405 998 HD21 LEU 36 HD21 LEU 36 -8.303 -8.409 4.406 999 HD22 LEU 36 HD22 LEU 36 -7.197 -7.120 4.857 1000 HD23 LEU 36 HD23 LEU 36 -7.749 -7.274 3.185 1001 H LEU 37 H LEU 37 -11.711 -5.751 2.370 1002 HA LEU 37 HA LEU 37 -10.434 -3.292 2.661 1003 HB2 LEU 37 HB3 LEU 37 -10.400 -4.481 0.545 1004 HB3 LEU 37 HB2 LEU 37 -12.140 -4.313 0.363 1005 HG LEU 37 HG LEU 37 -10.596 -2.708 -0.939 1006 HD11 LEU 37 HD11 LEU 37 -13.193 -2.411 0.078 1007 HD12 LEU 37 HD12 LEU 37 -12.452 -1.451 -1.197 1008 HD13 LEU 37 HD13 LEU 37 -12.397 -0.883 0.458 1009 HD21 LEU 37 HD21 LEU 37 -9.316 -2.217 1.295 1010 HD22 LEU 37 HD22 LEU 37 -10.592 -1.023 1.565 1011 HD23 LEU 37 HD23 LEU 37 -9.572 -0.926 0.138 1012 H GLN 38 H GLN 38 -13.876 -4.047 2.312 1013 HA GLN 38 HA GLN 38 -14.719 -1.320 2.498 1014 HB2 GLN 38 HB3 GLN 38 -16.971 -2.188 2.928 1015 HB3 GLN 38 HB2 GLN 38 -16.236 -3.074 1.599 1016 HG2 GLN 38 HG3 GLN 38 -15.664 -4.898 3.076 1017 HG3 GLN 38 HG2 GLN 38 -16.297 -4.040 4.487 1018 HE21 GLN 38 HE21 GLN 38 -18.154 -5.246 5.007 1019 HE22 GLN 38 HE22 GLN 38 -19.383 -5.581 3.916 1020 H THR 39 H THR 39 -14.188 -3.880 4.849 1021 HA THR 39 HA THR 39 -15.308 -2.622 7.081 1022 HB THR 39 HB THR 39 -13.021 -4.593 6.882 1023 HG1 THR 39 HG2 THR 39 -14.834 -5.441 6.042 1024 HG21 THR 39 HG21 THR 39 -13.644 -5.149 9.214 1025 HG22 THR 39 HG22 THR 39 -14.680 -3.711 9.253 1026 HG23 THR 39 HG23 THR 39 -12.936 -3.562 8.979 1027 H GLU 40 H GLU 40 -11.893 -2.722 6.041 1028 HA GLU 40 HA GLU 40 -11.018 -0.966 8.110 1029 HB2 GLU 40 HB3 GLU 40 -9.702 -1.986 5.603 1030 HB3 GLU 40 HB2 GLU 40 -8.927 -0.919 6.773 1031 HG2 GLU 40 HG3 GLU 40 -10.193 -3.571 7.512 1032 HG3 GLU 40 HG2 GLU 40 -8.471 -3.357 7.196 1033 H LEU 41 H LEU 41 -11.681 -0.489 4.679 1034 HA LEU 41 HA LEU 41 -11.118 2.367 5.025 1035 HB2 LEU 41 HB3 LEU 41 -11.369 0.552 2.684 1036 HB3 LEU 41 HB2 LEU 41 -11.650 2.239 2.421 1037 HG LEU 41 HG LEU 41 -9.409 2.729 3.604 1038 HD11 LEU 41 HD11 LEU 41 -9.156 -0.271 3.372 1039 HD12 LEU 41 HD12 LEU 41 -9.104 0.723 4.848 1040 HD13 LEU 41 HD13 LEU 41 -7.818 0.831 3.687 1041 HD21 LEU 41 HD21 LEU 41 -9.576 2.760 1.133 1042 HD22 LEU 41 HD22 LEU 41 -9.300 1.014 1.096 1043 HD23 LEU 41 HD23 LEU 41 -8.040 2.100 1.675 1044 H SER 42 H SER 42 -13.293 1.466 6.368 1045 HA SER 42 HA SER 42 -15.776 1.680 5.134 1046 HB2 SER 42 HB3 SER 42 -14.962 2.636 7.883 1047 HB3 SER 42 HB2 SER 42 -16.609 2.412 7.349 1048 HG SER 42 HG SER 42 -14.548 0.441 7.731 1049 H GLY 43 H GLY 43 -13.625 4.226 6.343 1050 HA2 GLY 43 HA3 GLY 43 -15.402 6.388 5.822 1051 HA3 GLY 43 HA2 GLY 43 -13.666 6.487 6.092 1052 H PHE 44 H PHE 44 -12.672 4.989 4.022 1053 HA PHE 44 HA PHE 44 -12.815 6.850 1.834 1054 HB2 PHE 44 HB3 PHE 44 -11.470 4.154 2.094 1055 HB3 PHE 44 HB2 PHE 44 -11.408 5.107 0.628 1056 HD1 PHE 44 HD2 PHE 44 -10.383 7.343 0.654 1057 HD2 PHE 44 HD1 PHE 44 -10.162 4.732 4.007 1058 HE1 PHE 44 HE2 PHE 44 -8.513 8.715 1.577 1059 HE2 PHE 44 HE1 PHE 44 -8.296 6.085 4.952 1060 HZ PHE 44 HZ PHE 44 -7.475 8.070 3.738 1061 H LEU 45 H LEU 45 -14.041 3.637 2.451 1062 HA LEU 45 HA LEU 45 -15.015 3.090 -0.085 1063 HB2 LEU 45 HB3 LEU 45 -14.932 1.280 1.348 1064 HB3 LEU 45 HB2 LEU 45 -15.678 2.152 2.682 1065 HG LEU 45 HG LEU 45 -17.776 2.138 1.626 1066 HD11 LEU 45 HD11 LEU 45 -17.906 2.085 -0.611 1067 HD12 LEU 45 HD12 LEU 45 -17.564 0.364 -0.594 1068 HD13 LEU 45 HD13 LEU 45 -16.245 1.530 -0.803 1069 HD21 LEU 45 HD21 LEU 45 -18.333 -0.176 1.814 1070 HD22 LEU 45 HD22 LEU 45 -16.922 0.072 2.846 1071 HD23 LEU 45 HD23 LEU 45 -16.738 -0.676 1.254 1072 H ASP 46 H ASP 46 -16.637 4.541 2.694 1073 HA ASP 46 HA ASP 46 -19.112 4.905 1.366 1074 HB2 ASP 46 HB3 ASP 46 -18.779 4.775 3.743 1075 HB3 ASP 46 HB2 ASP 46 -18.093 6.413 3.752 1076 H ALA 47 H ALA 47 -16.340 7.015 1.744 1077 HA ALA 47 HA ALA 47 -17.623 9.378 0.875 1078 HB1 ALA 47 HB1 ALA 47 -15.685 10.328 1.387 1079 HB2 ALA 47 HB2 ALA 47 -14.843 9.431 0.146 1080 HB3 ALA 47 HB3 ALA 47 -15.041 8.734 1.761 1081 H GLN 48 H GLN 48 -15.835 6.932 -0.970 1082 HA GLN 48 HA GLN 48 -16.730 8.306 -3.443 1083 HB2 GLN 48 HB3 GLN 48 -14.672 7.011 -4.471 1084 HB3 GLN 48 HB2 GLN 48 -14.422 8.522 -3.605 1085 HG2 GLN 48 HG3 GLN 48 -12.819 7.131 -2.767 1086 HG3 GLN 48 HG2 GLN 48 -14.041 6.987 -1.515 1087 HE21 GLN 48 HE21 GLN 48 -15.334 4.922 -1.555 1088 HE22 GLN 48 HE22 GLN 48 -14.722 3.570 -2.385 1089 H LYS 49 H LYS 49 -18.534 6.687 -2.399 1090 HA LYS 49 HA LYS 49 -18.479 3.957 -3.139 1091 HB2 LYS 49 HB3 LYS 49 -20.767 5.902 -2.773 1092 HB3 LYS 49 HB2 LYS 49 -20.923 4.146 -2.910 1093 HG2 LYS 49 HG3 LYS 49 -19.650 3.794 -0.901 1094 HG3 LYS 49 HG2 LYS 49 -19.191 5.487 -0.846 1095 HD2 LYS 49 HD3 LYS 49 -20.964 5.825 0.509 1096 HD3 LYS 49 HD2 LYS 49 -21.942 5.661 -0.922 1097 HE2 LYS 49 HE2 LYS 49 -22.615 3.515 -0.427 1098 HE3 LYS 49 HE1 LYS 49 -21.139 3.125 0.455 1099 HZ1 LYS 49 HZ1 LYS 49 -23.420 4.772 1.351 1100 HZ2 LYS 49 HZ2 LYS 49 -21.946 4.856 2.135 1101 HZ3 LYS 49 HZ3 LYS 49 -22.821 3.395 2.108 1102 H ASP 50 H ASP 50 -19.690 6.892 -4.678 1103 HA ASP 50 HA ASP 50 -20.644 5.473 -7.023 1104 HB2 ASP 50 HB3 ASP 50 -21.449 7.734 -7.696 1105 HB3 ASP 50 HB2 ASP 50 -22.067 7.209 -6.125 1106 H VAL 51 H VAL 51 -17.743 6.663 -6.072 1107 HA VAL 51 HA VAL 51 -16.944 7.986 -8.480 1108 HB VAL 51 HB VAL 51 -15.358 6.926 -6.162 1109 HG11 VAL 51 HG11 VAL 51 -13.749 8.811 -7.179 1110 HG12 VAL 51 HG12 VAL 51 -14.568 8.385 -8.669 1111 HG13 VAL 51 HG13 VAL 51 -13.686 7.152 -7.758 1112 HG21 VAL 51 HG21 VAL 51 -16.094 9.793 -6.843 1113 HG22 VAL 51 HG22 VAL 51 -15.380 9.222 -5.345 1114 HG23 VAL 51 HG23 VAL 51 -17.042 8.796 -5.748 1115 H ASP 52 H ASP 52 -15.924 7.194 -10.175 1116 HA ASP 52 HA ASP 52 -16.238 4.539 -10.967 1117 HB2 ASP 52 HB3 ASP 52 -15.952 6.343 -12.526 1118 HB3 ASP 52 HB2 ASP 52 -14.315 6.634 -11.951 1119 H ALA 53 H ALA 53 -13.423 6.183 -9.694 1120 HA ALA 53 HA ALA 53 -11.467 4.360 -10.166 1121 HB1 ALA 53 HB1 ALA 53 -11.201 6.626 -9.026 1122 HB2 ALA 53 HB2 ALA 53 -10.170 5.326 -8.434 1123 HB3 ALA 53 HB3 ALA 53 -11.599 5.796 -7.521 1124 H VAL 54 H VAL 54 -13.749 4.214 -7.455 1125 HA VAL 54 HA VAL 54 -12.465 2.110 -6.140 1126 HB VAL 54 HB VAL 54 -14.268 3.502 -5.102 1127 HG11 VAL 54 HG11 VAL 54 -16.402 3.548 -5.760 1128 HG12 VAL 54 HG12 VAL 54 -16.472 1.842 -6.095 1129 HG13 VAL 54 HG13 VAL 54 -15.811 2.949 -7.299 1130 HG21 VAL 54 HG21 VAL 54 -15.572 1.373 -4.171 1131 HG22 VAL 54 HG22 VAL 54 -13.910 1.679 -3.724 1132 HG23 VAL 54 HG23 VAL 54 -14.277 0.499 -4.982 1133 H ASP 55 H ASP 55 -14.888 2.079 -8.698 1134 HA ASP 55 HA ASP 55 -15.355 -0.707 -8.827 1135 HB2 ASP 55 HB3 ASP 55 -16.714 1.005 -10.032 1136 HB3 ASP 55 HB2 ASP 55 -15.268 1.301 -11.031 1137 H LYS 56 H LYS 56 -13.147 1.485 -10.456 1138 HA LYS 56 HA LYS 56 -12.004 -0.430 -12.158 1139 HB2 LYS 56 HB3 LYS 56 -10.701 2.101 -11.114 1140 HB3 LYS 56 HB2 LYS 56 -10.220 1.187 -12.542 1141 HG2 LYS 56 HG3 LYS 56 -12.887 2.601 -12.150 1142 HG3 LYS 56 HG2 LYS 56 -11.574 3.088 -13.209 1143 HD2 LYS 56 HD3 LYS 56 -11.860 0.661 -14.228 1144 HD3 LYS 56 HD2 LYS 56 -13.400 0.721 -13.427 1145 HE2 LYS 56 HE2 LYS 56 -13.220 1.587 -15.919 1146 HE3 LYS 56 HE1 LYS 56 -14.298 2.347 -14.782 1147 HZ1 LYS 56 HZ1 LYS 56 -12.843 4.116 -14.416 1148 HZ2 LYS 56 HZ2 LYS 56 -12.786 3.853 -16.089 1149 HZ3 LYS 56 HZ3 LYS 56 -11.506 3.323 -15.119 1150 H VAL 57 H VAL 57 -11.013 0.742 -8.986 1151 HA VAL 57 HA VAL 57 -8.761 -0.981 -8.776 1152 HB VAL 57 HB VAL 57 -10.423 0.334 -6.605 1153 HG11 VAL 57 HG11 VAL 57 -8.521 -0.110 -5.139 1154 HG12 VAL 57 HG12 VAL 57 -7.622 -0.812 -6.482 1155 HG13 VAL 57 HG13 VAL 57 -9.059 -1.620 -5.874 1156 HG21 VAL 57 HG21 VAL 57 -7.735 1.171 -7.729 1157 HG22 VAL 57 HG22 VAL 57 -8.769 2.089 -6.633 1158 HG23 VAL 57 HG23 VAL 57 -9.249 1.859 -8.308 1159 H MET 58 H MET 58 -12.161 -1.199 -7.805 1160 HA MET 58 HA MET 58 -12.098 -3.660 -6.428 1161 HB2 MET 58 HB3 MET 58 -14.191 -2.271 -8.118 1162 HB3 MET 58 HB2 MET 58 -14.502 -3.807 -7.336 1163 HG2 MET 58 HG3 MET 58 -13.313 -1.633 -5.741 1164 HG3 MET 58 HG2 MET 58 -15.027 -1.498 -6.116 1165 HE1 MET 58 HE1 MET 58 -16.493 -4.711 -5.308 1166 HE2 MET 58 HE2 MET 58 -16.514 -3.119 -6.074 1167 HE3 MET 58 HE3 MET 58 -16.924 -3.265 -4.369 1168 H LYS 59 H LYS 59 -12.642 -2.838 -9.806 1169 HA LYS 59 HA LYS 59 -12.866 -5.463 -10.702 1170 HB2 LYS 59 HB3 LYS 59 -13.607 -3.379 -11.835 1171 HB3 LYS 59 HB2 LYS 59 -11.949 -3.160 -12.388 1172 HG2 LYS 59 HG3 LYS 59 -12.244 -4.653 -14.053 1173 HG3 LYS 59 HG2 LYS 59 -12.558 -5.919 -12.900 1174 HD2 LYS 59 HD3 LYS 59 -14.683 -3.959 -13.859 1175 HD3 LYS 59 HD2 LYS 59 -14.413 -5.512 -14.625 1176 HE2 LYS 59 HE2 LYS 59 -15.341 -4.997 -11.785 1177 HE3 LYS 59 HE1 LYS 59 -16.199 -5.832 -13.059 1178 HZ1 LYS 59 HZ1 LYS 59 -14.502 -6.963 -11.168 1179 HZ2 LYS 59 HZ2 LYS 59 -13.720 -7.194 -12.679 1180 HZ3 LYS 59 HZ3 LYS 59 -15.288 -7.708 -12.429 1181 H GLU 60 H GLU 60 -10.166 -3.203 -10.496 1182 HA GLU 60 HA GLU 60 -8.269 -4.767 -11.827 1183 HB2 GLU 60 HB3 GLU 60 -7.983 -2.374 -11.203 1184 HB3 GLU 60 HB2 GLU 60 -7.796 -2.851 -9.519 1185 HG2 GLU 60 HG3 GLU 60 -5.794 -4.101 -10.029 1186 HG3 GLU 60 HG2 GLU 60 -6.023 -3.846 -11.758 1187 H LEU 61 H LEU 61 -9.300 -4.667 -8.461 1188 HA LEU 61 HA LEU 61 -7.594 -6.825 -7.644 1189 HB2 LEU 61 HB3 LEU 61 -9.906 -5.401 -6.391 1190 HB3 LEU 61 HB2 LEU 61 -9.482 -6.987 -5.780 1191 HG LEU 61 HG LEU 61 -8.345 -5.019 -4.626 1192 HD11 LEU 61 HD11 LEU 61 -7.501 -7.176 -4.194 1193 HD12 LEU 61 HD12 LEU 61 -6.104 -6.192 -4.598 1194 HD13 LEU 61 HD13 LEU 61 -6.752 -7.315 -5.786 1195 HD21 LEU 61 HD21 LEU 61 -6.620 -5.015 -7.156 1196 HD22 LEU 61 HD22 LEU 61 -6.375 -4.067 -5.711 1197 HD23 LEU 61 HD23 LEU 61 -7.771 -3.748 -6.724 1198 H ASP 62 H ASP 62 -10.749 -6.591 -9.134 1199 HA ASP 62 HA ASP 62 -11.467 -9.350 -8.844 1200 HB2 ASP 62 HB3 ASP 62 -12.259 -7.209 -10.825 1201 HB3 ASP 62 HB2 ASP 62 -12.677 -8.862 -11.117 1202 H GLU 63 H GLU 63 -9.529 -7.524 -11.138 1203 HA GLU 63 HA GLU 63 -8.945 -9.678 -12.961 1204 HB2 GLU 63 HB3 GLU 63 -7.119 -7.355 -12.195 1205 HB3 GLU 63 HB2 GLU 63 -7.026 -8.358 -13.616 1206 HG2 GLU 63 HG3 GLU 63 -9.424 -6.588 -13.018 1207 HG3 GLU 63 HG2 GLU 63 -8.067 -6.138 -14.035 1208 H ASN 64 H ASN 64 -7.461 -8.394 -10.073 1209 HA ASN 64 HA ASN 64 -5.625 -10.667 -9.799 1210 HB2 ASN 64 HB3 ASN 64 -5.227 -8.180 -8.990 1211 HB3 ASN 64 HB2 ASN 64 -6.222 -8.743 -7.622 1212 HD21 ASN 64 HD21 ASN 64 -3.260 -8.085 -7.603 1213 HD22 ASN 64 HD22 ASN 64 -2.545 -9.525 -7.059 1214 H GLY 65 H GLY 65 -8.409 -11.183 -10.033 1215 HA2 GLY 65 HA3 GLY 65 -9.166 -12.037 -7.336 1216 HA3 GLY 65 HA2 GLY 65 -10.285 -11.776 -8.697 1217 H ASP 66 H ASP 66 -7.282 -13.259 -9.299 1218 HA ASP 66 HA ASP 66 -8.405 -15.575 -10.405 1219 HB2 ASP 66 HB3 ASP 66 -6.194 -14.776 -11.018 1220 HB3 ASP 66 HB2 ASP 66 -5.621 -15.071 -9.379 1221 H GLY 67 H GLY 67 -6.969 -14.920 -7.261 1222 HA2 GLY 67 HA3 GLY 67 -8.635 -16.811 -5.977 1223 HA3 GLY 67 HA2 GLY 67 -7.032 -17.507 -6.170 1224 H GLU 68 H GLU 68 -5.255 -16.397 -5.239 1225 HA GLU 68 HA GLU 68 -5.944 -15.267 -2.643 1226 HB2 GLU 68 HB3 GLU 68 -3.321 -16.204 -3.841 1227 HB3 GLU 68 HB2 GLU 68 -3.529 -15.609 -2.198 1228 HG2 GLU 68 HG3 GLU 68 -5.017 -17.349 -1.606 1229 HG3 GLU 68 HG2 GLU 68 -5.191 -17.925 -3.255 1230 H VAL 69 H VAL 69 -5.031 -13.330 -1.849 1231 HA VAL 69 HA VAL 69 -3.761 -11.566 -3.771 1232 HB VAL 69 HB VAL 69 -5.919 -10.622 -3.696 1233 HG11 VAL 69 HG11 VAL 69 -5.906 -11.145 -0.725 1234 HG12 VAL 69 HG12 VAL 69 -6.922 -11.938 -1.935 1235 HG13 VAL 69 HG13 VAL 69 -7.164 -10.235 -1.553 1236 HG21 VAL 69 HG21 VAL 69 -4.911 -8.611 -3.330 1237 HG22 VAL 69 HG22 VAL 69 -3.858 -9.243 -2.070 1238 HG23 VAL 69 HG23 VAL 69 -5.494 -8.752 -1.686 1239 H ASP 70 H ASP 70 -1.852 -10.833 -2.951 1240 HA ASP 70 HA ASP 70 -1.238 -11.646 -0.213 1241 HB2 ASP 70 HB3 ASP 70 0.811 -12.082 -0.905 1242 HB3 ASP 70 HB2 ASP 70 0.177 -11.859 -2.537 1243 H PHE 71 H PHE 71 0.654 -10.134 0.668 1244 HA PHE 71 HA PHE 71 -0.740 -7.953 1.707 1245 HB2 PHE 71 HB3 PHE 71 1.135 -9.051 2.876 1246 HB3 PHE 71 HB2 PHE 71 2.259 -8.327 1.722 1247 HD1 PHE 71 HD1 PHE 71 -0.547 -7.366 3.980 1248 HD2 PHE 71 HD2 PHE 71 3.215 -6.202 2.247 1249 HE1 PHE 71 HE1 PHE 71 -0.569 -5.298 5.311 1250 HE2 PHE 71 HE2 PHE 71 3.179 -4.126 3.606 1251 HZ PHE 71 HZ PHE 71 1.316 -3.673 5.118 1252 H GLN 72 H GLN 72 1.751 -8.077 -0.819 1253 HA GLN 72 HA GLN 72 1.875 -5.273 -1.252 1254 HB2 GLN 72 HB3 GLN 72 2.597 -7.658 -2.931 1255 HB3 GLN 72 HB2 GLN 72 2.764 -6.009 -3.578 1256 HG2 GLN 72 HG3 GLN 72 4.236 -5.503 -1.641 1257 HG3 GLN 72 HG2 GLN 72 4.027 -7.165 -1.081 1258 HE21 GLN 72 HE21 GLN 72 4.880 -5.552 -4.230 1259 HE22 GLN 72 HE22 GLN 72 6.137 -6.618 -4.577 1260 H GLU 73 H GLU 73 -0.070 -7.847 -2.624 1261 HA GLU 73 HA GLU 73 -1.513 -6.212 -4.473 1262 HB2 GLU 73 HB3 GLU 73 -2.135 -8.879 -3.172 1263 HB3 GLU 73 HB2 GLU 73 -3.103 -8.164 -4.456 1264 HG2 GLU 73 HG3 GLU 73 -1.208 -8.160 -5.982 1265 HG3 GLU 73 HG2 GLU 73 -0.132 -8.693 -4.710 1266 H TYR 74 H TYR 74 -2.062 -7.241 -1.152 1267 HA TYR 74 HA TYR 74 -4.625 -6.115 -0.764 1268 HB2 TYR 74 HB3 TYR 74 -3.824 -7.730 0.795 1269 HB3 TYR 74 HB2 TYR 74 -2.397 -6.782 1.146 1270 HD1 TYR 74 HD1 TYR 74 -6.156 -6.222 1.143 1271 HD2 TYR 74 HD2 TYR 74 -2.399 -5.649 3.185 1272 HE1 TYR 74 HE1 TYR 74 -7.314 -5.096 2.970 1273 HE2 TYR 74 HE2 TYR 74 -3.589 -4.526 5.030 1274 HH TYR 74 HH TYR 74 -6.831 -4.722 5.521 1275 H VAL 75 H VAL 75 -1.414 -4.726 -0.047 1276 HA VAL 75 HA VAL 75 -2.492 -2.413 1.097 1277 HB VAL 75 HB VAL 75 -0.274 -1.379 0.868 1278 HG11 VAL 75 HG11 VAL 75 -0.122 -2.599 2.791 1279 HG12 VAL 75 HG12 VAL 75 0.914 -3.648 1.827 1280 HG13 VAL 75 HG13 VAL 75 -0.769 -4.051 2.031 1281 HG21 VAL 75 HG21 VAL 75 1.190 -2.040 -0.735 1282 HG22 VAL 75 HG22 VAL 75 -0.016 -3.149 -1.360 1283 HG23 VAL 75 HG23 VAL 75 1.113 -3.692 -0.148 1284 H VAL 76 H VAL 76 -1.644 -3.064 -2.279 1285 HA VAL 76 HA VAL 76 -1.928 -0.391 -3.117 1286 HB VAL 76 HB VAL 76 -0.709 -2.007 -4.484 1287 HG11 VAL 76 HG11 VAL 76 -2.116 -3.639 -5.864 1288 HG12 VAL 76 HG12 VAL 76 -3.390 -3.416 -4.675 1289 HG13 VAL 76 HG13 VAL 76 -1.820 -4.052 -4.188 1290 HG21 VAL 76 HG21 VAL 76 -3.174 -1.168 -6.040 1291 HG22 VAL 76 HG22 VAL 76 -1.537 -1.354 -6.633 1292 HG23 VAL 76 HG23 VAL 76 -1.926 -0.019 -5.549 1293 H LEU 77 H LEU 77 -4.222 -3.006 -2.731 1294 HA LEU 77 HA LEU 77 -6.437 -1.836 -4.045 1295 HB2 LEU 77 HB3 LEU 77 -6.471 -4.164 -3.354 1296 HB3 LEU 77 HB2 LEU 77 -6.304 -3.700 -1.670 1297 HG LEU 77 HG LEU 77 -8.503 -2.555 -1.728 1298 HD11 LEU 77 HD11 LEU 77 -8.205 -2.964 -4.620 1299 HD12 LEU 77 HD12 LEU 77 -9.158 -1.795 -3.716 1300 HD13 LEU 77 HD13 LEU 77 -9.792 -3.407 -3.989 1301 HD21 LEU 77 HD21 LEU 77 -9.859 -4.729 -2.421 1302 HD22 LEU 77 HD22 LEU 77 -8.843 -4.683 -0.994 1303 HD23 LEU 77 HD23 LEU 77 -8.241 -5.447 -2.473 1304 H VAL 78 H VAL 78 -5.429 -1.731 -0.644 1305 HA VAL 78 HA VAL 78 -7.475 0.152 0.025 1306 HB VAL 78 HB VAL 78 -6.387 0.356 2.204 1307 HG11 VAL 78 HG11 VAL 78 -6.014 -2.447 2.241 1308 HG12 VAL 78 HG12 VAL 78 -7.158 -2.180 0.955 1309 HG13 VAL 78 HG13 VAL 78 -7.496 -1.575 2.588 1310 HG21 VAL 78 HG21 VAL 78 -4.300 -0.860 2.679 1311 HG22 VAL 78 HG22 VAL 78 -3.996 0.305 1.389 1312 HG23 VAL 78 HG23 VAL 78 -4.240 -1.409 1.015 1313 H ALA 79 H ALA 79 -4.081 0.401 -0.819 1314 HA ALA 79 HA ALA 79 -3.797 3.184 -0.380 1315 HB1 ALA 79 HB1 ALA 79 -1.916 1.507 -0.825 1316 HB2 ALA 79 HB2 ALA 79 -1.829 3.073 -1.638 1317 HB3 ALA 79 HB3 ALA 79 -2.361 1.656 -2.529 1318 H ALA 80 H ALA 80 -4.624 1.399 -3.345 1319 HA ALA 80 HA ALA 80 -4.786 3.623 -5.002 1320 HB1 ALA 80 HB1 ALA 80 -6.438 1.087 -5.207 1321 HB2 ALA 80 HB2 ALA 80 -4.800 1.336 -5.850 1322 HB3 ALA 80 HB3 ALA 80 -6.128 2.268 -6.482 1323 H LEU 81 H LEU 81 -7.291 2.038 -3.070 1324 HA LEU 81 HA LEU 81 -9.387 3.850 -3.708 1325 HB2 LEU 81 HB3 LEU 81 -8.923 2.094 -1.293 1326 HB3 LEU 81 HB2 LEU 81 -10.411 3.001 -1.585 1327 HG LEU 81 HG LEU 81 -9.243 0.959 -3.499 1328 HD11 LEU 81 HD11 LEU 81 -11.207 0.708 -1.258 1329 HD12 LEU 81 HD12 LEU 81 -9.959 -0.409 -1.813 1330 HD13 LEU 81 HD13 LEU 81 -11.456 -0.235 -2.730 1331 HD21 LEU 81 HD21 LEU 81 -11.708 1.115 -4.333 1332 HD22 LEU 81 HD22 LEU 81 -10.601 2.385 -4.803 1333 HD23 LEU 81 HD23 LEU 81 -11.749 2.658 -3.482 1334 H THR 82 H THR 82 -6.943 3.760 -1.138 1335 HA THR 82 HA THR 82 -7.880 5.957 0.319 1336 HB THR 82 HB THR 82 -5.013 5.007 -0.025 1337 HG1 THR 82 HG2 THR 82 -6.417 3.410 0.773 1338 HG21 THR 82 HG21 THR 82 -4.392 6.376 1.714 1339 HG22 THR 82 HG22 THR 82 -5.964 6.290 2.481 1340 HG23 THR 82 HG23 THR 82 -5.719 7.367 1.113 1341 H VAL 83 H VAL 83 -5.378 5.812 -2.242 1342 HA VAL 83 HA VAL 83 -4.991 8.609 -2.346 1343 HB VAL 83 HB VAL 83 -3.318 7.105 -3.258 1344 HG11 VAL 83 HG11 VAL 83 -5.274 6.566 -5.509 1345 HG12 VAL 83 HG12 VAL 83 -4.950 5.452 -4.171 1346 HG13 VAL 83 HG13 VAL 83 -3.671 5.874 -5.295 1347 HG21 VAL 83 HG21 VAL 83 -4.358 8.613 -5.645 1348 HG22 VAL 83 HG22 VAL 83 -2.698 8.416 -5.107 1349 HG23 VAL 83 HG23 VAL 83 -3.793 9.491 -4.227 1350 H ALA 84 H ALA 84 -7.108 6.439 -4.185 1351 HA ALA 84 HA ALA 84 -7.970 8.184 -6.128 1352 HB1 ALA 84 HB1 ALA 84 -10.214 6.938 -5.898 1353 HB2 ALA 84 HB2 ALA 84 -9.412 5.989 -4.653 1354 HB3 ALA 84 HB3 ALA 84 -8.794 5.977 -6.299 1355 H MET 85 H MET 85 -9.401 7.680 -2.930 1356 HA MET 85 HA MET 85 -11.189 9.917 -3.136 1357 HB2 MET 85 HB3 MET 85 -11.447 7.900 -1.563 1358 HB3 MET 85 HB2 MET 85 -10.173 8.675 -0.623 1359 HG2 MET 85 HG3 MET 85 -11.535 10.746 -0.424 1360 HG3 MET 85 HG2 MET 85 -12.818 9.969 -1.319 1361 HE1 MET 85 HE1 MET 85 -11.823 10.629 2.446 1362 HE2 MET 85 HE2 MET 85 -10.504 9.984 1.477 1363 HE3 MET 85 HE3 MET 85 -11.191 9.009 2.772 1364 H ASN 86 H ASN 86 -8.075 9.332 -1.508 1365 HA ASN 86 HA ASN 86 -7.945 11.822 -0.254 1366 HB2 ASN 86 HB3 ASN 86 -6.440 9.713 0.129 1367 HB3 ASN 86 HB2 ASN 86 -5.399 10.460 -1.089 1368 HD21 ASN 86 HD21 ASN 86 -7.254 11.575 1.811 1369 HD22 ASN 86 HD22 ASN 86 -5.983 12.509 2.420 1370 H ASN 87 H ASN 87 -6.964 10.846 -3.461 1371 HA ASN 87 HA ASN 87 -5.551 13.155 -4.178 1372 HB2 ASN 87 HB3 ASN 87 -5.549 11.178 -5.608 1373 HB3 ASN 87 HB2 ASN 87 -7.272 11.343 -5.888 1374 HD21 ASN 87 HD21 ASN 87 -5.597 14.403 -5.752 1375 HD22 ASN 87 HD22 ASN 87 -5.543 14.650 -7.425 1376 H PHE 88 H PHE 88 -9.002 12.434 -4.118 1377 HA PHE 88 HA PHE 88 -9.814 14.947 -5.194 1378 HB2 PHE 88 HB3 PHE 88 -11.308 12.974 -3.429 1379 HB3 PHE 88 HB2 PHE 88 -11.984 14.486 -4.007 1380 HD1 PHE 88 HD2 PHE 88 -12.041 14.943 -6.525 1381 HD2 PHE 88 HD1 PHE 88 -11.281 11.066 -4.850 1382 HE1 PHE 88 HE2 PHE 88 -12.614 13.896 -8.681 1383 HE2 PHE 88 HE1 PHE 88 -11.860 10.016 -7.027 1384 HZ PHE 88 HZ PHE 88 -12.527 11.434 -8.938 1385 H PHE 89 H PHE 89 -8.996 13.781 -2.001 1386 HA PHE 89 HA PHE 89 -9.788 16.114 -0.572 1387 HB2 PHE 89 HB3 PHE 89 -7.909 13.861 0.078 1388 HB3 PHE 89 HB2 PHE 89 -7.812 15.335 1.005 1389 HD1 PHE 89 HD2 PHE 89 -10.409 12.926 -0.286 1390 HD2 PHE 89 HD1 PHE 89 -9.229 15.658 2.827 1391 HE1 PHE 89 HE2 PHE 89 -12.399 12.285 1.040 1392 HE2 PHE 89 HE1 PHE 89 -11.206 15.020 4.135 1393 HZ PHE 89 HZ PHE 89 -12.803 13.334 3.256 1394 H TRP 90 H TRP 90 -6.811 15.290 -2.253 1395 HA TRP 90 HA TRP 90 -5.367 17.668 -1.462 1396 HB2 TRP 90 HB3 TRP 90 -5.002 16.297 -4.128 1397 HB3 TRP 90 HB2 TRP 90 -3.809 17.121 -3.141 1398 HD1 TRP 90 HD TRP 90 -4.981 15.475 -0.460 1399 HE1 TRP 90 HE1 TRP 90 -4.068 13.078 -0.159 1400 HE3 TRP 90 HE3 TRP 90 -3.348 14.534 -5.167 1401 HZ2 TRP 90 HZ2 TRP 90 -2.788 11.052 -1.682 1402 HZ3 TRP 90 HZ3 TRP 90 -2.270 12.359 -5.739 1403 HH2 TRP 90 HH TRP 90 -1.998 10.616 -3.989 1404 H GLU 91 H GLU 91 -7.123 16.739 -4.304 1405 HA GLU 91 HA GLU 91 -6.928 19.271 -5.618 1406 HB2 GLU 91 HB3 GLU 91 -8.709 16.916 -6.028 1407 HB3 GLU 91 HB2 GLU 91 -8.659 18.272 -7.166 1408 HG2 GLU 91 HG3 GLU 91 -6.172 17.920 -7.437 1409 HG3 GLU 91 HG2 GLU 91 -6.258 16.614 -6.311 1410 H ASN 92 H ASN 92 -9.575 17.717 -3.848 1411 HA ASN 92 HA ASN 92 -11.007 20.295 -3.686 1412 HB2 ASN 92 HB3 ASN 92 -12.352 18.306 -4.431 1413 HB3 ASN 92 HB2 ASN 92 -11.935 17.514 -2.916 1414 HD21 ASN 92 HD21 ASN 92 -14.070 17.514 -1.987 1415 HD22 ASN 92 HD22 ASN 92 -14.860 18.953 -1.573 1416 H SER 93 H SER 93 -9.926 21.309 -2.107 1417 HA SER 93 HA SER 93 -9.642 19.921 0.474 1418 HB2 SER 93 HB3 SER 93 -7.512 20.146 -0.883 1419 HB3 SER 93 HB2 SER 93 -7.715 21.877 -0.713 1420 HG SER 93 HG SER 93 -8.016 21.224 1.653 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -12.274 5.603 8.014 2 HA2 GLY 1 HA3 GLY 1 -13.191 2.920 8.641 3 HA3 GLY 1 HA2 GLY 1 -11.751 3.387 7.767 4 H SER 2 H SER 2 -11.129 1.526 9.297 5 HA SER 2 HA SER 2 -10.528 2.352 12.024 6 HB2 SER 2 HB3 SER 2 -9.399 -0.168 10.952 7 HB3 SER 2 HB2 SER 2 -10.202 0.158 12.472 8 HG SER 2 HG SER 2 -11.141 -1.004 10.427 9 H GLU 3 H GLU 3 -8.149 1.270 12.608 10 HA GLU 3 HA GLU 3 -6.236 3.122 12.179 11 HB2 GLU 3 HB3 GLU 3 -5.753 0.135 12.359 12 HB3 GLU 3 HB2 GLU 3 -4.579 1.408 12.683 13 HG2 GLU 3 HG3 GLU 3 -5.320 0.903 14.776 14 HG3 GLU 3 HG2 GLU 3 -6.336 2.292 14.411 15 H LEU 4 H LEU 4 -7.373 0.811 9.915 16 HA LEU 4 HA LEU 4 -5.166 0.548 8.188 17 HB2 LEU 4 HB3 LEU 4 -8.159 0.384 7.750 18 HB3 LEU 4 HB2 LEU 4 -7.061 0.238 6.410 19 HG LEU 4 HG LEU 4 -7.566 -2.000 7.191 20 HD11 LEU 4 HD11 LEU 4 -5.172 -1.292 6.579 21 HD12 LEU 4 HD12 LEU 4 -5.473 -2.870 7.281 22 HD13 LEU 4 HD13 LEU 4 -4.808 -1.585 8.285 23 HD21 LEU 4 HD21 LEU 4 -6.374 -1.397 9.914 24 HD22 LEU 4 HD22 LEU 4 -7.388 -2.735 9.390 25 HD23 LEU 4 HD23 LEU 4 -8.102 -1.168 9.606 26 H GLU 5 H GLU 5 -7.814 2.923 8.294 27 HA GLU 5 HA GLU 5 -6.844 4.361 6.019 28 HB2 GLU 5 HB3 GLU 5 -8.773 5.162 8.217 29 HB3 GLU 5 HB2 GLU 5 -8.405 6.182 6.838 30 HG2 GLU 5 HG3 GLU 5 -9.043 4.293 5.332 31 HG3 GLU 5 HG2 GLU 5 -9.518 3.373 6.724 32 H THR 6 H THR 6 -6.410 4.794 9.514 33 HA THR 6 HA THR 6 -4.853 7.138 9.367 34 HB THR 6 HB THR 6 -4.440 4.919 11.380 35 HG1 THR 6 HG2 THR 6 -6.209 5.732 12.450 36 HG21 THR 6 HG21 THR 6 -4.264 7.942 11.507 37 HG22 THR 6 HG22 THR 6 -2.911 6.821 11.551 38 HG23 THR 6 HG23 THR 6 -4.043 6.872 12.888 39 H ALA 7 H ALA 7 -3.972 3.689 9.301 40 HA ALA 7 HA ALA 7 -1.185 4.021 9.103 41 HB1 ALA 7 HB1 ALA 7 -1.231 1.755 7.982 42 HB2 ALA 7 HB2 ALA 7 -2.988 1.826 8.022 43 HB3 ALA 7 HB3 ALA 7 -2.070 1.827 9.533 44 H MET 8 H MET 8 -3.645 3.700 6.555 45 HA MET 8 HA MET 8 -1.828 4.134 4.415 46 HB2 MET 8 HB3 MET 8 -4.800 4.597 4.543 47 HB3 MET 8 HB2 MET 8 -3.869 4.627 3.062 48 HG2 MET 8 HG3 MET 8 -4.231 2.237 4.918 49 HG3 MET 8 HG2 MET 8 -4.835 2.402 3.278 50 HE1 MET 8 HE1 MET 8 -3.511 3.132 1.483 51 HE2 MET 8 HE2 MET 8 -2.250 2.032 0.923 52 HE3 MET 8 HE3 MET 8 -1.789 3.563 1.648 53 H GLU 9 H GLU 9 -3.929 6.367 6.262 54 HA GLU 9 HA GLU 9 -3.222 8.571 4.710 55 HB2 GLU 9 HB3 GLU 9 -4.285 8.454 7.533 56 HB3 GLU 9 HB2 GLU 9 -3.938 9.979 6.724 57 HG2 GLU 9 HG3 GLU 9 -5.444 9.242 4.835 58 HG3 GLU 9 HG2 GLU 9 -5.887 7.835 5.793 59 H THR 10 H THR 10 -1.713 7.096 7.484 60 HA THR 10 HA THR 10 0.213 9.123 7.985 61 HB THR 10 HB THR 10 0.666 6.132 8.270 62 HG1 THR 10 HG2 THR 10 -1.339 6.896 9.256 63 HG21 THR 10 HG21 THR 10 2.421 8.190 8.714 64 HG22 THR 10 HG22 THR 10 2.449 6.668 9.592 65 HG23 THR 10 HG23 THR 10 1.664 8.063 10.292 66 H LEU 11 H LEU 11 0.188 6.352 5.773 67 HA LEU 11 HA LEU 11 2.707 6.926 4.615 68 HB2 LEU 11 HB3 LEU 11 0.283 5.419 3.596 69 HB3 LEU 11 HB2 LEU 11 1.786 5.522 2.679 70 HG LEU 11 HG LEU 11 1.643 4.476 5.530 71 HD11 LEU 11 HD11 LEU 11 1.368 2.350 4.800 72 HD12 LEU 11 HD12 LEU 11 2.005 2.659 3.194 73 HD13 LEU 11 HD13 LEU 11 0.361 3.159 3.610 74 HD21 LEU 11 HD21 LEU 11 3.719 4.038 3.361 75 HD22 LEU 11 HD22 LEU 11 3.845 3.599 5.058 76 HD23 LEU 11 HD23 LEU 11 3.908 5.290 4.593 77 H ILE 12 H ILE 12 -0.604 7.945 3.863 78 HA ILE 12 HA ILE 12 -0.030 9.336 1.463 79 HB ILE 12 HB ILE 12 -2.189 9.877 3.544 80 HG12 ILE 12 HG13 ILE 12 -2.177 7.598 2.273 81 HG13 ILE 12 HG12 ILE 12 -3.640 8.576 2.143 82 HG21 ILE 12 HG21 ILE 12 -3.309 10.983 1.565 83 HG22 ILE 12 HG22 ILE 12 -1.699 11.045 0.835 84 HG23 ILE 12 HG23 ILE 12 -2.006 11.865 2.367 85 HD11 ILE 12 HD11 ILE 12 -1.408 8.623 0.071 86 HD12 ILE 12 HD12 ILE 12 -3.019 9.354 -0.048 87 HD13 ILE 12 HD13 ILE 12 -2.841 7.612 -0.022 88 H ASN 13 H ASN 13 -0.110 10.399 4.821 89 HA ASN 13 HA ASN 13 0.291 13.149 4.382 90 HB2 ASN 13 HB3 ASN 13 0.981 11.355 6.686 91 HB3 ASN 13 HB2 ASN 13 1.260 13.088 6.731 92 HD21 ASN 13 HD21 ASN 13 -0.999 10.822 7.593 93 HD22 ASN 13 HD22 ASN 13 -2.404 11.782 7.573 94 H VAL 14 H VAL 14 2.650 10.554 4.964 95 HA VAL 14 HA VAL 14 4.968 12.188 4.811 96 HB VAL 14 HB VAL 14 4.594 9.234 4.236 97 HG11 VAL 14 HG11 VAL 14 6.695 10.141 3.230 98 HG12 VAL 14 HG12 VAL 14 7.012 9.026 4.548 99 HG13 VAL 14 HG13 VAL 14 7.166 10.753 4.815 100 HG21 VAL 14 HG21 VAL 14 5.630 10.627 6.749 101 HG22 VAL 14 HG22 VAL 14 5.325 8.903 6.537 102 HG23 VAL 14 HG23 VAL 14 3.984 10.038 6.551 103 H PHE 15 H PHE 15 3.183 10.266 2.441 104 HA PHE 15 HA PHE 15 4.826 10.744 0.210 105 HB2 PHE 15 HB3 PHE 15 3.050 9.051 0.260 106 HB3 PHE 15 HB2 PHE 15 1.827 10.307 0.298 107 HD1 PHE 15 HD1 PHE 15 4.564 8.827 -1.735 108 HD2 PHE 15 HD2 PHE 15 1.184 11.500 -1.704 109 HE1 PHE 15 HE1 PHE 15 4.644 8.982 -4.199 110 HE2 PHE 15 HE2 PHE 15 1.286 11.638 -4.162 111 HZ PHE 15 HZ PHE 15 3.016 10.388 -5.411 112 H HIS 16 H HIS 16 1.966 12.467 1.383 113 HA HIS 16 HA HIS 16 2.106 14.526 -0.591 114 HB2 HIS 16 HB3 HIS 16 0.545 14.120 1.916 115 HB3 HIS 16 HB2 HIS 16 0.775 15.777 1.385 116 HD1 HIS 16 HD1 HIS 16 -0.755 16.615 -0.405 117 HD2 HIS 16 HD2 HIS 16 -0.603 12.431 -0.350 118 HE1 HIS 16 HE1 HIS 16 -2.507 15.804 -2.051 119 HE2 HIS 16 HE2 HIS 16 -2.416 13.280 -2.073 120 H ALA 17 H ALA 17 3.438 14.203 2.677 121 HA ALA 17 HA ALA 17 4.423 16.842 2.886 122 HB1 ALA 17 HB1 ALA 17 5.798 14.404 4.080 123 HB2 ALA 17 HB2 ALA 17 4.360 15.152 4.789 124 HB3 ALA 17 HB3 ALA 17 5.844 16.076 4.630 125 H HIS 18 H HIS 18 5.818 13.938 1.462 126 HA HIS 18 HA HIS 18 8.179 15.401 0.678 127 HB2 HIS 18 HB3 HIS 18 7.337 12.536 0.198 128 HB3 HIS 18 HB2 HIS 18 8.715 13.315 -0.598 129 HD1 HIS 18 HD1 HIS 18 10.880 13.526 0.660 130 HD2 HIS 18 HD2 HIS 18 7.650 12.590 3.162 131 HE1 HIS 18 HE1 HIS 18 11.835 13.157 2.970 132 HE2 HIS 18 HE2 HIS 18 9.897 12.571 4.498 133 H SER 19 H SER 19 5.068 14.980 -0.620 134 HA SER 19 HA SER 19 5.650 15.011 -3.378 135 HB2 SER 19 HB3 SER 19 3.265 16.309 -1.972 136 HB3 SER 19 HB2 SER 19 3.431 16.017 -3.685 137 HG SER 19 HG SER 19 3.812 13.853 -1.893 138 H GLY 20 H GLY 20 5.524 17.570 -0.996 139 HA2 GLY 20 HA3 GLY 20 5.722 19.827 -2.637 140 HA3 GLY 20 HA2 GLY 20 6.344 19.720 -0.988 141 H LYS 21 H LYS 21 8.030 17.362 -2.011 142 HA LYS 21 HA LYS 21 10.444 18.799 -2.298 143 HB2 LYS 21 HB3 LYS 21 9.832 15.926 -3.080 144 HB3 LYS 21 HB2 LYS 21 11.432 16.606 -2.870 145 HG2 LYS 21 HG3 LYS 21 9.340 16.599 -0.693 146 HG3 LYS 21 HG2 LYS 21 10.568 15.356 -0.819 147 HD2 LYS 21 HD3 LYS 21 12.299 17.177 -0.631 148 HD3 LYS 21 HD2 LYS 21 10.989 18.325 -0.396 149 HE2 LYS 21 HE2 LYS 21 11.408 17.837 1.779 150 HE3 LYS 21 HE1 LYS 21 10.221 16.598 1.453 151 HZ1 LYS 21 HZ1 LYS 21 12.249 15.129 0.768 152 HZ2 LYS 21 HZ2 LYS 21 11.972 15.442 2.424 153 HZ3 LYS 21 HZ3 LYS 21 13.151 16.294 1.604 154 H GLU 22 H GLU 22 8.388 17.249 -4.727 155 HA GLU 22 HA GLU 22 9.324 19.061 -6.766 156 HB2 GLU 22 HB3 GLU 22 11.126 17.111 -6.618 157 HB3 GLU 22 HB2 GLU 22 9.850 16.177 -7.383 158 HG2 GLU 22 HG3 GLU 22 9.715 17.979 -9.192 159 HG3 GLU 22 HG2 GLU 22 11.131 18.691 -8.448 160 H GLY 23 H GLY 23 6.986 17.042 -5.463 161 HA2 GLY 23 HA3 GLY 23 5.802 15.809 -7.631 162 HA3 GLY 23 HA2 GLY 23 4.984 16.276 -6.141 163 H ASP 24 H ASP 24 4.184 16.402 -9.096 164 HA ASP 24 HA ASP 24 3.947 19.048 -9.974 165 HB2 ASP 24 HB3 ASP 24 3.436 16.974 -11.311 166 HB3 ASP 24 HB2 ASP 24 1.967 16.817 -10.353 167 H LYS 25 H LYS 25 1.811 17.001 -8.133 168 HA LYS 25 HA LYS 25 0.743 19.260 -6.606 169 HB2 LYS 25 HB3 LYS 25 -1.437 17.454 -6.930 170 HB3 LYS 25 HB2 LYS 25 -1.363 19.138 -7.396 171 HG2 LYS 25 HG3 LYS 25 -0.415 18.528 -9.590 172 HG3 LYS 25 HG2 LYS 25 -0.337 16.854 -9.098 173 HD2 LYS 25 HD3 LYS 25 -2.341 17.451 -10.549 174 HD3 LYS 25 HD2 LYS 25 -2.679 16.557 -9.074 175 HE2 LYS 25 HE2 LYS 25 -4.229 18.540 -9.466 176 HE3 LYS 25 HE1 LYS 25 -3.369 18.527 -7.926 177 HZ1 LYS 25 HZ1 LYS 25 -2.899 20.218 -10.285 178 HZ2 LYS 25 HZ2 LYS 25 -1.634 20.001 -9.193 179 HZ3 LYS 25 HZ3 LYS 25 -3.115 20.676 -8.686 180 H TYR 26 H TYR 26 -0.113 15.883 -7.045 181 HA TYR 26 HA TYR 26 1.114 15.324 -4.463 182 HB2 TYR 26 HB3 TYR 26 -1.181 13.593 -5.273 183 HB3 TYR 26 HB2 TYR 26 -0.741 14.220 -3.687 184 HD1 TYR 26 HD1 TYR 26 -0.804 16.953 -3.601 185 HD2 TYR 26 HD2 TYR 26 -3.158 14.446 -6.195 186 HE1 TYR 26 HE1 TYR 26 -2.432 18.778 -3.905 187 HE2 TYR 26 HE2 TYR 26 -4.774 16.262 -6.472 188 HH TYR 26 HH TYR 26 -4.090 19.470 -5.507 189 H LYS 27 H LYS 27 2.966 14.650 -5.448 190 HA LYS 27 HA LYS 27 2.999 12.004 -6.542 191 HB2 LYS 27 HB3 LYS 27 4.197 14.259 -8.231 192 HB3 LYS 27 HB2 LYS 27 4.281 12.520 -8.512 193 HG2 LYS 27 HG3 LYS 27 1.629 13.994 -8.433 194 HG3 LYS 27 HG2 LYS 27 2.593 13.838 -9.866 195 HD2 LYS 27 HD3 LYS 27 2.110 11.253 -8.382 196 HD3 LYS 27 HD2 LYS 27 0.753 11.948 -9.248 197 HE2 LYS 27 HE2 LYS 27 3.435 11.121 -10.351 198 HE3 LYS 27 HE1 LYS 27 1.855 10.519 -10.810 199 HZ1 LYS 27 HZ1 LYS 27 1.512 13.117 -11.411 200 HZ2 LYS 27 HZ2 LYS 27 2.232 12.021 -12.484 201 HZ3 LYS 27 HZ3 LYS 27 3.203 13.016 -11.548 202 H LEU 28 H LEU 28 5.233 11.215 -6.473 203 HA LEU 28 HA LEU 28 7.004 12.951 -4.900 204 HB2 LEU 28 HB3 LEU 28 6.006 11.266 -3.524 205 HB3 LEU 28 HB2 LEU 28 6.427 9.985 -4.640 206 HG LEU 28 HG LEU 28 8.882 10.672 -4.287 207 HD11 LEU 28 HD11 LEU 28 7.440 12.407 -2.307 208 HD12 LEU 28 HD12 LEU 28 8.789 12.834 -3.363 209 HD13 LEU 28 HD13 LEU 28 9.046 11.790 -1.950 210 HD21 LEU 28 HD21 LEU 28 7.631 9.912 -1.681 211 HD22 LEU 28 HD22 LEU 28 9.052 9.208 -2.466 212 HD23 LEU 28 HD23 LEU 28 7.439 8.814 -3.042 213 H SER 29 H SER 29 9.111 13.115 -5.787 214 HA SER 29 HA SER 29 9.557 11.639 -8.239 215 HB2 SER 29 HB3 SER 29 11.762 12.944 -8.254 216 HB3 SER 29 HB2 SER 29 10.248 13.821 -8.416 217 HG SER 29 HG SER 29 11.319 14.909 -6.873 218 H LYS 30 H LYS 30 11.572 10.370 -8.585 219 HA LYS 30 HA LYS 30 11.661 8.442 -6.498 220 HB2 LYS 30 HB3 LYS 30 13.619 8.570 -8.802 221 HB3 LYS 30 HB2 LYS 30 13.224 7.181 -7.828 222 HG2 LYS 30 HG3 LYS 30 11.430 8.643 -9.739 223 HG3 LYS 30 HG2 LYS 30 12.078 7.012 -9.928 224 HD2 LYS 30 HD3 LYS 30 10.713 7.037 -7.398 225 HD3 LYS 30 HD2 LYS 30 9.658 7.817 -8.579 226 HE2 LYS 30 HE2 LYS 30 10.963 5.275 -9.413 227 HE3 LYS 30 HE1 LYS 30 9.812 5.135 -8.141 228 HZ1 LYS 30 HZ1 LYS 30 8.577 6.839 -10.111 229 HZ2 LYS 30 HZ2 LYS 30 8.072 5.379 -9.514 230 HZ3 LYS 30 HZ3 LYS 30 9.053 5.412 -10.846 231 H LYS 31 H LYS 31 13.200 11.312 -6.732 232 HA LYS 31 HA LYS 31 15.815 10.799 -5.678 233 HB2 LYS 31 HB3 LYS 31 14.277 13.268 -4.909 234 HB3 LYS 31 HB2 LYS 31 15.961 13.069 -5.389 235 HG2 LYS 31 HG3 LYS 31 15.292 12.690 -7.738 236 HG3 LYS 31 HG2 LYS 31 13.609 12.777 -7.259 237 HD2 LYS 31 HD3 LYS 31 13.911 15.067 -6.542 238 HD3 LYS 31 HD2 LYS 31 15.602 15.035 -7.078 239 HE2 LYS 31 HE2 LYS 31 14.462 14.086 -9.302 240 HE3 LYS 31 HE1 LYS 31 13.074 14.852 -8.642 241 HZ1 LYS 31 HZ1 LYS 31 15.340 16.177 -9.809 242 HZ2 LYS 31 HZ2 LYS 31 14.986 16.766 -8.284 243 HZ3 LYS 31 HZ3 LYS 31 13.778 16.762 -9.494 244 H GLU 32 H GLU 32 12.791 11.832 -4.325 245 HA GLU 32 HA GLU 32 13.499 11.598 -1.583 246 HB2 GLU 32 HB3 GLU 32 10.865 11.761 -3.001 247 HB3 GLU 32 HB2 GLU 32 11.092 11.929 -1.251 248 HG2 GLU 32 HG3 GLU 32 12.430 13.732 -3.319 249 HG3 GLU 32 HG2 GLU 32 10.968 14.142 -2.454 250 H LEU 33 H LEU 33 12.001 9.557 -3.979 251 HA LEU 33 HA LEU 33 10.725 7.773 -2.308 252 HB2 LEU 33 HB3 LEU 33 10.458 7.822 -4.759 253 HB3 LEU 33 HB2 LEU 33 12.022 7.088 -5.005 254 HG LEU 33 HG LEU 33 9.966 5.561 -5.076 255 HD11 LEU 33 HD11 LEU 33 12.514 5.001 -4.654 256 HD12 LEU 33 HD12 LEU 33 11.275 3.763 -4.502 257 HD13 LEU 33 HD13 LEU 33 11.911 4.553 -3.056 258 HD21 LEU 33 HD21 LEU 33 9.014 6.554 -2.882 259 HD22 LEU 33 HD22 LEU 33 10.246 5.579 -2.057 260 HD23 LEU 33 HD23 LEU 33 9.014 4.797 -3.038 261 H LYS 34 H LYS 34 14.001 7.529 -3.655 262 HA LYS 34 HA LYS 34 14.693 5.291 -2.007 263 HB2 LYS 34 HB3 LYS 34 16.390 7.163 -3.680 264 HB3 LYS 34 HB2 LYS 34 17.055 5.801 -2.766 265 HG2 LYS 34 HG3 LYS 34 15.566 4.239 -3.913 266 HG3 LYS 34 HG2 LYS 34 14.854 5.547 -4.849 267 HD2 LYS 34 HD3 LYS 34 17.079 5.996 -5.871 268 HD3 LYS 34 HD2 LYS 34 17.765 4.649 -4.962 269 HE2 LYS 34 HE2 LYS 34 16.149 3.093 -6.074 270 HE3 LYS 34 HE1 LYS 34 15.501 4.461 -6.962 271 HZ1 LYS 34 HZ1 LYS 34 17.527 4.704 -8.156 272 HZ2 LYS 34 HZ2 LYS 34 17.130 3.081 -8.168 273 HZ3 LYS 34 HZ3 LYS 34 18.363 3.639 -7.135 274 H GLU 35 H GLU 35 15.204 8.768 -1.777 275 HA GLU 35 HA GLU 35 16.890 8.650 0.498 276 HB2 GLU 35 HB3 GLU 35 15.246 10.896 -0.682 277 HB3 GLU 35 HB2 GLU 35 16.381 11.103 0.657 278 HG2 GLU 35 HG3 GLU 35 18.222 10.237 -0.742 279 HG3 GLU 35 HG2 GLU 35 17.111 9.938 -2.058 280 H LEU 36 H LEU 36 13.378 9.149 0.202 281 HA LEU 36 HA LEU 36 13.087 9.481 3.050 282 HB2 LEU 36 HB3 LEU 36 11.092 10.350 2.585 283 HB3 LEU 36 HB2 LEU 36 11.604 10.356 0.915 284 HG LEU 36 HG LEU 36 10.650 7.877 0.902 285 HD11 LEU 36 HD11 LEU 36 10.000 8.739 3.550 286 HD12 LEU 36 HD12 LEU 36 9.580 7.231 2.769 287 HD13 LEU 36 HD13 LEU 36 8.496 8.614 2.646 288 HD21 LEU 36 HD21 LEU 36 8.529 8.735 0.172 289 HD22 LEU 36 HD22 LEU 36 9.814 9.837 -0.350 290 HD23 LEU 36 HD23 LEU 36 8.785 10.268 1.028 291 H LEU 37 H LEU 37 12.493 6.877 0.775 292 HA LEU 37 HA LEU 37 11.026 5.287 2.520 293 HB2 LEU 37 HB3 LEU 37 11.122 4.802 0.136 294 HB3 LEU 37 HB2 LEU 37 12.830 4.411 0.230 295 HG LEU 37 HG LEU 37 11.173 2.435 0.182 296 HD11 LEU 37 HD11 LEU 37 12.779 2.059 2.631 297 HD12 LEU 37 HD12 LEU 37 13.658 2.596 1.195 298 HD13 LEU 37 HD13 LEU 37 12.702 1.129 1.138 299 HD21 LEU 37 HD21 LEU 37 9.947 1.882 2.095 300 HD22 LEU 37 HD22 LEU 37 9.708 3.619 1.962 301 HD23 LEU 37 HD23 LEU 37 10.869 2.973 3.127 302 H GLN 38 H GLN 38 14.484 5.398 1.946 303 HA GLN 38 HA GLN 38 15.217 3.286 3.628 304 HB2 GLN 38 HB3 GLN 38 17.435 4.289 3.675 305 HB3 GLN 38 HB2 GLN 38 16.784 4.343 2.046 306 HG2 GLN 38 HG3 GLN 38 16.036 6.688 2.449 307 HG3 GLN 38 HG2 GLN 38 16.806 6.672 4.027 308 HE21 GLN 38 HE21 GLN 38 17.446 6.468 0.530 309 HE22 GLN 38 HE22 GLN 38 19.075 6.937 0.658 310 H THR 39 H THR 39 14.719 6.713 4.289 311 HA THR 39 HA THR 39 15.574 6.694 6.941 312 HB THR 39 HB THR 39 13.703 8.678 6.820 313 HG1 THR 39 HG2 THR 39 13.138 8.112 4.685 314 HG21 THR 39 HG21 THR 39 16.383 8.834 5.518 315 HG22 THR 39 HG22 THR 39 16.152 8.722 7.287 316 HG23 THR 39 HG23 THR 39 15.476 10.094 6.381 317 H GLU 40 H GLU 40 12.285 6.542 5.573 318 HA GLU 40 HA GLU 40 11.144 6.459 8.083 319 HB2 GLU 40 HB3 GLU 40 9.958 5.795 5.391 320 HB3 GLU 40 HB2 GLU 40 9.018 5.950 6.885 321 HG2 GLU 40 HG3 GLU 40 10.809 8.090 5.728 322 HG3 GLU 40 HG2 GLU 40 9.042 8.063 5.598 323 H LEU 41 H LEU 41 11.920 3.871 5.820 324 HA LEU 41 HA LEU 41 10.927 1.872 7.754 325 HB2 LEU 41 HB3 LEU 41 11.310 1.786 4.778 326 HB3 LEU 41 HB2 LEU 41 11.312 0.327 5.705 327 HG LEU 41 HG LEU 41 9.092 0.908 6.712 328 HD11 LEU 41 HD11 LEU 41 8.867 3.214 6.589 329 HD12 LEU 41 HD12 LEU 41 7.827 2.683 5.275 330 HD13 LEU 41 HD13 LEU 41 9.437 3.299 4.920 331 HD21 LEU 41 HD21 LEU 41 7.885 0.061 4.898 332 HD22 LEU 41 HD22 LEU 41 9.528 -0.402 4.461 333 HD23 LEU 41 HD23 LEU 41 8.791 1.028 3.734 334 H SER 42 H SER 42 13.368 3.217 8.174 335 HA SER 42 HA SER 42 15.594 1.926 7.089 336 HB2 SER 42 HB3 SER 42 16.451 2.754 9.558 337 HB3 SER 42 HB2 SER 42 16.372 3.734 8.100 338 HG SER 42 HG SER 42 14.740 4.804 8.929 339 H GLY 43 H GLY 43 13.547 1.137 9.787 340 HA2 GLY 43 HA3 GLY 43 15.158 -0.898 10.961 341 HA3 GLY 43 HA2 GLY 43 13.413 -0.681 11.133 342 H PHE 44 H PHE 44 12.537 -0.937 8.578 343 HA PHE 44 HA PHE 44 12.624 -3.800 8.197 344 HB2 PHE 44 HB3 PHE 44 11.237 -1.542 6.798 345 HB3 PHE 44 HB2 PHE 44 11.387 -3.080 5.974 346 HD1 PHE 44 HD2 PHE 44 10.606 -5.207 7.184 347 HD2 PHE 44 HD1 PHE 44 9.584 -1.248 8.472 348 HE1 PHE 44 HE2 PHE 44 8.719 -6.125 8.495 349 HE2 PHE 44 HE1 PHE 44 7.684 -2.167 9.787 350 HZ PHE 44 HZ PHE 44 7.253 -4.589 9.787 351 H LEU 45 H LEU 45 13.774 -0.944 6.544 352 HA LEU 45 HA LEU 45 14.909 -2.246 4.372 353 HB2 LEU 45 HB3 LEU 45 14.572 0.107 4.302 354 HB3 LEU 45 HB2 LEU 45 15.602 0.389 5.692 355 HG LEU 45 HG LEU 45 17.479 -0.527 4.500 356 HD11 LEU 45 HD11 LEU 45 15.385 -1.228 2.537 357 HD12 LEU 45 HD12 LEU 45 16.967 -1.958 2.816 358 HD13 LEU 45 HD13 LEU 45 16.826 -0.529 1.795 359 HD21 LEU 45 HD21 LEU 45 17.919 1.352 3.097 360 HD22 LEU 45 HD22 LEU 45 16.831 1.921 4.360 361 HD23 LEU 45 HD23 LEU 45 16.212 1.581 2.725 362 H ASP 46 H ASP 46 16.310 -1.333 7.503 363 HA ASP 46 HA ASP 46 18.876 -2.470 6.972 364 HB2 ASP 46 HB3 ASP 46 18.237 -0.848 8.849 365 HB3 ASP 46 HB2 ASP 46 17.581 -2.258 9.680 366 H ALA 47 H ALA 47 15.848 -3.677 8.194 367 HA ALA 47 HA ALA 47 16.776 -6.211 9.040 368 HB1 ALA 47 HB1 ALA 47 14.427 -6.920 8.915 369 HB2 ALA 47 HB2 ALA 47 14.015 -5.431 8.080 370 HB3 ALA 47 HB3 ALA 47 14.568 -5.365 9.743 371 H GLN 48 H GLN 48 15.595 -5.066 5.883 372 HA GLN 48 HA GLN 48 16.402 -7.712 4.772 373 HB2 GLN 48 HB3 GLN 48 14.698 -6.884 2.828 374 HB3 GLN 48 HB2 GLN 48 14.251 -7.890 4.186 375 HG2 GLN 48 HG3 GLN 48 12.612 -6.196 4.069 376 HG3 GLN 48 HG2 GLN 48 13.616 -5.738 5.438 377 HE21 GLN 48 HE21 GLN 48 15.429 -5.102 2.626 378 HE22 GLN 48 HE22 GLN 48 14.945 -3.494 2.424 379 H LYS 49 H LYS 49 18.329 -5.701 4.980 380 HA LYS 49 HA LYS 49 18.743 -4.496 2.406 381 HB2 LYS 49 HB3 LYS 49 20.703 -5.212 4.614 382 HB3 LYS 49 HB2 LYS 49 21.148 -4.406 3.116 383 HG2 LYS 49 HG3 LYS 49 19.579 -2.537 3.627 384 HG3 LYS 49 HG2 LYS 49 19.132 -3.381 5.108 385 HD2 LYS 49 HD3 LYS 49 21.354 -3.190 6.001 386 HD3 LYS 49 HD2 LYS 49 21.944 -2.499 4.490 387 HE2 LYS 49 HE2 LYS 49 20.894 -0.463 4.830 388 HE3 LYS 49 HE1 LYS 49 19.656 -1.115 5.900 389 HZ1 LYS 49 HZ1 LYS 49 21.428 0.224 6.991 390 HZ2 LYS 49 HZ2 LYS 49 22.546 -0.976 6.622 391 HZ3 LYS 49 HZ3 LYS 49 21.228 -1.310 7.642 392 H ASP 50 H ASP 50 19.519 -7.560 3.863 393 HA ASP 50 HA ASP 50 21.047 -8.451 1.570 394 HB2 ASP 50 HB3 ASP 50 21.620 -10.329 2.850 395 HB3 ASP 50 HB2 ASP 50 21.675 -8.978 3.963 396 H VAL 51 H VAL 51 17.923 -8.062 1.728 397 HA VAL 51 HA VAL 51 17.158 -10.767 0.872 398 HB VAL 51 HB VAL 51 15.541 -8.315 1.552 399 HG11 VAL 51 HG11 VAL 51 14.189 -9.322 -0.078 400 HG12 VAL 51 HG12 VAL 51 13.608 -10.105 1.387 401 HG13 VAL 51 HG13 VAL 51 14.721 -10.953 0.317 402 HG21 VAL 51 HG21 VAL 51 14.785 -9.687 3.450 403 HG22 VAL 51 HG22 VAL 51 16.548 -9.607 3.449 404 HG23 VAL 51 HG23 VAL 51 15.728 -11.050 2.867 405 H ASP 52 H ASP 52 16.734 -11.236 -1.224 406 HA ASP 52 HA ASP 52 17.713 -9.695 -3.257 407 HB2 ASP 52 HB3 ASP 52 17.275 -12.024 -3.624 408 HB3 ASP 52 HB2 ASP 52 15.543 -11.781 -3.397 409 H ALA 53 H ALA 53 14.410 -9.934 -2.140 410 HA ALA 53 HA ALA 53 13.129 -8.386 -4.066 411 HB1 ALA 53 HB1 ALA 53 12.390 -8.602 -1.129 412 HB2 ALA 53 HB2 ALA 53 11.922 -9.714 -2.411 413 HB3 ALA 53 HB3 ALA 53 11.343 -8.060 -2.444 414 H VAL 54 H VAL 54 15.219 -7.331 -1.484 415 HA VAL 54 HA VAL 54 14.215 -4.733 -1.231 416 HB VAL 54 HB VAL 54 16.097 -5.966 0.166 417 HG11 VAL 54 HG11 VAL 54 18.340 -5.240 -0.344 418 HG12 VAL 54 HG12 VAL 54 17.831 -4.467 -1.827 419 HG13 VAL 54 HG13 VAL 54 17.712 -6.223 -1.648 420 HG21 VAL 54 HG21 VAL 54 15.093 -3.590 0.492 421 HG22 VAL 54 HG22 VAL 54 16.525 -3.008 -0.358 422 HG23 VAL 54 HG23 VAL 54 16.694 -3.902 1.150 423 H ASP 55 H ASP 55 16.656 -6.012 -3.442 424 HA ASP 55 HA ASP 55 17.121 -3.503 -4.780 425 HB2 ASP 55 HB3 ASP 55 18.825 -5.255 -4.840 426 HB3 ASP 55 HB2 ASP 55 17.729 -6.313 -5.723 427 H LYS 56 H LYS 56 15.281 -6.397 -5.555 428 HA LYS 56 HA LYS 56 14.482 -5.621 -8.114 429 HB2 LYS 56 HB3 LYS 56 13.192 -7.514 -6.146 430 HB3 LYS 56 HB2 LYS 56 12.540 -7.198 -7.734 431 HG2 LYS 56 HG3 LYS 56 14.227 -9.211 -7.344 432 HG3 LYS 56 HG2 LYS 56 14.235 -8.302 -8.843 433 HD2 LYS 56 HD3 LYS 56 16.090 -6.859 -7.857 434 HD3 LYS 56 HD2 LYS 56 16.170 -7.995 -6.494 435 HE2 LYS 56 HE2 LYS 56 16.691 -8.543 -9.426 436 HE3 LYS 56 HE1 LYS 56 17.833 -8.573 -8.085 437 HZ1 LYS 56 HZ1 LYS 56 16.723 -10.438 -7.153 438 HZ2 LYS 56 HZ2 LYS 56 17.073 -10.756 -8.782 439 HZ3 LYS 56 HZ3 LYS 56 15.491 -10.390 -8.316 440 H VAL 57 H VAL 57 12.900 -5.022 -4.998 441 HA VAL 57 HA VAL 57 10.556 -4.028 -6.126 442 HB VAL 57 HB VAL 57 11.859 -3.379 -3.470 443 HG11 VAL 57 HG11 VAL 57 9.716 -2.496 -2.766 444 HG12 VAL 57 HG12 VAL 57 8.951 -3.038 -4.253 445 HG13 VAL 57 HG13 VAL 57 10.104 -1.712 -4.298 446 HG21 VAL 57 HG21 VAL 57 11.012 -5.812 -4.241 447 HG22 VAL 57 HG22 VAL 57 9.457 -5.160 -3.799 448 HG23 VAL 57 HG23 VAL 57 10.754 -5.225 -2.605 449 H MET 58 H MET 58 13.534 -2.387 -5.126 450 HA MET 58 HA MET 58 12.706 0.223 -5.930 451 HB2 MET 58 HB3 MET 58 15.591 -0.409 -6.280 452 HB3 MET 58 HB2 MET 58 14.777 0.924 -5.473 453 HG2 MET 58 HG3 MET 58 14.093 -0.809 -3.700 454 HG3 MET 58 HG2 MET 58 15.333 -1.807 -4.474 455 HE1 MET 58 HE1 MET 58 18.630 -0.120 -4.047 456 HE2 MET 58 HE2 MET 58 17.618 0.269 -5.422 457 HE3 MET 58 HE3 MET 58 17.641 -1.374 -4.809 458 H LYS 59 H LYS 59 14.265 -2.456 -7.468 459 HA LYS 59 HA LYS 59 15.112 -1.212 -9.816 460 HB2 LYS 59 HB3 LYS 59 15.658 -3.612 -8.892 461 HB3 LYS 59 HB2 LYS 59 14.194 -4.053 -9.723 462 HG2 LYS 59 HG3 LYS 59 16.117 -4.443 -11.207 463 HG3 LYS 59 HG2 LYS 59 15.029 -3.204 -11.837 464 HD2 LYS 59 HD3 LYS 59 17.497 -2.655 -12.017 465 HD3 LYS 59 HD2 LYS 59 16.540 -1.437 -11.210 466 HE2 LYS 59 HE2 LYS 59 18.573 -1.768 -9.943 467 HE3 LYS 59 HE1 LYS 59 17.293 -2.396 -8.947 468 HZ1 LYS 59 HZ1 LYS 59 18.272 -4.417 -9.009 469 HZ2 LYS 59 HZ2 LYS 59 19.547 -3.705 -9.790 470 HZ3 LYS 59 HZ3 LYS 59 18.338 -4.443 -10.705 471 H GLU 60 H GLU 60 12.124 -2.883 -9.021 472 HA GLU 60 HA GLU 60 10.841 -2.579 -11.537 473 HB2 GLU 60 HB3 GLU 60 9.769 -2.743 -8.735 474 HB3 GLU 60 HB2 GLU 60 8.760 -2.745 -10.187 475 HG2 GLU 60 HG3 GLU 60 10.962 -4.778 -9.620 476 HG3 GLU 60 HG2 GLU 60 9.252 -5.046 -9.339 477 H LEU 61 H LEU 61 11.027 -0.660 -8.601 478 HA LEU 61 HA LEU 61 9.365 1.480 -9.463 479 HB2 LEU 61 HB3 LEU 61 11.579 1.443 -7.419 480 HB3 LEU 61 HB2 LEU 61 10.434 2.758 -7.666 481 HG LEU 61 HG LEU 61 9.665 -0.079 -6.941 482 HD11 LEU 61 HD11 LEU 61 9.254 2.343 -5.258 483 HD12 LEU 61 HD12 LEU 61 10.747 1.375 -5.160 484 HD13 LEU 61 HD13 LEU 61 9.163 0.625 -4.863 485 HD21 LEU 61 HD21 LEU 61 7.799 0.608 -8.057 486 HD22 LEU 61 HD22 LEU 61 8.083 2.334 -7.778 487 HD23 LEU 61 HD23 LEU 61 7.451 1.297 -6.489 488 H ASP 62 H ASP 62 12.832 0.891 -9.637 489 HA ASP 62 HA ASP 62 13.515 3.432 -10.629 490 HB2 ASP 62 HB3 ASP 62 14.940 0.777 -10.594 491 HB3 ASP 62 HB2 ASP 62 15.575 2.107 -11.534 492 H GLU 63 H GLU 63 12.574 0.463 -12.272 493 HA GLU 63 HA GLU 63 13.001 1.515 -14.911 494 HB2 GLU 63 HB3 GLU 63 11.230 -0.743 -13.906 495 HB3 GLU 63 HB2 GLU 63 11.470 -0.354 -15.617 496 HG2 GLU 63 HG3 GLU 63 13.893 -0.659 -15.336 497 HG3 GLU 63 HG2 GLU 63 13.606 -1.013 -13.625 498 H ASN 64 H ASN 64 10.447 1.547 -12.616 499 HA ASN 64 HA ASN 64 8.772 3.318 -14.273 500 HB2 ASN 64 HB3 ASN 64 8.382 1.734 -11.833 501 HB3 ASN 64 HB2 ASN 64 7.686 3.343 -11.723 502 HD21 ASN 64 HD21 ASN 64 6.718 0.316 -12.452 503 HD22 ASN 64 HD22 ASN 64 5.588 0.640 -13.667 504 H GLY 65 H GLY 65 11.589 3.651 -12.967 505 HA2 GLY 65 HA3 GLY 65 11.136 5.974 -11.283 506 HA3 GLY 65 HA2 GLY 65 12.667 5.124 -11.531 507 H ASP 66 H ASP 66 10.414 6.273 -13.942 508 HA ASP 66 HA ASP 66 12.381 7.483 -15.547 509 HB2 ASP 66 HB3 ASP 66 10.208 6.751 -16.362 510 HB3 ASP 66 HB2 ASP 66 9.400 8.007 -15.418 511 H GLY 67 H GLY 67 10.266 8.653 -13.018 512 HA2 GLY 67 HA3 GLY 67 12.040 10.747 -12.290 513 HA3 GLY 67 HA2 GLY 67 10.664 11.414 -13.153 514 H GLU 68 H GLU 68 8.534 10.167 -12.345 515 HA GLU 68 HA GLU 68 8.251 10.982 -9.574 516 HB2 GLU 68 HB3 GLU 68 6.269 10.118 -11.670 517 HB3 GLU 68 HB2 GLU 68 5.854 10.564 -10.029 518 HG2 GLU 68 HG3 GLU 68 6.660 12.768 -10.287 519 HG3 GLU 68 HG2 GLU 68 7.408 12.460 -11.836 520 H VAL 69 H VAL 69 7.198 9.777 -8.038 521 HA VAL 69 HA VAL 69 6.542 7.017 -8.532 522 HB VAL 69 HB VAL 69 8.549 6.688 -7.256 523 HG11 VAL 69 HG11 VAL 69 7.631 9.112 -5.782 524 HG12 VAL 69 HG12 VAL 69 9.256 8.723 -6.322 525 HG13 VAL 69 HG13 VAL 69 8.560 7.936 -4.899 526 HG21 VAL 69 HG21 VAL 69 7.090 5.230 -6.254 527 HG22 VAL 69 HG22 VAL 69 6.018 6.487 -5.633 528 HG23 VAL 69 HG23 VAL 69 7.553 6.168 -4.861 529 H ASP 70 H ASP 70 4.499 6.731 -8.017 530 HA ASP 70 HA ASP 70 3.155 8.978 -6.723 531 HB2 ASP 70 HB3 ASP 70 2.092 8.405 -8.720 532 HB3 ASP 70 HB2 ASP 70 2.090 6.695 -8.401 533 H PHE 71 H PHE 71 1.188 8.188 -5.383 534 HA PHE 71 HA PHE 71 2.226 7.070 -3.037 535 HB2 PHE 71 HB3 PHE 71 0.176 8.502 -3.186 536 HB3 PHE 71 HB2 PHE 71 -0.697 7.119 -3.849 537 HD1 PHE 71 HD1 PHE 71 1.571 7.977 -1.011 538 HD2 PHE 71 HD2 PHE 71 -1.847 5.687 -2.280 539 HE1 PHE 71 HE1 PHE 71 1.233 7.177 1.290 540 HE2 PHE 71 HE2 PHE 71 -2.179 4.918 0.001 541 HZ PHE 71 HZ PHE 71 -0.647 5.643 1.810 542 H GLN 72 H GLN 72 0.426 5.766 -5.715 543 HA GLN 72 HA GLN 72 -0.042 3.120 -4.879 544 HB2 GLN 72 HB3 GLN 72 0.493 4.395 -7.543 545 HB3 GLN 72 HB2 GLN 72 -0.032 2.703 -7.393 546 HG2 GLN 72 HG3 GLN 72 -2.088 3.442 -6.346 547 HG3 GLN 72 HG2 GLN 72 -1.514 5.113 -6.284 548 HE21 GLN 72 HE21 GLN 72 -1.216 6.209 -8.352 549 HE22 GLN 72 HE22 GLN 72 -2.091 5.737 -9.736 550 H GLU 73 H GLU 73 2.802 4.572 -6.513 551 HA GLU 73 HA GLU 73 4.267 2.105 -6.551 552 HB2 GLU 73 HB3 GLU 73 5.164 4.969 -6.849 553 HB3 GLU 73 HB2 GLU 73 6.263 3.579 -6.982 554 HG2 GLU 73 HG3 GLU 73 4.904 2.754 -8.907 555 HG3 GLU 73 HG2 GLU 73 3.842 4.150 -8.756 556 H TYR 74 H TYR 74 4.106 4.923 -4.464 557 HA TYR 74 HA TYR 74 6.234 4.298 -2.748 558 HB2 TYR 74 HB3 TYR 74 5.286 6.529 -2.786 559 HB3 TYR 74 HB2 TYR 74 3.731 5.891 -2.262 560 HD1 TYR 74 HD1 TYR 74 7.286 5.424 -1.064 561 HD2 TYR 74 HD2 TYR 74 3.236 6.490 -0.072 562 HE1 TYR 74 HE1 TYR 74 7.934 5.709 1.308 563 HE2 TYR 74 HE2 TYR 74 3.902 6.786 2.296 564 HH TYR 74 HH TYR 74 7.097 6.985 3.308 565 H VAL 75 H VAL 75 2.768 3.544 -2.379 566 HA VAL 75 HA VAL 75 3.119 2.326 0.126 567 HB VAL 75 HB VAL 75 0.893 1.195 -0.334 568 HG11 VAL 75 HG11 VAL 75 -0.324 3.277 -0.113 569 HG12 VAL 75 HG12 VAL 75 1.011 4.191 -0.801 570 HG13 VAL 75 HG13 VAL 75 1.194 3.430 0.780 571 HG21 VAL 75 HG21 VAL 75 1.543 1.868 -3.028 572 HG22 VAL 75 HG22 VAL 75 0.261 2.947 -2.579 573 HG23 VAL 75 HG23 VAL 75 0.036 1.198 -2.422 574 H VAL 76 H VAL 76 3.250 0.898 -3.114 575 HA VAL 76 HA VAL 76 3.441 -1.749 -2.183 576 HB VAL 76 HB VAL 76 2.794 -1.190 -4.480 577 HG11 VAL 76 HG11 VAL 76 5.667 -0.235 -4.753 578 HG12 VAL 76 HG12 VAL 76 4.167 0.657 -5.036 579 HG13 VAL 76 HG13 VAL 76 4.626 -0.651 -6.110 580 HG21 VAL 76 HG21 VAL 76 3.767 -3.424 -3.923 581 HG22 VAL 76 HG22 VAL 76 5.356 -2.822 -4.433 582 HG23 VAL 76 HG23 VAL 76 4.041 -2.940 -5.597 583 H LEU 77 H LEU 77 5.841 0.751 -2.807 584 HA LEU 77 HA LEU 77 8.160 -0.837 -2.580 585 HB2 LEU 77 HB3 LEU 77 8.256 1.483 -3.358 586 HB3 LEU 77 HB2 LEU 77 7.709 2.043 -1.805 587 HG LEU 77 HG LEU 77 9.730 1.173 -0.685 588 HD11 LEU 77 HD11 LEU 77 11.623 0.403 -2.204 589 HD12 LEU 77 HD12 LEU 77 10.391 0.096 -3.416 590 HD13 LEU 77 HD13 LEU 77 10.336 -0.734 -1.852 591 HD21 LEU 77 HD21 LEU 77 11.443 2.567 -2.041 592 HD22 LEU 77 HD22 LEU 77 10.021 3.374 -1.362 593 HD23 LEU 77 HD23 LEU 77 10.070 2.948 -3.081 594 H VAL 78 H VAL 78 6.396 1.016 -0.132 595 HA VAL 78 HA VAL 78 8.027 0.035 1.990 596 HB VAL 78 HB VAL 78 6.369 1.018 3.521 597 HG11 VAL 78 HG11 VAL 78 6.269 3.355 2.133 598 HG12 VAL 78 HG12 VAL 78 7.507 2.511 1.213 599 HG13 VAL 78 HG13 VAL 78 7.696 2.744 2.955 600 HG21 VAL 78 HG21 VAL 78 4.279 0.453 2.349 601 HG22 VAL 78 HG22 VAL 78 4.772 1.475 0.988 602 HG23 VAL 78 HG23 VAL 78 4.416 2.197 2.546 603 H ALA 79 H ALA 79 4.888 -0.905 0.686 604 HA ALA 79 HA ALA 79 4.337 -2.892 2.593 605 HB1 ALA 79 HB1 ALA 79 3.419 -2.926 -0.281 606 HB2 ALA 79 HB2 ALA 79 2.680 -1.947 0.991 607 HB3 ALA 79 HB3 ALA 79 2.685 -3.708 1.117 608 H ALA 80 H ALA 80 5.921 -3.137 -0.571 609 HA ALA 80 HA ALA 80 6.137 -5.894 -0.624 610 HB1 ALA 80 HB1 ALA 80 7.958 -5.622 -2.187 611 HB2 ALA 80 HB2 ALA 80 8.132 -3.914 -1.756 612 HB3 ALA 80 HB3 ALA 80 6.675 -4.481 -2.582 613 H LEU 81 H LEU 81 8.390 -3.474 0.599 614 HA LEU 81 HA LEU 81 10.370 -5.276 1.562 615 HB2 LEU 81 HB3 LEU 81 9.605 -2.490 2.424 616 HB3 LEU 81 HB2 LEU 81 11.039 -3.314 2.990 617 HG LEU 81 HG LEU 81 10.403 -2.679 0.079 618 HD11 LEU 81 HD11 LEU 81 12.461 -1.488 1.939 619 HD12 LEU 81 HD12 LEU 81 10.961 -0.715 1.427 620 HD13 LEU 81 HD13 LEU 81 12.222 -1.045 0.243 621 HD21 LEU 81 HD21 LEU 81 12.969 -3.324 -0.041 622 HD22 LEU 81 HD22 LEU 81 11.761 -4.583 -0.076 623 HD23 LEU 81 HD23 LEU 81 12.629 -4.246 1.418 624 H THR 82 H THR 82 7.514 -3.805 3.021 625 HA THR 82 HA THR 82 7.911 -4.821 5.619 626 HB THR 82 HB THR 82 5.244 -4.254 4.313 627 HG1 THR 82 HG2 THR 82 6.668 -2.458 4.061 628 HG21 THR 82 HG21 THR 82 6.140 -4.010 7.201 629 HG22 THR 82 HG22 THR 82 5.222 -5.347 6.502 630 HG23 THR 82 HG23 THR 82 4.505 -3.755 6.570 631 H VAL 83 H VAL 83 5.856 -6.053 2.931 632 HA VAL 83 HA VAL 83 5.048 -8.331 4.354 633 HB VAL 83 HB VAL 83 3.842 -7.480 2.410 634 HG11 VAL 83 HG11 VAL 83 5.867 -7.051 0.994 635 HG12 VAL 83 HG12 VAL 83 4.576 -7.947 0.152 636 HG13 VAL 83 HG13 VAL 83 5.994 -8.796 0.740 637 HG21 VAL 83 HG21 VAL 83 3.366 -9.761 3.097 638 HG22 VAL 83 HG22 VAL 83 4.758 -10.339 2.153 639 HG23 VAL 83 HG23 VAL 83 3.357 -9.667 1.336 640 H ALA 84 H ALA 84 7.716 -7.756 2.126 641 HA ALA 84 HA ALA 84 8.615 -10.298 1.753 642 HB1 ALA 84 HB1 ALA 84 10.127 -7.713 2.090 643 HB2 ALA 84 HB2 ALA 84 9.746 -8.569 0.602 644 HB3 ALA 84 HB3 ALA 84 10.960 -9.219 1.703 645 H MET 85 H MET 85 9.694 -8.084 4.337 646 HA MET 85 HA MET 85 10.937 -10.171 5.824 647 HB2 MET 85 HB3 MET 85 10.288 -7.341 6.516 648 HB3 MET 85 HB2 MET 85 10.874 -8.466 7.736 649 HG2 MET 85 HG3 MET 85 12.249 -7.921 5.101 650 HG3 MET 85 HG2 MET 85 12.776 -7.254 6.663 651 HE1 MET 85 HE1 MET 85 12.812 -8.579 8.659 652 HE2 MET 85 HE2 MET 85 14.276 -9.544 8.624 653 HE3 MET 85 HE3 MET 85 12.719 -10.349 8.707 654 H ASN 86 H ASN 86 7.784 -8.592 6.126 655 HA ASN 86 HA ASN 86 7.193 -9.844 8.562 656 HB2 ASN 86 HB3 ASN 86 5.495 -8.605 6.443 657 HB3 ASN 86 HB2 ASN 86 4.756 -9.517 7.755 658 HD21 ASN 86 HD21 ASN 86 5.552 -8.829 10.072 659 HD22 ASN 86 HD22 ASN 86 5.843 -7.174 10.270 660 H ASN 87 H ASN 87 6.504 -10.941 5.251 661 HA ASN 87 HA ASN 87 5.229 -13.337 6.151 662 HB2 ASN 87 HB3 ASN 87 6.444 -12.511 3.532 663 HB3 ASN 87 HB2 ASN 87 5.808 -14.132 3.766 664 HD21 ASN 87 HD21 ASN 87 4.506 -12.595 1.875 665 HD22 ASN 87 HD22 ASN 87 3.004 -12.070 2.450 666 H PHE 88 H PHE 88 8.474 -12.449 5.249 667 HA PHE 88 HA PHE 88 9.686 -14.975 5.509 668 HB2 PHE 88 HB3 PHE 88 10.822 -13.114 4.389 669 HB3 PHE 88 HB2 PHE 88 10.894 -12.220 5.909 670 HD1 PHE 88 HD1 PHE 88 11.921 -15.448 4.334 671 HD2 PHE 88 HD2 PHE 88 12.711 -12.505 7.358 672 HE1 PHE 88 HE1 PHE 88 14.057 -16.601 4.905 673 HE2 PHE 88 HE2 PHE 88 14.829 -13.669 7.933 674 HZ PHE 88 HZ PHE 88 15.506 -15.712 6.702 675 H PHE 89 H PHE 89 9.153 -12.342 7.798 676 HA PHE 89 HA PHE 89 10.677 -12.990 9.898 677 HB2 PHE 89 HB3 PHE 89 8.161 -11.555 9.587 678 HB3 PHE 89 HB2 PHE 89 8.292 -12.278 11.161 679 HD1 PHE 89 HD1 PHE 89 10.879 -12.139 12.113 680 HD2 PHE 89 HD2 PHE 89 9.000 -9.359 9.436 681 HE1 PHE 89 HE1 PHE 89 12.468 -10.388 12.817 682 HE2 PHE 89 HE2 PHE 89 10.590 -7.604 10.146 683 HZ PHE 89 HZ PHE 89 12.333 -8.121 11.839 684 H TRP 90 H TRP 90 7.479 -14.392 9.293 685 HA TRP 90 HA TRP 90 7.375 -15.941 11.642 686 HB2 TRP 90 HB3 TRP 90 6.117 -16.687 8.980 687 HB3 TRP 90 HB2 TRP 90 5.561 -17.173 10.587 688 HD1 TRP 90 HD TRP 90 5.520 -14.391 8.112 689 HE1 TRP 90 HE1 TRP 90 4.032 -12.496 8.943 690 HE3 TRP 90 HE3 TRP 90 4.705 -15.971 12.870 691 HZ2 TRP 90 HZ2 TRP 90 2.643 -11.721 11.326 692 HZ3 TRP 90 HZ3 TRP 90 3.293 -14.631 14.410 693 HH2 TRP 90 HH TRP 90 2.262 -12.502 13.638 694 H GLU 91 H GLU 91 7.608 -17.518 8.491 695 HA GLU 91 HA GLU 91 9.778 -19.217 9.615 696 HB2 GLU 91 HB3 GLU 91 8.934 -20.581 7.429 697 HB3 GLU 91 HB2 GLU 91 8.365 -20.918 9.062 698 HG2 GLU 91 HG3 GLU 91 6.402 -19.530 8.683 699 HG3 GLU 91 HG2 GLU 91 7.033 -18.980 7.137 700 H ASN 92 H ASN 92 8.723 -18.852 6.327 701 HA ASN 92 HA ASN 92 11.129 -17.401 5.553 702 HB2 ASN 92 HB3 ASN 92 11.461 -19.993 5.376 703 HB3 ASN 92 HB2 ASN 92 10.378 -19.877 4.001 704 HD21 ASN 92 HD21 ASN 92 13.643 -19.435 4.980 705 HD22 ASN 92 HD22 ASN 92 14.221 -18.735 3.565 706 H SER 93 H SER 93 10.587 -17.929 2.703 707 HA SER 93 HA SER 93 9.281 -17.250 0.987 708 HB2 SER 93 HB3 SER 93 6.878 -17.245 2.791 709 HB3 SER 93 HB2 SER 93 6.959 -17.666 1.091 710 HG SER 93 HG SER 93 8.299 -19.470 1.793 711 H1 GLY 1 H GLY 1 9.973 1.832 14.899 712 HA2 GLY 1 HA3 GLY 1 11.764 3.563 13.272 713 HA3 GLY 1 HA2 GLY 1 10.787 2.295 12.583 714 H SER 2 H SER 2 10.304 4.440 11.360 715 HA SER 2 HA SER 2 8.648 6.403 12.459 716 HB2 SER 2 HB3 SER 2 8.966 5.366 9.637 717 HB3 SER 2 HB2 SER 2 7.825 6.623 10.057 718 HG SER 2 HG SER 2 9.665 7.563 9.480 719 H GLU 3 H GLU 3 6.425 6.720 12.308 720 HA GLU 3 HA GLU 3 4.666 4.744 13.123 721 HB2 GLU 3 HB3 GLU 3 4.188 7.204 11.422 722 HB3 GLU 3 HB2 GLU 3 2.924 6.265 12.178 723 HG2 GLU 3 HG3 GLU 3 3.747 6.739 14.409 724 HG3 GLU 3 HG2 GLU 3 5.203 7.475 13.780 725 H LEU 4 H LEU 4 5.967 5.518 10.008 726 HA LEU 4 HA LEU 4 4.086 4.280 8.343 727 HB2 LEU 4 HB3 LEU 4 7.050 4.659 7.973 728 HB3 LEU 4 HB2 LEU 4 5.934 4.168 6.705 729 HG LEU 4 HG LEU 4 5.894 6.814 8.216 730 HD11 LEU 4 HD11 LEU 4 5.842 7.062 5.418 731 HD12 LEU 4 HD12 LEU 4 7.152 5.964 5.837 732 HD13 LEU 4 HD13 LEU 4 7.088 7.585 6.551 733 HD21 LEU 4 HD21 LEU 4 3.817 5.443 6.537 734 HD22 LEU 4 HD22 LEU 4 4.045 7.183 6.348 735 HD23 LEU 4 HD23 LEU 4 3.632 6.517 7.920 736 H GLU 5 H GLU 5 7.012 2.980 9.976 737 HA GLU 5 HA GLU 5 6.756 0.365 8.865 738 HB2 GLU 5 HB3 GLU 5 8.065 1.305 11.446 739 HB3 GLU 5 HB2 GLU 5 8.151 -0.351 10.861 740 HG2 GLU 5 HG3 GLU 5 9.215 0.558 8.718 741 HG3 GLU 5 HG2 GLU 5 9.200 2.125 9.467 742 H THR 6 H THR 6 5.537 1.917 11.799 743 HA THR 6 HA THR 6 4.188 -0.344 12.850 744 HB THR 6 HB THR 6 3.262 2.511 13.148 745 HG1 THR 6 HG2 THR 6 4.766 2.435 14.972 746 HG21 THR 6 HG21 THR 6 2.130 0.307 14.105 747 HG22 THR 6 HG22 THR 6 2.217 1.771 15.059 748 HG23 THR 6 HG23 THR 6 3.377 0.471 15.340 749 H ALA 7 H ALA 7 3.148 2.323 10.712 750 HA ALA 7 HA ALA 7 0.483 1.551 10.406 751 HB1 ALA 7 HB1 ALA 7 1.294 3.726 9.671 752 HB2 ALA 7 HB2 ALA 7 0.564 2.889 8.298 753 HB3 ALA 7 HB3 ALA 7 2.309 2.978 8.437 754 H MET 8 H MET 8 3.358 0.745 8.491 755 HA MET 8 HA MET 8 1.983 -0.922 6.663 756 HB2 MET 8 HB3 MET 8 4.882 -0.964 7.487 757 HB3 MET 8 HB2 MET 8 4.232 -1.847 6.114 758 HG2 MET 8 HG3 MET 8 4.305 1.168 6.467 759 HG3 MET 8 HG2 MET 8 5.151 0.208 5.269 760 HE1 MET 8 HE1 MET 8 2.574 -1.019 2.891 761 HE2 MET 8 HE2 MET 8 2.437 -1.868 4.425 762 HE3 MET 8 HE3 MET 8 4.037 -1.394 3.846 763 H GLU 9 H GLU 9 3.628 -1.619 9.738 764 HA GLU 9 HA GLU 9 3.113 -4.385 9.574 765 HB2 GLU 9 HB3 GLU 9 3.710 -2.608 11.941 766 HB3 GLU 9 HB2 GLU 9 3.433 -4.336 12.105 767 HG2 GLU 9 HG3 GLU 9 5.266 -4.774 10.509 768 HG3 GLU 9 HG2 GLU 9 5.553 -3.053 10.354 769 H THR 10 H THR 10 1.279 -1.645 10.785 770 HA THR 10 HA THR 10 -0.821 -3.083 11.999 771 HB THR 10 HB THR 10 -1.171 -0.460 10.493 772 HG1 THR 10 HG2 THR 10 0.662 -0.527 12.033 773 HG21 THR 10 HG21 THR 10 -2.500 -1.431 13.023 774 HG22 THR 10 HG22 THR 10 -3.178 -1.733 11.428 775 HG23 THR 10 HG23 THR 10 -2.968 -0.080 12.003 776 H LEU 11 H LEU 11 -0.255 -1.979 8.701 777 HA LEU 11 HA LEU 11 -2.615 -3.015 7.508 778 HB2 LEU 11 HB3 LEU 11 0.148 -2.498 6.402 779 HB3 LEU 11 HB2 LEU 11 -1.227 -2.980 5.403 780 HG LEU 11 HG LEU 11 -1.222 -0.528 7.185 781 HD11 LEU 11 HD11 LEU 11 -0.102 -0.958 4.471 782 HD12 LEU 11 HD12 LEU 11 0.309 0.253 5.683 783 HD13 LEU 11 HD13 LEU 11 -1.110 0.467 4.676 784 HD21 LEU 11 HD21 LEU 11 -2.895 -0.454 4.827 785 HD22 LEU 11 HD22 LEU 11 -3.341 -0.279 6.515 786 HD23 LEU 11 HD23 LEU 11 -3.272 -1.890 5.781 787 H ILE 12 H ILE 12 0.614 -4.378 8.105 788 HA ILE 12 HA ILE 12 0.177 -6.889 6.839 789 HB ILE 12 HB ILE 12 2.007 -6.110 9.122 790 HG12 ILE 12 HG13 ILE 12 2.440 -5.116 6.784 791 HG13 ILE 12 HG12 ILE 12 3.746 -6.065 7.495 792 HG21 ILE 12 HG21 ILE 12 1.782 -8.728 7.641 793 HG22 ILE 12 HG22 ILE 12 1.680 -8.447 9.378 794 HG23 ILE 12 HG23 ILE 12 3.210 -8.243 8.552 795 HD11 ILE 12 HD11 ILE 12 3.253 -7.943 6.089 796 HD12 ILE 12 HD12 ILE 12 3.281 -6.516 5.078 797 HD13 ILE 12 HD13 ILE 12 1.737 -7.226 5.509 798 H ASN 13 H ASN 13 -0.305 -5.752 10.116 799 HA ASN 13 HA ASN 13 -0.964 -8.203 11.305 800 HB2 ASN 13 HB3 ASN 13 -1.711 -5.365 11.952 801 HB3 ASN 13 HB2 ASN 13 -2.403 -6.704 12.851 802 HD21 ASN 13 HD21 ASN 13 0.863 -5.590 11.780 803 HD22 ASN 13 HD22 ASN 13 1.631 -6.086 13.204 804 H VAL 14 H VAL 14 -3.003 -5.781 9.743 805 HA VAL 14 HA VAL 14 -5.472 -7.147 10.058 806 HB VAL 14 HB VAL 14 -4.527 -5.226 7.925 807 HG11 VAL 14 HG11 VAL 14 -6.556 -6.648 7.299 808 HG12 VAL 14 HG12 VAL 14 -6.802 -4.908 7.301 809 HG13 VAL 14 HG13 VAL 14 -7.401 -5.878 8.647 810 HG21 VAL 14 HG21 VAL 14 -6.407 -4.530 10.175 811 HG22 VAL 14 HG22 VAL 14 -5.295 -3.500 9.289 812 HG23 VAL 14 HG23 VAL 14 -4.672 -4.593 10.495 813 H PHE 15 H PHE 15 -3.100 -7.041 7.419 814 HA PHE 15 HA PHE 15 -4.406 -8.826 5.654 815 HB2 PHE 15 HB3 PHE 15 -2.502 -7.371 5.010 816 HB3 PHE 15 HB2 PHE 15 -1.425 -8.375 5.972 817 HD1 PHE 15 HD2 PHE 15 -0.886 -10.698 5.299 818 HD2 PHE 15 HD1 PHE 15 -3.449 -8.204 2.899 819 HE1 PHE 15 HE2 PHE 15 -0.665 -12.268 3.426 820 HE2 PHE 15 HE1 PHE 15 -3.218 -9.781 1.017 821 HZ PHE 15 HZ PHE 15 -1.842 -11.810 1.266 822 H HIS 16 H HIS 16 -1.866 -9.374 8.038 823 HA HIS 16 HA HIS 16 -1.796 -12.189 7.674 824 HB2 HIS 16 HB3 HIS 16 -0.521 -10.300 9.582 825 HB3 HIS 16 HB2 HIS 16 -0.718 -11.942 10.155 826 HD1 HIS 16 HD1 HIS 16 1.107 -13.518 9.500 827 HD2 HIS 16 HD2 HIS 16 0.725 -10.385 6.745 828 HE1 HIS 16 HE1 HIS 16 2.855 -13.897 7.750 829 HE2 HIS 16 HE2 HIS 16 2.662 -12.046 6.030 830 H ALA 17 H ALA 17 -3.579 -10.113 9.909 831 HA ALA 17 HA ALA 17 -4.668 -12.132 11.525 832 HB1 ALA 17 HB1 ALA 17 -6.592 -10.516 11.790 833 HB2 ALA 17 HB2 ALA 17 -5.787 -9.461 10.642 834 HB3 ALA 17 HB3 ALA 17 -5.015 -9.836 12.174 835 H HIS 18 H HIS 18 -5.820 -10.700 8.490 836 HA HIS 18 HA HIS 18 -7.992 -12.532 8.297 837 HB2 HIS 18 HB3 HIS 18 -6.841 -10.582 6.305 838 HB3 HIS 18 HB2 HIS 18 -8.083 -11.765 5.872 839 HD1 HIS 18 HD1 HIS 18 -10.526 -11.501 6.920 840 HD2 HIS 18 HD2 HIS 18 -7.800 -8.516 8.102 841 HE1 HIS 18 HE1 HIS 18 -11.830 -9.745 8.102 842 HE2 HIS 18 HE2 HIS 18 -10.227 -7.934 8.834 843 H SER 19 H SER 19 -4.665 -12.574 7.228 844 HA SER 19 HA SER 19 -4.817 -14.574 5.310 845 HB2 SER 19 HB3 SER 19 -2.639 -14.352 7.412 846 HB3 SER 19 HB2 SER 19 -2.541 -15.176 5.878 847 HG SER 19 HG SER 19 -3.328 -12.449 5.864 848 H GLY 20 H GLY 20 -4.775 -14.816 8.824 849 HA2 GLY 20 HA3 GLY 20 -4.629 -17.584 9.234 850 HA3 GLY 20 HA2 GLY 20 -5.512 -16.431 10.232 851 H LYS 21 H LYS 21 -7.200 -15.620 7.920 852 HA LYS 21 HA LYS 21 -9.444 -17.253 8.452 853 HB2 LYS 21 HB3 LYS 21 -8.910 -15.501 6.041 854 HB3 LYS 21 HB2 LYS 21 -10.459 -16.090 6.580 855 HG2 LYS 21 HG3 LYS 21 -8.725 -14.403 8.392 856 HG3 LYS 21 HG2 LYS 21 -9.877 -13.683 7.286 857 HD2 LYS 21 HD3 LYS 21 -11.685 -15.036 8.352 858 HD3 LYS 21 HD2 LYS 21 -10.508 -15.651 9.513 859 HE2 LYS 21 HE2 LYS 21 -10.992 -13.848 10.780 860 HE3 LYS 21 HE1 LYS 21 -10.046 -12.929 9.646 861 HZ1 LYS 21 HZ1 LYS 21 -12.981 -13.320 9.555 862 HZ2 LYS 21 HZ2 LYS 21 -12.073 -12.634 8.266 863 HZ3 LYS 21 HZ3 LYS 21 -12.111 -11.891 9.797 864 H GLU 22 H GLU 22 -7.130 -17.167 5.743 865 HA GLU 22 HA GLU 22 -7.685 -19.925 5.084 866 HB2 GLU 22 HB3 GLU 22 -9.670 -18.423 3.969 867 HB3 GLU 22 HB2 GLU 22 -8.377 -17.943 2.961 868 HG2 GLU 22 HG3 GLU 22 -7.872 -20.163 2.236 869 HG3 GLU 22 HG2 GLU 22 -9.053 -20.828 3.362 870 H GLY 23 H GLY 23 -6.852 -17.051 3.233 871 HA2 GLY 23 HA3 GLY 23 -5.180 -17.880 1.427 872 HA3 GLY 23 HA2 GLY 23 -4.859 -16.356 2.220 873 H ASP 24 H ASP 24 -4.030 -19.701 1.962 874 HA ASP 24 HA ASP 24 -2.306 -20.979 2.833 875 HB2 ASP 24 HB3 ASP 24 -1.511 -19.799 0.805 876 HB3 ASP 24 HB2 ASP 24 -0.753 -18.582 1.846 877 H LYS 25 H LYS 25 0.289 -20.096 3.807 878 HA LYS 25 HA LYS 25 -0.367 -19.848 6.524 879 HB2 LYS 25 HB3 LYS 25 2.058 -19.211 6.790 880 HB3 LYS 25 HB2 LYS 25 1.722 -20.848 6.183 881 HG2 LYS 25 HG3 LYS 25 2.137 -19.990 3.846 882 HG3 LYS 25 HG2 LYS 25 2.571 -18.413 4.523 883 HD2 LYS 25 HD3 LYS 25 4.353 -19.497 5.852 884 HD3 LYS 25 HD2 LYS 25 3.958 -21.036 5.107 885 HE2 LYS 25 HE2 LYS 25 4.761 -20.370 2.992 886 HE3 LYS 25 HE1 LYS 25 4.610 -18.656 3.365 887 HZ1 LYS 25 HZ1 LYS 25 6.510 -20.435 4.806 888 HZ2 LYS 25 HZ2 LYS 25 6.391 -18.745 4.826 889 HZ3 LYS 25 HZ3 LYS 25 6.938 -19.526 3.412 890 H TYR 26 H TYR 26 0.779 -17.525 4.141 891 HA TYR 26 HA TYR 26 -0.701 -15.585 5.581 892 HB2 TYR 26 HB3 TYR 26 1.378 -13.929 5.094 893 HB3 TYR 26 HB2 TYR 26 0.989 -14.719 6.620 894 HD1 TYR 26 HD2 TYR 26 3.114 -15.031 3.558 895 HD2 TYR 26 HD1 TYR 26 2.347 -16.370 7.543 896 HE1 TYR 26 HE2 TYR 26 5.258 -16.232 3.548 897 HE2 TYR 26 HE1 TYR 26 4.523 -17.592 7.552 898 HH TYR 26 HH TYR 26 6.949 -17.010 5.411 899 H LYS 27 H LYS 27 -2.051 -15.511 3.937 900 HA LYS 27 HA LYS 27 -1.396 -13.810 1.750 901 HB2 LYS 27 HB3 LYS 27 -2.284 -16.678 1.300 902 HB3 LYS 27 HB2 LYS 27 -2.562 -15.418 0.115 903 HG2 LYS 27 HG3 LYS 27 0.196 -16.042 1.217 904 HG3 LYS 27 HG2 LYS 27 -0.405 -16.817 -0.202 905 HD2 LYS 27 HD3 LYS 27 -0.294 -13.769 0.040 906 HD3 LYS 27 HD2 LYS 27 0.992 -14.747 -0.644 907 HE2 LYS 27 HE2 LYS 27 -1.788 -14.308 -1.737 908 HE3 LYS 27 HE1 LYS 27 -0.218 -14.096 -2.491 909 HZ1 LYS 27 HZ1 LYS 27 0.100 -16.552 -2.343 910 HZ2 LYS 27 HZ2 LYS 27 -1.142 -16.064 -3.356 911 HZ3 LYS 27 HZ3 LYS 27 -1.517 -16.737 -1.850 912 H LEU 28 H LEU 28 -3.580 -13.289 0.606 913 HA LEU 28 HA LEU 28 -5.714 -13.576 2.624 914 HB2 LEU 28 HB3 LEU 28 -4.791 -11.361 2.659 915 HB3 LEU 28 HB2 LEU 28 -4.952 -11.174 0.936 916 HG LEU 28 HG LEU 28 -7.468 -11.514 1.250 917 HD11 LEU 28 HD11 LEU 28 -7.689 -12.535 3.362 918 HD12 LEU 28 HD12 LEU 28 -8.111 -10.854 3.697 919 HD13 LEU 28 HD13 LEU 28 -6.515 -11.446 4.109 920 HD21 LEU 28 HD21 LEU 28 -7.800 -9.200 2.042 921 HD22 LEU 28 HD22 LEU 28 -6.413 -9.298 0.947 922 HD23 LEU 28 HD23 LEU 28 -6.154 -9.196 2.693 923 H SER 29 H SER 29 -7.590 -14.432 1.906 924 HA SER 29 HA SER 29 -7.849 -15.057 -0.906 925 HB2 SER 29 HB3 SER 29 -10.023 -16.122 -0.090 926 HB3 SER 29 HB2 SER 29 -8.503 -16.845 0.402 927 HG SER 29 HG SER 29 -9.801 -16.643 2.171 928 H LYS 30 H LYS 30 -9.857 -14.503 -2.058 929 HA LYS 30 HA LYS 30 -10.272 -11.677 -1.863 930 HB2 LYS 30 HB3 LYS 30 -12.049 -13.567 -3.387 931 HB3 LYS 30 HB2 LYS 30 -11.681 -11.896 -3.784 932 HG2 LYS 30 HG3 LYS 30 -9.922 -14.341 -4.051 933 HG3 LYS 30 HG2 LYS 30 -10.430 -13.268 -5.318 934 HD2 LYS 30 HD3 LYS 30 -8.526 -12.500 -3.056 935 HD3 LYS 30 HD2 LYS 30 -8.045 -12.857 -4.690 936 HE2 LYS 30 HE2 LYS 30 -9.726 -10.511 -3.762 937 HE3 LYS 30 HE1 LYS 30 -8.136 -10.473 -4.529 938 HZ1 LYS 30 HZ1 LYS 30 -10.193 -11.778 -6.148 939 HZ2 LYS 30 HZ2 LYS 30 -9.072 -10.539 -6.537 940 HZ3 LYS 30 HZ3 LYS 30 -10.476 -10.184 -5.734 941 H LYS 31 H LYS 31 -11.529 -14.231 -0.198 942 HA LYS 31 HA LYS 31 -14.293 -13.589 0.150 943 HB2 LYS 31 HB3 LYS 31 -12.512 -14.936 2.209 944 HB3 LYS 31 HB2 LYS 31 -14.223 -15.158 1.887 945 HG2 LYS 31 HG3 LYS 31 -13.711 -16.186 -0.304 946 HG3 LYS 31 HG2 LYS 31 -12.023 -15.894 -0.042 947 HD2 LYS 31 HD3 LYS 31 -12.005 -17.351 1.875 948 HD3 LYS 31 HD2 LYS 31 -13.747 -17.614 1.723 949 HE2 LYS 31 HE2 LYS 31 -13.213 -18.209 -0.661 950 HE3 LYS 31 HE1 LYS 31 -11.583 -18.455 -0.242 951 HZ1 LYS 31 HZ1 LYS 31 -13.648 -19.777 1.467 952 HZ2 LYS 31 HZ2 LYS 31 -12.023 -20.263 1.155 953 HZ3 LYS 31 HZ3 LYS 31 -13.227 -20.460 -0.009 954 H GLU 32 H GLU 32 -11.499 -13.239 2.216 955 HA GLU 32 HA GLU 32 -12.693 -11.583 4.156 956 HB2 GLU 32 HB3 GLU 32 -9.862 -12.350 3.504 957 HB3 GLU 32 HB2 GLU 32 -10.351 -11.486 4.975 958 HG2 GLU 32 HG3 GLU 32 -11.398 -14.220 4.111 959 HG3 GLU 32 HG2 GLU 32 -10.126 -13.925 5.295 960 H LEU 33 H LEU 33 -10.658 -11.123 1.356 961 HA LEU 33 HA LEU 33 -9.766 -8.548 1.829 962 HB2 LEU 33 HB3 LEU 33 -8.904 -10.004 0.031 963 HB3 LEU 33 HB2 LEU 33 -10.422 -9.841 -0.820 964 HG LEU 33 HG LEU 33 -8.489 -8.350 -1.609 965 HD11 LEU 33 HD11 LEU 33 -10.042 -7.090 -2.587 966 HD12 LEU 33 HD12 LEU 33 -10.609 -6.401 -1.072 967 HD13 LEU 33 HD13 LEU 33 -11.242 -7.946 -1.629 968 HD21 LEU 33 HD21 LEU 33 -9.263 -6.709 0.852 969 HD22 LEU 33 HD22 LEU 33 -8.114 -6.271 -0.393 970 HD23 LEU 33 HD23 LEU 33 -7.743 -7.599 0.681 971 H LYS 34 H LYS 34 -12.702 -9.602 0.120 972 HA LYS 34 HA LYS 34 -13.584 -6.967 -0.483 973 HB2 LYS 34 HB3 LYS 34 -15.196 -9.528 -0.174 974 HB3 LYS 34 HB2 LYS 34 -15.816 -7.997 -0.764 975 HG2 LYS 34 HG3 LYS 34 -14.233 -7.985 -2.619 976 HG3 LYS 34 HG2 LYS 34 -13.530 -9.498 -2.055 977 HD2 LYS 34 HD3 LYS 34 -15.730 -10.622 -2.318 978 HD3 LYS 34 HD2 LYS 34 -16.418 -9.139 -2.964 979 HE2 LYS 34 HE2 LYS 34 -14.054 -10.622 -4.189 980 HE3 LYS 34 HE1 LYS 34 -15.709 -10.784 -4.723 981 HZ1 LYS 34 HZ1 LYS 34 -15.727 -8.724 -5.658 982 HZ2 LYS 34 HZ2 LYS 34 -14.102 -9.056 -5.820 983 HZ3 LYS 34 HZ3 LYS 34 -14.633 -8.041 -4.562 984 H GLU 35 H GLU 35 -14.209 -9.166 2.203 985 HA GLU 35 HA GLU 35 -16.075 -7.470 3.521 986 HB2 GLU 35 HB3 GLU 35 -14.430 -9.827 4.476 987 HB3 GLU 35 HB2 GLU 35 -15.656 -9.026 5.444 988 HG2 GLU 35 HG3 GLU 35 -17.380 -9.510 3.802 989 HG3 GLU 35 HG2 GLU 35 -16.215 -10.183 2.699 990 H LEU 36 H LEU 36 -12.648 -8.163 4.084 991 HA LEU 36 HA LEU 36 -12.422 -6.390 6.244 992 HB2 LEU 36 HB3 LEU 36 -10.420 -7.304 6.495 993 HB3 LEU 36 HB2 LEU 36 -10.763 -8.312 5.108 994 HG LEU 36 HG LEU 36 -9.818 -6.280 3.700 995 HD11 LEU 36 HD11 LEU 36 -7.930 -5.592 5.710 996 HD12 LEU 36 HD12 LEU 36 -9.529 -5.299 6.390 997 HD13 LEU 36 HD13 LEU 36 -9.056 -4.513 4.893 998 HD21 LEU 36 HD21 LEU 36 -7.576 -7.245 3.908 999 HD22 LEU 36 HD22 LEU 36 -8.799 -8.517 4.019 1000 HD23 LEU 36 HD23 LEU 36 -8.010 -7.950 5.477 1001 H LEU 37 H LEU 37 -11.775 -5.922 2.799 1002 HA LEU 37 HA LEU 37 -10.574 -3.416 3.085 1003 HB2 LEU 37 HB3 LEU 37 -10.423 -4.670 0.966 1004 HB3 LEU 37 HB2 LEU 37 -12.157 -4.544 0.751 1005 HG LEU 37 HG LEU 37 -10.615 -2.923 -0.583 1006 HD11 LEU 37 HD11 LEU 37 -12.696 -1.380 0.871 1007 HD12 LEU 37 HD12 LEU 37 -13.203 -2.802 -0.044 1008 HD13 LEU 37 HD13 LEU 37 -12.360 -1.496 -0.851 1009 HD21 LEU 37 HD21 LEU 37 -9.821 -0.992 0.481 1010 HD22 LEU 37 HD22 LEU 37 -9.395 -2.252 1.629 1011 HD23 LEU 37 HD23 LEU 37 -10.795 -1.220 1.914 1012 H GLN 38 H GLN 38 -13.967 -4.275 2.568 1013 HA GLN 38 HA GLN 38 -14.853 -1.549 2.670 1014 HB2 GLN 38 HB3 GLN 38 -17.125 -2.436 2.913 1015 HB3 GLN 38 HB2 GLN 38 -16.289 -3.280 1.609 1016 HG2 GLN 38 HG3 GLN 38 -15.822 -5.144 3.170 1017 HG3 GLN 38 HG2 GLN 38 -16.679 -4.286 4.450 1018 HE21 GLN 38 HE21 GLN 38 -17.170 -6.712 2.287 1019 HE22 GLN 38 HE22 GLN 38 -18.839 -6.531 2.062 1020 H THR 39 H THR 39 -14.471 -4.095 5.036 1021 HA THR 39 HA THR 39 -15.791 -2.872 7.180 1022 HB THR 39 HB THR 39 -13.451 -4.759 7.189 1023 HG1 THR 39 HG2 THR 39 -15.142 -5.683 6.178 1024 HG21 THR 39 HG21 THR 39 -15.187 -3.692 9.379 1025 HG22 THR 39 HG22 THR 39 -13.458 -4.029 9.332 1026 HG23 THR 39 HG23 THR 39 -14.601 -5.357 9.465 1027 H GLU 40 H GLU 40 -12.321 -2.849 6.309 1028 HA GLU 40 HA GLU 40 -11.758 -1.179 8.569 1029 HB2 GLU 40 HB3 GLU 40 -9.894 -2.053 6.356 1030 HB3 GLU 40 HB2 GLU 40 -9.463 -1.357 7.921 1031 HG2 GLU 40 HG3 GLU 40 -10.984 -3.956 7.576 1032 HG3 GLU 40 HG2 GLU 40 -9.269 -3.849 7.951 1033 H LEU 41 H LEU 41 -11.817 -0.622 5.088 1034 HA LEU 41 HA LEU 41 -11.034 2.170 5.459 1035 HB2 LEU 41 HB3 LEU 41 -11.523 0.439 3.041 1036 HB3 LEU 41 HB2 LEU 41 -11.498 2.177 2.912 1037 HG LEU 41 HG LEU 41 -9.253 2.260 3.992 1038 HD11 LEU 41 HD11 LEU 41 -9.558 -0.747 3.892 1039 HD12 LEU 41 HD12 LEU 41 -9.183 0.277 5.289 1040 HD13 LEU 41 HD13 LEU 41 -7.995 0.061 4.017 1041 HD21 LEU 41 HD21 LEU 41 -8.711 0.391 1.790 1042 HD22 LEU 41 HD22 LEU 41 -8.289 2.084 1.968 1043 HD23 LEU 41 HD23 LEU 41 -9.873 1.653 1.355 1044 H SER 42 H SER 42 -13.345 1.598 6.779 1045 HA SER 42 HA SER 42 -15.730 1.873 5.449 1046 HB2 SER 42 HB3 SER 42 -15.310 3.245 8.073 1047 HB3 SER 42 HB2 SER 42 -16.660 2.278 7.514 1048 HG SER 42 HG SER 42 -15.442 0.435 7.768 1049 H GLY 43 H GLY 43 -13.454 4.398 6.474 1050 HA2 GLY 43 HA3 GLY 43 -15.151 6.589 5.860 1051 HA3 GLY 43 HA2 GLY 43 -13.411 6.658 6.131 1052 H PHE 44 H PHE 44 -12.456 5.040 4.148 1053 HA PHE 44 HA PHE 44 -12.678 6.732 1.838 1054 HB2 PHE 44 HB3 PHE 44 -11.211 4.135 2.297 1055 HB3 PHE 44 HB2 PHE 44 -11.312 4.881 0.704 1056 HD1 PHE 44 HD2 PHE 44 -10.256 6.990 0.227 1057 HD2 PHE 44 HD1 PHE 44 -10.011 5.238 4.090 1058 HE1 PHE 44 HE2 PHE 44 -8.425 8.587 0.816 1059 HE2 PHE 44 HE1 PHE 44 -8.177 6.816 4.717 1060 HZ PHE 44 HZ PHE 44 -7.389 8.490 3.074 1061 H LEU 45 H LEU 45 -13.850 3.568 2.750 1062 HA LEU 45 HA LEU 45 -15.062 2.815 0.348 1063 HB2 LEU 45 HB3 LEU 45 -14.888 1.222 2.067 1064 HB3 LEU 45 HB2 LEU 45 -15.670 2.274 3.241 1065 HG LEU 45 HG LEU 45 -17.734 2.150 2.072 1066 HD11 LEU 45 HD11 LEU 45 -16.093 0.630 0.054 1067 HD12 LEU 45 HD12 LEU 45 -17.370 1.863 -0.170 1068 HD13 LEU 45 HD13 LEU 45 -17.808 0.210 0.261 1069 HD21 LEU 45 HD21 LEU 45 -16.452 -0.064 3.335 1070 HD22 LEU 45 HD22 LEU 45 -17.506 -0.689 2.059 1071 HD23 LEU 45 HD23 LEU 45 -18.172 0.335 3.323 1072 H ASP 46 H ASP 46 -16.310 4.612 3.110 1073 HA ASP 46 HA ASP 46 -18.768 5.177 1.761 1074 HB2 ASP 46 HB3 ASP 46 -18.561 4.998 4.130 1075 HB3 ASP 46 HB2 ASP 46 -17.668 6.536 4.222 1076 H ALA 47 H ALA 47 -15.723 6.800 2.044 1077 HA ALA 47 HA ALA 47 -16.591 9.297 1.109 1078 HB1 ALA 47 HB1 ALA 47 -14.293 9.791 0.617 1079 HB2 ALA 47 HB2 ALA 47 -13.851 8.102 0.636 1080 HB3 ALA 47 HB3 ALA 47 -14.329 8.901 2.134 1081 H GLN 48 H GLN 48 -15.573 6.381 -0.635 1082 HA GLN 48 HA GLN 48 -16.366 7.769 -3.120 1083 HB2 GLN 48 HB3 GLN 48 -14.710 5.806 -4.100 1084 HB3 GLN 48 HB2 GLN 48 -14.262 7.463 -3.791 1085 HG2 GLN 48 HG3 GLN 48 -12.615 6.399 -2.646 1086 HG3 GLN 48 HG2 GLN 48 -13.747 6.561 -1.332 1087 HE21 GLN 48 HE21 GLN 48 -15.355 4.308 -3.042 1088 HE22 GLN 48 HE22 GLN 48 -14.578 2.899 -2.507 1089 H LYS 49 H LYS 49 -18.464 6.729 -2.080 1090 HA LYS 49 HA LYS 49 -18.950 3.993 -2.857 1091 HB2 LYS 49 HB3 LYS 49 -20.821 6.247 -2.162 1092 HB3 LYS 49 HB2 LYS 49 -21.397 4.705 -2.788 1093 HG2 LYS 49 HG3 LYS 49 -20.269 3.549 -0.907 1094 HG3 LYS 49 HG2 LYS 49 -19.735 5.119 -0.292 1095 HD2 LYS 49 HD3 LYS 49 -22.003 5.871 0.068 1096 HD3 LYS 49 HD2 LYS 49 -22.663 4.499 -0.781 1097 HE2 LYS 49 HE2 LYS 49 -22.703 4.403 1.802 1098 HE3 LYS 49 HE1 LYS 49 -22.146 2.983 0.928 1099 HZ1 LYS 49 HZ1 LYS 49 -19.840 3.900 1.222 1100 HZ2 LYS 49 HZ2 LYS 49 -20.616 3.351 2.597 1101 HZ3 LYS 49 HZ3 LYS 49 -20.521 5.030 2.321 1102 H ASP 50 H ASP 50 -19.527 7.138 -4.270 1103 HA ASP 50 HA ASP 50 -20.768 5.957 -6.605 1104 HB2 ASP 50 HB3 ASP 50 -21.411 8.134 -7.217 1105 HB3 ASP 50 HB2 ASP 50 -21.704 7.971 -5.495 1106 H VAL 51 H VAL 51 -17.636 6.306 -5.887 1107 HA VAL 51 HA VAL 51 -16.833 7.472 -8.425 1108 HB VAL 51 HB VAL 51 -15.069 6.163 -6.352 1109 HG11 VAL 51 HG11 VAL 51 -13.892 6.416 -8.416 1110 HG12 VAL 51 HG12 VAL 51 -13.400 7.788 -7.426 1111 HG13 VAL 51 HG13 VAL 51 -14.588 8.004 -8.713 1112 HG21 VAL 51 HG21 VAL 51 -16.010 9.044 -6.638 1113 HG22 VAL 51 HG22 VAL 51 -14.634 8.588 -5.653 1114 HG23 VAL 51 HG23 VAL 51 -16.246 8.000 -5.247 1115 H ASP 52 H ASP 52 -16.696 6.313 -10.167 1116 HA ASP 52 HA ASP 52 -17.353 3.606 -10.345 1117 HB2 ASP 52 HB3 ASP 52 -17.405 5.344 -12.192 1118 HB3 ASP 52 HB2 ASP 52 -15.663 5.123 -12.309 1119 H ALA 53 H ALA 53 -14.308 5.211 -10.078 1120 HA ALA 53 HA ALA 53 -12.547 3.204 -10.768 1121 HB1 ALA 53 HB1 ALA 53 -11.975 5.610 -10.203 1122 HB2 ALA 53 HB2 ALA 53 -10.857 4.377 -9.630 1123 HB3 ALA 53 HB3 ALA 53 -11.982 5.113 -8.501 1124 H VAL 54 H VAL 54 -14.416 3.514 -7.791 1125 HA VAL 54 HA VAL 54 -12.813 1.845 -6.237 1126 HB VAL 54 HB VAL 54 -14.721 3.222 -5.301 1127 HG11 VAL 54 HG11 VAL 54 -16.568 0.986 -6.079 1128 HG12 VAL 54 HG12 VAL 54 -16.349 2.362 -7.150 1129 HG13 VAL 54 HG13 VAL 54 -16.937 2.613 -5.521 1130 HG21 VAL 54 HG21 VAL 54 -13.729 1.510 -3.869 1131 HG22 VAL 54 HG22 VAL 54 -14.663 0.258 -4.683 1132 HG23 VAL 54 HG23 VAL 54 -15.486 1.422 -3.678 1133 H ASP 55 H ASP 55 -15.519 1.059 -8.384 1134 HA ASP 55 HA ASP 55 -15.524 -1.751 -7.993 1135 HB2 ASP 55 HB3 ASP 55 -17.321 -0.808 -9.194 1136 HB3 ASP 55 HB2 ASP 55 -16.262 -0.031 -10.350 1137 H LYS 56 H LYS 56 -13.919 0.292 -10.326 1138 HA LYS 56 HA LYS 56 -12.695 -1.809 -11.745 1139 HB2 LYS 56 HB3 LYS 56 -12.206 1.142 -11.660 1140 HB3 LYS 56 HB2 LYS 56 -11.149 0.089 -12.576 1141 HG2 LYS 56 HG3 LYS 56 -12.821 0.706 -14.141 1142 HG3 LYS 56 HG2 LYS 56 -13.282 -0.921 -13.637 1143 HD2 LYS 56 HD3 LYS 56 -14.882 0.161 -11.963 1144 HD3 LYS 56 HD2 LYS 56 -14.472 1.713 -12.707 1145 HE2 LYS 56 HE2 LYS 56 -16.515 0.859 -13.654 1146 HE3 LYS 56 HE1 LYS 56 -15.270 0.767 -14.893 1147 HZ1 LYS 56 HZ1 LYS 56 -16.024 -1.489 -13.103 1148 HZ2 LYS 56 HZ2 LYS 56 -15.049 -1.589 -14.513 1149 HZ3 LYS 56 HZ3 LYS 56 -16.682 -1.215 -14.613 1150 H VAL 57 H VAL 57 -11.432 0.185 -9.117 1151 HA VAL 57 HA VAL 57 -8.860 -1.081 -9.098 1152 HB VAL 57 HB VAL 57 -10.374 0.233 -6.825 1153 HG11 VAL 57 HG11 VAL 57 -7.388 0.065 -6.944 1154 HG12 VAL 57 HG12 VAL 57 -8.238 -1.387 -6.483 1155 HG13 VAL 57 HG13 VAL 57 -8.434 0.094 -5.533 1156 HG21 VAL 57 HG21 VAL 57 -9.630 1.565 -9.042 1157 HG22 VAL 57 HG22 VAL 57 -8.058 1.504 -8.247 1158 HG23 VAL 57 HG23 VAL 57 -9.410 2.270 -7.438 1159 H MET 58 H MET 58 -11.928 -1.691 -7.456 1160 HA MET 58 HA MET 58 -11.144 -3.967 -5.967 1161 HB2 MET 58 HB3 MET 58 -13.793 -3.172 -7.147 1162 HB3 MET 58 HB2 MET 58 -13.621 -4.475 -5.986 1163 HG2 MET 58 HG3 MET 58 -12.376 -1.901 -5.269 1164 HG3 MET 58 HG2 MET 58 -14.134 -1.871 -5.324 1165 HE1 MET 58 HE1 MET 58 -15.644 -3.093 -2.925 1166 HE2 MET 58 HE2 MET 58 -15.314 -4.747 -3.416 1167 HE3 MET 58 HE3 MET 58 -15.496 -3.497 -4.640 1168 H LYS 59 H LYS 59 -12.395 -3.495 -9.201 1169 HA LYS 59 HA LYS 59 -12.947 -6.141 -9.860 1170 HB2 LYS 59 HB3 LYS 59 -13.601 -3.952 -11.032 1171 HB3 LYS 59 HB2 LYS 59 -12.055 -4.092 -11.880 1172 HG2 LYS 59 HG3 LYS 59 -13.747 -5.113 -13.243 1173 HG3 LYS 59 HG2 LYS 59 -12.724 -6.380 -12.562 1174 HD2 LYS 59 HD3 LYS 59 -14.539 -7.366 -11.648 1175 HD3 LYS 59 HD2 LYS 59 -14.824 -5.984 -10.631 1176 HE2 LYS 59 HE2 LYS 59 -15.772 -6.113 -13.507 1177 HE3 LYS 59 HE1 LYS 59 -16.747 -6.687 -12.151 1178 HZ1 LYS 59 HZ1 LYS 59 -17.295 -4.425 -12.727 1179 HZ2 LYS 59 HZ2 LYS 59 -15.773 -3.883 -12.559 1180 HZ3 LYS 59 HZ3 LYS 59 -16.644 -4.350 -11.201 1181 H GLU 60 H GLU 60 -10.055 -4.197 -10.269 1182 HA GLU 60 HA GLU 60 -8.536 -6.175 -11.627 1183 HB2 GLU 60 HB3 GLU 60 -7.806 -3.759 -10.012 1184 HB3 GLU 60 HB2 GLU 60 -6.584 -4.773 -10.802 1185 HG2 GLU 60 HG3 GLU 60 -7.782 -4.384 -12.970 1186 HG3 GLU 60 HG2 GLU 60 -8.905 -3.348 -12.129 1187 H LEU 61 H LEU 61 -9.083 -5.427 -8.265 1188 HA LEU 61 HA LEU 61 -7.278 -7.397 -7.235 1189 HB2 LEU 61 HB3 LEU 61 -9.639 -5.921 -6.082 1190 HB3 LEU 61 HB2 LEU 61 -8.996 -7.314 -5.242 1191 HG LEU 61 HG LEU 61 -8.059 -4.956 -4.665 1192 HD11 LEU 61 HD11 LEU 61 -5.867 -5.967 -4.098 1193 HD12 LEU 61 HD12 LEU 61 -6.172 -7.275 -5.229 1194 HD13 LEU 61 HD13 LEU 61 -7.185 -7.094 -3.789 1195 HD21 LEU 61 HD21 LEU 61 -7.488 -4.419 -7.136 1196 HD22 LEU 61 HD22 LEU 61 -6.194 -5.607 -6.991 1197 HD23 LEU 61 HD23 LEU 61 -6.194 -4.190 -5.979 1198 H ASP 62 H ASP 62 -10.599 -7.378 -8.318 1199 HA ASP 62 HA ASP 62 -11.120 -10.103 -7.670 1200 HB2 ASP 62 HB3 ASP 62 -12.450 -8.113 -9.495 1201 HB3 ASP 62 HB2 ASP 62 -12.841 -9.813 -9.655 1202 H GLU 63 H GLU 63 -9.652 -8.538 -10.447 1203 HA GLU 63 HA GLU 63 -9.466 -10.882 -12.057 1204 HB2 GLU 63 HB3 GLU 63 -7.565 -8.522 -11.884 1205 HB3 GLU 63 HB2 GLU 63 -7.499 -9.756 -13.114 1206 HG2 GLU 63 HG3 GLU 63 -9.917 -9.186 -13.730 1207 HG3 GLU 63 HG2 GLU 63 -9.774 -7.861 -12.592 1208 H ASN 64 H ASN 64 -7.557 -9.453 -9.544 1209 HA ASN 64 HA ASN 64 -5.659 -11.627 -9.453 1210 HB2 ASN 64 HB3 ASN 64 -5.403 -9.129 -8.602 1211 HB3 ASN 64 HB2 ASN 64 -6.060 -9.825 -7.123 1212 HD21 ASN 64 HD21 ASN 64 -3.255 -8.886 -7.620 1213 HD22 ASN 64 HD22 ASN 64 -2.276 -10.226 -7.301 1214 H GLY 65 H GLY 65 -8.336 -12.424 -9.469 1215 HA2 GLY 65 HA3 GLY 65 -8.826 -13.494 -6.764 1216 HA3 GLY 65 HA2 GLY 65 -10.027 -13.346 -8.065 1217 H ASP 66 H ASP 66 -6.898 -14.244 -8.978 1218 HA ASP 66 HA ASP 66 -7.697 -16.656 -10.191 1219 HB2 ASP 66 HB3 ASP 66 -5.761 -15.349 -10.913 1220 HB3 ASP 66 HB2 ASP 66 -4.958 -15.704 -9.382 1221 H GLY 67 H GLY 67 -6.218 -15.908 -7.120 1222 HA2 GLY 67 HA3 GLY 67 -7.052 -18.486 -6.044 1223 HA3 GLY 67 HA2 GLY 67 -5.320 -18.247 -6.105 1224 H GLU 68 H GLU 68 -4.643 -16.013 -5.239 1225 HA GLU 68 HA GLU 68 -6.099 -15.329 -2.754 1226 HB2 GLU 68 HB3 GLU 68 -3.204 -16.140 -3.071 1227 HB3 GLU 68 HB2 GLU 68 -3.857 -15.376 -1.618 1228 HG2 GLU 68 HG3 GLU 68 -5.220 -17.184 -1.112 1229 HG3 GLU 68 HG2 GLU 68 -5.136 -17.925 -2.687 1230 H VAL 69 H VAL 69 -5.193 -13.288 -1.786 1231 HA VAL 69 HA VAL 69 -3.926 -11.608 -3.816 1232 HB VAL 69 HB VAL 69 -6.125 -10.699 -3.640 1233 HG11 VAL 69 HG11 VAL 69 -5.831 -11.100 -0.682 1234 HG12 VAL 69 HG12 VAL 69 -7.049 -11.779 -1.763 1235 HG13 VAL 69 HG13 VAL 69 -7.073 -10.057 -1.365 1236 HG21 VAL 69 HG21 VAL 69 -4.230 -9.144 -1.839 1237 HG22 VAL 69 HG22 VAL 69 -5.770 -8.507 -2.394 1238 HG23 VAL 69 HG23 VAL 69 -4.525 -8.919 -3.563 1239 H ASP 70 H ASP 70 -2.056 -10.664 -3.184 1240 HA ASP 70 HA ASP 70 -1.081 -11.457 -0.559 1241 HB2 ASP 70 HB3 ASP 70 0.878 -11.795 -1.619 1242 HB3 ASP 70 HB2 ASP 70 0.123 -11.277 -3.108 1243 H PHE 71 H PHE 71 0.631 -9.813 0.372 1244 HA PHE 71 HA PHE 71 -0.856 -7.694 1.464 1245 HB2 PHE 71 HB3 PHE 71 1.152 -8.776 2.530 1246 HB3 PHE 71 HB2 PHE 71 2.140 -7.880 1.366 1247 HD1 PHE 71 HD1 PHE 71 -0.659 -7.260 3.765 1248 HD2 PHE 71 HD2 PHE 71 2.992 -5.732 2.042 1249 HE1 PHE 71 HE1 PHE 71 -0.761 -5.283 5.230 1250 HE2 PHE 71 HE2 PHE 71 2.871 -3.795 3.516 1251 HZ PHE 71 HZ PHE 71 1.030 -3.541 5.103 1252 H GLN 72 H GLN 72 1.682 -7.751 -0.999 1253 HA GLN 72 HA GLN 72 1.747 -4.966 -1.488 1254 HB2 GLN 72 HB3 GLN 72 2.628 -7.381 -3.023 1255 HB3 GLN 72 HB2 GLN 72 2.744 -5.772 -3.787 1256 HG2 GLN 72 HG3 GLN 72 4.147 -5.080 -1.884 1257 HG3 GLN 72 HG2 GLN 72 3.917 -6.653 -1.144 1258 HE21 GLN 72 HE21 GLN 72 4.736 -5.597 -4.504 1259 HE22 GLN 72 HE22 GLN 72 6.071 -6.620 -4.648 1260 H GLU 73 H GLU 73 -0.153 -7.583 -2.819 1261 HA GLU 73 HA GLU 73 -1.663 -6.035 -4.705 1262 HB2 GLU 73 HB3 GLU 73 -2.180 -8.675 -3.305 1263 HB3 GLU 73 HB2 GLU 73 -3.176 -8.013 -4.602 1264 HG2 GLU 73 HG3 GLU 73 -1.458 -8.105 -6.188 1265 HG3 GLU 73 HG2 GLU 73 -0.190 -8.348 -4.979 1266 H TYR 74 H TYR 74 -2.141 -7.025 -1.345 1267 HA TYR 74 HA TYR 74 -4.709 -5.877 -0.943 1268 HB2 TYR 74 HB3 TYR 74 -3.913 -7.507 0.615 1269 HB3 TYR 74 HB2 TYR 74 -2.472 -6.556 0.952 1270 HD1 TYR 74 HD1 TYR 74 -6.171 -5.806 0.861 1271 HD2 TYR 74 HD2 TYR 74 -2.490 -5.606 3.076 1272 HE1 TYR 74 HE1 TYR 74 -7.339 -4.655 2.694 1273 HE2 TYR 74 HE2 TYR 74 -3.657 -4.457 4.926 1274 HH TYR 74 HH TYR 74 -7.134 -4.110 4.983 1275 H VAL 75 H VAL 75 -1.476 -4.507 -0.209 1276 HA VAL 75 HA VAL 75 -2.594 -2.196 0.855 1277 HB VAL 75 HB VAL 75 -0.379 -1.122 0.657 1278 HG11 VAL 75 HG11 VAL 75 -0.865 -2.479 2.617 1279 HG12 VAL 75 HG12 VAL 75 0.790 -2.801 2.122 1280 HG13 VAL 75 HG13 VAL 75 -0.481 -3.960 1.739 1281 HG21 VAL 75 HG21 VAL 75 0.971 -3.577 -0.164 1282 HG22 VAL 75 HG22 VAL 75 1.242 -1.916 -0.718 1283 HG23 VAL 75 HG23 VAL 75 0.022 -2.890 -1.478 1284 H VAL 76 H VAL 76 -1.653 -2.916 -2.478 1285 HA VAL 76 HA VAL 76 -1.833 -0.252 -3.346 1286 HB VAL 76 HB VAL 76 -0.682 -1.955 -4.703 1287 HG11 VAL 76 HG11 VAL 76 -2.008 -3.907 -4.431 1288 HG12 VAL 76 HG12 VAL 76 -2.138 -3.452 -6.123 1289 HG13 VAL 76 HG13 VAL 76 -3.470 -3.112 -5.028 1290 HG21 VAL 76 HG21 VAL 76 -1.576 0.104 -5.799 1291 HG22 VAL 76 HG22 VAL 76 -3.074 -0.756 -6.157 1292 HG23 VAL 76 HG23 VAL 76 -1.573 -1.273 -6.902 1293 H LEU 77 H LEU 77 -4.211 -2.786 -2.977 1294 HA LEU 77 HA LEU 77 -6.362 -1.593 -4.348 1295 HB2 LEU 77 HB3 LEU 77 -6.475 -3.871 -3.601 1296 HB3 LEU 77 HB2 LEU 77 -6.315 -3.386 -1.914 1297 HG LEU 77 HG LEU 77 -8.497 -2.187 -2.044 1298 HD11 LEU 77 HD11 LEU 77 -9.840 -2.927 -4.214 1299 HD12 LEU 77 HD12 LEU 77 -8.234 -2.886 -4.933 1300 HD13 LEU 77 HD13 LEU 77 -8.901 -1.451 -4.149 1301 HD21 LEU 77 HD21 LEU 77 -9.812 -4.422 -2.862 1302 HD22 LEU 77 HD22 LEU 77 -9.069 -4.277 -1.276 1303 HD23 LEU 77 HD23 LEU 77 -8.212 -5.099 -2.571 1304 H VAL 78 H VAL 78 -5.416 -1.413 -0.939 1305 HA VAL 78 HA VAL 78 -7.412 0.540 -0.364 1306 HB VAL 78 HB VAL 78 -6.384 0.756 1.814 1307 HG11 VAL 78 HG11 VAL 78 -7.319 -1.245 2.376 1308 HG12 VAL 78 HG12 VAL 78 -5.958 -2.117 1.684 1309 HG13 VAL 78 HG13 VAL 78 -7.326 -1.695 0.670 1310 HG21 VAL 78 HG21 VAL 78 -4.188 -1.002 0.691 1311 HG22 VAL 78 HG22 VAL 78 -4.323 -0.518 2.368 1312 HG23 VAL 78 HG23 VAL 78 -3.960 0.694 1.143 1313 H ALA 79 H ALA 79 -3.973 0.667 -1.091 1314 HA ALA 79 HA ALA 79 -3.586 3.420 -0.710 1315 HB1 ALA 79 HB1 ALA 79 -1.596 3.209 -1.866 1316 HB2 ALA 79 HB2 ALA 79 -2.185 1.877 -2.855 1317 HB3 ALA 79 HB3 ALA 79 -1.816 1.614 -1.149 1318 H ALA 80 H ALA 80 -4.447 1.650 -3.686 1319 HA ALA 80 HA ALA 80 -4.460 3.849 -5.383 1320 HB1 ALA 80 HB1 ALA 80 -6.265 2.433 -6.637 1321 HB2 ALA 80 HB2 ALA 80 -5.855 1.185 -5.456 1322 HB3 ALA 80 HB3 ALA 80 -4.613 1.849 -6.524 1323 H LEU 81 H LEU 81 -7.053 2.448 -3.445 1324 HA LEU 81 HA LEU 81 -9.043 4.356 -4.169 1325 HB2 LEU 81 HB3 LEU 81 -8.722 2.635 -1.702 1326 HB3 LEU 81 HB2 LEU 81 -10.146 3.613 -2.043 1327 HG LEU 81 HG LEU 81 -9.095 1.485 -3.941 1328 HD11 LEU 81 HD11 LEU 81 -9.799 0.324 -1.972 1329 HD12 LEU 81 HD12 LEU 81 -11.066 0.160 -3.183 1330 HD13 LEU 81 HD13 LEU 81 -11.279 1.288 -1.840 1331 HD21 LEU 81 HD21 LEU 81 -11.663 3.121 -3.825 1332 HD22 LEU 81 HD22 LEU 81 -11.466 1.673 -4.803 1333 HD23 LEU 81 HD23 LEU 81 -10.470 3.084 -5.141 1334 H THR 82 H THR 82 -6.680 4.156 -1.552 1335 HA THR 82 HA THR 82 -7.499 6.442 -0.159 1336 HB THR 82 HB THR 82 -4.663 5.407 -0.293 1337 HG1 THR 82 HG2 THR 82 -6.243 3.756 0.208 1338 HG21 THR 82 HG21 THR 82 -6.080 6.670 2.042 1339 HG22 THR 82 HG22 THR 82 -5.231 7.648 0.839 1340 HG23 THR 82 HG23 THR 82 -4.356 6.443 1.784 1341 H VAL 83 H VAL 83 -4.926 6.084 -2.602 1342 HA VAL 83 HA VAL 83 -4.117 8.783 -2.528 1343 HB VAL 83 HB VAL 83 -2.786 6.931 -3.532 1344 HG11 VAL 83 HG11 VAL 83 -4.567 5.820 -4.721 1345 HG12 VAL 83 HG12 VAL 83 -3.190 6.179 -5.766 1346 HG13 VAL 83 HG13 VAL 83 -4.639 7.143 -5.903 1347 HG21 VAL 83 HG21 VAL 83 -2.216 9.322 -4.078 1348 HG22 VAL 83 HG22 VAL 83 -3.267 9.210 -5.501 1349 HG23 VAL 83 HG23 VAL 83 -1.843 8.206 -5.394 1350 H ALA 84 H ALA 84 -6.420 7.122 -4.654 1351 HA ALA 84 HA ALA 84 -7.005 9.363 -6.243 1352 HB1 ALA 84 HB1 ALA 84 -7.591 7.120 -6.962 1353 HB2 ALA 84 HB2 ALA 84 -9.049 8.107 -6.897 1354 HB3 ALA 84 HB3 ALA 84 -8.717 6.934 -5.617 1355 H MET 85 H MET 85 -8.692 7.972 -3.462 1356 HA MET 85 HA MET 85 -10.666 10.008 -3.301 1357 HB2 MET 85 HB3 MET 85 -10.306 7.570 -2.065 1358 HB3 MET 85 HB2 MET 85 -9.971 8.722 -0.774 1359 HG2 MET 85 HG3 MET 85 -12.453 8.809 -2.515 1360 HG3 MET 85 HG2 MET 85 -12.353 8.032 -0.942 1361 HE1 MET 85 HE1 MET 85 -12.162 10.468 1.651 1362 HE2 MET 85 HE2 MET 85 -10.568 10.128 1.006 1363 HE3 MET 85 HE3 MET 85 -11.773 8.855 1.057 1364 H ASN 86 H ASN 86 -7.565 9.564 -1.565 1365 HA ASN 86 HA ASN 86 -7.974 11.822 0.069 1366 HB2 ASN 86 HB3 ASN 86 -6.379 10.022 0.593 1367 HB3 ASN 86 HB2 ASN 86 -5.297 10.642 -0.648 1368 HD21 ASN 86 HD21 ASN 86 -4.075 12.537 -0.168 1369 HD22 ASN 86 HD22 ASN 86 -4.194 13.352 1.317 1370 H ASN 87 H ASN 87 -6.141 11.473 -2.960 1371 HA ASN 87 HA ASN 87 -5.155 14.139 -2.950 1372 HB2 ASN 87 HB3 ASN 87 -5.612 12.130 -5.122 1373 HB3 ASN 87 HB2 ASN 87 -4.972 13.732 -5.470 1374 HD21 ASN 87 HD21 ASN 87 -3.413 11.519 -6.039 1375 HD22 ASN 87 HD22 ASN 87 -2.101 11.389 -4.989 1376 H PHE 88 H PHE 88 -8.040 12.659 -4.239 1377 HA PHE 88 HA PHE 88 -9.085 14.707 -5.743 1378 HB2 PHE 88 HB3 PHE 88 -10.091 12.432 -5.495 1379 HB3 PHE 88 HB2 PHE 88 -10.713 12.900 -3.918 1380 HD1 PHE 88 HD1 PHE 88 -10.825 13.652 -7.549 1381 HD2 PHE 88 HD2 PHE 88 -12.710 14.282 -3.734 1382 HE1 PHE 88 HE1 PHE 88 -12.795 14.678 -8.674 1383 HE2 PHE 88 HE2 PHE 88 -14.654 15.294 -4.861 1384 HZ PHE 88 HZ PHE 88 -14.701 15.495 -7.323 1385 H PHE 89 H PHE 89 -8.717 14.520 -2.296 1386 HA PHE 89 HA PHE 89 -10.683 16.313 -1.475 1387 HB2 PHE 89 HB3 PHE 89 -8.050 15.540 -0.323 1388 HB3 PHE 89 HB2 PHE 89 -8.895 16.860 0.389 1389 HD1 PHE 89 HD1 PHE 89 -11.707 16.217 0.359 1390 HD2 PHE 89 HD2 PHE 89 -8.367 13.559 0.900 1391 HE1 PHE 89 HE1 PHE 89 -13.157 14.648 1.554 1392 HE2 PHE 89 HE2 PHE 89 -9.845 11.975 2.111 1393 HZ PHE 89 HZ PHE 89 -12.248 12.518 2.433 1394 H TRP 90 H TRP 90 -7.372 16.902 -2.526 1395 HA TRP 90 HA TRP 90 -7.569 19.705 -1.918 1396 HB2 TRP 90 HB3 TRP 90 -5.399 18.310 -3.461 1397 HB3 TRP 90 HB2 TRP 90 -5.275 19.849 -2.598 1398 HD1 TRP 90 HD TRP 90 -4.984 16.208 -2.211 1399 HE1 TRP 90 HE1 TRP 90 -4.552 15.597 0.241 1400 HE3 TRP 90 HE3 TRP 90 -6.002 20.678 -0.018 1401 HZ2 TRP 90 HZ2 TRP 90 -4.648 16.837 2.815 1402 HZ3 TRP 90 HZ3 TRP 90 -5.843 20.947 2.424 1403 HH2 TRP 90 HH TRP 90 -5.156 19.020 3.855 1404 H GLU 91 H GLU 91 -6.342 18.540 -5.019 1405 HA GLU 91 HA GLU 91 -8.080 20.620 -6.280 1406 HB2 GLU 91 HB3 GLU 91 -5.550 19.338 -7.302 1407 HB3 GLU 91 HB2 GLU 91 -6.441 20.628 -8.094 1408 HG2 GLU 91 HG3 GLU 91 -5.907 22.203 -6.467 1409 HG3 GLU 91 HG2 GLU 91 -5.570 20.993 -5.242 1410 H ASN 92 H ASN 92 -6.474 17.939 -7.842 1411 HA ASN 92 HA ASN 92 -8.948 16.529 -8.360 1412 HB2 ASN 92 HB3 ASN 92 -8.644 18.198 -10.238 1413 HB3 ASN 92 HB2 ASN 92 -7.163 17.338 -10.646 1414 HD21 ASN 92 HD21 ASN 92 -10.661 17.121 -10.659 1415 HD22 ASN 92 HD22 ASN 92 -10.754 15.666 -11.531 1416 H SER 93 H SER 93 -8.424 14.471 -9.539 1417 HA SER 93 HA SER 93 -7.292 12.502 -9.647 1418 HB2 SER 93 HB3 SER 93 -4.773 14.133 -9.717 1419 HB3 SER 93 HB2 SER 93 -5.105 12.618 -10.531 1420 HG SER 93 HG SER 93 -6.863 14.717 -11.100 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -10.676 6.284 8.638 2 HA2 GLY 1 HA3 GLY 1 -12.438 5.463 10.720 3 HA3 GLY 1 HA2 GLY 1 -11.925 4.536 9.332 4 H SER 2 H SER 2 -11.127 2.674 10.043 5 HA SER 2 HA SER 2 -9.969 2.220 12.559 6 HB2 SER 2 HB3 SER 2 -9.457 0.610 10.066 7 HB3 SER 2 HB2 SER 2 -9.456 0.053 11.731 8 HG SER 2 HG SER 2 -11.355 -0.381 10.489 9 H GLU 3 H GLU 3 -7.687 1.244 12.754 10 HA GLU 3 HA GLU 3 -5.785 3.214 12.459 11 HB2 GLU 3 HB3 GLU 3 -5.197 0.241 12.410 12 HB3 GLU 3 HB2 GLU 3 -4.114 1.542 12.892 13 HG2 GLU 3 HG3 GLU 3 -4.831 0.868 14.930 14 HG3 GLU 3 HG2 GLU 3 -6.040 2.105 14.617 15 H LEU 4 H LEU 4 -6.826 0.766 10.253 16 HA LEU 4 HA LEU 4 -4.691 0.816 8.403 17 HB2 LEU 4 HB3 LEU 4 -7.639 0.247 7.954 18 HB3 LEU 4 HB2 LEU 4 -6.401 -0.045 6.771 19 HG LEU 4 HG LEU 4 -6.514 -2.150 7.714 20 HD11 LEU 4 HD11 LEU 4 -4.613 -2.570 9.062 21 HD12 LEU 4 HD12 LEU 4 -4.624 -0.983 9.782 22 HD13 LEU 4 HD13 LEU 4 -4.171 -1.190 8.083 23 HD21 LEU 4 HD21 LEU 4 -6.637 -1.580 10.599 24 HD22 LEU 4 HD22 LEU 4 -7.659 -2.594 9.589 25 HD23 LEU 4 HD23 LEU 4 -8.009 -0.901 9.711 26 H GLU 5 H GLU 5 -7.665 2.780 8.553 27 HA GLU 5 HA GLU 5 -7.045 4.148 6.153 28 HB2 GLU 5 HB3 GLU 5 -8.822 4.963 8.481 29 HB3 GLU 5 HB2 GLU 5 -8.696 5.862 6.974 30 HG2 GLU 5 HG3 GLU 5 -9.359 3.719 5.755 31 HG3 GLU 5 HG2 GLU 5 -9.654 3.018 7.322 32 H THR 6 H THR 6 -6.405 4.803 9.554 33 HA THR 6 HA THR 6 -5.008 7.248 9.146 34 HB THR 6 HB THR 6 -4.487 5.232 11.341 35 HG1 THR 6 HG2 THR 6 -6.209 5.973 12.345 36 HG21 THR 6 HG21 THR 6 -2.871 6.930 11.509 37 HG22 THR 6 HG22 THR 6 -4.123 7.495 12.588 38 HG23 THR 6 HG23 THR 6 -3.974 8.187 10.973 39 H ALA 7 H ALA 7 -3.948 3.853 9.369 40 HA ALA 7 HA ALA 7 -1.215 4.277 9.110 41 HB1 ALA 7 HB1 ALA 7 -2.904 1.967 8.132 42 HB2 ALA 7 HB2 ALA 7 -2.051 2.080 9.668 43 HB3 ALA 7 HB3 ALA 7 -1.147 1.941 8.161 44 H MET 8 H MET 8 -3.649 3.732 6.561 45 HA MET 8 HA MET 8 -1.801 4.053 4.425 46 HB2 MET 8 HB3 MET 8 -4.800 4.454 4.465 47 HB3 MET 8 HB2 MET 8 -3.816 4.415 3.009 48 HG2 MET 8 HG3 MET 8 -4.135 2.145 5.013 49 HG3 MET 8 HG2 MET 8 -4.775 2.194 3.373 50 HE1 MET 8 HE1 MET 8 -1.708 3.098 1.492 51 HE2 MET 8 HE2 MET 8 -3.465 2.940 1.527 52 HE3 MET 8 HE3 MET 8 -2.472 1.573 1.031 53 H GLU 9 H GLU 9 -3.934 6.334 6.135 54 HA GLU 9 HA GLU 9 -3.199 8.465 4.480 55 HB2 GLU 9 HB3 GLU 9 -4.426 8.469 7.236 56 HB3 GLU 9 HB2 GLU 9 -4.048 9.960 6.374 57 HG2 GLU 9 HG3 GLU 9 -5.410 9.198 4.450 58 HG3 GLU 9 HG2 GLU 9 -5.818 7.731 5.325 59 H THR 10 H THR 10 -1.769 7.107 7.334 60 HA THR 10 HA THR 10 0.094 9.152 7.933 61 HB THR 10 HB THR 10 0.708 6.191 8.077 62 HG1 THR 10 HG2 THR 10 -1.405 6.748 9.000 63 HG21 THR 10 HG21 THR 10 1.468 8.453 9.944 64 HG22 THR 10 HG22 THR 10 2.485 7.906 8.623 65 HG23 THR 10 HG23 THR 10 2.099 6.812 9.947 66 H LEU 11 H LEU 11 0.175 6.438 5.661 67 HA LEU 11 HA LEU 11 2.703 7.053 4.563 68 HB2 LEU 11 HB3 LEU 11 0.325 5.558 3.413 69 HB3 LEU 11 HB2 LEU 11 1.870 5.685 2.582 70 HG LEU 11 HG LEU 11 1.597 4.577 5.394 71 HD11 LEU 11 HD11 LEU 11 0.439 3.298 3.375 72 HD12 LEU 11 HD12 LEU 11 1.382 2.451 4.593 73 HD13 LEU 11 HD13 LEU 11 2.109 2.816 3.039 74 HD21 LEU 11 HD21 LEU 11 3.812 3.668 3.720 75 HD22 LEU 11 HD22 LEU 11 3.849 4.329 5.334 76 HD23 LEU 11 HD23 LEU 11 3.871 5.412 3.944 77 H ILE 12 H ILE 12 -0.600 8.047 3.802 78 HA ILE 12 HA ILE 12 -0.019 9.527 1.459 79 HB ILE 12 HB ILE 12 -2.195 9.933 3.545 80 HG12 ILE 12 HG13 ILE 12 -2.190 7.742 2.186 81 HG13 ILE 12 HG12 ILE 12 -3.642 8.726 2.030 82 HG21 ILE 12 HG21 ILE 12 -2.418 11.935 2.570 83 HG22 ILE 12 HG22 ILE 12 -3.224 11.009 1.320 84 HG23 ILE 12 HG23 ILE 12 -1.527 11.458 1.120 85 HD11 ILE 12 HD11 ILE 12 -3.230 9.215 -0.159 86 HD12 ILE 12 HD12 ILE 12 -2.316 7.735 -0.067 87 HD13 ILE 12 HD13 ILE 12 -1.477 9.278 0.033 88 H ASN 13 H ASN 13 -0.112 10.411 4.876 89 HA ASN 13 HA ASN 13 0.329 13.178 4.642 90 HB2 ASN 13 HB3 ASN 13 1.205 11.270 6.827 91 HB3 ASN 13 HB2 ASN 13 1.249 13.019 6.942 92 HD21 ASN 13 HD21 ASN 13 -0.485 10.868 8.319 93 HD22 ASN 13 HD22 ASN 13 -2.064 11.473 8.146 94 H VAL 14 H VAL 14 2.655 10.516 5.082 95 HA VAL 14 HA VAL 14 4.927 12.200 4.865 96 HB VAL 14 HB VAL 14 6.222 10.125 4.659 97 HG11 VAL 14 HG11 VAL 14 4.082 9.577 6.712 98 HG12 VAL 14 HG12 VAL 14 5.100 10.994 6.860 99 HG13 VAL 14 HG13 VAL 14 5.827 9.395 6.854 100 HG21 VAL 14 HG21 VAL 14 4.528 8.897 3.219 101 HG22 VAL 14 HG22 VAL 14 3.558 8.715 4.695 102 HG23 VAL 14 HG23 VAL 14 5.124 7.959 4.585 103 H PHE 15 H PHE 15 3.053 10.313 2.562 104 HA PHE 15 HA PHE 15 4.709 10.697 0.314 105 HB2 PHE 15 HB3 PHE 15 2.807 9.120 0.316 106 HB3 PHE 15 HB2 PHE 15 1.681 10.471 0.418 107 HD1 PHE 15 HD1 PHE 15 4.144 8.746 -1.735 108 HD2 PHE 15 HD2 PHE 15 1.267 11.929 -1.478 109 HE1 PHE 15 HE1 PHE 15 4.242 9.034 -4.179 110 HE2 PHE 15 HE2 PHE 15 1.368 12.215 -3.935 111 HZ PHE 15 HZ PHE 15 2.837 10.789 -5.282 112 H HIS 16 H HIS 16 1.976 12.600 1.586 113 HA HIS 16 HA HIS 16 2.205 14.657 -0.359 114 HB2 HIS 16 HB3 HIS 16 0.964 14.659 2.417 115 HB3 HIS 16 HB2 HIS 16 0.945 16.059 1.367 116 HD1 HIS 16 HD1 HIS 16 0.436 14.541 -1.351 117 HD2 HIS 16 HD2 HIS 16 -1.754 13.984 2.158 118 HE1 HIS 16 HE1 HIS 16 -1.837 13.642 -2.055 119 HE2 HIS 16 HE2 HIS 16 -3.188 13.287 0.075 120 H ALA 17 H ALA 17 3.635 14.174 2.821 121 HA ALA 17 HA ALA 17 4.865 16.676 3.134 122 HB1 ALA 17 HB1 ALA 17 6.310 15.637 4.733 123 HB2 ALA 17 HB2 ALA 17 6.074 14.046 4.029 124 HB3 ALA 17 HB3 ALA 17 4.747 14.841 4.877 125 H HIS 18 H HIS 18 6.153 13.704 1.685 126 HA HIS 18 HA HIS 18 8.552 15.005 0.791 127 HB2 HIS 18 HB3 HIS 18 7.389 12.282 0.234 128 HB3 HIS 18 HB2 HIS 18 8.852 12.885 -0.552 129 HD1 HIS 18 HD1 HIS 18 10.976 13.300 0.895 130 HD2 HIS 18 HD2 HIS 18 7.714 11.775 3.054 131 HE1 HIS 18 HE1 HIS 18 11.835 12.655 3.190 132 HE2 HIS 18 HE2 HIS 18 9.860 11.735 4.509 133 H SER 19 H SER 19 5.458 14.280 -0.706 134 HA SER 19 HA SER 19 6.165 14.855 -3.350 135 HB2 SER 19 HB3 SER 19 3.577 15.390 -1.891 136 HB3 SER 19 HB2 SER 19 3.763 15.493 -3.635 137 HG SER 19 HG SER 19 4.083 13.234 -1.911 138 H GLY 20 H GLY 20 5.231 16.952 -0.686 139 HA2 GLY 20 HA3 GLY 20 5.106 19.381 -2.096 140 HA3 GLY 20 HA2 GLY 20 5.385 19.209 -0.368 141 H LYS 21 H LYS 21 7.818 17.419 -1.610 142 HA LYS 21 HA LYS 21 9.693 19.662 -1.321 143 HB2 LYS 21 HB3 LYS 21 10.295 16.689 -1.428 144 HB3 LYS 21 HB2 LYS 21 11.378 17.986 -0.945 145 HG2 LYS 21 HG3 LYS 21 8.797 17.272 0.460 146 HG3 LYS 21 HG2 LYS 21 10.403 16.778 0.986 147 HD2 LYS 21 HD3 LYS 21 11.066 19.157 1.196 148 HD3 LYS 21 HD2 LYS 21 9.439 19.665 0.757 149 HE2 LYS 21 HE2 LYS 21 10.137 17.925 3.146 150 HE3 LYS 21 HE1 LYS 21 9.788 19.643 3.197 151 HZ1 LYS 21 HZ1 LYS 21 7.910 18.032 3.683 152 HZ2 LYS 21 HZ2 LYS 21 7.780 17.716 2.063 153 HZ3 LYS 21 HZ3 LYS 21 7.554 19.292 2.671 154 H GLU 22 H GLU 22 10.165 16.736 -3.176 155 HA GLU 22 HA GLU 22 11.293 18.306 -5.369 156 HB2 GLU 22 HB3 GLU 22 11.348 15.386 -4.656 157 HB3 GLU 22 HB2 GLU 22 12.079 16.040 -6.136 158 HG2 GLU 22 HG3 GLU 22 12.696 17.015 -3.350 159 HG3 GLU 22 HG2 GLU 22 13.648 15.764 -4.130 160 H GLY 23 H GLY 23 8.417 16.609 -4.639 161 HA2 GLY 23 HA3 GLY 23 7.860 15.847 -7.370 162 HA3 GLY 23 HA2 GLY 23 6.836 15.572 -5.958 163 H ASP 24 H ASP 24 5.362 16.224 -7.800 164 HA ASP 24 HA ASP 24 5.010 19.089 -8.231 165 HB2 ASP 24 HB3 ASP 24 4.467 17.277 -9.941 166 HB3 ASP 24 HB2 ASP 24 3.114 16.813 -8.911 167 H LYS 25 H LYS 25 2.114 18.991 -8.000 168 HA LYS 25 HA LYS 25 1.763 19.632 -5.272 169 HB2 LYS 25 HB3 LYS 25 -0.756 18.720 -6.064 170 HB3 LYS 25 HB2 LYS 25 -0.172 20.364 -6.104 171 HG2 LYS 25 HG3 LYS 25 -1.057 19.805 -8.204 172 HG3 LYS 25 HG2 LYS 25 0.691 19.988 -8.431 173 HD2 LYS 25 HD3 LYS 25 0.949 17.607 -8.671 174 HD3 LYS 25 HD2 LYS 25 -0.627 17.288 -7.963 175 HE2 LYS 25 HE2 LYS 25 -0.589 17.030 -10.462 176 HE3 LYS 25 HE1 LYS 25 -1.763 18.193 -9.887 177 HZ1 LYS 25 HZ1 LYS 25 0.959 18.881 -10.907 178 HZ2 LYS 25 HZ2 LYS 25 -0.234 20.002 -10.377 179 HZ3 LYS 25 HZ3 LYS 25 -0.497 19.064 -11.738 180 H TYR 26 H TYR 26 1.073 16.678 -7.084 181 HA TYR 26 HA TYR 26 1.567 15.266 -4.643 182 HB2 TYR 26 HB3 TYR 26 -0.399 13.630 -5.441 183 HB3 TYR 26 HB2 TYR 26 -0.694 14.986 -4.367 184 HD1 TYR 26 HD2 TYR 26 -0.897 13.825 -7.885 185 HD2 TYR 26 HD1 TYR 26 -1.908 16.946 -5.111 186 HE1 TYR 26 HE2 TYR 26 -2.382 14.840 -9.571 187 HE2 TYR 26 HE1 TYR 26 -3.410 17.955 -6.808 188 HH TYR 26 HH TYR 26 -4.531 16.339 -9.291 189 H LYS 27 H LYS 27 3.467 14.520 -5.361 190 HA LYS 27 HA LYS 27 3.440 12.159 -6.839 191 HB2 LYS 27 HB3 LYS 27 4.618 14.567 -8.206 192 HB3 LYS 27 HB2 LYS 27 5.396 13.016 -8.394 193 HG2 LYS 27 HG3 LYS 27 2.602 13.799 -9.207 194 HG3 LYS 27 HG2 LYS 27 3.910 13.234 -10.217 195 HD2 LYS 27 HD3 LYS 27 3.765 11.082 -8.569 196 HD3 LYS 27 HD2 LYS 27 2.097 11.624 -8.467 197 HE2 LYS 27 HE2 LYS 27 2.699 11.733 -11.235 198 HE3 LYS 27 HE1 LYS 27 3.488 10.300 -10.610 199 HZ1 LYS 27 HZ1 LYS 27 0.727 10.626 -9.699 200 HZ2 LYS 27 HZ2 LYS 27 1.587 9.243 -10.222 201 HZ3 LYS 27 HZ3 LYS 27 0.967 10.305 -11.335 202 H LEU 28 H LEU 28 5.535 11.059 -6.724 203 HA LEU 28 HA LEU 28 7.307 12.316 -4.749 204 HB2 LEU 28 HB3 LEU 28 5.939 10.458 -3.823 205 HB3 LEU 28 HB2 LEU 28 6.644 9.369 -5.012 206 HG LEU 28 HG LEU 28 8.930 9.981 -4.082 207 HD11 LEU 28 HD11 LEU 28 8.777 10.909 -1.695 208 HD12 LEU 28 HD12 LEU 28 7.148 11.430 -2.120 209 HD13 LEU 28 HD13 LEU 28 8.527 12.077 -2.996 210 HD21 LEU 28 HD21 LEU 28 8.666 8.588 -2.063 211 HD22 LEU 28 HD22 LEU 28 7.742 7.907 -3.410 212 HD23 LEU 28 HD23 LEU 28 6.921 8.799 -2.134 213 H SER 29 H SER 29 9.313 12.568 -5.550 214 HA SER 29 HA SER 29 9.984 11.363 -8.094 215 HB2 SER 29 HB3 SER 29 12.111 12.751 -7.766 216 HB3 SER 29 HB2 SER 29 10.597 13.613 -7.969 217 HG SER 29 HG SER 29 10.894 14.394 -6.051 218 H LYS 30 H LYS 30 12.186 10.393 -8.339 219 HA LYS 30 HA LYS 30 12.352 8.156 -6.552 220 HB2 LYS 30 HB3 LYS 30 14.489 8.945 -8.530 221 HB3 LYS 30 HB2 LYS 30 14.087 7.341 -7.955 222 HG2 LYS 30 HG3 LYS 30 12.487 9.089 -9.844 223 HG3 LYS 30 HG2 LYS 30 13.169 7.515 -10.147 224 HD2 LYS 30 HD3 LYS 30 11.014 7.929 -8.035 225 HD3 LYS 30 HD2 LYS 30 10.634 7.557 -9.703 226 HE2 LYS 30 HE2 LYS 30 12.656 5.704 -8.809 227 HE3 LYS 30 HE1 LYS 30 11.346 5.724 -7.636 228 HZ1 LYS 30 HZ1 LYS 30 11.223 4.184 -9.646 229 HZ2 LYS 30 HZ2 LYS 30 10.732 5.545 -10.537 230 HZ3 LYS 30 HZ3 LYS 30 9.792 4.999 -9.300 231 H LYS 31 H LYS 31 13.424 11.253 -6.247 232 HA LYS 31 HA LYS 31 15.954 10.812 -4.870 233 HB2 LYS 31 HB3 LYS 31 14.373 13.303 -4.347 234 HB3 LYS 31 HB2 LYS 31 16.064 13.071 -4.716 235 HG2 LYS 31 HG3 LYS 31 15.618 12.743 -7.073 236 HG3 LYS 31 HG2 LYS 31 13.889 12.733 -6.797 237 HD2 LYS 31 HD3 LYS 31 14.026 15.031 -5.919 238 HD3 LYS 31 HD2 LYS 31 15.741 15.066 -6.355 239 HE2 LYS 31 HE2 LYS 31 15.094 14.503 -8.689 240 HE3 LYS 31 HE1 LYS 31 13.433 14.569 -8.228 241 HZ1 LYS 31 HZ1 LYS 31 13.632 16.671 -8.917 242 HZ2 LYS 31 HZ2 LYS 31 15.262 16.854 -8.507 243 HZ3 LYS 31 HZ3 LYS 31 14.065 16.971 -7.316 244 H GLU 32 H GLU 32 12.807 12.067 -3.985 245 HA GLU 32 HA GLU 32 13.029 11.872 -1.197 246 HB2 GLU 32 HB3 GLU 32 10.641 11.851 -3.036 247 HB3 GLU 32 HB2 GLU 32 10.583 12.112 -1.285 248 HG2 GLU 32 HG3 GLU 32 12.121 13.879 -3.252 249 HG3 GLU 32 HG2 GLU 32 10.527 14.244 -2.620 250 H LEU 33 H LEU 33 11.792 9.734 -3.699 251 HA LEU 33 HA LEU 33 10.559 7.851 -2.057 252 HB2 LEU 33 HB3 LEU 33 10.256 7.940 -4.523 253 HB3 LEU 33 HB2 LEU 33 11.925 7.414 -4.707 254 HG LEU 33 HG LEU 33 10.064 5.636 -4.907 255 HD11 LEU 33 HD11 LEU 33 12.698 5.434 -4.375 256 HD12 LEU 33 HD12 LEU 33 11.625 4.051 -4.480 257 HD13 LEU 33 HD13 LEU 33 12.049 4.702 -2.910 258 HD21 LEU 33 HD21 LEU 33 9.117 4.755 -2.939 259 HD22 LEU 33 HD22 LEU 33 9.046 6.482 -2.636 260 HD23 LEU 33 HD23 LEU 33 10.313 5.513 -1.893 261 H LYS 34 H LYS 34 13.916 7.874 -3.321 262 HA LYS 34 HA LYS 34 14.511 5.508 -1.816 263 HB2 LYS 34 HB3 LYS 34 16.708 5.601 -2.626 264 HB3 LYS 34 HB2 LYS 34 15.746 6.232 -3.958 265 HG2 LYS 34 HG3 LYS 34 16.324 8.535 -3.284 266 HG3 LYS 34 HG2 LYS 34 17.272 7.940 -1.921 267 HD2 LYS 34 HD3 LYS 34 18.733 6.699 -3.524 268 HD3 LYS 34 HD2 LYS 34 17.815 7.364 -4.855 269 HE2 LYS 34 HE2 LYS 34 19.651 8.803 -4.672 270 HE3 LYS 34 HE1 LYS 34 18.371 9.701 -3.852 271 HZ1 LYS 34 HZ1 LYS 34 20.051 7.868 -2.265 272 HZ2 LYS 34 HZ2 LYS 34 19.328 9.299 -1.769 273 HZ3 LYS 34 HZ3 LYS 34 20.715 9.333 -2.733 274 H GLU 35 H GLU 35 15.129 8.955 -1.383 275 HA GLU 35 HA GLU 35 16.679 8.747 0.946 276 HB2 GLU 35 HB3 GLU 35 14.815 10.941 0.003 277 HB3 GLU 35 HB2 GLU 35 15.943 11.096 1.346 278 HG2 GLU 35 HG3 GLU 35 16.781 10.332 -1.465 279 HG3 GLU 35 HG2 GLU 35 16.853 11.968 -0.857 280 H LEU 36 H LEU 36 13.176 9.387 0.592 281 HA LEU 36 HA LEU 36 12.703 9.220 3.363 282 HB2 LEU 36 HB3 LEU 36 10.691 9.976 2.890 283 HB3 LEU 36 HB2 LEU 36 11.186 10.131 1.227 284 HG LEU 36 HG LEU 36 10.407 7.581 1.095 285 HD11 LEU 36 HD11 LEU 36 9.960 7.791 3.722 286 HD12 LEU 36 HD12 LEU 36 8.887 6.864 2.697 287 HD13 LEU 36 HD13 LEU 36 8.450 8.507 3.173 288 HD21 LEU 36 HD21 LEU 36 8.229 8.345 0.369 289 HD22 LEU 36 HD22 LEU 36 9.421 9.569 -0.062 290 HD23 LEU 36 HD23 LEU 36 8.376 9.817 1.334 291 H LEU 37 H LEU 37 12.400 6.786 0.817 292 HA LEU 37 HA LEU 37 11.131 4.884 2.418 293 HB2 LEU 37 HB3 LEU 37 11.246 4.641 -0.012 294 HB3 LEU 37 HB2 LEU 37 12.989 4.429 0.061 295 HG LEU 37 HG LEU 37 11.591 2.297 -0.182 296 HD11 LEU 37 HD11 LEU 37 13.271 1.127 0.692 297 HD12 LEU 37 HD12 LEU 37 13.113 1.831 2.290 298 HD13 LEU 37 HD13 LEU 37 14.004 2.687 1.024 299 HD21 LEU 37 HD21 LEU 37 9.942 3.164 1.638 300 HD22 LEU 37 HD22 LEU 37 11.133 2.533 2.779 301 HD23 LEU 37 HD23 LEU 37 10.372 1.454 1.611 302 H GLN 38 H GLN 38 14.611 5.323 1.781 303 HA GLN 38 HA GLN 38 15.345 3.207 3.532 304 HB2 GLN 38 HB3 GLN 38 17.616 3.958 3.290 305 HB3 GLN 38 HB2 GLN 38 16.848 4.124 1.715 306 HG2 GLN 38 HG3 GLN 38 16.461 6.553 2.258 307 HG3 GLN 38 HG2 GLN 38 17.382 6.316 3.739 308 HE21 GLN 38 HE21 GLN 38 18.874 7.984 2.652 309 HE22 GLN 38 HE22 GLN 38 20.046 7.389 1.578 310 H THR 39 H THR 39 14.969 6.661 3.912 311 HA THR 39 HA THR 39 15.952 6.878 6.542 312 HB THR 39 HB THR 39 13.855 8.485 5.088 313 HG1 THR 39 HG2 THR 39 15.657 8.678 3.983 314 HG21 THR 39 HG21 THR 39 14.707 10.283 6.714 315 HG22 THR 39 HG22 THR 39 15.317 8.911 7.668 316 HG23 THR 39 HG23 THR 39 13.599 9.047 7.312 317 H GLU 40 H GLU 40 12.569 6.602 5.367 318 HA GLU 40 HA GLU 40 11.594 6.502 8.016 319 HB2 GLU 40 HB3 GLU 40 10.189 6.004 5.398 320 HB3 GLU 40 HB2 GLU 40 9.397 6.136 6.971 321 HG2 GLU 40 HG3 GLU 40 11.112 8.305 5.692 322 HG3 GLU 40 HG2 GLU 40 9.361 8.318 5.767 323 H LEU 41 H LEU 41 12.106 3.999 5.567 324 HA LEU 41 HA LEU 41 11.126 1.982 7.459 325 HB2 LEU 41 HB3 LEU 41 11.856 1.886 4.540 326 HB3 LEU 41 HB2 LEU 41 11.723 0.445 5.486 327 HG LEU 41 HG LEU 41 9.419 1.009 6.215 328 HD11 LEU 41 HD11 LEU 41 9.940 3.478 4.580 329 HD12 LEU 41 HD12 LEU 41 9.211 3.308 6.181 330 HD13 LEU 41 HD13 LEU 41 8.302 2.841 4.752 331 HD21 LEU 41 HD21 LEU 41 8.588 -0.034 4.407 332 HD22 LEU 41 HD22 LEU 41 10.199 0.039 3.708 333 HD23 LEU 41 HD23 LEU 41 9.011 1.294 3.338 334 H SER 42 H SER 42 13.482 3.505 7.962 335 HA SER 42 HA SER 42 15.841 2.269 7.261 336 HB2 SER 42 HB3 SER 42 16.459 3.243 9.676 337 HB3 SER 42 HB2 SER 42 16.286 4.237 8.250 338 HG SER 42 HG SER 42 14.549 5.102 9.070 339 H GLY 43 H GLY 43 13.481 1.466 9.747 340 HA2 GLY 43 HA3 GLY 43 15.032 -0.422 11.173 341 HA3 GLY 43 HA2 GLY 43 13.274 -0.326 11.115 342 H PHE 44 H PHE 44 12.741 -0.712 8.473 343 HA PHE 44 HA PHE 44 13.042 -3.572 8.172 344 HB2 PHE 44 HB3 PHE 44 11.935 -1.437 6.345 345 HB3 PHE 44 HB2 PHE 44 12.128 -3.096 5.823 346 HD1 PHE 44 HD2 PHE 44 10.966 -4.950 7.100 347 HD2 PHE 44 HD1 PHE 44 10.129 -0.810 7.729 348 HE1 PHE 44 HE2 PHE 44 8.816 -5.564 8.183 349 HE2 PHE 44 HE1 PHE 44 7.956 -1.421 8.818 350 HZ PHE 44 HZ PHE 44 7.318 -3.789 9.040 351 H LEU 45 H LEU 45 14.296 -0.700 6.615 352 HA LEU 45 HA LEU 45 15.825 -1.999 4.692 353 HB2 LEU 45 HB3 LEU 45 15.323 0.303 4.455 354 HB3 LEU 45 HB2 LEU 45 16.088 0.714 5.974 355 HG LEU 45 HG LEU 45 18.196 -0.020 5.161 356 HD11 LEU 45 HD11 LEU 45 18.397 -0.405 2.592 357 HD12 LEU 45 HD12 LEU 45 16.645 -0.577 2.586 358 HD13 LEU 45 HD13 LEU 45 17.648 -1.714 3.497 359 HD21 LEU 45 HD21 LEU 45 17.162 2.333 4.695 360 HD22 LEU 45 HD22 LEU 45 17.192 1.813 3.002 361 HD23 LEU 45 HD23 LEU 45 18.687 1.903 3.923 362 H ASP 46 H ASP 46 16.763 -0.799 7.914 363 HA ASP 46 HA ASP 46 19.428 -1.729 7.769 364 HB2 ASP 46 HB3 ASP 46 18.761 -0.075 9.409 365 HB3 ASP 46 HB2 ASP 46 17.669 -1.227 10.166 366 H ALA 47 H ALA 47 16.435 -3.166 8.869 367 HA ALA 47 HA ALA 47 17.518 -5.415 10.116 368 HB1 ALA 47 HB1 ALA 47 15.228 -6.455 9.634 369 HB2 ALA 47 HB2 ALA 47 14.820 -4.904 8.899 370 HB3 ALA 47 HB3 ALA 47 15.268 -4.983 10.602 371 H GLN 48 H GLN 48 16.590 -4.969 6.707 372 HA GLN 48 HA GLN 48 17.894 -7.575 6.177 373 HB2 GLN 48 HB3 GLN 48 16.060 -7.741 4.259 374 HB3 GLN 48 HB2 GLN 48 15.740 -8.305 5.894 375 HG2 GLN 48 HG3 GLN 48 13.877 -7.051 5.399 376 HG3 GLN 48 HG2 GLN 48 14.826 -5.871 6.285 377 HE21 GLN 48 HE21 GLN 48 15.623 -4.050 5.077 378 HE22 GLN 48 HE22 GLN 48 15.232 -3.789 3.437 379 H LYS 49 H LYS 49 19.382 -5.254 5.815 380 HA LYS 49 HA LYS 49 19.421 -4.481 3.055 381 HB2 LYS 49 HB3 LYS 49 21.646 -4.545 5.096 382 HB3 LYS 49 HB2 LYS 49 21.836 -3.913 3.464 383 HG2 LYS 49 HG3 LYS 49 19.906 -2.322 3.947 384 HG3 LYS 49 HG2 LYS 49 19.996 -2.894 5.620 385 HD2 LYS 49 HD3 LYS 49 22.368 -1.704 4.172 386 HD3 LYS 49 HD2 LYS 49 21.258 -0.771 5.177 387 HE2 LYS 49 HE2 LYS 49 21.723 -2.432 7.043 388 HE3 LYS 49 HE1 LYS 49 23.044 -3.059 6.059 389 HZ1 LYS 49 HZ1 LYS 49 22.840 -0.170 6.599 390 HZ2 LYS 49 HZ2 LYS 49 24.246 -1.066 6.289 391 HZ3 LYS 49 HZ3 LYS 49 23.454 -1.186 7.770 392 H ASP 50 H ASP 50 20.882 -7.011 4.929 393 HA ASP 50 HA ASP 50 22.601 -8.103 2.971 394 HB2 ASP 50 HB3 ASP 50 21.341 -9.377 5.417 395 HB3 ASP 50 HB2 ASP 50 22.553 -10.140 4.417 396 H VAL 51 H VAL 51 19.198 -8.268 3.316 397 HA VAL 51 HA VAL 51 18.792 -10.832 2.155 398 HB VAL 51 HB VAL 51 16.929 -8.452 2.456 399 HG11 VAL 51 HG11 VAL 51 15.872 -9.603 0.739 400 HG12 VAL 51 HG12 VAL 51 15.208 -10.416 2.148 401 HG13 VAL 51 HG13 VAL 51 16.511 -11.170 1.239 402 HG21 VAL 51 HG21 VAL 51 17.227 -11.084 3.946 403 HG22 VAL 51 HG22 VAL 51 15.954 -9.921 4.236 404 HG23 VAL 51 HG23 VAL 51 17.635 -9.495 4.585 405 H ASP 52 H ASP 52 19.681 -7.800 0.890 406 HA ASP 52 HA ASP 52 20.173 -7.095 -1.223 407 HB2 ASP 52 HB3 ASP 52 21.314 -9.174 -1.600 408 HB3 ASP 52 HB2 ASP 52 19.802 -10.025 -1.910 409 H ALA 53 H ALA 53 17.385 -9.273 -1.127 410 HA ALA 53 HA ALA 53 16.026 -8.386 -3.374 411 HB1 ALA 53 HB1 ALA 53 14.390 -8.863 -0.917 412 HB2 ALA 53 HB2 ALA 53 15.353 -10.207 -1.542 413 HB3 ALA 53 HB3 ALA 53 14.153 -9.428 -2.560 414 H VAL 54 H VAL 54 16.491 -6.846 -0.322 415 HA VAL 54 HA VAL 54 14.484 -4.891 -0.435 416 HB VAL 54 HB VAL 54 15.790 -5.256 1.604 417 HG11 VAL 54 HG11 VAL 54 18.014 -4.803 1.856 418 HG12 VAL 54 HG12 VAL 54 18.179 -3.914 0.355 419 HG13 VAL 54 HG13 VAL 54 18.012 -5.676 0.336 420 HG21 VAL 54 HG21 VAL 54 16.128 -2.468 0.426 421 HG22 VAL 54 HG22 VAL 54 16.434 -2.871 2.101 422 HG23 VAL 54 HG23 VAL 54 14.805 -3.026 1.456 423 H ASP 55 H ASP 55 17.792 -4.890 -1.683 424 HA ASP 55 HA ASP 55 17.774 -2.304 -2.946 425 HB2 ASP 55 HB3 ASP 55 19.849 -3.720 -2.636 426 HB3 ASP 55 HB2 ASP 55 19.165 -4.820 -3.855 427 H LYS 56 H LYS 56 16.922 -5.551 -3.912 428 HA LYS 56 HA LYS 56 16.430 -4.970 -6.633 429 HB2 LYS 56 HB3 LYS 56 15.203 -7.202 -4.990 430 HB3 LYS 56 HB2 LYS 56 15.381 -7.132 -6.731 431 HG2 LYS 56 HG3 LYS 56 17.710 -7.143 -4.770 432 HG3 LYS 56 HG2 LYS 56 17.195 -8.498 -5.759 433 HD2 LYS 56 HD3 LYS 56 17.590 -7.102 -7.791 434 HD3 LYS 56 HD2 LYS 56 18.188 -5.823 -6.775 435 HE2 LYS 56 HE2 LYS 56 20.001 -7.312 -7.741 436 HE3 LYS 56 HE1 LYS 56 20.045 -7.064 -5.997 437 HZ1 LYS 56 HZ1 LYS 56 20.249 -9.438 -6.979 438 HZ2 LYS 56 HZ2 LYS 56 18.559 -9.397 -7.065 439 HZ3 LYS 56 HZ3 LYS 56 19.372 -9.178 -5.573 440 H VAL 57 H VAL 57 14.347 -5.025 -3.813 441 HA VAL 57 HA VAL 57 11.944 -4.342 -5.166 442 HB VAL 57 HB VAL 57 12.797 -3.676 -2.327 443 HG11 VAL 57 HG11 VAL 57 10.300 -3.699 -1.965 444 HG12 VAL 57 HG12 VAL 57 10.113 -3.673 -3.724 445 HG13 VAL 57 HG13 VAL 57 10.901 -2.336 -2.905 446 HG21 VAL 57 HG21 VAL 57 12.439 -5.848 -1.808 447 HG22 VAL 57 HG22 VAL 57 12.327 -6.213 -3.524 448 HG23 VAL 57 HG23 VAL 57 10.870 -5.837 -2.605 449 H MET 58 H MET 58 14.583 -2.505 -3.745 450 HA MET 58 HA MET 58 13.648 0.136 -4.281 451 HB2 MET 58 HB3 MET 58 16.518 -0.926 -4.216 452 HB3 MET 58 HB2 MET 58 16.020 0.746 -4.165 453 HG2 MET 58 HG3 MET 58 14.906 -1.175 -2.220 454 HG3 MET 58 HG2 MET 58 16.493 -0.466 -1.888 455 HE1 MET 58 HE1 MET 58 16.446 2.479 -0.814 456 HE2 MET 58 HE2 MET 58 16.024 3.087 -2.415 457 HE3 MET 58 HE3 MET 58 17.002 1.623 -2.261 458 H LYS 59 H LYS 59 15.419 -2.298 -6.086 459 HA LYS 59 HA LYS 59 16.020 -0.732 -8.320 460 HB2 LYS 59 HB3 LYS 59 17.121 -2.918 -7.828 461 HB3 LYS 59 HB2 LYS 59 15.627 -3.746 -8.299 462 HG2 LYS 59 HG3 LYS 59 17.097 -3.735 -10.193 463 HG3 LYS 59 HG2 LYS 59 15.813 -2.573 -10.523 464 HD2 LYS 59 HD3 LYS 59 17.348 -0.734 -9.650 465 HD3 LYS 59 HD2 LYS 59 18.591 -1.968 -9.521 466 HE2 LYS 59 HE2 LYS 59 18.663 -2.349 -11.776 467 HE3 LYS 59 HE1 LYS 59 17.125 -1.521 -12.082 468 HZ1 LYS 59 HZ1 LYS 59 18.143 0.587 -11.501 469 HZ2 LYS 59 HZ2 LYS 59 19.111 -0.152 -12.675 470 HZ3 LYS 59 HZ3 LYS 59 19.597 -0.158 -11.076 471 H GLU 60 H GLU 60 13.292 -2.789 -7.511 472 HA GLU 60 HA GLU 60 11.902 -2.681 -9.945 473 HB2 GLU 60 HB3 GLU 60 10.861 -2.782 -7.106 474 HB3 GLU 60 HB2 GLU 60 9.881 -3.017 -8.550 475 HG2 GLU 60 HG3 GLU 60 12.357 -4.654 -7.954 476 HG3 GLU 60 HG2 GLU 60 10.738 -5.180 -7.539 477 H LEU 61 H LEU 61 12.030 -0.491 -7.212 478 HA LEU 61 HA LEU 61 10.290 1.506 -8.311 479 HB2 LEU 61 HB3 LEU 61 12.296 1.474 -6.069 480 HB3 LEU 61 HB2 LEU 61 11.684 3.002 -6.664 481 HG LEU 61 HG LEU 61 10.456 1.825 -4.709 482 HD11 LEU 61 HD11 LEU 61 8.307 2.778 -5.439 483 HD12 LEU 61 HD12 LEU 61 8.857 2.814 -7.103 484 HD13 LEU 61 HD13 LEU 61 9.629 3.841 -5.894 485 HD21 LEU 61 HD21 LEU 61 10.256 -0.396 -5.956 486 HD22 LEU 61 HD22 LEU 61 9.060 0.376 -7.006 487 HD23 LEU 61 HD23 LEU 61 8.757 0.220 -5.294 488 H ASP 62 H ASP 62 13.704 0.806 -8.425 489 HA ASP 62 HA ASP 62 14.537 3.134 -9.813 490 HB2 ASP 62 HB3 ASP 62 16.031 1.415 -8.648 491 HB3 ASP 62 HB2 ASP 62 15.815 0.438 -10.101 492 H GLU 63 H GLU 63 13.311 0.024 -10.899 493 HA GLU 63 HA GLU 63 13.650 0.360 -13.725 494 HB2 GLU 63 HB3 GLU 63 11.290 -0.895 -12.277 495 HB3 GLU 63 HB2 GLU 63 11.720 -1.149 -13.954 496 HG2 GLU 63 HG3 GLU 63 13.469 -1.932 -11.599 497 HG3 GLU 63 HG2 GLU 63 12.377 -2.987 -12.479 498 H ASN 64 H ASN 64 11.399 1.407 -11.378 499 HA ASN 64 HA ASN 64 9.711 2.901 -13.217 500 HB2 ASN 64 HB3 ASN 64 8.617 1.842 -11.385 501 HB3 ASN 64 HB2 ASN 64 9.715 2.479 -10.214 502 HD21 ASN 64 HD21 ASN 64 7.345 3.692 -12.640 503 HD22 ASN 64 HD22 ASN 64 6.887 5.048 -11.734 504 H GLY 65 H GLY 65 12.748 3.370 -12.347 505 HA2 GLY 65 HA3 GLY 65 12.701 6.006 -11.234 506 HA3 GLY 65 HA2 GLY 65 14.114 5.146 -11.851 507 H ASP 66 H ASP 66 11.942 4.853 -14.213 508 HA ASP 66 HA ASP 66 13.198 6.585 -16.038 509 HB2 ASP 66 HB3 ASP 66 10.572 5.123 -15.986 510 HB3 ASP 66 HB2 ASP 66 10.977 6.193 -17.324 511 H GLY 67 H GLY 67 10.320 6.871 -14.057 512 HA2 GLY 67 HA3 GLY 67 10.288 9.778 -14.555 513 HA3 GLY 67 HA2 GLY 67 8.805 8.841 -14.655 514 H GLU 68 H GLU 68 7.671 9.514 -12.945 515 HA GLU 68 HA GLU 68 8.974 9.613 -10.309 516 HB2 GLU 68 HB3 GLU 68 6.573 11.040 -11.414 517 HB3 GLU 68 HB2 GLU 68 6.951 11.054 -9.701 518 HG2 GLU 68 HG3 GLU 68 9.156 12.006 -10.165 519 HG3 GLU 68 HG2 GLU 68 8.870 11.946 -11.891 520 H VAL 69 H VAL 69 7.473 9.239 -8.475 521 HA VAL 69 HA VAL 69 5.793 6.881 -8.960 522 HB VAL 69 HB VAL 69 7.564 5.853 -7.860 523 HG11 VAL 69 HG11 VAL 69 8.007 8.317 -6.164 524 HG12 VAL 69 HG12 VAL 69 8.908 7.976 -7.646 525 HG13 VAL 69 HG13 VAL 69 9.036 6.904 -6.255 526 HG21 VAL 69 HG21 VAL 69 5.347 6.261 -6.199 527 HG22 VAL 69 HG22 VAL 69 6.660 6.837 -5.218 528 HG23 VAL 69 HG23 VAL 69 6.701 5.198 -5.841 529 H ASP 70 H ASP 70 3.782 6.908 -8.014 530 HA ASP 70 HA ASP 70 3.292 9.243 -6.332 531 HB2 ASP 70 HB3 ASP 70 1.011 9.378 -7.028 532 HB3 ASP 70 HB2 ASP 70 1.988 9.196 -8.470 533 H PHE 71 H PHE 71 0.870 8.356 -5.365 534 HA PHE 71 HA PHE 71 1.871 7.171 -3.022 535 HB2 PHE 71 HB3 PHE 71 -0.295 8.460 -3.199 536 HB3 PHE 71 HB2 PHE 71 -0.993 6.993 -3.908 537 HD1 PHE 71 HD1 PHE 71 1.077 8.045 -0.966 538 HD2 PHE 71 HD2 PHE 71 -2.031 5.441 -2.419 539 HE1 PHE 71 HE1 PHE 71 0.751 7.157 1.307 540 HE2 PHE 71 HE2 PHE 71 -2.345 4.571 -0.113 541 HZ PHE 71 HZ PHE 71 -0.965 5.416 1.733 542 H GLN 72 H GLN 72 0.191 5.764 -5.781 543 HA GLN 72 HA GLN 72 0.000 3.152 -4.778 544 HB2 GLN 72 HB3 GLN 72 -0.040 4.304 -7.523 545 HB3 GLN 72 HB2 GLN 72 -0.136 2.537 -7.289 546 HG2 GLN 72 HG3 GLN 72 -2.096 2.916 -5.819 547 HG3 GLN 72 HG2 GLN 72 -1.951 4.650 -6.100 548 HE21 GLN 72 HE21 GLN 72 -3.398 1.794 -7.326 549 HE22 GLN 72 HE22 GLN 72 -3.859 2.416 -8.825 550 H GLU 73 H GLU 73 2.527 4.651 -6.875 551 HA GLU 73 HA GLU 73 4.074 2.250 -6.836 552 HB2 GLU 73 HB3 GLU 73 4.926 5.087 -7.568 553 HB3 GLU 73 HB2 GLU 73 5.986 3.695 -7.671 554 HG2 GLU 73 HG3 GLU 73 5.188 3.664 -9.806 555 HG3 GLU 73 HG2 GLU 73 3.919 2.710 -9.064 556 H TYR 74 H TYR 74 3.917 5.098 -4.834 557 HA TYR 74 HA TYR 74 6.211 4.589 -3.274 558 HB2 TYR 74 HB3 TYR 74 5.213 6.777 -3.192 559 HB3 TYR 74 HB2 TYR 74 3.683 6.106 -2.651 560 HD1 TYR 74 HD1 TYR 74 7.243 5.566 -1.527 561 HD2 TYR 74 HD2 TYR 74 3.243 6.722 -0.433 562 HE1 TYR 74 HE1 TYR 74 7.940 5.783 0.828 563 HE2 TYR 74 HE2 TYR 74 3.961 6.941 1.928 564 HH TYR 74 HH TYR 74 6.962 7.251 2.914 565 H VAL 75 H VAL 75 2.803 3.673 -2.655 566 HA VAL 75 HA VAL 75 3.414 2.493 -0.189 567 HB VAL 75 HB VAL 75 1.204 1.343 -0.341 568 HG11 VAL 75 HG11 VAL 75 -0.086 3.418 -0.283 569 HG12 VAL 75 HG12 VAL 75 1.245 4.304 -1.013 570 HG13 VAL 75 HG13 VAL 75 1.423 3.609 0.597 571 HG21 VAL 75 HG21 VAL 75 1.543 1.731 -3.125 572 HG22 VAL 75 HG22 VAL 75 0.304 2.873 -2.659 573 HG23 VAL 75 HG23 VAL 75 0.098 1.157 -2.309 574 H VAL 76 H VAL 76 3.375 1.046 -3.412 575 HA VAL 76 HA VAL 76 3.518 -1.587 -2.482 576 HB VAL 76 HB VAL 76 2.888 -1.075 -4.791 577 HG11 VAL 76 HG11 VAL 76 4.735 -0.524 -6.420 578 HG12 VAL 76 HG12 VAL 76 5.735 -0.074 -5.048 579 HG13 VAL 76 HG13 VAL 76 4.210 0.771 -5.364 580 HG21 VAL 76 HG21 VAL 76 4.650 -3.156 -3.978 581 HG22 VAL 76 HG22 VAL 76 5.255 -2.582 -5.526 582 HG23 VAL 76 HG23 VAL 76 3.595 -3.123 -5.387 583 H LEU 77 H LEU 77 5.985 0.835 -3.066 584 HA LEU 77 HA LEU 77 8.251 -0.828 -2.893 585 HB2 LEU 77 HB3 LEU 77 8.423 1.473 -3.651 586 HB3 LEU 77 HB2 LEU 77 7.883 2.054 -2.085 587 HG LEU 77 HG LEU 77 9.885 1.105 -0.988 588 HD11 LEU 77 HD11 LEU 77 11.687 0.514 -2.973 589 HD12 LEU 77 HD12 LEU 77 10.214 -0.249 -3.566 590 HD13 LEU 77 HD13 LEU 77 10.830 -0.620 -1.952 591 HD21 LEU 77 HD21 LEU 77 10.363 3.293 -1.521 592 HD22 LEU 77 HD22 LEU 77 10.147 3.049 -3.253 593 HD23 LEU 77 HD23 LEU 77 11.616 2.492 -2.455 594 H VAL 78 H VAL 78 6.574 1.048 -0.375 595 HA VAL 78 HA VAL 78 8.226 -0.012 1.679 596 HB VAL 78 HB VAL 78 6.741 1.077 3.253 597 HG11 VAL 78 HG11 VAL 78 7.936 2.394 0.986 598 HG12 VAL 78 HG12 VAL 78 7.720 3.011 2.625 599 HG13 VAL 78 HG13 VAL 78 6.469 3.261 1.425 600 HG21 VAL 78 HG21 VAL 78 4.648 2.160 2.490 601 HG22 VAL 78 HG22 VAL 78 4.556 0.430 2.236 602 HG23 VAL 78 HG23 VAL 78 4.909 1.515 0.878 603 H ALA 79 H ALA 79 5.050 -0.838 0.421 604 HA ALA 79 HA ALA 79 4.420 -2.859 2.283 605 HB1 ALA 79 HB1 ALA 79 2.818 -1.866 0.704 606 HB2 ALA 79 HB2 ALA 79 2.818 -3.639 0.668 607 HB3 ALA 79 HB3 ALA 79 3.618 -2.727 -0.611 608 H ALA 80 H ALA 80 5.999 -3.068 -0.895 609 HA ALA 80 HA ALA 80 6.257 -5.819 -0.975 610 HB1 ALA 80 HB1 ALA 80 7.952 -3.615 -2.145 611 HB2 ALA 80 HB2 ALA 80 6.797 -4.665 -2.960 612 HB3 ALA 80 HB3 ALA 80 8.335 -5.317 -2.409 613 H LEU 81 H LEU 81 8.455 -3.379 0.323 614 HA LEU 81 HA LEU 81 10.402 -5.187 1.339 615 HB2 LEU 81 HB3 LEU 81 9.642 -2.384 2.180 616 HB3 LEU 81 HB2 LEU 81 11.034 -3.259 2.812 617 HG LEU 81 HG LEU 81 10.569 -2.682 -0.135 618 HD11 LEU 81 HD11 LEU 81 10.992 -0.606 1.016 619 HD12 LEU 81 HD12 LEU 81 12.419 -1.069 0.099 620 HD13 LEU 81 HD13 LEU 81 12.383 -1.310 1.849 621 HD21 LEU 81 HD21 LEU 81 12.777 -4.021 1.438 622 HD22 LEU 81 HD22 LEU 81 13.097 -3.252 -0.125 623 HD23 LEU 81 HD23 LEU 81 11.966 -4.585 -0.027 624 H THR 82 H THR 82 7.503 -3.704 2.735 625 HA THR 82 HA THR 82 7.871 -4.734 5.321 626 HB THR 82 HB THR 82 5.199 -4.160 4.017 627 HG1 THR 82 HG2 THR 82 6.729 -2.411 3.794 628 HG21 THR 82 HG21 THR 82 5.633 -3.403 6.815 629 HG22 THR 82 HG22 THR 82 5.774 -5.135 6.556 630 HG23 THR 82 HG23 THR 82 4.311 -4.283 6.071 631 H VAL 83 H VAL 83 5.889 -5.983 2.615 632 HA VAL 83 HA VAL 83 5.176 -8.333 4.038 633 HB VAL 83 HB VAL 83 3.783 -7.680 2.243 634 HG11 VAL 83 HG11 VAL 83 4.458 -7.125 0.082 635 HG12 VAL 83 HG12 VAL 83 5.569 -8.468 -0.002 636 HG13 VAL 83 HG13 VAL 83 6.048 -6.998 0.817 637 HG21 VAL 83 HG21 VAL 83 3.448 -9.780 1.126 638 HG22 VAL 83 HG22 VAL 83 4.093 -10.147 2.725 639 HG23 VAL 83 HG23 VAL 83 5.140 -10.218 1.309 640 H ALA 84 H ALA 84 7.804 -7.679 1.761 641 HA ALA 84 HA ALA 84 8.785 -10.292 1.631 642 HB1 ALA 84 HB1 ALA 84 10.376 -7.712 1.592 643 HB2 ALA 84 HB2 ALA 84 9.634 -8.492 0.185 644 HB3 ALA 84 HB3 ALA 84 10.941 -9.288 1.048 645 H MET 85 H MET 85 9.740 -7.664 3.871 646 HA MET 85 HA MET 85 11.387 -9.453 5.368 647 HB2 MET 85 HB3 MET 85 11.635 -6.904 5.308 648 HB3 MET 85 HB2 MET 85 10.307 -6.869 6.475 649 HG2 MET 85 HG3 MET 85 11.596 -8.424 7.971 650 HG3 MET 85 HG2 MET 85 12.918 -8.389 6.829 651 HE1 MET 85 HE1 MET 85 11.726 -5.396 9.989 652 HE2 MET 85 HE2 MET 85 11.868 -7.140 10.068 653 HE3 MET 85 HE3 MET 85 10.589 -6.427 9.094 654 H ASN 86 H ASN 86 8.063 -8.281 5.794 655 HA ASN 86 HA ASN 86 7.720 -9.367 8.372 656 HB2 ASN 86 HB3 ASN 86 6.145 -7.755 7.051 657 HB3 ASN 86 HB2 ASN 86 5.408 -9.245 6.459 658 HD21 ASN 86 HD21 ASN 86 5.835 -7.179 9.275 659 HD22 ASN 86 HD22 ASN 86 4.789 -7.993 10.298 660 H ASN 87 H ASN 87 7.212 -10.774 5.177 661 HA ASN 87 HA ASN 87 6.016 -13.163 6.031 662 HB2 ASN 87 HB3 ASN 87 7.603 -12.462 3.574 663 HB3 ASN 87 HB2 ASN 87 7.019 -14.103 3.846 664 HD21 ASN 87 HD21 ASN 87 5.975 -12.678 1.654 665 HD22 ASN 87 HD22 ASN 87 4.363 -12.262 1.976 666 H PHE 88 H PHE 88 9.336 -12.168 5.915 667 HA PHE 88 HA PHE 88 10.630 -14.626 6.235 668 HB2 PHE 88 HB3 PHE 88 11.971 -12.668 5.865 669 HB3 PHE 88 HB2 PHE 88 11.309 -11.868 7.275 670 HD1 PHE 88 HD2 PHE 88 13.264 -14.931 6.303 671 HD2 PHE 88 HD1 PHE 88 12.397 -12.009 9.356 672 HE1 PHE 88 HE2 PHE 88 15.062 -15.869 7.732 673 HE2 PHE 88 HE1 PHE 88 14.195 -12.960 10.759 674 HZ PHE 88 HZ PHE 88 15.522 -14.882 9.954 675 H PHE 89 H PHE 89 9.198 -12.494 8.678 676 HA PHE 89 HA PHE 89 9.935 -13.997 10.934 677 HB2 PHE 89 HB3 PHE 89 7.599 -12.188 10.393 678 HB3 PHE 89 HB2 PHE 89 7.805 -12.934 11.952 679 HD1 PHE 89 HD1 PHE 89 10.417 -12.776 12.832 680 HD2 PHE 89 HD2 PHE 89 8.466 -10.044 10.144 681 HE1 PHE 89 HE1 PHE 89 12.038 -11.021 13.439 682 HE2 PHE 89 HE2 PHE 89 10.088 -8.293 10.747 683 HZ PHE 89 HZ PHE 89 11.885 -8.769 12.401 684 H TRP 90 H TRP 90 7.019 -14.166 8.936 685 HA TRP 90 HA TRP 90 5.917 -16.341 10.470 686 HB2 TRP 90 HB3 TRP 90 5.040 -15.460 7.724 687 HB3 TRP 90 HB2 TRP 90 4.094 -16.317 8.942 688 HD1 TRP 90 HD TRP 90 5.290 -12.914 7.992 689 HE1 TRP 90 HE1 TRP 90 4.397 -11.171 9.566 690 HE3 TRP 90 HE3 TRP 90 3.298 -15.999 11.513 691 HZ2 TRP 90 HZ2 TRP 90 2.931 -11.081 12.105 692 HZ3 TRP 90 HZ3 TRP 90 2.156 -15.068 13.502 693 HH2 TRP 90 HH TRP 90 1.973 -12.615 13.799 694 H GLU 91 H GLU 91 7.666 -16.089 7.481 695 HA GLU 91 HA GLU 91 7.413 -18.853 6.760 696 HB2 GLU 91 HB3 GLU 91 9.468 -16.826 6.143 697 HB3 GLU 91 HB2 GLU 91 9.434 -18.401 5.366 698 HG2 GLU 91 HG3 GLU 91 7.094 -18.011 4.652 699 HG3 GLU 91 HG2 GLU 91 7.140 -16.385 5.271 700 H ASN 92 H ASN 92 9.997 -17.060 8.417 701 HA ASN 92 HA ASN 92 11.029 -19.651 9.347 702 HB2 ASN 92 HB3 ASN 92 12.608 -17.280 8.350 703 HB3 ASN 92 HB2 ASN 92 13.321 -18.668 9.162 704 HD21 ASN 92 HD21 ASN 92 12.826 -17.497 6.096 705 HD22 ASN 92 HD22 ASN 92 12.725 -18.956 5.250 706 H SER 93 H SER 93 11.056 -19.790 11.419 707 HA SER 93 HA SER 93 11.883 -17.683 13.176 708 HB2 SER 93 HB3 SER 93 9.453 -17.236 12.358 709 HB3 SER 93 HB2 SER 93 9.011 -18.440 13.566 710 HG SER 93 HG SER 93 10.744 -16.832 14.719 711 H1 GLY 1 H GLY 1 12.917 4.485 12.908 712 HA2 GLY 1 HA3 GLY 1 11.625 2.544 12.071 713 HA3 GLY 1 HA2 GLY 1 11.202 2.249 13.759 714 H SER 2 H SER 2 10.394 3.929 10.943 715 HA SER 2 HA SER 2 9.049 6.148 12.123 716 HB2 SER 2 HB3 SER 2 8.900 5.003 9.330 717 HB3 SER 2 HB2 SER 2 8.218 6.534 9.854 718 HG SER 2 HG SER 2 10.065 7.129 9.221 719 H GLU 3 H GLU 3 6.756 6.609 11.976 720 HA GLU 3 HA GLU 3 4.998 4.686 13.023 721 HB2 GLU 3 HB3 GLU 3 4.293 7.023 11.223 722 HB3 GLU 3 HB2 GLU 3 3.238 6.206 12.346 723 HG2 GLU 3 HG3 GLU 3 3.843 8.019 13.621 724 HG3 GLU 3 HG2 GLU 3 5.023 6.860 14.164 725 H LEU 4 H LEU 4 6.094 5.471 9.872 726 HA LEU 4 HA LEU 4 4.150 4.356 8.221 727 HB2 LEU 4 HB3 LEU 4 7.143 4.525 7.806 728 HB3 LEU 4 HB2 LEU 4 5.937 4.249 6.562 729 HG LEU 4 HG LEU 4 5.985 6.723 8.329 730 HD11 LEU 4 HD11 LEU 4 7.305 6.078 5.776 731 HD12 LEU 4 HD12 LEU 4 7.723 7.241 7.052 732 HD13 LEU 4 HD13 LEU 4 6.501 7.646 5.876 733 HD21 LEU 4 HD21 LEU 4 4.505 6.358 5.731 734 HD22 LEU 4 HD22 LEU 4 4.259 7.550 7.007 735 HD23 LEU 4 HD23 LEU 4 3.724 5.910 7.258 736 H GLU 5 H GLU 5 7.002 2.935 9.818 737 HA GLU 5 HA GLU 5 6.766 0.393 8.614 738 HB2 GLU 5 HB3 GLU 5 8.012 1.269 11.238 739 HB3 GLU 5 HB2 GLU 5 8.142 -0.366 10.605 740 HG2 GLU 5 HG3 GLU 5 9.182 0.589 8.509 741 HG3 GLU 5 HG2 GLU 5 9.114 2.163 9.238 742 H THR 6 H THR 6 5.512 1.825 11.610 743 HA THR 6 HA THR 6 4.147 -0.469 12.549 744 HB THR 6 HB THR 6 3.260 2.395 12.968 745 HG1 THR 6 HG2 THR 6 4.774 2.543 14.522 746 HG21 THR 6 HG21 THR 6 2.281 -0.037 13.896 747 HG22 THR 6 HG22 THR 6 1.967 1.535 14.598 748 HG23 THR 6 HG23 THR 6 3.277 0.535 15.228 749 H ALA 7 H ALA 7 3.183 2.281 10.546 750 HA ALA 7 HA ALA 7 0.505 1.627 10.160 751 HB1 ALA 7 HB1 ALA 7 0.604 3.020 8.147 752 HB2 ALA 7 HB2 ALA 7 2.348 2.909 8.126 753 HB3 ALA 7 HB3 ALA 7 1.545 3.779 9.433 754 H MET 8 H MET 8 3.343 0.714 8.222 755 HA MET 8 HA MET 8 1.888 -0.874 6.390 756 HB2 MET 8 HB3 MET 8 4.810 -1.022 7.172 757 HB3 MET 8 HB2 MET 8 4.097 -1.864 5.804 758 HG2 MET 8 HG3 MET 8 4.196 1.150 6.198 759 HG3 MET 8 HG2 MET 8 5.095 0.219 5.016 760 HE1 MET 8 HE1 MET 8 2.792 -0.957 2.491 761 HE2 MET 8 HE2 MET 8 2.456 -1.907 3.934 762 HE3 MET 8 HE3 MET 8 4.115 -1.380 3.602 763 H GLU 9 H GLU 9 3.557 -1.702 9.428 764 HA GLU 9 HA GLU 9 2.949 -4.429 9.166 765 HB2 GLU 9 HB3 GLU 9 3.665 -2.831 11.620 766 HB3 GLU 9 HB2 GLU 9 3.337 -4.551 11.687 767 HG2 GLU 9 HG3 GLU 9 5.149 -4.974 10.024 768 HG3 GLU 9 HG2 GLU 9 5.460 -3.231 9.965 769 H THR 10 H THR 10 1.199 -1.712 10.491 770 HA THR 10 HA THR 10 -0.825 -3.103 11.855 771 HB THR 10 HB THR 10 -1.266 -0.570 10.234 772 HG1 THR 10 HG2 THR 10 0.630 -0.705 11.825 773 HG21 THR 10 HG21 THR 10 -2.492 -1.399 12.872 774 HG22 THR 10 HG22 THR 10 -3.218 -1.788 11.321 775 HG23 THR 10 HG23 THR 10 -2.998 -0.108 11.788 776 H LEU 11 H LEU 11 -0.487 -2.159 8.464 777 HA LEU 11 HA LEU 11 -2.905 -3.331 7.520 778 HB2 LEU 11 HB3 LEU 11 -0.270 -2.732 6.159 779 HB3 LEU 11 HB2 LEU 11 -1.670 -3.341 5.287 780 HG LEU 11 HG LEU 11 -1.748 -0.804 6.962 781 HD11 LEU 11 HD11 LEU 11 -1.260 0.473 5.083 782 HD12 LEU 11 HD12 LEU 11 -1.558 -0.851 3.960 783 HD13 LEU 11 HD13 LEU 11 -0.100 -0.839 4.945 784 HD21 LEU 11 HD21 LEU 11 -3.491 -1.533 4.612 785 HD22 LEU 11 HD22 LEU 11 -3.826 -0.404 5.903 786 HD23 LEU 11 HD23 LEU 11 -3.934 -2.129 6.207 787 H ILE 12 H ILE 12 0.403 -4.510 7.916 788 HA ILE 12 HA ILE 12 0.044 -7.068 6.762 789 HB ILE 12 HB ILE 12 1.912 -6.150 8.965 790 HG12 ILE 12 HG13 ILE 12 2.126 -5.146 6.579 791 HG13 ILE 12 HG12 ILE 12 3.568 -5.900 7.254 792 HG21 ILE 12 HG21 ILE 12 1.446 -8.792 7.776 793 HG22 ILE 12 HG22 ILE 12 2.193 -8.339 9.316 794 HG23 ILE 12 HG23 ILE 12 3.127 -8.280 7.829 795 HD11 ILE 12 HD11 ILE 12 3.477 -7.685 5.808 796 HD12 ILE 12 HD12 ILE 12 2.760 -6.449 4.821 797 HD13 ILE 12 HD13 ILE 12 1.718 -7.631 5.623 798 H ASN 13 H ASN 13 -0.277 -5.900 10.079 799 HA ASN 13 HA ASN 13 -0.875 -8.380 11.296 800 HB2 ASN 13 HB3 ASN 13 -1.575 -5.536 12.057 801 HB3 ASN 13 HB2 ASN 13 -2.048 -6.920 13.028 802 HD21 ASN 13 HD21 ASN 13 0.662 -4.901 12.154 803 HD22 ASN 13 HD22 ASN 13 1.802 -5.664 13.137 804 H VAL 14 H VAL 14 -2.914 -5.910 9.839 805 HA VAL 14 HA VAL 14 -5.394 -7.249 10.262 806 HB VAL 14 HB VAL 14 -4.509 -5.128 8.289 807 HG11 VAL 14 HG11 VAL 14 -6.338 -6.267 7.206 808 HG12 VAL 14 HG12 VAL 14 -7.026 -4.835 7.985 809 HG13 VAL 14 HG13 VAL 14 -7.216 -6.411 8.726 810 HG21 VAL 14 HG21 VAL 14 -4.609 -4.317 10.578 811 HG22 VAL 14 HG22 VAL 14 -6.149 -5.151 10.841 812 HG23 VAL 14 HG23 VAL 14 -6.071 -3.789 9.748 813 H PHE 15 H PHE 15 -3.053 -7.177 7.614 814 HA PHE 15 HA PHE 15 -4.436 -8.817 5.806 815 HB2 PHE 15 HB3 PHE 15 -2.381 -7.528 5.272 816 HB3 PHE 15 HB2 PHE 15 -1.447 -8.632 6.277 817 HD1 PHE 15 HD1 PHE 15 -3.490 -8.359 3.188 818 HD2 PHE 15 HD2 PHE 15 -0.850 -10.836 5.515 819 HE1 PHE 15 HE1 PHE 15 -3.255 -9.915 1.276 820 HE2 PHE 15 HE2 PHE 15 -0.621 -12.381 3.610 821 HZ PHE 15 HZ PHE 15 -1.819 -11.930 1.488 822 H HIS 16 H HIS 16 -2.080 -9.616 8.331 823 HA HIS 16 HA HIS 16 -2.190 -12.433 8.033 824 HB2 HIS 16 HB3 HIS 16 -1.524 -10.758 10.463 825 HB3 HIS 16 HB2 HIS 16 -1.383 -12.509 10.408 826 HD1 HIS 16 HD1 HIS 16 -0.195 -12.953 7.646 827 HD2 HIS 16 HD2 HIS 16 1.137 -9.977 10.242 828 HE1 HIS 16 HE1 HIS 16 2.179 -12.371 6.921 829 HE2 HIS 16 HE2 HIS 16 3.008 -10.563 8.510 830 H ALA 17 H ALA 17 -4.053 -10.180 10.007 831 HA ALA 17 HA ALA 17 -5.477 -11.994 11.568 832 HB1 ALA 17 HB1 ALA 17 -6.362 -9.313 10.454 833 HB2 ALA 17 HB2 ALA 17 -5.709 -9.642 12.056 834 HB3 ALA 17 HB3 ALA 17 -7.296 -10.249 11.611 835 H HIS 18 H HIS 18 -6.214 -10.776 8.348 836 HA HIS 18 HA HIS 18 -8.526 -12.486 8.058 837 HB2 HIS 18 HB3 HIS 18 -7.042 -10.735 6.122 838 HB3 HIS 18 HB2 HIS 18 -8.405 -11.770 5.661 839 HD1 HIS 18 HD1 HIS 18 -10.760 -11.282 6.823 840 HD2 HIS 18 HD2 HIS 18 -7.783 -8.422 7.552 841 HE1 HIS 18 HE1 HIS 18 -11.910 -9.256 7.807 842 HE2 HIS 18 HE2 HIS 18 -10.107 -7.511 8.263 843 H SER 19 H SER 19 -5.116 -12.647 7.102 844 HA SER 19 HA SER 19 -5.319 -14.843 5.369 845 HB2 SER 19 HB3 SER 19 -3.066 -14.153 7.286 846 HB3 SER 19 HB2 SER 19 -2.979 -15.323 5.988 847 HG SER 19 HG SER 19 -3.700 -13.485 4.616 848 H GLY 20 H GLY 20 -5.048 -14.676 8.862 849 HA2 GLY 20 HA3 GLY 20 -4.858 -17.414 9.410 850 HA3 GLY 20 HA2 GLY 20 -5.537 -16.206 10.497 851 H LYS 21 H LYS 21 -7.525 -15.512 8.272 852 HA LYS 21 HA LYS 21 -9.588 -17.244 9.264 853 HB2 LYS 21 HB3 LYS 21 -9.812 -15.084 7.149 854 HB3 LYS 21 HB2 LYS 21 -11.120 -15.824 8.054 855 HG2 LYS 21 HG3 LYS 21 -8.836 -14.300 9.315 856 HG3 LYS 21 HG2 LYS 21 -10.431 -13.624 9.003 857 HD2 LYS 21 HD3 LYS 21 -11.461 -15.322 10.454 858 HD3 LYS 21 HD2 LYS 21 -9.892 -16.029 10.820 859 HE2 LYS 21 HE2 LYS 21 -10.673 -13.177 11.343 860 HE3 LYS 21 HE1 LYS 21 -10.691 -14.438 12.569 861 HZ1 LYS 21 HZ1 LYS 21 -8.619 -13.268 12.738 862 HZ2 LYS 21 HZ2 LYS 21 -8.260 -13.423 11.101 863 HZ3 LYS 21 HZ3 LYS 21 -8.267 -14.771 12.113 864 H GLU 22 H GLU 22 -9.067 -16.296 5.880 865 HA GLU 22 HA GLU 22 -9.690 -19.075 5.050 866 HB2 GLU 22 HB3 GLU 22 -10.436 -16.426 3.824 867 HB3 GLU 22 HB2 GLU 22 -10.539 -17.942 2.927 868 HG2 GLU 22 HG3 GLU 22 -11.817 -17.547 5.619 869 HG3 GLU 22 HG2 GLU 22 -12.691 -17.192 4.151 870 H GLY 23 H GLY 23 -7.146 -16.941 5.139 871 HA2 GLY 23 HA3 GLY 23 -6.142 -17.473 2.454 872 HA3 GLY 23 HA2 GLY 23 -5.396 -16.453 3.668 873 H ASP 24 H ASP 24 -3.905 -18.143 2.130 874 HA ASP 24 HA ASP 24 -3.193 -20.499 3.683 875 HB2 ASP 24 HB3 ASP 24 -3.074 -20.544 1.189 876 HB3 ASP 24 HB2 ASP 24 -1.873 -19.267 1.258 877 H LYS 25 H LYS 25 -1.777 -20.326 5.355 878 HA LYS 25 HA LYS 25 -0.536 -19.197 6.941 879 HB2 LYS 25 HB3 LYS 25 1.832 -18.554 5.782 880 HB3 LYS 25 HB2 LYS 25 1.370 -20.205 6.155 881 HG2 LYS 25 HG3 LYS 25 0.606 -20.572 3.872 882 HG3 LYS 25 HG2 LYS 25 0.903 -18.911 3.423 883 HD2 LYS 25 HD3 LYS 25 3.314 -19.246 4.065 884 HD3 LYS 25 HD2 LYS 25 2.976 -20.958 4.254 885 HE2 LYS 25 HE2 LYS 25 2.436 -19.367 1.747 886 HE3 LYS 25 HE1 LYS 25 3.884 -20.326 2.046 887 HZ1 LYS 25 HZ1 LYS 25 2.567 -21.809 0.943 888 HZ2 LYS 25 HZ2 LYS 25 1.101 -21.272 1.575 889 HZ3 LYS 25 HZ3 LYS 25 2.165 -22.215 2.517 890 H TYR 26 H TYR 26 0.956 -17.213 4.446 891 HA TYR 26 HA TYR 26 -0.502 -14.905 5.524 892 HB2 TYR 26 HB3 TYR 26 1.495 -13.647 4.347 893 HB3 TYR 26 HB2 TYR 26 1.688 -14.319 5.965 894 HD1 TYR 26 HD1 TYR 26 2.913 -16.299 6.343 895 HD2 TYR 26 HD2 TYR 26 2.531 -14.755 2.388 896 HE1 TYR 26 HE1 TYR 26 4.753 -17.841 5.556 897 HE2 TYR 26 HE2 TYR 26 4.301 -16.250 1.592 898 HH TYR 26 HH TYR 26 6.382 -17.384 2.886 899 H LYS 27 H LYS 27 -2.216 -15.071 4.109 900 HA LYS 27 HA LYS 27 -1.842 -13.980 1.489 901 HB2 LYS 27 HB3 LYS 27 -3.015 -16.749 1.788 902 HB3 LYS 27 HB2 LYS 27 -3.192 -15.776 0.333 903 HG2 LYS 27 HG3 LYS 27 -0.548 -16.747 1.515 904 HG3 LYS 27 HG2 LYS 27 -1.366 -17.474 0.172 905 HD2 LYS 27 HD3 LYS 27 -0.458 -14.554 0.109 906 HD3 LYS 27 HD2 LYS 27 0.481 -15.884 -0.503 907 HE2 LYS 27 HE2 LYS 27 -2.182 -14.905 -1.546 908 HE3 LYS 27 HE1 LYS 27 -0.664 -15.084 -2.407 909 HZ1 LYS 27 HZ1 LYS 27 -2.498 -17.261 -1.487 910 HZ2 LYS 27 HZ2 LYS 27 -0.889 -17.557 -1.950 911 HZ3 LYS 27 HZ3 LYS 27 -1.970 -16.891 -3.042 912 H LEU 28 H LEU 28 -3.943 -13.338 0.567 913 HA LEU 28 HA LEU 28 -6.044 -13.317 2.625 914 HB2 LEU 28 HB3 LEU 28 -4.978 -11.150 2.506 915 HB3 LEU 28 HB2 LEU 28 -5.197 -11.078 0.768 916 HG LEU 28 HG LEU 28 -7.709 -11.292 1.200 917 HD11 LEU 28 HD11 LEU 28 -6.692 -10.832 4.000 918 HD12 LEU 28 HD12 LEU 28 -7.659 -12.197 3.448 919 HD13 LEU 28 HD13 LEU 28 -8.364 -10.571 3.521 920 HD21 LEU 28 HD21 LEU 28 -6.817 -9.134 0.636 921 HD22 LEU 28 HD22 LEU 28 -6.118 -8.940 2.257 922 HD23 LEU 28 HD23 LEU 28 -7.870 -8.944 2.038 923 H SER 29 H SER 29 -7.940 -14.163 1.928 924 HA SER 29 HA SER 29 -8.256 -14.841 -0.871 925 HB2 SER 29 HB3 SER 29 -10.583 -15.492 0.606 926 HB3 SER 29 HB2 SER 29 -9.313 -16.574 0.071 927 HG SER 29 HG SER 29 -8.783 -16.734 2.087 928 H LYS 30 H LYS 30 -10.246 -14.257 -2.026 929 HA LYS 30 HA LYS 30 -10.725 -11.421 -1.800 930 HB2 LYS 30 HB3 LYS 30 -12.434 -13.350 -3.367 931 HB3 LYS 30 HB2 LYS 30 -12.180 -11.653 -3.690 932 HG2 LYS 30 HG3 LYS 30 -10.161 -13.895 -3.989 933 HG3 LYS 30 HG2 LYS 30 -10.882 -12.991 -5.282 934 HD2 LYS 30 HD3 LYS 30 -9.071 -11.783 -3.146 935 HD3 LYS 30 HD2 LYS 30 -8.575 -12.161 -4.783 936 HE2 LYS 30 HE2 LYS 30 -10.600 -10.047 -3.932 937 HE3 LYS 30 HE1 LYS 30 -9.071 -9.810 -4.757 938 HZ1 LYS 30 HZ1 LYS 30 -10.962 -11.553 -6.175 939 HZ2 LYS 30 HZ2 LYS 30 -9.973 -10.274 -6.729 940 HZ3 LYS 30 HZ3 LYS 30 -11.417 -9.957 -5.948 941 H LYS 31 H LYS 31 -11.914 -14.086 -0.192 942 HA LYS 31 HA LYS 31 -14.653 -13.364 0.273 943 HB2 LYS 31 HB3 LYS 31 -12.884 -14.761 2.285 944 HB3 LYS 31 HB2 LYS 31 -14.597 -14.937 1.979 945 HG2 LYS 31 HG3 LYS 31 -14.160 -15.979 -0.190 946 HG3 LYS 31 HG2 LYS 31 -12.451 -15.776 0.012 947 HD2 LYS 31 HD3 LYS 31 -12.587 -17.086 2.146 948 HD3 LYS 31 HD2 LYS 31 -14.265 -17.454 1.723 949 HE2 LYS 31 HE2 LYS 31 -13.142 -18.163 -0.586 950 HE3 LYS 31 HE1 LYS 31 -11.732 -18.270 0.395 951 HZ1 LYS 31 HZ1 LYS 31 -12.819 -19.721 2.000 952 HZ2 LYS 31 HZ2 LYS 31 -12.879 -20.432 0.441 953 HZ3 LYS 31 HZ3 LYS 31 -14.243 -19.709 1.090 954 H GLU 32 H GLU 32 -11.666 -13.126 2.053 955 HA GLU 32 HA GLU 32 -12.578 -11.517 4.190 956 HB2 GLU 32 HB3 GLU 32 -9.849 -12.264 3.179 957 HB3 GLU 32 HB2 GLU 32 -10.186 -11.479 4.734 958 HG2 GLU 32 HG3 GLU 32 -11.302 -14.188 3.871 959 HG3 GLU 32 HG2 GLU 32 -9.913 -13.959 4.917 960 H LEU 33 H LEU 33 -10.690 -10.951 1.264 961 HA LEU 33 HA LEU 33 -9.768 -8.416 1.858 962 HB2 LEU 33 HB3 LEU 33 -8.927 -9.768 -0.046 963 HB3 LEU 33 HB2 LEU 33 -10.487 -9.513 -0.823 964 HG LEU 33 HG LEU 33 -8.475 -8.006 -1.537 965 HD11 LEU 33 HD11 LEU 33 -11.197 -7.740 -1.766 966 HD12 LEU 33 HD12 LEU 33 -10.008 -6.704 -2.520 967 HD13 LEU 33 HD13 LEU 33 -10.743 -6.214 -1.008 968 HD21 LEU 33 HD21 LEU 33 -9.442 -6.301 0.801 969 HD22 LEU 33 HD22 LEU 33 -8.070 -6.055 -0.252 970 HD23 LEU 33 HD23 LEU 33 -8.017 -7.337 0.924 971 H LYS 34 H LYS 34 -12.781 -9.301 0.170 972 HA LYS 34 HA LYS 34 -13.545 -6.612 -0.266 973 HB2 LYS 34 HB3 LYS 34 -15.818 -7.450 -0.620 974 HB3 LYS 34 HB2 LYS 34 -14.668 -8.471 -1.482 975 HG2 LYS 34 HG3 LYS 34 -14.733 -10.113 0.375 976 HG3 LYS 34 HG2 LYS 34 -15.873 -9.078 1.244 977 HD2 LYS 34 HD3 LYS 34 -17.577 -9.419 -0.368 978 HD3 LYS 34 HD2 LYS 34 -16.467 -10.150 -1.515 979 HE2 LYS 34 HE2 LYS 34 -17.938 -11.760 -0.164 980 HE3 LYS 34 HE1 LYS 34 -16.219 -12.111 -0.228 981 HZ1 LYS 34 HZ1 LYS 34 -17.400 -12.143 2.041 982 HZ2 LYS 34 HZ2 LYS 34 -17.298 -10.470 2.038 983 HZ3 LYS 34 HZ3 LYS 34 -15.896 -11.441 1.955 984 H GLU 35 H GLU 35 -14.188 -8.877 2.362 985 HA GLU 35 HA GLU 35 -15.898 -7.201 3.892 986 HB2 GLU 35 HB3 GLU 35 -13.966 -9.331 4.882 987 HB3 GLU 35 HB2 GLU 35 -15.341 -8.657 5.747 988 HG2 GLU 35 HG3 GLU 35 -15.530 -10.169 3.149 989 HG3 GLU 35 HG2 GLU 35 -15.855 -10.860 4.729 990 H LEU 36 H LEU 36 -12.474 -7.917 3.934 991 HA LEU 36 HA LEU 36 -11.576 -6.225 5.964 992 HB2 LEU 36 HB3 LEU 36 -10.195 -7.971 5.162 993 HB3 LEU 36 HB2 LEU 36 -10.393 -7.449 3.498 994 HG LEU 36 HG LEU 36 -9.084 -5.510 3.865 995 HD11 LEU 36 HD11 LEU 36 -8.534 -6.505 6.699 996 HD12 LEU 36 HD12 LEU 36 -9.732 -5.251 6.349 997 HD13 LEU 36 HD13 LEU 36 -8.027 -4.991 5.958 998 HD21 LEU 36 HD21 LEU 36 -6.949 -6.885 4.864 999 HD22 LEU 36 HD22 LEU 36 -7.583 -7.019 3.224 1000 HD23 LEU 36 HD23 LEU 36 -8.044 -8.209 4.433 1001 H LEU 37 H LEU 37 -11.694 -5.716 2.451 1002 HA LEU 37 HA LEU 37 -10.600 -3.166 2.624 1003 HB2 LEU 37 HB3 LEU 37 -10.492 -4.399 0.545 1004 HB3 LEU 37 HB2 LEU 37 -12.241 -4.434 0.409 1005 HG LEU 37 HG LEU 37 -10.779 -2.709 -0.979 1006 HD11 LEU 37 HD11 LEU 37 -12.681 -1.532 -1.414 1007 HD12 LEU 37 HD12 LEU 37 -13.202 -1.467 0.260 1008 HD13 LEU 37 HD13 LEU 37 -13.376 -2.962 -0.669 1009 HD21 LEU 37 HD21 LEU 37 -9.943 -1.731 1.421 1010 HD22 LEU 37 HD22 LEU 37 -11.452 -0.815 1.203 1011 HD23 LEU 37 HD23 LEU 37 -10.210 -0.726 0.003 1012 H GLN 38 H GLN 38 -14.001 -4.183 2.378 1013 HA GLN 38 HA GLN 38 -14.933 -1.495 2.524 1014 HB2 GLN 38 HB3 GLN 38 -17.154 -2.387 2.757 1015 HB3 GLN 38 HB2 GLN 38 -16.305 -3.392 1.588 1016 HG2 GLN 38 HG3 GLN 38 -15.807 -5.018 3.452 1017 HG3 GLN 38 HG2 GLN 38 -16.814 -4.045 4.514 1018 HE21 GLN 38 HE21 GLN 38 -18.520 -5.630 4.754 1019 HE22 GLN 38 HE22 GLN 38 -19.488 -6.086 3.440 1020 H THR 39 H THR 39 -14.438 -4.043 4.893 1021 HA THR 39 HA THR 39 -15.560 -2.712 7.079 1022 HB THR 39 HB THR 39 -13.407 -4.807 6.940 1023 HG1 THR 39 HG2 THR 39 -15.167 -5.620 6.148 1024 HG21 THR 39 HG21 THR 39 -14.398 -5.275 9.302 1025 HG22 THR 39 HG22 THR 39 -14.806 -3.537 9.255 1026 HG23 THR 39 HG23 THR 39 -13.137 -4.089 9.024 1027 H GLU 40 H GLU 40 -12.099 -2.923 6.071 1028 HA GLU 40 HA GLU 40 -11.457 -1.128 8.234 1029 HB2 GLU 40 HB3 GLU 40 -9.618 -2.425 6.223 1030 HB3 GLU 40 HB2 GLU 40 -9.123 -1.526 7.652 1031 HG2 GLU 40 HG3 GLU 40 -10.840 -4.020 7.668 1032 HG3 GLU 40 HG2 GLU 40 -9.137 -3.964 8.108 1033 H LEU 41 H LEU 41 -11.992 -0.723 4.890 1034 HA LEU 41 HA LEU 41 -11.059 2.073 5.175 1035 HB2 LEU 41 HB3 LEU 41 -11.173 0.219 2.879 1036 HB3 LEU 41 HB2 LEU 41 -11.417 1.906 2.528 1037 HG LEU 41 HG LEU 41 -9.267 2.335 3.931 1038 HD11 LEU 41 HD11 LEU 41 -9.062 -0.639 3.437 1039 HD12 LEU 41 HD12 LEU 41 -9.039 0.191 4.997 1040 HD13 LEU 41 HD13 LEU 41 -7.699 0.383 3.874 1041 HD21 LEU 41 HD21 LEU 41 -8.772 0.743 1.423 1042 HD22 LEU 41 HD22 LEU 41 -7.939 2.192 1.993 1043 HD23 LEU 41 HD23 LEU 41 -9.565 2.316 1.337 1044 H SER 42 H SER 42 -13.559 0.974 6.180 1045 HA SER 42 HA SER 42 -15.756 1.387 4.561 1046 HB2 SER 42 HB3 SER 42 -15.557 2.133 7.490 1047 HB3 SER 42 HB2 SER 42 -17.021 1.829 6.585 1048 HG SER 42 HG SER 42 -15.479 -0.257 6.131 1049 H GLY 43 H GLY 43 -13.816 3.793 6.296 1050 HA2 GLY 43 HA3 GLY 43 -15.487 6.007 5.767 1051 HA3 GLY 43 HA2 GLY 43 -13.772 6.062 6.165 1052 H PHE 44 H PHE 44 -12.626 4.712 4.132 1053 HA PHE 44 HA PHE 44 -12.605 6.644 2.020 1054 HB2 PHE 44 HB3 PHE 44 -11.305 3.956 2.350 1055 HB3 PHE 44 HB2 PHE 44 -11.226 4.800 0.811 1056 HD1 PHE 44 HD2 PHE 44 -10.217 7.080 0.707 1057 HD2 PHE 44 HD1 PHE 44 -9.983 4.647 4.212 1058 HE1 PHE 44 HE2 PHE 44 -8.360 8.504 1.559 1059 HE2 PHE 44 HE1 PHE 44 -8.113 6.066 5.069 1060 HZ PHE 44 HZ PHE 44 -7.316 7.988 3.740 1061 H LEU 45 H LEU 45 -13.833 3.409 2.355 1062 HA LEU 45 HA LEU 45 -14.857 3.108 -0.241 1063 HB2 LEU 45 HB3 LEU 45 -14.621 1.166 1.031 1064 HB3 LEU 45 HB2 LEU 45 -15.433 1.848 2.422 1065 HG LEU 45 HG LEU 45 -17.522 1.859 1.309 1066 HD11 LEU 45 HD11 LEU 45 -17.276 0.358 -1.049 1067 HD12 LEU 45 HD12 LEU 45 -15.877 1.437 -1.116 1068 HD13 LEU 45 HD13 LEU 45 -17.511 2.090 -0.918 1069 HD21 LEU 45 HD21 LEU 45 -17.922 -0.543 1.144 1070 HD22 LEU 45 HD22 LEU 45 -16.755 -0.218 2.412 1071 HD23 LEU 45 HD23 LEU 45 -16.209 -0.827 0.833 1072 H ASP 46 H ASP 46 -16.379 4.227 2.737 1073 HA ASP 46 HA ASP 46 -18.893 4.694 1.507 1074 HB2 ASP 46 HB3 ASP 46 -18.526 4.174 3.777 1075 HB3 ASP 46 HB2 ASP 46 -17.818 5.773 4.092 1076 H ALA 47 H ALA 47 -16.157 6.791 2.262 1077 HA ALA 47 HA ALA 47 -17.436 9.232 1.660 1078 HB1 ALA 47 HB1 ALA 47 -14.873 9.769 0.950 1079 HB2 ALA 47 HB2 ALA 47 -14.620 8.348 1.942 1080 HB3 ALA 47 HB3 ALA 47 -15.442 9.764 2.612 1081 H GLN 48 H GLN 48 -15.676 6.967 -0.420 1082 HA GLN 48 HA GLN 48 -16.782 8.433 -2.733 1083 HB2 GLN 48 HB3 GLN 48 -14.835 7.745 -4.047 1084 HB3 GLN 48 HB2 GLN 48 -14.352 8.728 -2.672 1085 HG2 GLN 48 HG3 GLN 48 -13.070 7.040 -1.851 1086 HG3 GLN 48 HG2 GLN 48 -14.419 5.919 -1.920 1087 HE21 GLN 48 HE21 GLN 48 -14.978 5.222 -4.256 1088 HE22 GLN 48 HE22 GLN 48 -13.675 4.808 -5.257 1089 H LYS 49 H LYS 49 -18.215 6.541 -1.486 1090 HA LYS 49 HA LYS 49 -18.102 3.903 -2.524 1091 HB2 LYS 49 HB3 LYS 49 -19.516 4.630 -0.610 1092 HB3 LYS 49 HB2 LYS 49 -20.544 5.507 -1.741 1093 HG2 LYS 49 HG3 LYS 49 -20.193 2.797 -2.706 1094 HG3 LYS 49 HG2 LYS 49 -20.698 2.741 -1.026 1095 HD2 LYS 49 HD3 LYS 49 -22.121 4.239 -3.255 1096 HD3 LYS 49 HD2 LYS 49 -22.631 2.754 -2.499 1097 HE2 LYS 49 HE2 LYS 49 -23.795 3.984 -1.018 1098 HE3 LYS 49 HE1 LYS 49 -22.262 4.448 -0.293 1099 HZ1 LYS 49 HZ1 LYS 49 -22.578 6.519 -1.007 1100 HZ2 LYS 49 HZ2 LYS 49 -24.107 6.094 -1.524 1101 HZ3 LYS 49 HZ3 LYS 49 -22.822 6.062 -2.616 1102 H ASP 50 H ASP 50 -19.635 6.855 -3.545 1103 HA ASP 50 HA ASP 50 -21.063 5.676 -5.729 1104 HB2 ASP 50 HB3 ASP 50 -20.606 8.591 -5.071 1105 HB3 ASP 50 HB2 ASP 50 -21.764 7.952 -6.217 1106 H VAL 51 H VAL 51 -17.859 6.425 -5.421 1107 HA VAL 51 HA VAL 51 -17.510 7.562 -8.064 1108 HB VAL 51 HB VAL 51 -15.465 6.697 -5.998 1109 HG11 VAL 51 HG11 VAL 51 -15.248 8.014 -8.695 1110 HG12 VAL 51 HG12 VAL 51 -14.262 6.720 -8.010 1111 HG13 VAL 51 HG13 VAL 51 -14.070 8.374 -7.445 1112 HG21 VAL 51 HG21 VAL 51 -16.850 8.581 -5.207 1113 HG22 VAL 51 HG22 VAL 51 -16.582 9.434 -6.728 1114 HG23 VAL 51 HG23 VAL 51 -15.238 9.159 -5.628 1115 H ASP 52 H ASP 52 -17.033 6.436 -9.828 1116 HA ASP 52 HA ASP 52 -17.445 3.685 -10.020 1117 HB2 ASP 52 HB3 ASP 52 -17.662 5.053 -11.966 1118 HB3 ASP 52 HB2 ASP 52 -15.981 5.564 -11.876 1119 H ALA 53 H ALA 53 -14.471 5.497 -9.742 1120 HA ALA 53 HA ALA 53 -12.638 3.512 -10.254 1121 HB1 ALA 53 HB1 ALA 53 -11.027 4.750 -8.961 1122 HB2 ALA 53 HB2 ALA 53 -12.295 5.600 -8.090 1123 HB3 ALA 53 HB3 ALA 53 -12.061 5.884 -9.820 1124 H VAL 54 H VAL 54 -14.722 3.839 -7.478 1125 HA VAL 54 HA VAL 54 -13.238 2.259 -5.675 1126 HB VAL 54 HB VAL 54 -15.480 3.686 -5.306 1127 HG11 VAL 54 HG11 VAL 54 -16.589 0.905 -5.770 1128 HG12 VAL 54 HG12 VAL 54 -16.987 2.379 -6.671 1129 HG13 VAL 54 HG13 VAL 54 -17.417 2.237 -4.993 1130 HG21 VAL 54 HG21 VAL 54 -15.842 2.439 -3.205 1131 HG22 VAL 54 HG22 VAL 54 -14.123 2.680 -3.499 1132 HG23 VAL 54 HG23 VAL 54 -14.864 1.110 -3.820 1133 H ASP 55 H ASP 55 -15.701 1.385 -8.053 1134 HA ASP 55 HA ASP 55 -15.588 -1.450 -7.606 1135 HB2 ASP 55 HB3 ASP 55 -17.433 -0.392 -8.933 1136 HB3 ASP 55 HB2 ASP 55 -16.206 0.052 -10.139 1137 H LYS 56 H LYS 56 -13.944 0.818 -9.699 1138 HA LYS 56 HA LYS 56 -12.624 -1.097 -11.274 1139 HB2 LYS 56 HB3 LYS 56 -11.705 1.724 -10.682 1140 HB3 LYS 56 HB2 LYS 56 -11.208 0.723 -12.035 1141 HG2 LYS 56 HG3 LYS 56 -14.050 1.678 -11.512 1142 HG3 LYS 56 HG2 LYS 56 -12.968 2.235 -12.773 1143 HD2 LYS 56 HD3 LYS 56 -12.841 -0.288 -13.468 1144 HD3 LYS 56 HD2 LYS 56 -14.252 -0.449 -12.457 1145 HE2 LYS 56 HE2 LYS 56 -14.598 0.041 -15.013 1146 HE3 LYS 56 HE1 LYS 56 -15.628 0.807 -13.822 1147 HZ1 LYS 56 HZ1 LYS 56 -14.510 2.265 -15.627 1148 HZ2 LYS 56 HZ2 LYS 56 -13.136 2.199 -14.678 1149 HZ3 LYS 56 HZ3 LYS 56 -14.600 2.827 -14.056 1150 H VAL 57 H VAL 57 -11.518 0.587 -8.375 1151 HA VAL 57 HA VAL 57 -8.981 -0.726 -8.256 1152 HB VAL 57 HB VAL 57 -10.684 0.475 -6.044 1153 HG11 VAL 57 HG11 VAL 57 -9.183 -0.678 -4.766 1154 HG12 VAL 57 HG12 VAL 57 -8.141 0.670 -5.157 1155 HG13 VAL 57 HG13 VAL 57 -7.999 -0.828 -6.061 1156 HG21 VAL 57 HG21 VAL 57 -8.288 1.629 -7.523 1157 HG22 VAL 57 HG22 VAL 57 -9.258 2.441 -6.303 1158 HG23 VAL 57 HG23 VAL 57 -9.963 2.068 -7.873 1159 H MET 58 H MET 58 -12.169 -1.382 -6.972 1160 HA MET 58 HA MET 58 -11.645 -3.755 -5.507 1161 HB2 MET 58 HB3 MET 58 -14.065 -2.692 -6.977 1162 HB3 MET 58 HB2 MET 58 -14.078 -4.185 -6.055 1163 HG2 MET 58 HG3 MET 58 -13.072 -1.647 -4.898 1164 HG3 MET 58 HG2 MET 58 -14.793 -2.007 -4.816 1165 HE1 MET 58 HE1 MET 58 -14.844 -5.500 -3.723 1166 HE2 MET 58 HE2 MET 58 -15.543 -4.101 -4.529 1167 HE3 MET 58 HE3 MET 58 -15.691 -4.243 -2.786 1168 H LYS 59 H LYS 59 -12.474 -3.050 -8.841 1169 HA LYS 59 HA LYS 59 -12.856 -5.649 -9.746 1170 HB2 LYS 59 HB3 LYS 59 -13.549 -3.556 -10.865 1171 HB3 LYS 59 HB2 LYS 59 -11.880 -3.291 -11.337 1172 HG2 LYS 59 HG3 LYS 59 -12.393 -4.480 -13.206 1173 HG3 LYS 59 HG2 LYS 59 -12.132 -5.876 -12.175 1174 HD2 LYS 59 HD3 LYS 59 -14.866 -4.681 -12.051 1175 HD3 LYS 59 HD2 LYS 59 -14.461 -5.476 -13.562 1176 HE2 LYS 59 HE2 LYS 59 -14.257 -6.744 -10.801 1177 HE3 LYS 59 HE1 LYS 59 -15.532 -6.994 -11.953 1178 HZ1 LYS 59 HZ1 LYS 59 -14.211 -8.170 -13.370 1179 HZ2 LYS 59 HZ2 LYS 59 -13.675 -8.654 -11.865 1180 HZ3 LYS 59 HZ3 LYS 59 -12.716 -7.603 -12.802 1181 H GLU 60 H GLU 60 -10.002 -3.577 -9.668 1182 HA GLU 60 HA GLU 60 -8.239 -5.204 -11.113 1183 HB2 GLU 60 HB3 GLU 60 -7.788 -3.355 -8.770 1184 HB3 GLU 60 HB2 GLU 60 -6.476 -4.066 -9.705 1185 HG2 GLU 60 HG3 GLU 60 -7.311 -2.978 -11.747 1186 HG3 GLU 60 HG2 GLU 60 -8.694 -2.345 -10.889 1187 H LEU 61 H LEU 61 -9.087 -5.157 -7.703 1188 HA LEU 61 HA LEU 61 -7.563 -7.477 -7.016 1189 HB2 LEU 61 HB3 LEU 61 -9.714 -5.910 -5.651 1190 HB3 LEU 61 HB2 LEU 61 -9.341 -7.515 -5.050 1191 HG LEU 61 HG LEU 61 -8.022 -5.603 -3.984 1192 HD11 LEU 61 HD11 LEU 61 -6.225 -7.625 -5.306 1193 HD12 LEU 61 HD12 LEU 61 -7.356 -8.084 -4.029 1194 HD13 LEU 61 HD13 LEU 61 -6.092 -6.898 -3.717 1195 HD21 LEU 61 HD21 LEU 61 -7.570 -4.367 -6.147 1196 HD22 LEU 61 HD22 LEU 61 -6.492 -5.679 -6.629 1197 HD23 LEU 61 HD23 LEU 61 -6.115 -4.710 -5.236 1198 H ASP 62 H ASP 62 -10.829 -6.913 -8.182 1199 HA ASP 62 HA ASP 62 -11.735 -9.598 -7.933 1200 HB2 ASP 62 HB3 ASP 62 -13.217 -7.610 -8.462 1201 HB3 ASP 62 HB2 ASP 62 -12.546 -7.683 -10.098 1202 H GLU 63 H GLU 63 -10.003 -7.893 -10.493 1203 HA GLU 63 HA GLU 63 -9.883 -10.052 -12.390 1204 HB2 GLU 63 HB3 GLU 63 -7.756 -7.939 -11.830 1205 HB3 GLU 63 HB2 GLU 63 -7.943 -8.897 -13.291 1206 HG2 GLU 63 HG3 GLU 63 -9.917 -6.787 -12.305 1207 HG3 GLU 63 HG2 GLU 63 -8.760 -6.659 -13.601 1208 H ASN 64 H ASN 64 -7.996 -9.034 -9.650 1209 HA ASN 64 HA ASN 64 -6.242 -11.341 -9.742 1210 HB2 ASN 64 HB3 ASN 64 -5.722 -8.951 -8.851 1211 HB3 ASN 64 HB2 ASN 64 -6.531 -9.512 -7.389 1212 HD21 ASN 64 HD21 ASN 64 -3.687 -8.923 -7.542 1213 HD22 ASN 64 HD22 ASN 64 -2.846 -10.364 -7.237 1214 H GLY 65 H GLY 65 -9.065 -11.861 -9.650 1215 HA2 GLY 65 HA3 GLY 65 -9.533 -12.915 -6.948 1216 HA3 GLY 65 HA2 GLY 65 -10.733 -12.807 -8.253 1217 H ASP 66 H ASP 66 -7.630 -13.839 -9.105 1218 HA ASP 66 HA ASP 66 -8.434 -16.260 -10.241 1219 HB2 ASP 66 HB3 ASP 66 -6.425 -14.871 -10.794 1220 HB3 ASP 66 HB2 ASP 66 -5.674 -15.516 -9.339 1221 H GLY 67 H GLY 67 -6.956 -15.505 -7.161 1222 HA2 GLY 67 HA3 GLY 67 -7.860 -18.019 -6.021 1223 HA3 GLY 67 HA2 GLY 67 -6.106 -17.823 -6.118 1224 H GLU 68 H GLU 68 -5.138 -16.055 -5.031 1225 HA GLU 68 HA GLU 68 -6.738 -14.926 -2.822 1226 HB2 GLU 68 HB3 GLU 68 -3.994 -16.162 -2.690 1227 HB3 GLU 68 HB2 GLU 68 -4.680 -15.168 -1.406 1228 HG2 GLU 68 HG3 GLU 68 -6.554 -16.701 -1.146 1229 HG3 GLU 68 HG2 GLU 68 -5.986 -17.690 -2.487 1230 H VAL 69 H VAL 69 -5.597 -13.108 -1.794 1231 HA VAL 69 HA VAL 69 -4.060 -11.526 -3.742 1232 HB VAL 69 HB VAL 69 -6.039 -10.316 -3.694 1233 HG11 VAL 69 HG11 VAL 69 -7.470 -10.028 -1.711 1234 HG12 VAL 69 HG12 VAL 69 -6.345 -10.979 -0.755 1235 HG13 VAL 69 HG13 VAL 69 -7.235 -11.732 -2.079 1236 HG21 VAL 69 HG21 VAL 69 -4.168 -9.243 -1.568 1237 HG22 VAL 69 HG22 VAL 69 -5.771 -8.555 -1.687 1238 HG23 VAL 69 HG23 VAL 69 -4.726 -8.523 -3.079 1239 H ASP 70 H ASP 70 -2.162 -10.752 -3.043 1240 HA ASP 70 HA ASP 70 -1.319 -11.662 -0.415 1241 HB2 ASP 70 HB3 ASP 70 0.725 -11.907 -1.264 1242 HB3 ASP 70 HB2 ASP 70 -0.037 -11.739 -2.829 1243 H PHE 71 H PHE 71 0.462 -10.120 0.565 1244 HA PHE 71 HA PHE 71 -0.969 -7.955 1.608 1245 HB2 PHE 71 HB3 PHE 71 0.916 -8.990 2.794 1246 HB3 PHE 71 HB2 PHE 71 2.018 -8.284 1.602 1247 HD1 PHE 71 HD1 PHE 71 -0.627 -7.390 4.061 1248 HD2 PHE 71 HD2 PHE 71 2.779 -5.991 1.825 1249 HE1 PHE 71 HE1 PHE 71 -0.673 -5.264 5.290 1250 HE2 PHE 71 HE2 PHE 71 2.728 -3.884 3.084 1251 HZ PHE 71 HZ PHE 71 1.016 -3.500 4.804 1252 H GLN 72 H GLN 72 1.584 -8.093 -0.864 1253 HA GLN 72 HA GLN 72 1.823 -5.329 -1.216 1254 HB2 GLN 72 HB3 GLN 72 3.394 -7.127 -2.119 1255 HB3 GLN 72 HB2 GLN 72 2.193 -7.423 -3.373 1256 HG2 GLN 72 HG3 GLN 72 2.312 -5.055 -4.047 1257 HG3 GLN 72 HG2 GLN 72 3.508 -4.789 -2.785 1258 HE21 GLN 72 HE21 GLN 72 3.304 -5.373 -6.037 1259 HE22 GLN 72 HE22 GLN 72 4.834 -6.057 -6.296 1260 H GLU 73 H GLU 73 -0.249 -7.762 -2.637 1261 HA GLU 73 HA GLU 73 -1.643 -6.072 -4.459 1262 HB2 GLU 73 HB3 GLU 73 -1.535 -8.667 -4.337 1263 HB3 GLU 73 HB2 GLU 73 -2.804 -8.519 -3.143 1264 HG2 GLU 73 HG3 GLU 73 -3.898 -8.843 -5.254 1265 HG3 GLU 73 HG2 GLU 73 -4.114 -7.147 -4.848 1266 H TYR 74 H TYR 74 -2.144 -7.055 -1.118 1267 HA TYR 74 HA TYR 74 -4.678 -5.900 -0.662 1268 HB2 TYR 74 HB3 TYR 74 -3.847 -7.503 0.912 1269 HB3 TYR 74 HB2 TYR 74 -2.396 -6.549 1.185 1270 HD1 TYR 74 HD1 TYR 74 -6.123 -5.734 1.250 1271 HD2 TYR 74 HD2 TYR 74 -2.333 -5.676 3.305 1272 HE1 TYR 74 HE1 TYR 74 -7.166 -4.605 3.155 1273 HE2 TYR 74 HE2 TYR 74 -3.399 -4.551 5.221 1274 HH TYR 74 HH TYR 74 -6.171 -4.535 6.034 1275 H VAL 75 H VAL 75 -1.439 -4.513 -0.105 1276 HA VAL 75 HA VAL 75 -2.447 -2.128 0.962 1277 HB VAL 75 HB VAL 75 -0.250 -1.112 0.492 1278 HG11 VAL 75 HG11 VAL 75 -0.051 -3.924 1.615 1279 HG12 VAL 75 HG12 VAL 75 -0.687 -2.545 2.512 1280 HG13 VAL 75 HG13 VAL 75 0.991 -2.557 1.996 1281 HG21 VAL 75 HG21 VAL 75 0.576 -3.798 -0.592 1282 HG22 VAL 75 HG22 VAL 75 1.437 -2.245 -0.698 1283 HG23 VAL 75 HG23 VAL 75 0.070 -2.525 -1.697 1284 H VAL 76 H VAL 76 -1.702 -2.979 -2.403 1285 HA VAL 76 HA VAL 76 -1.965 -0.353 -3.356 1286 HB VAL 76 HB VAL 76 -0.782 -2.045 -4.661 1287 HG11 VAL 76 HG11 VAL 76 -1.930 -4.035 -4.257 1288 HG12 VAL 76 HG12 VAL 76 -2.190 -3.706 -5.964 1289 HG13 VAL 76 HG13 VAL 76 -3.480 -3.404 -4.816 1290 HG21 VAL 76 HG21 VAL 76 -1.731 -1.554 -6.861 1291 HG22 VAL 76 HG22 VAL 76 -1.792 -0.112 -5.856 1292 HG23 VAL 76 HG23 VAL 76 -3.258 -1.056 -6.137 1293 H LEU 77 H LEU 77 -4.336 -2.912 -2.922 1294 HA LEU 77 HA LEU 77 -6.514 -1.726 -4.274 1295 HB2 LEU 77 HB3 LEU 77 -6.562 -4.032 -3.416 1296 HB3 LEU 77 HB2 LEU 77 -6.458 -3.432 -1.774 1297 HG LEU 77 HG LEU 77 -8.639 -2.154 -2.209 1298 HD11 LEU 77 HD11 LEU 77 -9.292 -4.017 -4.409 1299 HD12 LEU 77 HD12 LEU 77 -8.291 -2.655 -4.837 1300 HD13 LEU 77 HD13 LEU 77 -9.863 -2.406 -4.059 1301 HD21 LEU 77 HD21 LEU 77 -9.998 -4.378 -2.205 1302 HD22 LEU 77 HD22 LEU 77 -8.918 -4.008 -0.866 1303 HD23 LEU 77 HD23 LEU 77 -8.410 -5.154 -2.104 1304 H VAL 78 H VAL 78 -5.515 -1.582 -0.877 1305 HA VAL 78 HA VAL 78 -7.475 0.380 -0.249 1306 HB VAL 78 HB VAL 78 -6.443 0.514 1.952 1307 HG11 VAL 78 HG11 VAL 78 -7.783 -1.599 0.989 1308 HG12 VAL 78 HG12 VAL 78 -7.082 -1.631 2.610 1309 HG13 VAL 78 HG13 VAL 78 -6.243 -2.404 1.276 1310 HG21 VAL 78 HG21 VAL 78 -4.414 -0.751 2.483 1311 HG22 VAL 78 HG22 VAL 78 -4.043 0.363 1.176 1312 HG23 VAL 78 HG23 VAL 78 -4.332 -1.348 0.833 1313 H ALA 79 H ALA 79 -4.026 0.487 -1.002 1314 HA ALA 79 HA ALA 79 -3.667 3.213 -0.457 1315 HB1 ALA 79 HB1 ALA 79 -2.200 1.610 -2.550 1316 HB2 ALA 79 HB2 ALA 79 -1.775 1.614 -0.834 1317 HB3 ALA 79 HB3 ALA 79 -1.658 3.094 -1.781 1318 H ALA 80 H ALA 80 -4.608 1.535 -3.437 1319 HA ALA 80 HA ALA 80 -4.611 3.761 -5.102 1320 HB1 ALA 80 HB1 ALA 80 -6.559 2.389 -6.263 1321 HB2 ALA 80 HB2 ALA 80 -6.052 1.138 -5.130 1322 HB3 ALA 80 HB3 ALA 80 -4.908 1.780 -6.288 1323 H LEU 81 H LEU 81 -7.181 2.355 -3.092 1324 HA LEU 81 HA LEU 81 -9.152 4.332 -3.627 1325 HB2 LEU 81 HB3 LEU 81 -8.740 2.477 -1.281 1326 HB3 LEU 81 HB2 LEU 81 -10.134 3.541 -1.432 1327 HG LEU 81 HG LEU 81 -9.347 1.537 -3.580 1328 HD11 LEU 81 HD11 LEU 81 -9.880 0.211 -1.736 1329 HD12 LEU 81 HD12 LEU 81 -11.355 0.273 -2.699 1330 HD13 LEU 81 HD13 LEU 81 -11.224 1.241 -1.225 1331 HD21 LEU 81 HD21 LEU 81 -11.946 1.937 -3.946 1332 HD22 LEU 81 HD22 LEU 81 -10.771 3.061 -4.623 1333 HD23 LEU 81 HD23 LEU 81 -11.617 3.461 -3.128 1334 H THR 82 H THR 82 -6.652 4.045 -1.132 1335 HA THR 82 HA THR 82 -7.420 6.310 0.358 1336 HB THR 82 HB THR 82 -4.568 5.332 0.034 1337 HG1 THR 82 HG2 THR 82 -6.119 3.604 0.518 1338 HG21 THR 82 HG21 THR 82 -4.141 6.396 2.047 1339 HG22 THR 82 HG22 THR 82 -5.806 6.279 2.585 1340 HG23 THR 82 HG23 THR 82 -5.355 7.484 1.386 1341 H VAL 83 H VAL 83 -4.935 5.990 -2.194 1342 HA VAL 83 HA VAL 83 -4.446 8.793 -2.283 1343 HB VAL 83 HB VAL 83 -2.744 7.336 -3.035 1344 HG11 VAL 83 HG11 VAL 83 -2.985 5.612 -4.522 1345 HG12 VAL 83 HG12 VAL 83 -3.976 6.566 -5.611 1346 HG13 VAL 83 HG13 VAL 83 -4.709 5.793 -4.212 1347 HG21 VAL 83 HG21 VAL 83 -3.866 8.958 -5.345 1348 HG22 VAL 83 HG22 VAL 83 -2.267 8.243 -5.331 1349 HG23 VAL 83 HG23 VAL 83 -2.671 9.493 -4.152 1350 H ALA 84 H ALA 84 -6.544 6.676 -4.212 1351 HA ALA 84 HA ALA 84 -7.336 8.562 -6.092 1352 HB1 ALA 84 HB1 ALA 84 -8.007 6.318 -6.487 1353 HB2 ALA 84 HB2 ALA 84 -9.505 7.165 -6.109 1354 HB3 ALA 84 HB3 ALA 84 -8.734 6.179 -4.890 1355 H MET 85 H MET 85 -8.919 7.668 -3.032 1356 HA MET 85 HA MET 85 -10.849 9.735 -3.233 1357 HB2 MET 85 HB3 MET 85 -11.059 7.620 -1.827 1358 HB3 MET 85 HB2 MET 85 -9.952 8.402 -0.702 1359 HG2 MET 85 HG3 MET 85 -11.492 10.326 -0.459 1360 HG3 MET 85 HG2 MET 85 -12.615 9.572 -1.575 1361 HE1 MET 85 HE1 MET 85 -10.685 9.553 1.554 1362 HE2 MET 85 HE2 MET 85 -11.523 8.510 2.687 1363 HE3 MET 85 HE3 MET 85 -12.223 10.054 2.276 1364 H ASN 86 H ASN 86 -7.806 9.423 -1.408 1365 HA ASN 86 HA ASN 86 -8.081 11.811 0.035 1366 HB2 ASN 86 HB3 ASN 86 -6.496 10.098 0.700 1367 HB3 ASN 86 HB2 ASN 86 -5.535 10.397 -0.749 1368 HD21 ASN 86 HD21 ASN 86 -6.528 11.814 2.346 1369 HD22 ASN 86 HD22 ASN 86 -5.340 13.012 2.373 1370 H ASN 87 H ASN 87 -6.341 11.211 -3.022 1371 HA ASN 87 HA ASN 87 -5.271 13.798 -3.164 1372 HB2 ASN 87 HB3 ASN 87 -4.665 11.685 -4.584 1373 HB3 ASN 87 HB2 ASN 87 -5.872 12.326 -5.701 1374 HD21 ASN 87 HD21 ASN 87 -4.837 13.574 -7.267 1375 HD22 ASN 87 HD22 ASN 87 -3.548 14.620 -6.948 1376 H PHE 88 H PHE 88 -8.350 12.569 -4.172 1377 HA PHE 88 HA PHE 88 -9.271 14.616 -5.826 1378 HB2 PHE 88 HB3 PHE 88 -10.557 12.559 -5.341 1379 HB3 PHE 88 HB2 PHE 88 -10.815 13.119 -3.699 1380 HD1 PHE 88 HD2 PHE 88 -11.639 13.753 -7.255 1381 HD2 PHE 88 HD1 PHE 88 -12.428 14.874 -3.181 1382 HE1 PHE 88 HE2 PHE 88 -13.624 15.024 -7.990 1383 HE2 PHE 88 HE1 PHE 88 -14.421 16.141 -3.919 1384 HZ PHE 88 HZ PHE 88 -15.021 16.216 -6.333 1385 H PHE 89 H PHE 89 -9.201 14.409 -2.284 1386 HA PHE 89 HA PHE 89 -10.544 16.831 -1.783 1387 HB2 PHE 89 HB3 PHE 89 -8.496 15.359 -0.098 1388 HB3 PHE 89 HB2 PHE 89 -9.452 16.709 0.475 1389 HD1 PHE 89 HD1 PHE 89 -12.114 16.409 -0.388 1390 HD2 PHE 89 HD2 PHE 89 -9.322 13.301 0.636 1391 HE1 PHE 89 HE1 PHE 89 -13.987 14.894 0.109 1392 HE2 PHE 89 HE2 PHE 89 -11.207 11.779 1.135 1393 HZ PHE 89 HZ PHE 89 -13.549 12.571 0.874 1394 H TRP 90 H TRP 90 -7.125 16.121 -2.277 1395 HA TRP 90 HA TRP 90 -6.254 18.859 -1.866 1396 HB2 TRP 90 HB3 TRP 90 -4.871 16.590 -3.339 1397 HB3 TRP 90 HB2 TRP 90 -4.141 18.122 -2.876 1398 HD1 TRP 90 HD TRP 90 -5.673 15.016 -1.352 1399 HE1 TRP 90 HE1 TRP 90 -4.840 14.704 0.993 1400 HE3 TRP 90 HE3 TRP 90 -2.996 19.304 -0.889 1401 HZ2 TRP 90 HZ2 TRP 90 -3.152 16.120 2.918 1402 HZ3 TRP 90 HZ3 TRP 90 -1.771 19.807 1.211 1403 HH2 TRP 90 HH TRP 90 -1.851 18.204 3.116 1404 H GLU 91 H GLU 91 -6.965 16.833 -4.596 1405 HA GLU 91 HA GLU 91 -6.411 18.815 -6.573 1406 HB2 GLU 91 HB3 GLU 91 -8.176 16.411 -6.672 1407 HB3 GLU 91 HB2 GLU 91 -7.810 17.390 -8.094 1408 HG2 GLU 91 HG3 GLU 91 -5.391 17.056 -7.671 1409 HG3 GLU 91 HG2 GLU 91 -5.761 16.000 -6.339 1410 H ASN 92 H ASN 92 -9.455 17.861 -5.043 1411 HA ASN 92 HA ASN 92 -10.769 20.197 -6.268 1412 HB2 ASN 92 HB3 ASN 92 -11.948 17.992 -6.344 1413 HB3 ASN 92 HB2 ASN 92 -11.958 17.975 -4.586 1414 HD21 ASN 92 HD21 ASN 92 -14.442 17.900 -5.417 1415 HD22 ASN 92 HD22 ASN 92 -15.216 19.402 -5.426 1416 H SER 93 H SER 93 -10.100 21.908 -5.113 1417 HA SER 93 HA SER 93 -11.000 22.335 -2.451 1418 HB2 SER 93 HB3 SER 93 -8.284 21.256 -2.913 1419 HB3 SER 93 HB2 SER 93 -8.365 22.628 -1.817 1420 HG SER 93 HG SER 93 -9.348 20.036 -1.673 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -11.233 8.265 11.972 2 HA2 GLY 1 HA3 GLY 1 -11.925 6.620 10.481 3 HA3 GLY 1 HA2 GLY 1 -10.420 6.838 9.589 4 H SER 2 H SER 2 -10.636 4.412 9.512 5 HA SER 2 HA SER 2 -10.199 2.870 11.881 6 HB2 SER 2 HB3 SER 2 -9.496 1.977 9.074 7 HB3 SER 2 HB2 SER 2 -10.032 1.017 10.438 8 HG SER 2 HG SER 2 -11.465 2.012 8.527 9 H GLU 3 H GLU 3 -8.195 1.477 12.114 10 HA GLU 3 HA GLU 3 -5.830 3.058 12.193 11 HB2 GLU 3 HB3 GLU 3 -6.323 0.093 12.495 12 HB3 GLU 3 HB2 GLU 3 -4.713 0.796 12.569 13 HG2 GLU 3 HG3 GLU 3 -5.272 2.176 14.359 14 HG3 GLU 3 HG2 GLU 3 -6.999 1.759 14.322 15 H LEU 4 H LEU 4 -7.135 0.724 9.967 16 HA LEU 4 HA LEU 4 -4.907 0.516 8.189 17 HB2 LEU 4 HB3 LEU 4 -7.899 0.230 7.828 18 HB3 LEU 4 HB2 LEU 4 -6.809 0.069 6.468 19 HG LEU 4 HG LEU 4 -7.298 -2.131 7.352 20 HD11 LEU 4 HD11 LEU 4 -4.967 -1.566 6.594 21 HD12 LEU 4 HD12 LEU 4 -5.147 -2.997 7.582 22 HD13 LEU 4 HD13 LEU 4 -4.475 -1.546 8.296 23 HD21 LEU 4 HD21 LEU 4 -7.115 -2.754 9.598 24 HD22 LEU 4 HD22 LEU 4 -7.783 -1.164 9.682 25 HD23 LEU 4 HD23 LEU 4 -6.051 -1.406 10.011 26 H GLU 5 H GLU 5 -7.701 2.661 8.367 27 HA GLU 5 HA GLU 5 -7.049 4.254 6.112 28 HB2 GLU 5 HB3 GLU 5 -8.764 4.835 8.557 29 HB3 GLU 5 HB2 GLU 5 -8.681 5.865 7.145 30 HG2 GLU 5 HG3 GLU 5 -9.422 3.962 5.721 31 HG3 GLU 5 HG2 GLU 5 -9.563 2.962 7.143 32 H THR 6 H THR 6 -6.434 4.469 9.566 33 HA THR 6 HA THR 6 -5.088 6.960 9.565 34 HB THR 6 HB THR 6 -4.404 4.657 11.405 35 HG1 THR 6 HG2 THR 6 -6.757 5.057 11.158 36 HG21 THR 6 HG21 THR 6 -4.656 7.218 12.682 37 HG22 THR 6 HG22 THR 6 -3.652 7.413 11.264 38 HG23 THR 6 HG23 THR 6 -3.226 6.228 12.471 39 H ALA 7 H ALA 7 -3.947 3.604 9.248 40 HA ALA 7 HA ALA 7 -1.220 4.127 9.016 41 HB1 ALA 7 HB1 ALA 7 -2.855 1.908 7.736 42 HB2 ALA 7 HB2 ALA 7 -2.049 1.850 9.299 43 HB3 ALA 7 HB3 ALA 7 -1.098 1.941 7.824 44 H MET 8 H MET 8 -3.720 3.848 6.488 45 HA MET 8 HA MET 8 -1.977 4.400 4.332 46 HB2 MET 8 HB3 MET 8 -4.936 5.065 4.467 47 HB3 MET 8 HB2 MET 8 -3.979 4.842 3.019 48 HG2 MET 8 HG3 MET 8 -3.589 2.474 4.581 49 HG3 MET 8 HG2 MET 8 -5.301 2.841 4.589 50 HE1 MET 8 HE1 MET 8 -2.217 1.945 2.817 51 HE2 MET 8 HE2 MET 8 -2.423 3.330 1.741 52 HE3 MET 8 HE3 MET 8 -2.647 1.713 1.112 53 H GLU 9 H GLU 9 -3.989 6.523 6.338 54 HA GLU 9 HA GLU 9 -3.227 8.867 5.016 55 HB2 GLU 9 HB3 GLU 9 -4.300 8.434 7.793 56 HB3 GLU 9 HB2 GLU 9 -3.933 10.039 7.188 57 HG2 GLU 9 HG3 GLU 9 -5.772 8.080 5.775 58 HG3 GLU 9 HG2 GLU 9 -6.314 9.421 6.788 59 H THR 10 H THR 10 -1.775 7.086 7.643 60 HA THR 10 HA THR 10 0.186 8.991 8.361 61 HB THR 10 HB THR 10 0.636 5.981 8.341 62 HG1 THR 10 HG2 THR 10 -1.449 6.677 9.304 63 HG21 THR 10 HG21 THR 10 1.488 7.820 10.539 64 HG22 THR 10 HG22 THR 10 2.372 7.906 9.037 65 HG23 THR 10 HG23 THR 10 2.269 6.380 9.909 66 H LEU 11 H LEU 11 0.112 6.380 5.985 67 HA LEU 11 HA LEU 11 2.651 6.933 4.821 68 HB2 LEU 11 HB3 LEU 11 0.204 5.511 3.786 69 HB3 LEU 11 HB2 LEU 11 1.714 5.580 2.877 70 HG LEU 11 HG LEU 11 1.498 4.483 5.705 71 HD11 LEU 11 HD11 LEU 11 0.166 3.195 3.967 72 HD12 LEU 11 HD12 LEU 11 1.414 2.297 4.820 73 HD13 LEU 11 HD13 LEU 11 1.707 2.837 3.176 74 HD21 LEU 11 HD21 LEU 11 3.817 5.283 4.706 75 HD22 LEU 11 HD22 LEU 11 3.639 3.884 3.652 76 HD23 LEU 11 HD23 LEU 11 3.685 3.666 5.381 77 H ILE 12 H ILE 12 -0.649 8.037 4.066 78 HA ILE 12 HA ILE 12 -0.008 9.445 1.693 79 HB ILE 12 HB ILE 12 -2.159 9.995 3.765 80 HG12 ILE 12 HG13 ILE 12 -2.290 7.777 2.445 81 HG13 ILE 12 HG12 ILE 12 -3.678 8.847 2.286 82 HG21 ILE 12 HG21 ILE 12 -1.732 12.040 2.522 83 HG22 ILE 12 HG22 ILE 12 -3.283 11.329 2.111 84 HG23 ILE 12 HG23 ILE 12 -1.937 11.169 0.994 85 HD11 ILE 12 HD11 ILE 12 -2.799 7.812 0.155 86 HD12 ILE 12 HD12 ILE 12 -1.400 8.862 0.273 87 HD13 ILE 12 HD13 ILE 12 -3.019 9.543 0.114 88 H ASN 13 H ASN 13 -0.090 10.459 5.073 89 HA ASN 13 HA ASN 13 0.529 13.185 4.642 90 HB2 ASN 13 HB3 ASN 13 0.908 11.345 6.993 91 HB3 ASN 13 HB2 ASN 13 1.453 13.012 7.020 92 HD21 ASN 13 HD21 ASN 13 -1.403 10.983 6.896 93 HD22 ASN 13 HD22 ASN 13 -2.539 12.210 7.197 94 H VAL 14 H VAL 14 2.597 10.401 5.285 95 HA VAL 14 HA VAL 14 5.041 11.841 5.148 96 HB VAL 14 HB VAL 14 4.404 8.903 4.748 97 HG11 VAL 14 HG11 VAL 14 6.435 8.840 3.758 98 HG12 VAL 14 HG12 VAL 14 7.056 9.011 5.403 99 HG13 VAL 14 HG13 VAL 14 6.922 10.420 4.369 100 HG21 VAL 14 HG21 VAL 14 4.021 9.501 7.034 101 HG22 VAL 14 HG22 VAL 14 5.401 10.596 7.064 102 HG23 VAL 14 HG23 VAL 14 5.659 8.866 7.023 103 H PHE 15 H PHE 15 3.149 10.028 2.780 104 HA PHE 15 HA PHE 15 4.842 10.304 0.566 105 HB2 PHE 15 HB3 PHE 15 2.872 8.815 0.659 106 HB3 PHE 15 HB2 PHE 15 1.813 10.214 0.628 107 HD1 PHE 15 HD1 PHE 15 4.375 8.334 -1.302 108 HD2 PHE 15 HD2 PHE 15 1.352 11.395 -1.415 109 HE1 PHE 15 HE1 PHE 15 4.497 8.375 -3.776 110 HE2 PHE 15 HE2 PHE 15 1.490 11.425 -3.885 111 HZ PHE 15 HZ PHE 15 3.071 9.900 -5.059 112 H HIS 16 H HIS 16 2.186 12.323 1.747 113 HA HIS 16 HA HIS 16 2.306 14.308 -0.276 114 HB2 HIS 16 HB3 HIS 16 1.091 14.092 2.441 115 HB3 HIS 16 HB2 HIS 16 1.315 15.695 1.778 116 HD1 HIS 16 HD1 HIS 16 -0.510 16.503 0.292 117 HD2 HIS 16 HD2 HIS 16 -0.296 12.346 0.377 118 HE1 HIS 16 HE1 HIS 16 -2.447 15.675 -1.075 119 HE2 HIS 16 HE2 HIS 16 -2.370 13.134 -1.034 120 H ALA 17 H ALA 17 3.802 13.991 2.900 121 HA ALA 17 HA ALA 17 4.978 16.486 3.137 122 HB1 ALA 17 HB1 ALA 17 6.510 15.512 4.680 123 HB2 ALA 17 HB2 ALA 17 6.372 13.919 3.954 124 HB3 ALA 17 HB3 ALA 17 5.016 14.608 4.847 125 H HIS 18 H HIS 18 6.269 13.569 1.603 126 HA HIS 18 HA HIS 18 8.557 14.921 0.551 127 HB2 HIS 18 HB3 HIS 18 7.385 12.212 -0.090 128 HB3 HIS 18 HB2 HIS 18 8.834 12.846 -0.859 129 HD1 HIS 18 HD1 HIS 18 10.965 13.388 0.761 130 HD2 HIS 18 HD2 HIS 18 7.789 11.310 2.561 131 HE1 HIS 18 HE1 HIS 18 11.818 12.505 2.939 132 HE2 HIS 18 HE2 HIS 18 9.903 11.265 4.076 133 H SER 19 H SER 19 5.347 14.184 -0.738 134 HA SER 19 HA SER 19 5.814 14.846 -3.434 135 HB2 SER 19 HB3 SER 19 3.321 15.542 -1.838 136 HB3 SER 19 HB2 SER 19 3.438 15.445 -3.560 137 HG SER 19 HG SER 19 4.132 13.219 -1.886 138 H GLY 20 H GLY 20 5.028 16.887 -0.667 139 HA2 GLY 20 HA3 GLY 20 4.921 19.352 -2.007 140 HA3 GLY 20 HA2 GLY 20 5.304 19.128 -0.304 141 H LYS 21 H LYS 21 7.619 17.486 -0.735 142 HA LYS 21 HA LYS 21 9.582 19.513 -0.851 143 HB2 LYS 21 HB3 LYS 21 9.895 16.503 -1.025 144 HB3 LYS 21 HB2 LYS 21 11.200 17.659 -0.800 145 HG2 LYS 21 HG3 LYS 21 10.185 18.502 1.257 146 HG3 LYS 21 HG2 LYS 21 8.817 17.411 1.033 147 HD2 LYS 21 HD3 LYS 21 10.400 15.476 1.173 148 HD3 LYS 21 HD2 LYS 21 11.702 16.585 1.545 149 HE2 LYS 21 HE2 LYS 21 9.201 16.067 3.170 150 HE3 LYS 21 HE1 LYS 21 10.874 15.775 3.654 151 HZ1 LYS 21 HZ1 LYS 21 11.250 18.200 3.565 152 HZ2 LYS 21 HZ2 LYS 21 10.049 17.769 4.652 153 HZ3 LYS 21 HZ3 LYS 21 9.607 18.445 3.188 154 H GLU 22 H GLU 22 8.542 17.099 -3.247 155 HA GLU 22 HA GLU 22 10.482 18.200 -5.146 156 HB2 GLU 22 HB3 GLU 22 8.842 15.871 -6.043 157 HB3 GLU 22 HB2 GLU 22 10.533 16.211 -6.178 158 HG2 GLU 22 HG3 GLU 22 10.760 15.743 -3.636 159 HG3 GLU 22 HG2 GLU 22 9.108 15.235 -3.740 160 H GLY 23 H GLY 23 7.049 18.173 -4.561 161 HA2 GLY 23 HA3 GLY 23 5.943 20.141 -5.537 162 HA3 GLY 23 HA2 GLY 23 6.679 19.741 -7.072 163 H ASP 24 H ASP 24 4.525 19.725 -7.945 164 HA ASP 24 HA ASP 24 2.645 18.708 -8.728 165 HB2 ASP 24 HB3 ASP 24 4.246 16.638 -8.759 166 HB3 ASP 24 HB2 ASP 24 3.393 16.156 -7.307 167 H LYS 25 H LYS 25 0.538 17.801 -7.911 168 HA LYS 25 HA LYS 25 -0.139 19.062 -5.429 169 HB2 LYS 25 HB3 LYS 25 -2.168 17.671 -5.537 170 HB3 LYS 25 HB2 LYS 25 -2.003 18.829 -6.890 171 HG2 LYS 25 HG3 LYS 25 -0.784 16.578 -7.928 172 HG3 LYS 25 HG2 LYS 25 -1.958 15.824 -6.849 173 HD2 LYS 25 HD3 LYS 25 -3.033 17.999 -8.574 174 HD3 LYS 25 HD2 LYS 25 -2.462 16.585 -9.427 175 HE2 LYS 25 HE2 LYS 25 -4.656 15.954 -9.003 176 HE3 LYS 25 HE1 LYS 25 -3.838 15.242 -7.614 177 HZ1 LYS 25 HZ1 LYS 25 -5.223 16.437 -6.370 178 HZ2 LYS 25 HZ2 LYS 25 -5.814 17.250 -7.712 179 HZ3 LYS 25 HZ3 LYS 25 -4.456 17.863 -6.894 180 H TYR 26 H TYR 26 0.274 15.717 -6.340 181 HA TYR 26 HA TYR 26 1.661 15.147 -4.009 182 HB2 TYR 26 HB3 TYR 26 -0.204 13.249 -3.390 183 HB3 TYR 26 HB2 TYR 26 -0.017 14.772 -2.540 184 HD1 TYR 26 HD2 TYR 26 -1.951 12.996 -5.149 185 HD2 TYR 26 HD1 TYR 26 -1.620 16.583 -2.806 186 HE1 TYR 26 HE2 TYR 26 -4.174 13.664 -5.873 187 HE2 TYR 26 HE1 TYR 26 -3.868 17.276 -3.536 188 HH TYR 26 HH TYR 26 -6.158 15.556 -4.647 189 H LYS 27 H LYS 27 3.095 14.304 -5.317 190 HA LYS 27 HA LYS 27 2.692 11.599 -6.145 191 HB2 LYS 27 HB3 LYS 27 3.693 13.690 -8.129 192 HB3 LYS 27 HB2 LYS 27 3.780 11.940 -8.339 193 HG2 LYS 27 HG3 LYS 27 1.168 13.399 -7.898 194 HG3 LYS 27 HG2 LYS 27 1.821 13.126 -9.489 195 HD2 LYS 27 HD3 LYS 27 1.439 10.769 -7.572 196 HD3 LYS 27 HD2 LYS 27 0.135 11.358 -8.565 197 HE2 LYS 27 HE2 LYS 27 2.757 10.192 -9.511 198 HE3 LYS 27 HE1 LYS 27 1.132 9.637 -9.849 199 HZ1 LYS 27 HZ1 LYS 27 2.605 11.892 -10.972 200 HZ2 LYS 27 HZ2 LYS 27 0.893 12.020 -10.913 201 HZ3 LYS 27 HZ3 LYS 27 1.641 10.765 -11.756 202 H LEU 28 H LEU 28 4.874 10.608 -6.508 203 HA LEU 28 HA LEU 28 6.935 12.164 -5.097 204 HB2 LEU 28 HB3 LEU 28 6.072 10.491 -3.623 205 HB3 LEU 28 HB2 LEU 28 6.190 9.241 -4.850 206 HG LEU 28 HG LEU 28 8.712 9.639 -4.865 207 HD11 LEU 28 HD11 LEU 28 9.584 11.292 -3.766 208 HD12 LEU 28 HD12 LEU 28 8.865 10.781 -2.235 209 HD13 LEU 28 HD13 LEU 28 8.001 11.894 -3.290 210 HD21 LEU 28 HD21 LEU 28 7.143 8.593 -2.533 211 HD22 LEU 28 HD22 LEU 28 8.891 8.721 -2.397 212 HD23 LEU 28 HD23 LEU 28 8.177 7.726 -3.677 213 H SER 29 H SER 29 8.822 12.317 -6.091 214 HA SER 29 HA SER 29 9.172 10.850 -8.614 215 HB2 SER 29 HB3 SER 29 11.241 12.701 -8.449 216 HB3 SER 29 HB2 SER 29 9.779 12.807 -9.380 217 HG SER 29 HG SER 29 9.648 13.536 -6.649 218 H LYS 30 H LYS 30 11.688 10.581 -9.004 219 HA LYS 30 HA LYS 30 12.402 8.567 -7.021 220 HB2 LYS 30 HB3 LYS 30 14.019 9.342 -9.454 221 HB3 LYS 30 HB2 LYS 30 14.080 7.851 -8.533 222 HG2 LYS 30 HG3 LYS 30 11.674 8.803 -10.116 223 HG3 LYS 30 HG2 LYS 30 12.764 7.542 -10.641 224 HD2 LYS 30 HD3 LYS 30 11.455 7.228 -7.930 225 HD3 LYS 30 HD2 LYS 30 10.493 6.979 -9.364 226 HE2 LYS 30 HE2 LYS 30 12.999 5.523 -8.539 227 HE3 LYS 30 HE1 LYS 30 11.390 4.845 -8.752 228 HZ1 LYS 30 HZ1 LYS 30 12.389 6.067 -11.243 229 HZ2 LYS 30 HZ2 LYS 30 11.852 4.515 -10.989 230 HZ3 LYS 30 HZ3 LYS 30 13.400 4.901 -10.593 231 H LYS 31 H LYS 31 12.651 11.589 -6.549 232 HA LYS 31 HA LYS 31 15.503 11.747 -5.898 233 HB2 LYS 31 HB3 LYS 31 13.769 14.001 -5.077 234 HB3 LYS 31 HB2 LYS 31 15.265 13.996 -5.977 235 HG2 LYS 31 HG3 LYS 31 14.070 13.138 -8.012 236 HG3 LYS 31 HG2 LYS 31 12.589 13.227 -7.075 237 HD2 LYS 31 HD3 LYS 31 12.725 15.549 -6.845 238 HD3 LYS 31 HD2 LYS 31 14.296 15.665 -7.687 239 HE2 LYS 31 HE2 LYS 31 11.657 14.684 -8.759 240 HE3 LYS 31 HE1 LYS 31 12.402 16.191 -9.205 241 HZ1 LYS 31 HZ1 LYS 31 14.165 13.922 -9.582 242 HZ2 LYS 31 HZ2 LYS 31 13.806 15.170 -10.622 243 HZ3 LYS 31 HZ3 LYS 31 12.787 13.840 -10.541 244 H GLU 32 H GLU 32 12.519 12.601 -4.135 245 HA GLU 32 HA GLU 32 13.662 12.262 -1.559 246 HB2 GLU 32 HB3 GLU 32 10.778 12.395 -2.485 247 HB3 GLU 32 HB2 GLU 32 11.273 12.323 -0.801 248 HG2 GLU 32 HG3 GLU 32 12.199 14.458 -2.744 249 HG3 GLU 32 HG2 GLU 32 10.819 14.639 -1.681 250 H LEU 33 H LEU 33 11.873 10.129 -3.679 251 HA LEU 33 HA LEU 33 10.855 8.317 -1.935 252 HB2 LEU 33 HB3 LEU 33 10.326 8.249 -4.327 253 HB3 LEU 33 HB2 LEU 33 11.967 7.733 -4.667 254 HG LEU 33 HG LEU 33 10.061 5.953 -4.626 255 HD11 LEU 33 HD11 LEU 33 12.711 5.715 -4.556 256 HD12 LEU 33 HD12 LEU 33 11.627 4.340 -4.409 257 HD13 LEU 33 HD13 LEU 33 12.351 5.026 -2.970 258 HD21 LEU 33 HD21 LEU 33 9.273 5.159 -2.626 259 HD22 LEU 33 HD22 LEU 33 9.536 6.806 -2.087 260 HD23 LEU 33 HD23 LEU 33 10.726 5.555 -1.738 261 H LYS 34 H LYS 34 14.129 8.060 -3.360 262 HA LYS 34 HA LYS 34 14.803 5.574 -2.168 263 HB2 LYS 34 HB3 LYS 34 16.571 7.944 -2.645 264 HB3 LYS 34 HB2 LYS 34 17.133 6.309 -2.350 265 HG2 LYS 34 HG3 LYS 34 17.101 6.009 -4.619 266 HG3 LYS 34 HG2 LYS 34 15.352 6.024 -4.501 267 HD2 LYS 34 HD3 LYS 34 15.992 7.671 -6.120 268 HD3 LYS 34 HD2 LYS 34 15.376 8.522 -4.718 269 HE2 LYS 34 HE2 LYS 34 18.034 8.666 -5.948 270 HE3 LYS 34 HE1 LYS 34 17.283 9.756 -4.809 271 HZ1 LYS 34 HZ1 LYS 34 19.386 8.451 -4.194 272 HZ2 LYS 34 HZ2 LYS 34 18.379 7.178 -3.800 273 HZ3 LYS 34 HZ3 LYS 34 18.244 8.691 -3.003 274 H GLU 35 H GLU 35 15.299 8.890 -1.193 275 HA GLU 35 HA GLU 35 16.591 8.331 1.246 276 HB2 GLU 35 HB3 GLU 35 15.073 10.870 0.674 277 HB3 GLU 35 HB2 GLU 35 16.533 10.644 1.628 278 HG2 GLU 35 HG3 GLU 35 16.330 10.505 -1.424 279 HG3 GLU 35 HG2 GLU 35 17.226 11.609 -0.439 280 H LEU 36 H LEU 36 13.311 9.138 0.371 281 HA LEU 36 HA LEU 36 12.125 9.133 2.927 282 HB2 LEU 36 HB3 LEU 36 10.759 10.015 1.264 283 HB3 LEU 36 HB2 LEU 36 11.252 8.821 0.090 284 HG LEU 36 HG LEU 36 9.958 7.106 1.211 285 HD11 LEU 36 HD11 LEU 36 8.231 8.743 2.820 286 HD12 LEU 36 HD12 LEU 36 9.886 9.016 3.366 287 HD13 LEU 36 HD13 LEU 36 9.223 7.383 3.320 288 HD21 LEU 36 HD21 LEU 36 7.664 8.657 0.937 289 HD22 LEU 36 HD22 LEU 36 8.528 7.788 -0.327 290 HD23 LEU 36 HD23 LEU 36 8.866 9.492 -0.061 291 H LEU 37 H LEU 37 12.460 6.533 0.498 292 HA LEU 37 HA LEU 37 11.135 4.652 2.086 293 HB2 LEU 37 HB3 LEU 37 11.387 4.319 -0.324 294 HB3 LEU 37 HB2 LEU 37 13.125 4.142 -0.154 295 HG LEU 37 HG LEU 37 11.674 2.008 -0.366 296 HD11 LEU 37 HD11 LEU 37 13.344 1.742 2.092 297 HD12 LEU 37 HD12 LEU 37 14.147 2.363 0.651 298 HD13 LEU 37 HD13 LEU 37 13.333 0.805 0.608 299 HD21 LEU 37 HD21 LEU 37 10.583 1.172 1.556 300 HD22 LEU 37 HD22 LEU 37 10.056 2.841 1.444 301 HD23 LEU 37 HD23 LEU 37 11.302 2.379 2.609 302 H GLN 38 H GLN 38 14.633 5.219 1.689 303 HA GLN 38 HA GLN 38 15.291 3.160 3.509 304 HB2 GLN 38 HB3 GLN 38 17.554 4.037 3.559 305 HB3 GLN 38 HB2 GLN 38 16.973 4.113 1.891 306 HG2 GLN 38 HG3 GLN 38 16.479 6.504 2.189 307 HG3 GLN 38 HG2 GLN 38 17.024 6.432 3.865 308 HE21 GLN 38 HE21 GLN 38 18.254 7.983 1.502 309 HE22 GLN 38 HE22 GLN 38 19.839 7.438 1.464 310 H THR 39 H THR 39 14.713 6.584 3.885 311 HA THR 39 HA THR 39 15.525 6.849 6.548 312 HB THR 39 HB THR 39 13.468 8.341 4.940 313 HG1 THR 39 HG2 THR 39 15.310 8.561 3.988 314 HG21 THR 39 HG21 THR 39 13.997 10.190 6.515 315 HG22 THR 39 HG22 THR 39 14.775 9.006 7.593 316 HG23 THR 39 HG23 THR 39 13.049 8.870 7.174 317 H GLU 40 H GLU 40 12.207 6.404 5.246 318 HA GLU 40 HA GLU 40 11.121 6.286 7.865 319 HB2 GLU 40 HB3 GLU 40 9.834 5.567 5.220 320 HB3 GLU 40 HB2 GLU 40 9.000 5.760 6.760 321 HG2 GLU 40 HG3 GLU 40 10.621 7.928 5.381 322 HG3 GLU 40 HG2 GLU 40 8.868 7.836 5.431 323 H LEU 41 H LEU 41 11.939 3.798 5.513 324 HA LEU 41 HA LEU 41 11.027 1.716 7.387 325 HB2 LEU 41 HB3 LEU 41 11.732 1.749 4.484 326 HB3 LEU 41 HB2 LEU 41 11.795 0.258 5.340 327 HG LEU 41 HG LEU 41 9.440 0.673 6.212 328 HD11 LEU 41 HD11 LEU 41 8.105 2.260 4.717 329 HD12 LEU 41 HD12 LEU 41 9.652 2.963 4.263 330 HD13 LEU 41 HD13 LEU 41 9.126 2.979 5.956 331 HD21 LEU 41 HD21 LEU 41 10.166 -0.678 4.054 332 HD22 LEU 41 HD22 LEU 41 9.371 0.648 3.213 333 HD23 LEU 41 HD23 LEU 41 8.463 -0.345 4.362 334 H SER 42 H SER 42 13.210 3.163 8.215 335 HA SER 42 HA SER 42 15.720 2.185 7.540 336 HB2 SER 42 HB3 SER 42 14.671 3.066 10.234 337 HB3 SER 42 HB2 SER 42 16.368 2.798 9.890 338 HG SER 42 HG SER 42 14.589 4.750 8.753 339 H GLY 43 H GLY 43 13.327 0.829 9.808 340 HA2 GLY 43 HA3 GLY 43 14.983 -1.303 10.727 341 HA3 GLY 43 HA2 GLY 43 13.236 -1.180 10.883 342 H PHE 44 H PHE 44 12.482 -1.081 8.227 343 HA PHE 44 HA PHE 44 12.596 -3.870 7.598 344 HB2 PHE 44 HB3 PHE 44 11.352 -1.531 6.170 345 HB3 PHE 44 HB2 PHE 44 11.344 -3.147 5.472 346 HD1 PHE 44 HD2 PHE 44 10.500 -5.047 6.999 347 HD2 PHE 44 HD1 PHE 44 9.698 -0.918 7.671 348 HE1 PHE 44 HE2 PHE 44 8.549 -5.669 8.437 349 HE2 PHE 44 HE1 PHE 44 7.749 -1.530 9.112 350 HZ PHE 44 HZ PHE 44 7.187 -3.884 9.477 351 H LEU 45 H LEU 45 13.975 -0.938 6.352 352 HA LEU 45 HA LEU 45 15.135 -1.999 4.068 353 HB2 LEU 45 HB3 LEU 45 14.911 0.368 4.385 354 HB3 LEU 45 HB2 LEU 45 15.923 0.354 5.808 355 HG LEU 45 HG LEU 45 17.743 -0.497 4.570 356 HD11 LEU 45 HD11 LEU 45 17.421 -0.197 1.892 357 HD12 LEU 45 HD12 LEU 45 15.735 -0.435 2.300 358 HD13 LEU 45 HD13 LEU 45 16.924 -1.691 2.686 359 HD21 LEU 45 HD21 LEU 45 18.453 1.576 3.847 360 HD22 LEU 45 HD22 LEU 45 16.972 2.069 4.633 361 HD23 LEU 45 HD23 LEU 45 17.017 1.856 2.872 362 H ASP 46 H ASP 46 16.359 -1.675 7.378 363 HA ASP 46 HA ASP 46 18.996 -2.442 6.980 364 HB2 ASP 46 HB3 ASP 46 18.183 -1.597 9.102 365 HB3 ASP 46 HB2 ASP 46 17.189 -3.027 9.315 366 H ALA 47 H ALA 47 16.253 -4.531 7.815 367 HA ALA 47 HA ALA 47 17.771 -6.947 7.614 368 HB1 ALA 47 HB1 ALA 47 15.836 -8.070 8.148 369 HB2 ALA 47 HB2 ALA 47 14.826 -6.987 7.197 370 HB3 ALA 47 HB3 ALA 47 15.423 -6.471 8.774 371 H GLN 48 H GLN 48 15.659 -5.180 5.435 372 HA GLN 48 HA GLN 48 15.590 -7.141 3.417 373 HB2 GLN 48 HB3 GLN 48 14.957 -4.194 3.341 374 HB3 GLN 48 HB2 GLN 48 14.777 -5.270 1.949 375 HG2 GLN 48 HG3 GLN 48 13.442 -5.718 4.641 376 HG3 GLN 48 HG2 GLN 48 12.639 -5.089 3.205 377 HE21 GLN 48 HE21 GLN 48 13.754 -7.970 4.770 378 HE22 GLN 48 HE22 GLN 48 13.336 -9.027 3.510 379 H LYS 49 H LYS 49 17.895 -4.714 4.038 380 HA LYS 49 HA LYS 49 19.102 -4.638 1.476 381 HB2 LYS 49 HB3 LYS 49 20.301 -4.174 4.211 382 HB3 LYS 49 HB2 LYS 49 21.265 -4.097 2.751 383 HG2 LYS 49 HG3 LYS 49 18.720 -2.508 3.095 384 HG3 LYS 49 HG2 LYS 49 20.297 -1.860 3.542 385 HD2 LYS 49 HD3 LYS 49 20.927 -2.651 1.042 386 HD3 LYS 49 HD2 LYS 49 19.193 -2.508 0.822 387 HE2 LYS 49 HE2 LYS 49 20.077 -0.362 0.241 388 HE3 LYS 49 HE1 LYS 49 19.381 -0.139 1.832 389 HZ1 LYS 49 HZ1 LYS 49 21.713 -0.761 2.653 390 HZ2 LYS 49 HZ2 LYS 49 21.391 0.772 2.082 391 HZ3 LYS 49 HZ3 LYS 49 22.225 -0.341 1.089 392 H ASP 50 H ASP 50 19.566 -6.845 4.150 393 HA ASP 50 HA ASP 50 21.640 -8.321 2.830 394 HB2 ASP 50 HB3 ASP 50 21.043 -8.331 5.392 395 HB3 ASP 50 HB2 ASP 50 19.862 -9.533 4.908 396 H VAL 51 H VAL 51 18.377 -7.998 2.120 397 HA VAL 51 HA VAL 51 18.146 -10.721 1.079 398 HB VAL 51 HB VAL 51 16.043 -8.598 1.607 399 HG11 VAL 51 HG11 VAL 51 15.045 -9.850 -0.062 400 HG12 VAL 51 HG12 VAL 51 14.585 -10.780 1.352 401 HG13 VAL 51 HG13 VAL 51 15.928 -11.318 0.357 402 HG21 VAL 51 HG21 VAL 51 16.688 -11.193 3.068 403 HG22 VAL 51 HG22 VAL 51 15.345 -10.118 3.434 404 HG23 VAL 51 HG23 VAL 51 17.002 -9.570 3.688 405 H ASP 52 H ASP 52 18.138 -11.001 -1.066 406 HA ASP 52 HA ASP 52 18.961 -9.002 -2.865 407 HB2 ASP 52 HB3 ASP 52 19.349 -11.315 -3.375 408 HB3 ASP 52 HB2 ASP 52 17.623 -11.655 -3.388 409 H ALA 53 H ALA 53 15.788 -10.241 -2.072 410 HA ALA 53 HA ALA 53 14.295 -9.305 -4.165 411 HB1 ALA 53 HB1 ALA 53 12.394 -9.574 -2.876 412 HB2 ALA 53 HB2 ALA 53 13.186 -9.099 -1.385 413 HB3 ALA 53 HB3 ALA 53 13.529 -10.679 -2.109 414 H VAL 54 H VAL 54 15.754 -7.404 -1.631 415 HA VAL 54 HA VAL 54 14.096 -5.156 -1.816 416 HB VAL 54 HB VAL 54 15.796 -5.467 -0.020 417 HG11 VAL 54 HG11 VAL 54 17.960 -4.423 -1.806 418 HG12 VAL 54 HG12 VAL 54 17.614 -6.154 -1.836 419 HG13 VAL 54 HG13 VAL 54 18.057 -5.375 -0.340 420 HG21 VAL 54 HG21 VAL 54 16.831 -2.939 -0.822 421 HG22 VAL 54 HG22 VAL 54 15.476 -3.248 0.263 422 HG23 VAL 54 HG23 VAL 54 15.191 -3.028 -1.453 423 H ASP 55 H ASP 55 16.916 -6.142 -3.668 424 HA ASP 55 HA ASP 55 17.213 -3.828 -5.291 425 HB2 ASP 55 HB3 ASP 55 18.857 -5.676 -5.292 426 HB3 ASP 55 HB2 ASP 55 17.652 -6.711 -6.050 427 H LYS 56 H LYS 56 15.472 -6.795 -5.730 428 HA LYS 56 HA LYS 56 14.400 -6.253 -8.253 429 HB2 LYS 56 HB3 LYS 56 13.573 -8.162 -6.090 430 HB3 LYS 56 HB2 LYS 56 12.807 -8.120 -7.666 431 HG2 LYS 56 HG3 LYS 56 14.953 -8.501 -8.791 432 HG3 LYS 56 HG2 LYS 56 15.800 -8.485 -7.245 433 HD2 LYS 56 HD3 LYS 56 14.723 -10.402 -6.502 434 HD3 LYS 56 HD2 LYS 56 13.568 -10.455 -7.845 435 HE2 LYS 56 HE2 LYS 56 15.466 -12.090 -8.073 436 HE3 LYS 56 HE1 LYS 56 15.386 -10.948 -9.406 437 HZ1 LYS 56 HZ1 LYS 56 17.207 -9.671 -8.422 438 HZ2 LYS 56 HZ2 LYS 56 17.624 -11.294 -8.505 439 HZ3 LYS 56 HZ3 LYS 56 17.174 -10.647 -7.026 440 H VAL 57 H VAL 57 13.043 -5.717 -5.034 441 HA VAL 57 HA VAL 57 10.455 -4.891 -5.976 442 HB VAL 57 HB VAL 57 11.921 -4.358 -3.378 443 HG11 VAL 57 HG11 VAL 57 10.146 -2.652 -3.980 444 HG12 VAL 57 HG12 VAL 57 9.880 -3.518 -2.484 445 HG13 VAL 57 HG13 VAL 57 8.981 -3.976 -3.948 446 HG21 VAL 57 HG21 VAL 57 11.266 -6.757 -3.927 447 HG22 VAL 57 HG22 VAL 57 9.584 -6.219 -3.937 448 HG23 VAL 57 HG23 VAL 57 10.535 -6.112 -2.456 449 H MET 58 H MET 58 13.368 -3.295 -4.908 450 HA MET 58 HA MET 58 12.531 -0.671 -5.350 451 HB2 MET 58 HB3 MET 58 14.451 -1.174 -3.949 452 HB3 MET 58 HB2 MET 58 15.312 -1.878 -5.305 453 HG2 MET 58 HG3 MET 58 15.397 0.100 -6.427 454 HG3 MET 58 HG2 MET 58 14.362 1.008 -5.314 455 HE1 MET 58 HE1 MET 58 17.824 -0.340 -6.194 456 HE2 MET 58 HE2 MET 58 17.394 -1.558 -4.992 457 HE3 MET 58 HE3 MET 58 18.702 -0.444 -4.665 458 H LYS 59 H LYS 59 14.050 -3.059 -7.443 459 HA LYS 59 HA LYS 59 14.679 -1.339 -9.582 460 HB2 LYS 59 HB3 LYS 59 15.624 -3.609 -9.299 461 HB3 LYS 59 HB2 LYS 59 14.048 -4.297 -9.676 462 HG2 LYS 59 HG3 LYS 59 14.412 -4.092 -11.874 463 HG3 LYS 59 HG2 LYS 59 14.742 -2.371 -11.706 464 HD2 LYS 59 HD3 LYS 59 16.679 -3.521 -12.667 465 HD3 LYS 59 HD2 LYS 59 17.094 -2.887 -11.075 466 HE2 LYS 59 HE2 LYS 59 16.193 -5.424 -10.412 467 HE3 LYS 59 HE1 LYS 59 16.859 -5.693 -12.015 468 HZ1 LYS 59 HZ1 LYS 59 18.230 -5.396 -9.594 469 HZ2 LYS 59 HZ2 LYS 59 18.673 -4.090 -10.587 470 HZ3 LYS 59 HZ3 LYS 59 18.881 -5.675 -11.121 471 H GLU 60 H GLU 60 11.827 -3.436 -9.049 472 HA GLU 60 HA GLU 60 10.553 -2.642 -11.450 473 HB2 GLU 60 HB3 GLU 60 9.528 -3.813 -8.890 474 HB3 GLU 60 HB2 GLU 60 8.475 -3.507 -10.271 475 HG2 GLU 60 HG3 GLU 60 9.960 -4.923 -11.683 476 HG3 GLU 60 HG2 GLU 60 10.962 -5.231 -10.276 477 H LEU 61 H LEU 61 10.342 -1.472 -8.146 478 HA LEU 61 HA LEU 61 8.422 0.541 -8.720 479 HB2 LEU 61 HB3 LEU 61 10.341 0.047 -6.471 480 HB3 LEU 61 HB2 LEU 61 9.567 1.627 -6.605 481 HG LEU 61 HG LEU 61 8.352 -0.167 -5.175 482 HD11 LEU 61 HD11 LEU 61 7.294 1.921 -5.816 483 HD12 LEU 61 HD12 LEU 61 6.151 0.596 -5.954 484 HD13 LEU 61 HD13 LEU 61 6.892 1.262 -7.404 485 HD21 LEU 61 HD21 LEU 61 8.599 -2.009 -6.927 486 HD22 LEU 61 HD22 LEU 61 7.425 -1.134 -7.915 487 HD23 LEU 61 HD23 LEU 61 6.963 -1.752 -6.352 488 H ASP 62 H ASP 62 11.938 0.411 -8.838 489 HA ASP 62 HA ASP 62 12.328 3.128 -9.438 490 HB2 ASP 62 HB3 ASP 62 14.172 1.534 -8.826 491 HB3 ASP 62 HB2 ASP 62 13.994 0.817 -10.421 492 H GLU 63 H GLU 63 11.781 0.302 -11.518 493 HA GLU 63 HA GLU 63 11.914 1.693 -13.994 494 HB2 GLU 63 HB3 GLU 63 10.382 -0.796 -13.210 495 HB3 GLU 63 HB2 GLU 63 10.572 -0.229 -14.858 496 HG2 GLU 63 HG3 GLU 63 13.026 -0.367 -14.700 497 HG3 GLU 63 HG2 GLU 63 12.879 -0.879 -13.019 498 H ASN 64 H ASN 64 9.276 0.887 -11.816 499 HA ASN 64 HA ASN 64 7.172 1.983 -13.349 500 HB2 ASN 64 HB3 ASN 64 7.233 0.582 -11.065 501 HB3 ASN 64 HB2 ASN 64 7.129 2.254 -10.450 502 HD21 ASN 64 HD21 ASN 64 5.006 0.275 -10.248 503 HD22 ASN 64 HD22 ASN 64 3.647 0.899 -11.069 504 H GLY 65 H GLY 65 9.285 3.295 -10.872 505 HA2 GLY 65 HA3 GLY 65 8.180 5.942 -10.891 506 HA3 GLY 65 HA2 GLY 65 9.730 5.454 -10.188 507 H ASP 66 H ASP 66 8.622 5.063 -13.511 508 HA ASP 66 HA ASP 66 11.071 5.880 -14.640 509 HB2 ASP 66 HB3 ASP 66 9.450 4.479 -15.856 510 HB3 ASP 66 HB2 ASP 66 8.324 5.836 -15.888 511 H GLY 67 H GLY 67 8.103 7.479 -13.962 512 HA2 GLY 67 HA3 GLY 67 9.356 10.116 -14.589 513 HA3 GLY 67 HA2 GLY 67 7.634 9.815 -14.774 514 H GLU 68 H GLU 68 6.679 8.772 -12.724 515 HA GLU 68 HA GLU 68 7.732 10.018 -10.278 516 HB2 GLU 68 HB3 GLU 68 4.900 10.203 -11.328 517 HB3 GLU 68 HB2 GLU 68 5.360 10.597 -9.679 518 HG2 GLU 68 HG3 GLU 68 6.870 12.326 -10.435 519 HG3 GLU 68 HG2 GLU 68 6.605 11.917 -12.120 520 H VAL 69 H VAL 69 6.919 9.006 -8.374 521 HA VAL 69 HA VAL 69 5.733 6.349 -8.800 522 HB VAL 69 HB VAL 69 7.926 5.906 -7.921 523 HG11 VAL 69 HG11 VAL 69 8.679 8.115 -7.326 524 HG12 VAL 69 HG12 VAL 69 8.798 7.109 -5.889 525 HG13 VAL 69 HG13 VAL 69 7.462 8.227 -6.059 526 HG21 VAL 69 HG21 VAL 69 6.682 4.534 -6.586 527 HG22 VAL 69 HG22 VAL 69 5.725 5.834 -5.850 528 HG23 VAL 69 HG23 VAL 69 7.385 5.542 -5.346 529 H ASP 70 H ASP 70 3.764 6.250 -8.050 530 HA ASP 70 HA ASP 70 2.744 8.567 -6.631 531 HB2 ASP 70 HB3 ASP 70 1.518 7.925 -8.581 532 HB3 ASP 70 HB2 ASP 70 1.428 6.267 -8.045 533 H PHE 71 H PHE 71 0.804 7.916 -5.170 534 HA PHE 71 HA PHE 71 1.904 6.929 -2.821 535 HB2 PHE 71 HB3 PHE 71 -0.125 8.383 -2.954 536 HB3 PHE 71 HB2 PHE 71 -1.035 6.993 -3.534 537 HD1 PHE 71 HD1 PHE 71 1.338 7.874 -0.798 538 HD2 PHE 71 HD2 PHE 71 -2.184 5.681 -1.924 539 HE1 PHE 71 HE1 PHE 71 1.049 7.140 1.524 540 HE2 PHE 71 HE2 PHE 71 -2.469 4.958 0.418 541 HZ PHE 71 HZ PHE 71 -0.872 5.668 2.140 542 H GLN 72 H GLN 72 -0.131 5.389 -5.263 543 HA GLN 72 HA GLN 72 -0.448 2.921 -3.961 544 HB2 GLN 72 HB3 GLN 72 -0.493 3.730 -6.844 545 HB3 GLN 72 HB2 GLN 72 -0.818 2.054 -6.361 546 HG2 GLN 72 HG3 GLN 72 -2.638 2.890 -4.888 547 HG3 GLN 72 HG2 GLN 72 -2.286 4.535 -5.414 548 HE21 GLN 72 HE21 GLN 72 -2.735 1.390 -7.150 549 HE22 GLN 72 HE22 GLN 72 -3.827 2.032 -8.277 550 H GLU 73 H GLU 73 2.086 4.036 -6.208 551 HA GLU 73 HA GLU 73 3.554 1.601 -6.157 552 HB2 GLU 73 HB3 GLU 73 4.440 4.430 -6.763 553 HB3 GLU 73 HB2 GLU 73 5.468 3.003 -6.938 554 HG2 GLU 73 HG3 GLU 73 4.644 3.137 -9.083 555 HG3 GLU 73 HG2 GLU 73 3.404 2.114 -8.371 556 H TYR 74 H TYR 74 3.569 4.538 -4.245 557 HA TYR 74 HA TYR 74 5.875 4.049 -2.730 558 HB2 TYR 74 HB3 TYR 74 4.880 6.258 -2.754 559 HB3 TYR 74 HB2 TYR 74 3.391 5.632 -2.082 560 HD1 TYR 74 HD1 TYR 74 7.076 5.468 -1.163 561 HD2 TYR 74 HD2 TYR 74 3.024 6.119 0.149 562 HE1 TYR 74 HE1 TYR 74 7.878 5.876 1.122 563 HE2 TYR 74 HE2 TYR 74 3.849 6.551 2.446 564 HH TYR 74 HH TYR 74 7.208 6.948 3.172 565 H VAL 75 H VAL 75 2.479 3.235 -1.992 566 HA VAL 75 HA VAL 75 3.150 2.040 0.467 567 HB VAL 75 HB VAL 75 0.941 1.098 0.555 568 HG11 VAL 75 HG11 VAL 75 0.353 3.687 -0.808 569 HG12 VAL 75 HG12 VAL 75 1.482 3.723 0.540 570 HG13 VAL 75 HG13 VAL 75 -0.136 3.109 0.780 571 HG21 VAL 75 HG21 VAL 75 0.991 0.460 -2.026 572 HG22 VAL 75 HG22 VAL 75 0.335 2.078 -2.237 573 HG23 VAL 75 HG23 VAL 75 -0.514 0.895 -1.244 574 H VAL 76 H VAL 76 2.859 0.632 -2.784 575 HA VAL 76 HA VAL 76 3.178 -2.020 -1.855 576 HB VAL 76 HB VAL 76 2.214 -1.532 -4.086 577 HG11 VAL 76 HG11 VAL 76 3.698 -0.947 -5.953 578 HG12 VAL 76 HG12 VAL 76 5.039 -0.750 -4.832 579 HG13 VAL 76 HG13 VAL 76 3.621 0.306 -4.725 580 HG21 VAL 76 HG21 VAL 76 4.752 -3.202 -4.242 581 HG22 VAL 76 HG22 VAL 76 3.359 -3.311 -5.305 582 HG23 VAL 76 HG23 VAL 76 3.201 -3.772 -3.611 583 H LEU 77 H LEU 77 5.497 0.418 -2.893 584 HA LEU 77 HA LEU 77 7.795 -1.231 -2.912 585 HB2 LEU 77 HB3 LEU 77 7.837 1.083 -3.799 586 HB3 LEU 77 HB2 LEU 77 7.540 1.693 -2.198 587 HG LEU 77 HG LEU 77 9.670 0.836 -1.357 588 HD11 LEU 77 HD11 LEU 77 10.072 -1.155 -2.499 589 HD12 LEU 77 HD12 LEU 77 11.313 -0.067 -3.099 590 HD13 LEU 77 HD13 LEU 77 9.914 -0.421 -4.098 591 HD21 LEU 77 HD21 LEU 77 11.228 2.184 -2.808 592 HD22 LEU 77 HD22 LEU 77 9.768 3.048 -2.350 593 HD23 LEU 77 HD23 LEU 77 9.918 2.370 -3.972 594 H VAL 78 H VAL 78 6.406 0.764 -0.308 595 HA VAL 78 HA VAL 78 8.308 -0.175 1.563 596 HB VAL 78 HB VAL 78 7.010 0.972 3.270 597 HG11 VAL 78 HG11 VAL 78 7.846 2.909 2.489 598 HG12 VAL 78 HG12 VAL 78 6.571 3.022 1.283 599 HG13 VAL 78 HG13 VAL 78 8.055 2.154 0.910 600 HG21 VAL 78 HG21 VAL 78 4.879 2.161 2.525 601 HG22 VAL 78 HG22 VAL 78 4.728 0.406 2.676 602 HG23 VAL 78 HG23 VAL 78 4.934 1.151 1.087 603 H ALA 79 H ALA 79 4.998 -1.113 0.780 604 HA ALA 79 HA ALA 79 4.683 -3.015 2.837 605 HB1 ALA 79 HB1 ALA 79 2.798 -2.162 1.460 606 HB2 ALA 79 HB2 ALA 79 2.842 -3.915 1.518 607 HB3 ALA 79 HB3 ALA 79 3.441 -3.066 0.096 608 H ALA 80 H ALA 80 5.930 -3.311 -0.462 609 HA ALA 80 HA ALA 80 6.163 -6.081 -0.574 610 HB1 ALA 80 HB1 ALA 80 6.519 -4.816 -2.573 611 HB2 ALA 80 HB2 ALA 80 8.042 -5.615 -2.192 612 HB3 ALA 80 HB3 ALA 80 7.820 -3.901 -1.811 613 H LEU 81 H LEU 81 8.491 -3.672 0.476 614 HA LEU 81 HA LEU 81 10.498 -5.476 1.360 615 HB2 LEU 81 HB3 LEU 81 9.818 -2.647 2.168 616 HB3 LEU 81 HB2 LEU 81 11.259 -3.490 2.716 617 HG LEU 81 HG LEU 81 10.570 -3.115 -0.220 618 HD11 LEU 81 HD11 LEU 81 12.330 -1.470 1.619 619 HD12 LEU 81 HD12 LEU 81 10.955 -0.931 0.645 620 HD13 LEU 81 HD13 LEU 81 12.450 -1.417 -0.142 621 HD21 LEU 81 HD21 LEU 81 13.047 -4.074 1.270 622 HD22 LEU 81 HD22 LEU 81 13.057 -3.592 -0.420 623 HD23 LEU 81 HD23 LEU 81 12.110 -4.981 0.075 624 H THR 82 H THR 82 7.722 -3.945 2.912 625 HA THR 82 HA THR 82 8.229 -4.836 5.525 626 HB THR 82 HB THR 82 5.504 -4.357 4.302 627 HG1 THR 82 HG2 THR 82 7.047 -2.591 3.986 628 HG21 THR 82 HG21 THR 82 5.986 -5.354 6.744 629 HG22 THR 82 HG22 THR 82 4.682 -4.220 6.430 630 HG23 THR 82 HG23 THR 82 6.200 -3.642 7.101 631 H VAL 83 H VAL 83 6.113 -6.269 2.987 632 HA VAL 83 HA VAL 83 5.414 -8.514 4.560 633 HB VAL 83 HB VAL 83 4.038 -7.898 2.671 634 HG11 VAL 83 HG11 VAL 83 6.241 -8.868 0.830 635 HG12 VAL 83 HG12 VAL 83 5.951 -7.168 1.165 636 HG13 VAL 83 HG13 VAL 83 4.710 -8.143 0.377 637 HG21 VAL 83 HG21 VAL 83 3.912 -10.101 1.465 638 HG22 VAL 83 HG22 VAL 83 3.768 -10.210 3.216 639 HG23 VAL 83 HG23 VAL 83 5.283 -10.656 2.415 640 H ALA 84 H ALA 84 7.953 -8.053 2.153 641 HA ALA 84 HA ALA 84 8.943 -10.671 2.165 642 HB1 ALA 84 HB1 ALA 84 10.530 -8.110 1.852 643 HB2 ALA 84 HB2 ALA 84 9.697 -8.951 0.550 644 HB3 ALA 84 HB3 ALA 84 11.052 -9.723 1.381 645 H MET 85 H MET 85 9.934 -7.860 4.159 646 HA MET 85 HA MET 85 11.738 -9.433 5.704 647 HB2 MET 85 HB3 MET 85 11.755 -6.857 5.532 648 HB3 MET 85 HB2 MET 85 10.417 -6.937 6.677 649 HG2 MET 85 HG3 MET 85 11.782 -8.202 8.293 650 HG3 MET 85 HG2 MET 85 13.135 -8.186 7.185 651 HE1 MET 85 HE1 MET 85 11.499 -4.887 9.824 652 HE2 MET 85 HE2 MET 85 12.001 -6.474 10.363 653 HE3 MET 85 HE3 MET 85 10.650 -6.343 9.250 654 H ASN 86 H ASN 86 8.373 -8.404 6.189 655 HA ASN 86 HA ASN 86 8.056 -9.149 8.797 656 HB2 ASN 86 HB3 ASN 86 6.210 -8.584 6.667 657 HB3 ASN 86 HB2 ASN 86 5.637 -9.988 7.505 658 HD21 ASN 86 HD21 ASN 86 6.404 -6.592 7.938 659 HD22 ASN 86 HD22 ASN 86 5.693 -6.410 9.461 660 H ASN 87 H ASN 87 8.362 -11.201 6.067 661 HA ASN 87 HA ASN 87 7.421 -13.622 6.944 662 HB2 ASN 87 HB3 ASN 87 8.433 -13.498 4.772 663 HB3 ASN 87 HB2 ASN 87 9.962 -12.971 5.453 664 HD21 ASN 87 HD21 ASN 87 7.793 -15.820 5.399 665 HD22 ASN 87 HD22 ASN 87 9.035 -16.954 5.665 666 H PHE 88 H PHE 88 10.353 -11.900 7.841 667 HA PHE 88 HA PHE 88 11.541 -13.891 9.415 668 HB2 PHE 88 HB3 PHE 88 11.812 -10.880 9.426 669 HB3 PHE 88 HB2 PHE 88 12.700 -11.893 10.540 670 HD1 PHE 88 HD1 PHE 88 14.190 -13.748 9.620 671 HD2 PHE 88 HD2 PHE 88 12.568 -10.626 7.150 672 HE1 PHE 88 HE1 PHE 88 15.893 -14.220 7.898 673 HE2 PHE 88 HE2 PHE 88 14.287 -11.108 5.425 674 HZ PHE 88 HZ PHE 88 15.946 -12.908 5.798 675 H PHE 89 H PHE 89 9.314 -11.267 10.192 676 HA PHE 89 HA PHE 89 9.326 -11.525 13.016 677 HB2 PHE 89 HB3 PHE 89 7.175 -10.518 11.138 678 HB3 PHE 89 HB2 PHE 89 7.060 -10.434 12.879 679 HD1 PHE 89 HD1 PHE 89 10.516 -10.016 12.437 680 HD2 PHE 89 HD2 PHE 89 6.795 -7.940 11.635 681 HE1 PHE 89 HE1 PHE 89 11.690 -7.887 12.415 682 HE2 PHE 89 HE2 PHE 89 8.021 -5.809 11.621 683 HZ PHE 89 HZ PHE 89 10.464 -5.770 12.013 684 H TRP 90 H TRP 90 7.137 -12.925 10.639 685 HA TRP 90 HA TRP 90 5.778 -14.414 12.726 686 HB2 TRP 90 HB3 TRP 90 5.252 -14.586 9.762 687 HB3 TRP 90 HB2 TRP 90 4.202 -15.107 11.076 688 HD1 TRP 90 HD TRP 90 5.812 -11.908 9.732 689 HE1 TRP 90 HE1 TRP 90 4.384 -9.922 10.323 690 HE3 TRP 90 HE3 TRP 90 2.251 -14.290 12.481 691 HZ2 TRP 90 HZ2 TRP 90 1.937 -9.374 11.806 692 HZ3 TRP 90 HZ3 TRP 90 0.369 -13.006 13.474 693 HH2 TRP 90 HH TRP 90 0.211 -10.561 13.139 694 H GLU 91 H GLU 91 7.720 -15.219 9.910 695 HA GLU 91 HA GLU 91 7.724 -18.018 10.859 696 HB2 GLU 91 HB3 GLU 91 8.226 -16.896 8.134 697 HB3 GLU 91 HB2 GLU 91 8.398 -18.601 8.547 698 HG2 GLU 91 HG3 GLU 91 6.105 -18.727 9.323 699 HG3 GLU 91 HG2 GLU 91 5.820 -17.028 8.974 700 H ASN 92 H ASN 92 10.103 -16.012 9.101 701 HA ASN 92 HA ASN 92 12.174 -17.816 10.066 702 HB2 ASN 92 HB3 ASN 92 12.245 -16.883 7.756 703 HB3 ASN 92 HB2 ASN 92 12.521 -15.282 8.421 704 HD21 ASN 92 HD21 ASN 92 14.508 -16.089 6.808 705 HD22 ASN 92 HD22 ASN 92 15.867 -16.611 7.677 706 H SER 93 H SER 93 12.554 -17.619 12.203 707 HA SER 93 HA SER 93 13.801 -15.175 13.135 708 HB2 SER 93 HB3 SER 93 11.085 -15.368 13.414 709 HB3 SER 93 HB2 SER 93 11.638 -16.095 14.915 710 HG SER 93 HG SER 93 12.761 -14.235 15.380 711 H1 GLY 1 H GLY 1 12.198 3.833 14.725 712 HA2 GLY 1 HA3 GLY 1 12.081 2.881 11.992 713 HA3 GLY 1 HA2 GLY 1 11.128 1.946 13.120 714 H SER 2 H SER 2 10.519 3.996 10.903 715 HA SER 2 HA SER 2 9.190 6.191 12.199 716 HB2 SER 2 HB3 SER 2 9.121 5.060 9.401 717 HB3 SER 2 HB2 SER 2 8.138 6.413 9.907 718 HG SER 2 HG SER 2 9.903 7.306 9.192 719 H GLU 3 H GLU 3 6.931 6.561 12.376 720 HA GLU 3 HA GLU 3 5.399 4.463 13.377 721 HB2 GLU 3 HB3 GLU 3 4.451 7.034 12.052 722 HB3 GLU 3 HB2 GLU 3 3.487 5.962 13.061 723 HG2 GLU 3 HG3 GLU 3 4.154 7.528 14.619 724 HG3 GLU 3 HG2 GLU 3 5.350 6.285 14.835 725 H LEU 4 H LEU 4 6.208 5.347 10.180 726 HA LEU 4 HA LEU 4 4.051 4.258 8.750 727 HB2 LEU 4 HB3 LEU 4 6.975 4.429 7.990 728 HB3 LEU 4 HB2 LEU 4 5.674 4.001 6.896 729 HG LEU 4 HG LEU 4 5.939 6.641 8.378 730 HD11 LEU 4 HD11 LEU 4 6.913 5.679 5.844 731 HD12 LEU 4 HD12 LEU 4 7.196 7.215 6.657 732 HD13 LEU 4 HD13 LEU 4 5.790 7.015 5.614 733 HD21 LEU 4 HD21 LEU 4 3.689 5.364 6.871 734 HD22 LEU 4 HD22 LEU 4 4.016 7.059 6.536 735 HD23 LEU 4 HD23 LEU 4 3.678 6.535 8.187 736 H GLU 5 H GLU 5 7.050 2.883 10.079 737 HA GLU 5 HA GLU 5 6.725 0.314 8.964 738 HB2 GLU 5 HB3 GLU 5 8.129 1.199 11.511 739 HB3 GLU 5 HB2 GLU 5 8.218 -0.433 10.861 740 HG2 GLU 5 HG3 GLU 5 9.177 0.527 8.726 741 HG3 GLU 5 HG2 GLU 5 9.140 2.102 9.465 742 H THR 6 H THR 6 5.712 1.790 11.982 743 HA THR 6 HA THR 6 4.375 -0.455 13.062 744 HB THR 6 HB THR 6 3.627 2.448 13.483 745 HG1 THR 6 HG2 THR 6 5.911 0.998 14.164 746 HG21 THR 6 HG21 THR 6 2.681 1.741 15.493 747 HG22 THR 6 HG22 THR 6 3.662 0.287 15.579 748 HG23 THR 6 HG23 THR 6 2.309 0.365 14.466 749 H ALA 7 H ALA 7 3.348 2.219 10.951 750 HA ALA 7 HA ALA 7 0.638 1.493 10.720 751 HB1 ALA 7 HB1 ALA 7 0.593 2.883 8.768 752 HB2 ALA 7 HB2 ALA 7 2.327 2.751 8.556 753 HB3 ALA 7 HB3 ALA 7 1.674 3.660 9.929 754 H MET 8 H MET 8 3.484 0.623 8.785 755 HA MET 8 HA MET 8 2.085 -1.086 6.990 756 HB2 MET 8 HB3 MET 8 4.998 -1.133 7.830 757 HB3 MET 8 HB2 MET 8 4.336 -2.029 6.465 758 HG2 MET 8 HG3 MET 8 4.404 1.007 6.756 759 HG3 MET 8 HG2 MET 8 5.294 0.018 5.612 760 HE1 MET 8 HE1 MET 8 3.288 -0.982 2.974 761 HE2 MET 8 HE2 MET 8 2.735 -2.049 4.259 762 HE3 MET 8 HE3 MET 8 4.424 -1.546 4.217 763 H GLU 9 H GLU 9 3.704 -1.626 10.080 764 HA GLU 9 HA GLU 9 3.288 -4.403 10.202 765 HB2 GLU 9 HB3 GLU 9 3.565 -2.280 12.338 766 HB3 GLU 9 HB2 GLU 9 3.324 -3.978 12.733 767 HG2 GLU 9 HG3 GLU 9 5.549 -2.981 10.930 768 HG3 GLU 9 HG2 GLU 9 5.714 -3.210 12.669 769 H THR 10 H THR 10 1.323 -1.606 11.087 770 HA THR 10 HA THR 10 -0.848 -3.033 12.211 771 HB THR 10 HB THR 10 -1.145 -0.425 10.670 772 HG1 THR 10 HG2 THR 10 0.667 -0.603 12.359 773 HG21 THR 10 HG21 THR 10 -2.533 -1.528 13.131 774 HG22 THR 10 HG22 THR 10 -3.203 -1.511 11.507 775 HG23 THR 10 HG23 THR 10 -2.885 0.001 12.341 776 H LEU 11 H LEU 11 -0.073 -1.974 8.934 777 HA LEU 11 HA LEU 11 -2.374 -3.059 7.697 778 HB2 LEU 11 HB3 LEU 11 0.400 -2.494 6.633 779 HB3 LEU 11 HB2 LEU 11 -0.928 -3.023 5.605 780 HG LEU 11 HG LEU 11 -1.053 -0.549 7.357 781 HD11 LEU 11 HD11 LEU 11 -0.920 0.506 4.931 782 HD12 LEU 11 HD12 LEU 11 -0.007 -0.945 4.570 783 HD13 LEU 11 HD13 LEU 11 0.533 0.153 5.847 784 HD21 LEU 11 HD21 LEU 11 -3.182 -0.386 6.663 785 HD22 LEU 11 HD22 LEU 11 -3.056 -2.004 5.953 786 HD23 LEU 11 HD23 LEU 11 -2.737 -0.585 4.978 787 H ILE 12 H ILE 12 0.860 -4.391 8.343 788 HA ILE 12 HA ILE 12 0.426 -6.917 7.098 789 HB ILE 12 HB ILE 12 2.298 -6.157 9.384 790 HG12 ILE 12 HG13 ILE 12 2.616 -5.199 6.974 791 HG13 ILE 12 HG12 ILE 12 3.989 -5.982 7.735 792 HG21 ILE 12 HG21 ILE 12 1.993 -8.471 9.638 793 HG22 ILE 12 HG22 ILE 12 3.441 -8.325 8.642 794 HG23 ILE 12 HG23 ILE 12 1.901 -8.706 7.899 795 HD11 ILE 12 HD11 ILE 12 3.684 -7.997 6.435 796 HD12 ILE 12 HD12 ILE 12 3.531 -6.654 5.329 797 HD13 ILE 12 HD13 ILE 12 2.088 -7.480 5.874 798 H ASN 13 H ASN 13 -0.023 -5.801 10.425 799 HA ASN 13 HA ASN 13 -0.827 -8.280 11.495 800 HB2 ASN 13 HB3 ASN 13 -1.346 -5.437 12.346 801 HB3 ASN 13 HB2 ASN 13 -2.040 -6.798 13.219 802 HD21 ASN 13 HD21 ASN 13 0.891 -5.091 12.543 803 HD22 ASN 13 HD22 ASN 13 1.903 -5.980 13.589 804 H VAL 14 H VAL 14 -2.714 -5.631 10.094 805 HA VAL 14 HA VAL 14 -5.248 -6.860 10.443 806 HB VAL 14 HB VAL 14 -4.303 -4.860 8.377 807 HG11 VAL 14 HG11 VAL 14 -6.388 -6.031 7.704 808 HG12 VAL 14 HG12 VAL 14 -6.687 -4.342 8.069 809 HG13 VAL 14 HG13 VAL 14 -7.114 -5.583 9.243 810 HG21 VAL 14 HG21 VAL 14 -6.037 -4.089 10.666 811 HG22 VAL 14 HG22 VAL 14 -4.691 -3.217 9.935 812 HG23 VAL 14 HG23 VAL 14 -4.381 -4.494 11.085 813 H PHE 15 H PHE 15 -2.921 -6.755 7.774 814 HA PHE 15 HA PHE 15 -4.342 -8.323 5.940 815 HB2 PHE 15 HB3 PHE 15 -2.320 -7.017 5.404 816 HB3 PHE 15 HB2 PHE 15 -1.345 -8.128 6.357 817 HD1 PHE 15 HD1 PHE 15 -3.411 -7.779 3.315 818 HD2 PHE 15 HD2 PHE 15 -0.785 -10.354 5.538 819 HE1 PHE 15 HE1 PHE 15 -3.214 -9.293 1.363 820 HE2 PHE 15 HE2 PHE 15 -0.600 -11.837 3.600 821 HZ PHE 15 HZ PHE 15 -1.801 -11.326 1.525 822 H HIS 16 H HIS 16 -1.949 -9.207 8.396 823 HA HIS 16 HA HIS 16 -2.026 -11.978 7.966 824 HB2 HIS 16 HB3 HIS 16 -1.212 -10.270 10.302 825 HB3 HIS 16 HB2 HIS 16 -1.224 -12.023 10.439 826 HD1 HIS 16 HD1 HIS 16 1.212 -12.648 10.238 827 HD2 HIS 16 HD2 HIS 16 0.051 -9.915 7.315 828 HE1 HIS 16 HE1 HIS 16 3.166 -12.423 8.625 829 HE2 HIS 16 HE2 HIS 16 2.469 -10.768 6.849 830 H ALA 17 H ALA 17 -3.974 -9.867 9.982 831 HA ALA 17 HA ALA 17 -5.324 -11.820 11.461 832 HB1 ALA 17 HB1 ALA 17 -6.841 -9.448 10.383 833 HB2 ALA 17 HB2 ALA 17 -5.553 -9.197 11.556 834 HB3 ALA 17 HB3 ALA 17 -6.929 -10.197 11.971 835 H HIS 18 H HIS 18 -6.185 -10.428 8.324 836 HA HIS 18 HA HIS 18 -8.365 -12.207 7.883 837 HB2 HIS 18 HB3 HIS 18 -6.794 -10.539 5.912 838 HB3 HIS 18 HB2 HIS 18 -8.267 -11.437 5.547 839 HD1 HIS 18 HD1 HIS 18 -10.515 -10.723 6.960 840 HD2 HIS 18 HD2 HIS 18 -7.259 -8.082 7.199 841 HE1 HIS 18 HE1 HIS 18 -11.371 -8.574 7.967 842 HE2 HIS 18 HE2 HIS 18 -9.425 -6.967 8.113 843 H SER 19 H SER 19 -4.924 -12.281 6.943 844 HA SER 19 HA SER 19 -5.044 -14.632 5.383 845 HB2 SER 19 HB3 SER 19 -2.807 -13.778 7.264 846 HB3 SER 19 HB2 SER 19 -2.694 -14.970 5.987 847 HG SER 19 HG SER 19 -3.548 -13.038 4.656 848 H GLY 20 H GLY 20 -4.806 -14.048 8.844 849 HA2 GLY 20 HA3 GLY 20 -4.640 -16.739 9.700 850 HA3 GLY 20 HA2 GLY 20 -5.217 -15.381 10.668 851 H LYS 21 H LYS 21 -7.379 -14.579 9.010 852 HA LYS 21 HA LYS 21 -9.442 -16.316 9.925 853 HB2 LYS 21 HB3 LYS 21 -9.529 -14.294 7.652 854 HB3 LYS 21 HB2 LYS 21 -10.922 -15.026 8.419 855 HG2 LYS 21 HG3 LYS 21 -8.892 -13.264 9.851 856 HG3 LYS 21 HG2 LYS 21 -10.470 -12.762 9.275 857 HD2 LYS 21 HD3 LYS 21 -11.570 -14.363 10.749 858 HD3 LYS 21 HD2 LYS 21 -10.010 -14.955 11.319 859 HE2 LYS 21 HE2 LYS 21 -9.469 -12.713 12.195 860 HE3 LYS 21 HE1 LYS 21 -11.009 -12.100 11.614 861 HZ1 LYS 21 HZ1 LYS 21 -10.633 -13.036 14.044 862 HZ2 LYS 21 HZ2 LYS 21 -11.156 -14.471 13.288 863 HZ3 LYS 21 HZ3 LYS 21 -12.127 -13.088 13.269 864 H GLU 22 H GLU 22 -7.963 -15.787 6.762 865 HA GLU 22 HA GLU 22 -9.448 -17.863 5.502 866 HB2 GLU 22 HB3 GLU 22 -7.004 -16.311 4.528 867 HB3 GLU 22 HB2 GLU 22 -7.895 -17.497 3.600 868 HG2 GLU 22 HG3 GLU 22 -9.905 -16.213 3.771 869 HG3 GLU 22 HG2 GLU 22 -9.138 -15.105 4.897 870 H GLY 23 H GLY 23 -6.182 -17.684 6.881 871 HA2 GLY 23 HA3 GLY 23 -5.730 -19.846 8.123 872 HA3 GLY 23 HA2 GLY 23 -5.976 -20.628 6.576 873 H ASP 24 H ASP 24 -4.574 -18.286 5.228 874 HA ASP 24 HA ASP 24 -2.007 -19.517 5.131 875 HB2 ASP 24 HB3 ASP 24 -3.072 -18.188 3.228 876 HB3 ASP 24 HB2 ASP 24 -2.607 -16.741 4.110 877 H LYS 25 H LYS 25 0.028 -18.683 5.703 878 HA LYS 25 HA LYS 25 0.129 -17.502 8.260 879 HB2 LYS 25 HB3 LYS 25 2.516 -17.366 7.991 880 HB3 LYS 25 HB2 LYS 25 1.983 -18.942 7.395 881 HG2 LYS 25 HG3 LYS 25 2.227 -16.732 5.338 882 HG3 LYS 25 HG2 LYS 25 3.694 -17.303 6.084 883 HD2 LYS 25 HD3 LYS 25 2.764 -19.708 5.537 884 HD3 LYS 25 HD2 LYS 25 1.765 -18.822 4.393 885 HE2 LYS 25 HE2 LYS 25 3.655 -19.272 3.077 886 HE3 LYS 25 HE1 LYS 25 4.000 -17.659 3.690 887 HZ1 LYS 25 HZ1 LYS 25 5.904 -18.579 4.382 888 HZ2 LYS 25 HZ2 LYS 25 5.367 -20.138 4.245 889 HZ3 LYS 25 HZ3 LYS 25 5.037 -19.241 5.647 890 H TYR 26 H TYR 26 0.457 -16.231 5.038 891 HA TYR 26 HA TYR 26 -0.756 -13.919 5.792 892 HB2 TYR 26 HB3 TYR 26 1.160 -12.297 4.996 893 HB3 TYR 26 HB2 TYR 26 0.976 -12.854 6.669 894 HD1 TYR 26 HD1 TYR 26 2.452 -14.517 7.603 895 HD2 TYR 26 HD2 TYR 26 3.006 -13.096 3.604 896 HE1 TYR 26 HE1 TYR 26 4.735 -15.508 7.572 897 HE2 TYR 26 HE2 TYR 26 5.265 -14.083 3.555 898 HH TYR 26 HH TYR 26 6.356 -16.313 5.885 899 H LYS 27 H LYS 27 -2.034 -14.291 4.172 900 HA LYS 27 HA LYS 27 -1.348 -13.265 1.619 901 HB2 LYS 27 HB3 LYS 27 -2.359 -16.134 1.807 902 HB3 LYS 27 HB2 LYS 27 -2.428 -15.132 0.366 903 HG2 LYS 27 HG3 LYS 27 0.173 -15.640 1.794 904 HG3 LYS 27 HG2 LYS 27 -0.405 -16.740 0.577 905 HD2 LYS 27 HD3 LYS 27 -0.142 -13.746 0.014 906 HD3 LYS 27 HD2 LYS 27 1.184 -14.862 -0.229 907 HE2 LYS 27 HE2 LYS 27 -1.406 -14.665 -1.738 908 HE3 LYS 27 HE1 LYS 27 0.228 -14.855 -2.346 909 HZ1 LYS 27 HZ1 LYS 27 -0.001 -17.175 -1.075 910 HZ2 LYS 27 HZ2 LYS 27 -0.609 -16.957 -2.639 911 HZ3 LYS 27 HZ3 LYS 27 -1.648 -16.844 -1.320 912 H LEU 28 H LEU 28 -3.423 -12.755 0.462 913 HA LEU 28 HA LEU 28 -5.695 -12.992 2.285 914 HB2 LEU 28 HB3 LEU 28 -4.748 -10.770 2.395 915 HB3 LEU 28 HB2 LEU 28 -4.943 -10.542 0.657 916 HG LEU 28 HG LEU 28 -7.412 -10.943 0.990 917 HD11 LEU 28 HD11 LEU 28 -7.640 -12.122 2.960 918 HD12 LEU 28 HD12 LEU 28 -8.036 -10.485 3.499 919 HD13 LEU 28 HD13 LEU 28 -6.442 -11.159 3.827 920 HD21 LEU 28 HD21 LEU 28 -7.733 -8.765 2.247 921 HD22 LEU 28 HD22 LEU 28 -6.703 -8.670 0.808 922 HD23 LEU 28 HD23 LEU 28 -5.983 -8.692 2.426 923 H SER 29 H SER 29 -7.418 -13.864 1.443 924 HA SER 29 HA SER 29 -7.485 -14.261 -1.424 925 HB2 SER 29 HB3 SER 29 -9.462 -15.519 0.487 926 HB3 SER 29 HB2 SER 29 -8.929 -16.038 -1.093 927 HG SER 29 HG SER 29 -7.403 -15.861 1.267 928 H LYS 30 H LYS 30 -9.711 -13.949 -2.439 929 HA LYS 30 HA LYS 30 -10.516 -11.265 -1.861 930 HB2 LYS 30 HB3 LYS 30 -12.008 -13.173 -3.645 931 HB3 LYS 30 HB2 LYS 30 -11.982 -11.415 -3.715 932 HG2 LYS 30 HG3 LYS 30 -9.707 -13.306 -4.362 933 HG3 LYS 30 HG2 LYS 30 -10.581 -12.268 -5.465 934 HD2 LYS 30 HD3 LYS 30 -9.368 -10.702 -3.221 935 HD3 LYS 30 HD2 LYS 30 -8.219 -11.617 -4.195 936 HE2 LYS 30 HE2 LYS 30 -10.277 -9.716 -5.302 937 HE3 LYS 30 HE1 LYS 30 -8.559 -9.354 -5.108 938 HZ1 LYS 30 HZ1 LYS 30 -8.174 -11.377 -6.566 939 HZ2 LYS 30 HZ2 LYS 30 -9.001 -10.042 -7.315 940 HZ3 LYS 30 HZ3 LYS 30 -9.859 -11.344 -6.812 941 H LYS 31 H LYS 31 -11.396 -14.080 -0.352 942 HA LYS 31 HA LYS 31 -14.142 -13.407 0.115 943 HB2 LYS 31 HB3 LYS 31 -14.130 -15.139 1.834 944 HB3 LYS 31 HB2 LYS 31 -13.373 -15.730 0.359 945 HG2 LYS 31 HG3 LYS 31 -11.120 -15.044 1.446 946 HG3 LYS 31 HG2 LYS 31 -12.017 -14.858 2.929 947 HD2 LYS 31 HD3 LYS 31 -11.308 -17.072 3.125 948 HD3 LYS 31 HD2 LYS 31 -12.889 -17.297 2.493 949 HE2 LYS 31 HE2 LYS 31 -11.270 -16.983 0.191 950 HE3 LYS 31 HE1 LYS 31 -10.324 -17.943 1.311 951 HZ1 LYS 31 HZ1 LYS 31 -13.159 -18.633 0.855 952 HZ2 LYS 31 HZ2 LYS 31 -11.865 -19.648 1.326 953 HZ3 LYS 31 HZ3 LYS 31 -11.996 -19.095 -0.248 954 H GLU 32 H GLU 32 -11.213 -13.097 2.150 955 HA GLU 32 HA GLU 32 -12.538 -11.437 4.095 956 HB2 GLU 32 HB3 GLU 32 -9.665 -12.129 3.564 957 HB3 GLU 32 HB2 GLU 32 -10.171 -11.028 4.854 958 HG2 GLU 32 HG3 GLU 32 -11.162 -13.880 4.536 959 HG3 GLU 32 HG2 GLU 32 -9.809 -13.415 5.565 960 H LEU 33 H LEU 33 -10.399 -10.895 1.344 961 HA LEU 33 HA LEU 33 -9.610 -8.336 1.936 962 HB2 LEU 33 HB3 LEU 33 -8.553 -9.614 0.135 963 HB3 LEU 33 HB2 LEU 33 -10.035 -9.520 -0.786 964 HG LEU 33 HG LEU 33 -8.114 -7.885 -1.390 965 HD11 LEU 33 HD11 LEU 33 -10.839 -7.794 -1.779 966 HD12 LEU 33 HD12 LEU 33 -9.652 -6.767 -2.545 967 HD13 LEU 33 HD13 LEU 33 -10.486 -6.201 -1.107 968 HD21 LEU 33 HD21 LEU 33 -9.310 -5.964 0.563 969 HD22 LEU 33 HD22 LEU 33 -7.700 -6.058 -0.089 970 HD23 LEU 33 HD23 LEU 33 -8.148 -7.114 1.235 971 H LYS 34 H LYS 34 -12.409 -9.131 -0.122 972 HA LYS 34 HA LYS 34 -13.003 -6.393 -0.475 973 HB2 LYS 34 HB3 LYS 34 -15.214 -7.118 -1.326 974 HB3 LYS 34 HB2 LYS 34 -13.879 -7.968 -2.097 975 HG2 LYS 34 HG3 LYS 34 -14.273 -9.870 -0.471 976 HG3 LYS 34 HG2 LYS 34 -15.723 -9.030 0.070 977 HD2 LYS 34 HD3 LYS 34 -16.621 -9.055 -2.226 978 HD3 LYS 34 HD2 LYS 34 -15.165 -9.846 -2.792 979 HE2 LYS 34 HE2 LYS 34 -16.646 -11.626 -2.515 980 HE3 LYS 34 HE1 LYS 34 -15.679 -11.680 -1.039 981 HZ1 LYS 34 HZ1 LYS 34 -17.677 -10.009 -0.333 982 HZ2 LYS 34 HZ2 LYS 34 -17.679 -11.681 -0.071 983 HZ3 LYS 34 HZ3 LYS 34 -18.483 -11.047 -1.399 984 H GLU 35 H GLU 35 -13.991 -8.737 1.906 985 HA GLU 35 HA GLU 35 -15.851 -7.072 3.283 986 HB2 GLU 35 HB3 GLU 35 -14.105 -9.341 4.275 987 HB3 GLU 35 HB2 GLU 35 -15.419 -8.588 5.175 988 HG2 GLU 35 HG3 GLU 35 -15.752 -9.937 2.483 989 HG3 GLU 35 HG2 GLU 35 -16.116 -10.709 4.007 990 H LEU 36 H LEU 36 -12.414 -7.791 3.628 991 HA LEU 36 HA LEU 36 -11.852 -6.170 5.835 992 HB2 LEU 36 HB3 LEU 36 -10.193 -7.710 5.415 993 HB3 LEU 36 HB2 LEU 36 -10.302 -7.528 3.687 994 HG LEU 36 HG LEU 36 -9.142 -5.412 3.763 995 HD11 LEU 36 HD11 LEU 36 -9.936 -5.173 6.410 996 HD12 LEU 36 HD12 LEU 36 -8.646 -4.253 5.651 997 HD13 LEU 36 HD13 LEU 36 -8.248 -5.685 6.587 998 HD21 LEU 36 HD21 LEU 36 -8.003 -7.943 4.673 999 HD22 LEU 36 HD22 LEU 36 -7.028 -6.570 5.175 1000 HD23 LEU 36 HD23 LEU 36 -7.425 -6.797 3.472 1001 H LEU 37 H LEU 37 -11.549 -5.505 2.364 1002 HA LEU 37 HA LEU 37 -10.515 -2.956 2.736 1003 HB2 LEU 37 HB3 LEU 37 -10.183 -3.939 0.597 1004 HB3 LEU 37 HB2 LEU 37 -11.895 -4.218 0.354 1005 HG LEU 37 HG LEU 37 -10.750 -2.321 -0.946 1006 HD11 LEU 37 HD11 LEU 37 -12.774 -1.394 -1.289 1007 HD12 LEU 37 HD12 LEU 37 -13.098 -1.121 0.415 1008 HD13 LEU 37 HD13 LEU 37 -13.336 -2.722 -0.285 1009 HD21 LEU 37 HD21 LEU 37 -10.212 -1.291 1.738 1010 HD22 LEU 37 HD22 LEU 37 -11.331 -0.234 0.893 1011 HD23 LEU 37 HD23 LEU 37 -9.808 -0.625 0.160 1012 H GLN 38 H GLN 38 -13.871 -4.023 2.185 1013 HA GLN 38 HA GLN 38 -14.915 -1.376 2.327 1014 HB2 GLN 38 HB3 GLN 38 -17.099 -2.322 2.334 1015 HB3 GLN 38 HB2 GLN 38 -16.138 -3.390 1.309 1016 HG2 GLN 38 HG3 GLN 38 -15.896 -4.961 3.189 1017 HG3 GLN 38 HG2 GLN 38 -16.813 -3.899 4.242 1018 HE21 GLN 38 HE21 GLN 38 -17.591 -6.679 3.404 1019 HE22 GLN 38 HE22 GLN 38 -19.050 -6.497 2.589 1020 H THR 39 H THR 39 -14.471 -3.923 4.688 1021 HA THR 39 HA THR 39 -15.771 -2.679 6.814 1022 HB THR 39 HB THR 39 -13.546 -4.688 6.719 1023 HG1 THR 39 HG2 THR 39 -15.221 -5.556 5.883 1024 HG21 THR 39 HG21 THR 39 -14.932 -5.047 9.122 1025 HG22 THR 39 HG22 THR 39 -14.639 -3.302 9.020 1026 HG23 THR 39 HG23 THR 39 -13.305 -4.434 8.874 1027 H GLU 40 H GLU 40 -12.265 -2.705 6.055 1028 HA GLU 40 HA GLU 40 -11.772 -0.922 8.245 1029 HB2 GLU 40 HB3 GLU 40 -9.939 -2.009 6.117 1030 HB3 GLU 40 HB2 GLU 40 -9.419 -0.977 7.456 1031 HG2 GLU 40 HG3 GLU 40 -10.823 -3.656 7.769 1032 HG3 GLU 40 HG2 GLU 40 -9.106 -3.371 7.995 1033 H LEU 41 H LEU 41 -11.930 -0.526 4.768 1034 HA LEU 41 HA LEU 41 -11.286 2.327 5.107 1035 HB2 LEU 41 HB3 LEU 41 -11.076 0.376 2.911 1036 HB3 LEU 41 HB2 LEU 41 -11.311 2.045 2.443 1037 HG LEU 41 HG LEU 41 -9.357 2.536 4.135 1038 HD11 LEU 41 HD11 LEU 41 -7.753 0.622 4.258 1039 HD12 LEU 41 HD12 LEU 41 -9.031 -0.437 3.665 1040 HD13 LEU 41 HD13 LEU 41 -9.216 0.399 5.206 1041 HD21 LEU 41 HD21 LEU 41 -9.285 2.623 1.558 1042 HD22 LEU 41 HD22 LEU 41 -8.595 0.997 1.643 1043 HD23 LEU 41 HD23 LEU 41 -7.757 2.350 2.388 1044 H SER 42 H SER 42 -13.851 1.334 5.906 1045 HA SER 42 HA SER 42 -15.877 1.619 4.051 1046 HB2 SER 42 HB3 SER 42 -15.902 2.510 6.934 1047 HB3 SER 42 HB2 SER 42 -17.321 2.268 5.946 1048 HG SER 42 HG SER 42 -15.785 0.057 5.721 1049 H GLY 43 H GLY 43 -14.144 4.184 5.796 1050 HA2 GLY 43 HA3 GLY 43 -15.775 6.334 4.914 1051 HA3 GLY 43 HA2 GLY 43 -14.115 6.453 5.501 1052 H PHE 44 H PHE 44 -12.710 5.006 3.720 1053 HA PHE 44 HA PHE 44 -12.458 6.740 1.471 1054 HB2 PHE 44 HB3 PHE 44 -11.266 4.027 2.060 1055 HB3 PHE 44 HB2 PHE 44 -10.926 4.914 0.588 1056 HD1 PHE 44 HD2 PHE 44 -10.074 7.333 0.828 1057 HD2 PHE 44 HD1 PHE 44 -10.065 4.485 4.003 1058 HE1 PHE 44 HE2 PHE 44 -8.348 8.684 2.019 1059 HE2 PHE 44 HE1 PHE 44 -8.324 5.828 5.199 1060 HZ PHE 44 HZ PHE 44 -7.482 7.918 4.201 1061 H LEU 45 H LEU 45 -13.769 3.535 1.973 1062 HA LEU 45 HA LEU 45 -14.487 3.007 -0.693 1063 HB2 LEU 45 HB3 LEU 45 -14.572 1.102 0.563 1064 HB3 LEU 45 HB2 LEU 45 -15.222 1.903 1.986 1065 HG LEU 45 HG LEU 45 -17.388 2.103 0.907 1066 HD11 LEU 45 HD11 LEU 45 -17.314 2.147 -1.355 1067 HD12 LEU 45 HD12 LEU 45 -17.454 0.404 -1.232 1068 HD13 LEU 45 HD13 LEU 45 -15.865 1.140 -1.476 1069 HD21 LEU 45 HD21 LEU 45 -18.044 -0.187 1.072 1070 HD22 LEU 45 HD22 LEU 45 -16.730 0.033 2.205 1071 HD23 LEU 45 HD23 LEU 45 -16.440 -0.762 0.644 1072 H ASP 46 H ASP 46 -16.349 4.430 1.976 1073 HA ASP 46 HA ASP 46 -18.689 4.806 0.489 1074 HB2 ASP 46 HB3 ASP 46 -18.793 4.895 2.758 1075 HB3 ASP 46 HB2 ASP 46 -17.673 6.255 2.938 1076 H ALA 47 H ALA 47 -15.898 6.865 0.985 1077 HA ALA 47 HA ALA 47 -16.880 9.147 -0.416 1078 HB1 ALA 47 HB1 ALA 47 -14.160 8.185 0.392 1079 HB2 ALA 47 HB2 ALA 47 -15.015 9.658 0.863 1080 HB3 ALA 47 HB3 ALA 47 -14.311 9.524 -0.743 1081 H GLN 48 H GLN 48 -15.225 6.241 -1.353 1082 HA GLN 48 HA GLN 48 -14.778 7.157 -4.055 1083 HB2 GLN 48 HB3 GLN 48 -14.040 4.650 -2.577 1084 HB3 GLN 48 HB2 GLN 48 -13.707 4.850 -4.292 1085 HG2 GLN 48 HG3 GLN 48 -12.783 6.761 -2.112 1086 HG3 GLN 48 HG2 GLN 48 -11.751 5.558 -2.872 1087 HE21 GLN 48 HE21 GLN 48 -13.094 5.997 -5.547 1088 HE22 GLN 48 HE22 GLN 48 -12.495 7.487 -6.083 1089 H LYS 49 H LYS 49 -17.450 5.826 -2.703 1090 HA LYS 49 HA LYS 49 -18.047 3.673 -4.403 1091 HB2 LYS 49 HB3 LYS 49 -20.045 5.489 -3.039 1092 HB3 LYS 49 HB2 LYS 49 -20.480 4.030 -3.918 1093 HG2 LYS 49 HG3 LYS 49 -18.946 2.708 -2.455 1094 HG3 LYS 49 HG2 LYS 49 -18.647 4.181 -1.527 1095 HD2 LYS 49 HD3 LYS 49 -21.402 2.996 -1.928 1096 HD3 LYS 49 HD2 LYS 49 -20.369 2.638 -0.549 1097 HE2 LYS 49 HE2 LYS 49 -20.277 5.375 -0.499 1098 HE3 LYS 49 HE1 LYS 49 -21.852 5.124 -1.212 1099 HZ1 LYS 49 HZ1 LYS 49 -21.336 3.440 1.123 1100 HZ2 LYS 49 HZ2 LYS 49 -22.696 4.386 0.714 1101 HZ3 LYS 49 HZ3 LYS 49 -21.331 5.111 1.377 1102 H ASP 50 H ASP 50 -18.898 7.082 -5.009 1103 HA ASP 50 HA ASP 50 -20.105 6.271 -7.531 1104 HB2 ASP 50 HB3 ASP 50 -21.062 8.166 -6.116 1105 HB3 ASP 50 HB2 ASP 50 -19.680 9.129 -6.632 1106 H VAL 51 H VAL 51 -17.047 6.749 -6.554 1107 HA VAL 51 HA VAL 51 -16.066 8.154 -8.880 1108 HB VAL 51 HB VAL 51 -14.604 6.724 -6.668 1109 HG11 VAL 51 HG11 VAL 51 -12.949 6.932 -8.310 1110 HG12 VAL 51 HG12 VAL 51 -12.815 8.513 -7.532 1111 HG13 VAL 51 HG13 VAL 51 -13.701 8.359 -9.024 1112 HG21 VAL 51 HG21 VAL 51 -14.307 8.950 -5.677 1113 HG22 VAL 51 HG22 VAL 51 -16.019 8.675 -5.943 1114 HG23 VAL 51 HG23 VAL 51 -15.110 9.700 -7.053 1115 H ASP 52 H ASP 52 -15.251 7.273 -10.689 1116 HA ASP 52 HA ASP 52 -15.876 4.668 -11.494 1117 HB2 ASP 52 HB3 ASP 52 -15.477 6.452 -13.092 1118 HB3 ASP 52 HB2 ASP 52 -13.790 6.557 -12.613 1119 H ALA 53 H ALA 53 -12.853 5.995 -10.259 1120 HA ALA 53 HA ALA 53 -11.169 3.883 -10.761 1121 HB1 ALA 53 HB1 ALA 53 -9.850 4.630 -8.776 1122 HB2 ALA 53 HB2 ALA 53 -11.132 5.764 -8.386 1123 HB3 ALA 53 HB3 ALA 53 -10.244 5.912 -9.909 1124 H VAL 54 H VAL 54 -13.626 4.109 -8.248 1125 HA VAL 54 HA VAL 54 -12.614 2.025 -6.653 1126 HB VAL 54 HB VAL 54 -14.587 3.677 -6.166 1127 HG11 VAL 54 HG11 VAL 54 -16.795 2.809 -6.494 1128 HG12 VAL 54 HG12 VAL 54 -16.210 1.319 -7.194 1129 HG13 VAL 54 HG13 VAL 54 -16.042 2.841 -8.074 1130 HG21 VAL 54 HG21 VAL 54 -14.084 0.913 -5.207 1131 HG22 VAL 54 HG22 VAL 54 -15.666 1.556 -4.803 1132 HG23 VAL 54 HG23 VAL 54 -14.222 2.413 -4.286 1133 H ASP 55 H ASP 55 -14.778 1.992 -9.452 1134 HA ASP 55 HA ASP 55 -15.215 -0.822 -9.497 1135 HB2 ASP 55 HB3 ASP 55 -16.456 0.941 -10.885 1136 HB3 ASP 55 HB2 ASP 55 -15.005 0.938 -11.916 1137 H LYS 56 H LYS 56 -12.955 1.315 -11.077 1138 HA LYS 56 HA LYS 56 -11.609 -0.667 -12.564 1139 HB2 LYS 56 HB3 LYS 56 -10.466 1.992 -11.662 1140 HB3 LYS 56 HB2 LYS 56 -9.945 1.018 -13.017 1141 HG2 LYS 56 HG3 LYS 56 -12.690 2.305 -12.755 1142 HG3 LYS 56 HG2 LYS 56 -11.378 2.855 -13.782 1143 HD2 LYS 56 HD3 LYS 56 -11.426 0.669 -14.964 1144 HD3 LYS 56 HD2 LYS 56 -12.784 0.177 -13.989 1145 HE2 LYS 56 HE2 LYS 56 -13.504 1.133 -16.227 1146 HE3 LYS 56 HE1 LYS 56 -14.218 1.920 -14.837 1147 HZ1 LYS 56 HZ1 LYS 56 -11.710 2.993 -16.024 1148 HZ2 LYS 56 HZ2 LYS 56 -12.879 3.759 -15.063 1149 HZ3 LYS 56 HZ3 LYS 56 -13.228 3.379 -16.654 1150 H VAL 57 H VAL 57 -10.919 0.695 -9.391 1151 HA VAL 57 HA VAL 57 -8.461 -0.746 -9.035 1152 HB VAL 57 HB VAL 57 -10.331 0.522 -6.995 1153 HG11 VAL 57 HG11 VAL 57 -7.445 -0.304 -6.654 1154 HG12 VAL 57 HG12 VAL 57 -8.810 -1.285 -6.142 1155 HG13 VAL 57 HG13 VAL 57 -8.547 0.301 -5.415 1156 HG21 VAL 57 HG21 VAL 57 -7.653 1.556 -7.935 1157 HG22 VAL 57 HG22 VAL 57 -8.918 2.432 -7.083 1158 HG23 VAL 57 HG23 VAL 57 -9.128 2.007 -8.783 1159 H MET 58 H MET 58 -11.817 -1.145 -8.125 1160 HA MET 58 HA MET 58 -11.562 -3.608 -6.804 1161 HB2 MET 58 HB3 MET 58 -13.554 -2.194 -6.591 1162 HB3 MET 58 HB2 MET 58 -13.904 -2.408 -8.302 1163 HG2 MET 58 HG3 MET 58 -14.156 -4.697 -8.043 1164 HG3 MET 58 HG2 MET 58 -13.749 -4.684 -6.307 1165 HE1 MET 58 HE1 MET 58 -17.386 -3.661 -8.647 1166 HE2 MET 58 HE2 MET 58 -15.708 -3.445 -9.122 1167 HE3 MET 58 HE3 MET 58 -16.575 -2.120 -8.357 1168 H LYS 59 H LYS 59 -12.074 -2.696 -10.176 1169 HA LYS 59 HA LYS 59 -12.559 -5.248 -11.232 1170 HB2 LYS 59 HB3 LYS 59 -12.788 -2.944 -12.388 1171 HB3 LYS 59 HB2 LYS 59 -11.073 -3.118 -12.747 1172 HG2 LYS 59 HG3 LYS 59 -11.906 -4.167 -14.606 1173 HG3 LYS 59 HG2 LYS 59 -11.846 -5.533 -13.515 1174 HD2 LYS 59 HD3 LYS 59 -14.040 -5.742 -14.215 1175 HD3 LYS 59 HD2 LYS 59 -14.284 -4.695 -12.827 1176 HE2 LYS 59 HE2 LYS 59 -13.790 -2.804 -14.766 1177 HE3 LYS 59 HE1 LYS 59 -14.549 -4.060 -15.721 1178 HZ1 LYS 59 HZ1 LYS 59 -16.423 -3.165 -15.013 1179 HZ2 LYS 59 HZ2 LYS 59 -15.703 -2.314 -13.739 1180 HZ3 LYS 59 HZ3 LYS 59 -16.163 -3.929 -13.530 1181 H GLU 60 H GLU 60 -9.556 -3.431 -10.804 1182 HA GLU 60 HA GLU 60 -7.811 -5.270 -11.963 1183 HB2 GLU 60 HB3 GLU 60 -7.522 -3.283 -9.755 1184 HB3 GLU 60 HB2 GLU 60 -6.139 -4.245 -10.306 1185 HG2 GLU 60 HG3 GLU 60 -7.869 -2.491 -12.096 1186 HG3 GLU 60 HG2 GLU 60 -6.320 -2.004 -11.417 1187 H LEU 61 H LEU 61 -8.957 -4.937 -8.646 1188 HA LEU 61 HA LEU 61 -7.700 -7.307 -7.654 1189 HB2 LEU 61 HB3 LEU 61 -9.960 -5.573 -6.699 1190 HB3 LEU 61 HB2 LEU 61 -9.695 -7.130 -5.938 1191 HG LEU 61 HG LEU 61 -8.538 -5.090 -4.887 1192 HD11 LEU 61 HD11 LEU 61 -6.497 -6.374 -4.347 1193 HD12 LEU 61 HD12 LEU 61 -6.872 -7.531 -5.613 1194 HD13 LEU 61 HD13 LEU 61 -7.957 -7.337 -4.223 1195 HD21 LEU 61 HD21 LEU 61 -7.656 -4.091 -6.978 1196 HD22 LEU 61 HD22 LEU 61 -6.640 -5.511 -7.244 1197 HD23 LEU 61 HD23 LEU 61 -6.356 -4.472 -5.863 1198 H ASP 62 H ASP 62 -10.848 -6.601 -9.060 1199 HA ASP 62 HA ASP 62 -12.109 -9.068 -8.695 1200 HB2 ASP 62 HB3 ASP 62 -13.151 -6.952 -9.620 1201 HB3 ASP 62 HB2 ASP 62 -12.379 -7.333 -11.151 1202 H GLU 63 H GLU 63 -10.133 -7.922 -11.380 1203 HA GLU 63 HA GLU 63 -10.099 -10.418 -12.775 1204 HB2 GLU 63 HB3 GLU 63 -8.251 -8.024 -12.899 1205 HB3 GLU 63 HB2 GLU 63 -8.152 -9.412 -13.989 1206 HG2 GLU 63 HG3 GLU 63 -10.522 -9.043 -14.671 1207 HG3 GLU 63 HG2 GLU 63 -10.542 -7.675 -13.539 1208 H ASN 64 H ASN 64 -8.092 -8.948 -10.329 1209 HA ASN 64 HA ASN 64 -6.094 -10.969 -10.371 1210 HB2 ASN 64 HB3 ASN 64 -6.267 -8.581 -9.137 1211 HB3 ASN 64 HB2 ASN 64 -6.621 -9.610 -7.758 1212 HD21 ASN 64 HD21 ASN 64 -4.050 -8.056 -8.662 1213 HD22 ASN 64 HD22 ASN 64 -2.839 -9.228 -8.497 1214 H GLY 65 H GLY 65 -9.331 -11.125 -9.555 1215 HA2 GLY 65 HA3 GLY 65 -9.401 -12.912 -7.337 1216 HA3 GLY 65 HA2 GLY 65 -10.641 -12.744 -8.601 1217 H ASP 66 H ASP 66 -7.785 -13.398 -10.116 1218 HA ASP 66 HA ASP 66 -8.457 -16.021 -10.896 1219 HB2 ASP 66 HB3 ASP 66 -5.937 -14.375 -10.970 1220 HB3 ASP 66 HB2 ASP 66 -5.912 -16.065 -11.403 1221 H GLY 67 H GLY 67 -6.373 -14.664 -8.412 1222 HA2 GLY 67 HA3 GLY 67 -6.421 -17.226 -6.982 1223 HA3 GLY 67 HA2 GLY 67 -4.879 -16.433 -7.324 1224 H GLU 68 H GLU 68 -4.263 -15.899 -5.335 1225 HA GLU 68 HA GLU 68 -6.064 -14.567 -3.473 1226 HB2 GLU 68 HB3 GLU 68 -3.236 -15.578 -3.280 1227 HB3 GLU 68 HB2 GLU 68 -4.004 -14.719 -1.959 1228 HG2 GLU 68 HG3 GLU 68 -5.793 -16.417 -1.879 1229 HG3 GLU 68 HG2 GLU 68 -5.134 -17.241 -3.277 1230 H VAL 69 H VAL 69 -5.228 -12.680 -2.302 1231 HA VAL 69 HA VAL 69 -3.620 -10.887 -3.993 1232 HB VAL 69 HB VAL 69 -5.803 -9.928 -4.040 1233 HG11 VAL 69 HG11 VAL 69 -7.215 -9.656 -2.008 1234 HG12 VAL 69 HG12 VAL 69 -6.028 -10.575 -1.097 1235 HG13 VAL 69 HG13 VAL 69 -6.918 -11.347 -2.402 1236 HG21 VAL 69 HG21 VAL 69 -5.641 -8.067 -2.153 1237 HG22 VAL 69 HG22 VAL 69 -4.546 -8.054 -3.512 1238 HG23 VAL 69 HG23 VAL 69 -4.005 -8.681 -1.958 1239 H ASP 70 H ASP 70 -1.763 -10.340 -3.027 1240 HA ASP 70 HA ASP 70 -1.485 -11.206 -0.278 1241 HB2 ASP 70 HB3 ASP 70 -0.006 -12.153 -1.962 1242 HB3 ASP 70 HB2 ASP 70 0.644 -10.585 -2.321 1243 H PHE 71 H PHE 71 0.532 -9.851 0.727 1244 HA PHE 71 HA PHE 71 -0.703 -7.611 1.759 1245 HB2 PHE 71 HB3 PHE 71 1.219 -8.840 2.795 1246 HB3 PHE 71 HB2 PHE 71 2.291 -8.021 1.663 1247 HD1 PHE 71 HD1 PHE 71 -0.521 -7.167 3.950 1248 HD2 PHE 71 HD2 PHE 71 3.353 -6.013 2.483 1249 HE1 PHE 71 HE1 PHE 71 -0.516 -5.238 5.465 1250 HE2 PHE 71 HE2 PHE 71 3.347 -4.087 4.038 1251 HZ PHE 71 HZ PHE 71 1.447 -3.691 5.506 1252 H GLN 72 H GLN 72 1.763 -7.794 -0.725 1253 HA GLN 72 HA GLN 72 2.075 -5.031 -1.195 1254 HB2 GLN 72 HB3 GLN 72 2.549 -7.513 -2.733 1255 HB3 GLN 72 HB2 GLN 72 2.767 -5.941 -3.583 1256 HG2 GLN 72 HG3 GLN 72 4.398 -5.381 -1.780 1257 HG3 GLN 72 HG2 GLN 72 4.075 -6.951 -1.041 1258 HE21 GLN 72 HE21 GLN 72 4.094 -6.843 -4.550 1259 HE22 GLN 72 HE22 GLN 72 5.597 -7.583 -4.739 1260 H GLU 73 H GLU 73 -0.119 -7.423 -2.679 1261 HA GLU 73 HA GLU 73 -1.395 -5.527 -4.362 1262 HB2 GLU 73 HB3 GLU 73 -2.492 -8.204 -3.396 1263 HB3 GLU 73 HB2 GLU 73 -3.062 -7.222 -4.745 1264 HG2 GLU 73 HG3 GLU 73 -1.705 -8.657 -5.893 1265 HG3 GLU 73 HG2 GLU 73 -0.529 -7.405 -5.535 1266 H TYR 74 H TYR 74 -1.994 -6.734 -1.116 1267 HA TYR 74 HA TYR 74 -4.519 -5.570 -0.695 1268 HB2 TYR 74 HB3 TYR 74 -3.808 -7.247 0.810 1269 HB3 TYR 74 HB2 TYR 74 -2.328 -6.388 1.209 1270 HD1 TYR 74 HD1 TYR 74 -6.076 -5.571 1.214 1271 HD2 TYR 74 HD2 TYR 74 -2.310 -5.453 3.335 1272 HE1 TYR 74 HE1 TYR 74 -7.168 -4.508 3.119 1273 HE2 TYR 74 HE2 TYR 74 -3.449 -4.387 5.247 1274 HH TYR 74 HH TYR 74 -6.535 -4.452 5.816 1275 H VAL 75 H VAL 75 -1.265 -4.269 0.059 1276 HA VAL 75 HA VAL 75 -2.296 -1.887 1.161 1277 HB VAL 75 HB VAL 75 -0.071 -0.922 0.913 1278 HG11 VAL 75 HG11 VAL 75 0.329 -3.777 1.786 1279 HG12 VAL 75 HG12 VAL 75 -0.752 -2.719 2.685 1280 HG13 VAL 75 HG13 VAL 75 0.944 -2.301 2.519 1281 HG21 VAL 75 HG21 VAL 75 0.335 -2.244 -1.365 1282 HG22 VAL 75 HG22 VAL 75 0.922 -3.502 -0.302 1283 HG23 VAL 75 HG23 VAL 75 1.661 -1.899 -0.283 1284 H VAL 76 H VAL 76 -1.399 -2.649 -2.172 1285 HA VAL 76 HA VAL 76 -1.694 0.010 -3.036 1286 HB VAL 76 HB VAL 76 -0.419 -1.587 -4.375 1287 HG11 VAL 76 HG11 VAL 76 -3.084 -2.941 -4.858 1288 HG12 VAL 76 HG12 VAL 76 -1.682 -3.597 -4.004 1289 HG13 VAL 76 HG13 VAL 76 -1.590 -3.295 -5.722 1290 HG21 VAL 76 HG21 VAL 76 -2.749 -0.911 -6.136 1291 HG22 VAL 76 HG22 VAL 76 -1.028 -0.702 -6.438 1292 HG23 VAL 76 HG23 VAL 76 -1.872 0.404 -5.351 1293 H LEU 77 H LEU 77 -3.947 -2.652 -2.745 1294 HA LEU 77 HA LEU 77 -6.119 -1.496 -4.125 1295 HB2 LEU 77 HB3 LEU 77 -6.146 -3.846 -3.464 1296 HB3 LEU 77 HB2 LEU 77 -6.127 -3.402 -1.765 1297 HG LEU 77 HG LEU 77 -8.317 -2.247 -2.041 1298 HD11 LEU 77 HD11 LEU 77 -8.768 -1.542 -4.083 1299 HD12 LEU 77 HD12 LEU 77 -9.407 -3.156 -4.371 1300 HD13 LEU 77 HD13 LEU 77 -7.776 -2.755 -4.885 1301 HD21 LEU 77 HD21 LEU 77 -8.683 -4.396 -1.273 1302 HD22 LEU 77 HD22 LEU 77 -8.015 -5.169 -2.715 1303 HD23 LEU 77 HD23 LEU 77 -9.613 -4.426 -2.762 1304 H VAL 78 H VAL 78 -5.240 -1.411 -0.670 1305 HA VAL 78 HA VAL 78 -7.352 0.420 -0.086 1306 HB VAL 78 HB VAL 78 -6.272 0.649 2.161 1307 HG11 VAL 78 HG11 VAL 78 -7.867 -1.268 1.373 1308 HG12 VAL 78 HG12 VAL 78 -6.968 -1.480 2.888 1309 HG13 VAL 78 HG13 VAL 78 -6.417 -2.272 1.429 1310 HG21 VAL 78 HG21 VAL 78 -4.422 -1.566 1.335 1311 HG22 VAL 78 HG22 VAL 78 -4.311 -0.509 2.732 1312 HG23 VAL 78 HG23 VAL 78 -3.890 0.110 1.140 1313 H ALA 79 H ALA 79 -3.934 0.789 -0.825 1314 HA ALA 79 HA ALA 79 -3.829 3.570 -0.308 1315 HB1 ALA 79 HB1 ALA 79 -1.730 2.501 -0.561 1316 HB2 ALA 79 HB2 ALA 79 -1.913 3.491 -2.019 1317 HB3 ALA 79 HB3 ALA 79 -2.223 1.770 -2.089 1318 H ALA 80 H ALA 80 -4.658 1.667 -3.168 1319 HA ALA 80 HA ALA 80 -4.790 3.706 -5.021 1320 HB1 ALA 80 HB1 ALA 80 -6.385 2.277 -6.246 1321 HB2 ALA 80 HB2 ALA 80 -6.547 1.254 -4.821 1322 HB3 ALA 80 HB3 ALA 80 -5.007 1.344 -5.666 1323 H LEU 81 H LEU 81 -7.326 2.400 -2.932 1324 HA LEU 81 HA LEU 81 -9.293 4.313 -3.665 1325 HB2 LEU 81 HB3 LEU 81 -9.028 2.554 -1.228 1326 HB3 LEU 81 HB2 LEU 81 -10.440 3.549 -1.545 1327 HG LEU 81 HG LEU 81 -9.384 1.456 -3.499 1328 HD11 LEU 81 HD11 LEU 81 -11.208 1.229 -1.190 1329 HD12 LEU 81 HD12 LEU 81 -10.283 -0.001 -2.049 1330 HD13 LEU 81 HD13 LEU 81 -11.817 0.553 -2.701 1331 HD21 LEU 81 HD21 LEU 81 -10.598 2.860 -4.845 1332 HD22 LEU 81 HD22 LEU 81 -11.629 3.458 -3.541 1333 HD23 LEU 81 HD23 LEU 81 -11.917 1.867 -4.250 1334 H THR 82 H THR 82 -6.872 4.197 -1.041 1335 HA THR 82 HA THR 82 -7.733 6.526 0.274 1336 HB THR 82 HB THR 82 -4.892 5.482 0.124 1337 HG1 THR 82 HG2 THR 82 -6.292 3.765 0.717 1338 HG21 THR 82 HG21 THR 82 -5.620 7.772 1.300 1339 HG22 THR 82 HG22 THR 82 -4.497 6.670 2.073 1340 HG23 THR 82 HG23 THR 82 -6.185 6.667 2.548 1341 H VAL 83 H VAL 83 -5.234 6.061 -2.260 1342 HA VAL 83 HA VAL 83 -4.507 8.786 -2.378 1343 HB VAL 83 HB VAL 83 -3.162 6.886 -3.305 1344 HG11 VAL 83 HG11 VAL 83 -5.163 6.997 -5.568 1345 HG12 VAL 83 HG12 VAL 83 -4.847 5.664 -4.450 1346 HG13 VAL 83 HG13 VAL 83 -3.616 6.155 -5.601 1347 HG21 VAL 83 HG21 VAL 83 -3.721 9.182 -5.223 1348 HG22 VAL 83 HG22 VAL 83 -2.346 8.086 -5.300 1349 HG23 VAL 83 HG23 VAL 83 -2.517 9.162 -3.921 1350 H ALA 84 H ALA 84 -6.903 6.898 -4.203 1351 HA ALA 84 HA ALA 84 -7.707 8.950 -5.949 1352 HB1 ALA 84 HB1 ALA 84 -9.632 7.658 -6.384 1353 HB2 ALA 84 HB2 ALA 84 -9.569 6.853 -4.820 1354 HB3 ALA 84 HB3 ALA 84 -8.366 6.477 -6.054 1355 H MET 85 H MET 85 -9.040 7.963 -2.790 1356 HA MET 85 HA MET 85 -10.896 10.103 -2.681 1357 HB2 MET 85 HB3 MET 85 -11.019 8.060 -1.186 1358 HB3 MET 85 HB2 MET 85 -9.607 8.737 -0.352 1359 HG2 MET 85 HG3 MET 85 -10.844 10.788 0.197 1360 HG3 MET 85 HG2 MET 85 -12.251 10.166 -0.653 1361 HE1 MET 85 HE1 MET 85 -13.304 10.119 3.063 1362 HE2 MET 85 HE2 MET 85 -13.357 10.973 1.519 1363 HE3 MET 85 HE3 MET 85 -11.959 11.150 2.559 1364 H ASN 86 H ASN 86 -7.594 9.655 -1.508 1365 HA ASN 86 HA ASN 86 -7.396 12.068 -0.112 1366 HB2 ASN 86 HB3 ASN 86 -5.706 10.292 0.077 1367 HB3 ASN 86 HB2 ASN 86 -5.203 10.656 -1.579 1368 HD21 ASN 86 HD21 ASN 86 -5.604 12.259 1.591 1369 HD22 ASN 86 HD22 ASN 86 -4.348 13.374 1.406 1370 H ASN 87 H ASN 87 -6.850 11.249 -3.474 1371 HA ASN 87 HA ASN 87 -5.818 13.697 -4.364 1372 HB2 ASN 87 HB3 ASN 87 -5.874 11.715 -5.796 1373 HB3 ASN 87 HB2 ASN 87 -7.623 11.749 -5.794 1374 HD21 ASN 87 HD21 ASN 87 -8.441 12.637 -7.682 1375 HD22 ASN 87 HD22 ASN 87 -7.716 13.908 -8.549 1376 H PHE 88 H PHE 88 -9.151 12.531 -4.099 1377 HA PHE 88 HA PHE 88 -10.339 14.980 -4.926 1378 HB2 PHE 88 HB3 PHE 88 -11.491 12.580 -3.485 1379 HB3 PHE 88 HB2 PHE 88 -12.440 13.985 -3.935 1380 HD1 PHE 88 HD2 PHE 88 -12.109 14.840 -6.440 1381 HD2 PHE 88 HD1 PHE 88 -11.312 10.843 -5.072 1382 HE1 PHE 88 HE2 PHE 88 -12.285 14.023 -8.743 1383 HE2 PHE 88 HE1 PHE 88 -11.483 10.020 -7.378 1384 HZ PHE 88 HZ PHE 88 -11.970 11.583 -9.231 1385 H PHE 89 H PHE 89 -9.350 13.622 -1.858 1386 HA PHE 89 HA PHE 89 -10.764 14.978 -0.038 1387 HB2 PHE 89 HB3 PHE 89 -8.827 13.344 0.131 1388 HB3 PHE 89 HB2 PHE 89 -7.774 14.758 0.310 1389 HD1 PHE 89 HD1 PHE 89 -8.422 16.433 2.176 1390 HD2 PHE 89 HD2 PHE 89 -10.048 12.497 1.810 1391 HE1 PHE 89 HE1 PHE 89 -9.130 16.523 4.544 1392 HE2 PHE 89 HE2 PHE 89 -10.781 12.550 4.144 1393 HZ PHE 89 HZ PHE 89 -10.316 14.598 5.558 1394 H TRP 90 H TRP 90 -7.798 16.132 -1.611 1395 HA TRP 90 HA TRP 90 -7.904 18.747 -0.401 1396 HB2 TRP 90 HB3 TRP 90 -6.317 18.049 -2.876 1397 HB3 TRP 90 HB2 TRP 90 -5.980 19.248 -1.630 1398 HD1 TRP 90 HD TRP 90 -5.703 15.570 -2.372 1399 HE1 TRP 90 HE1 TRP 90 -4.356 14.410 -0.539 1400 HE3 TRP 90 HE3 TRP 90 -5.328 19.415 0.943 1401 HZ2 TRP 90 HZ2 TRP 90 -3.223 15.057 2.051 1402 HZ3 TRP 90 HZ3 TRP 90 -4.113 19.127 3.072 1403 HH2 TRP 90 HH TRP 90 -3.057 16.943 3.623 1404 H GLU 91 H GLU 91 -8.591 17.477 -3.615 1405 HA GLU 91 HA GLU 91 -9.318 19.996 -4.726 1406 HB2 GLU 91 HB3 GLU 91 -9.905 17.194 -5.613 1407 HB3 GLU 91 HB2 GLU 91 -10.287 18.625 -6.566 1408 HG2 GLU 91 HG3 GLU 91 -7.893 19.316 -6.475 1409 HG3 GLU 91 HG2 GLU 91 -7.529 17.857 -5.593 1410 H ASN 92 H ASN 92 -11.354 17.217 -3.785 1411 HA ASN 92 HA ASN 92 -13.584 19.059 -3.299 1412 HB2 ASN 92 HB3 ASN 92 -13.879 18.323 -5.617 1413 HB3 ASN 92 HB2 ASN 92 -13.768 16.639 -5.089 1414 HD21 ASN 92 HD21 ASN 92 -15.796 15.717 -4.877 1415 HD22 ASN 92 HD22 ASN 92 -17.190 16.528 -4.370 1416 H SER 93 H SER 93 -13.820 18.635 -1.158 1417 HA SER 93 HA SER 93 -15.071 16.279 -0.332 1418 HB2 SER 93 HB3 SER 93 -12.111 16.419 0.041 1419 HB3 SER 93 HB2 SER 93 -13.071 15.607 1.273 1420 HG SER 93 HG SER 93 -13.183 15.123 -1.529 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -9.967 8.839 12.186 2 HA2 GLY 1 HA3 GLY 1 -11.379 7.459 10.309 3 HA3 GLY 1 HA2 GLY 1 -9.790 7.629 9.578 4 H SER 2 H SER 2 -10.301 5.158 9.879 5 HA SER 2 HA SER 2 -9.736 4.119 12.520 6 HB2 SER 2 HB3 SER 2 -9.706 2.509 9.986 7 HB3 SER 2 HB2 SER 2 -10.151 2.038 11.625 8 HG SER 2 HG SER 2 -11.461 3.744 9.807 9 H GLU 3 H GLU 3 -7.971 2.290 12.621 10 HA GLU 3 HA GLU 3 -5.460 3.496 12.507 11 HB2 GLU 3 HB3 GLU 3 -6.200 0.552 12.487 12 HB3 GLU 3 HB2 GLU 3 -4.590 1.194 12.782 13 HG2 GLU 3 HG3 GLU 3 -5.382 0.882 14.857 14 HG3 GLU 3 HG2 GLU 3 -5.694 2.607 14.659 15 H LEU 4 H LEU 4 -6.931 1.113 10.357 16 HA LEU 4 HA LEU 4 -4.751 0.839 8.570 17 HB2 LEU 4 HB3 LEU 4 -7.723 0.340 8.330 18 HB3 LEU 4 HB2 LEU 4 -6.651 0.115 6.960 19 HG LEU 4 HG LEU 4 -7.179 -1.930 8.522 20 HD11 LEU 4 HD11 LEU 4 -5.112 -2.949 7.983 21 HD12 LEU 4 HD12 LEU 4 -4.298 -1.397 7.836 22 HD13 LEU 4 HD13 LEU 4 -5.539 -1.874 6.660 23 HD21 LEU 4 HD21 LEU 4 -6.631 -0.931 10.659 24 HD22 LEU 4 HD22 LEU 4 -4.983 -0.539 10.120 25 HD23 LEU 4 HD23 LEU 4 -5.469 -2.198 10.321 26 H GLU 5 H GLU 5 -7.605 2.867 8.575 27 HA GLU 5 HA GLU 5 -7.153 4.179 6.109 28 HB2 GLU 5 HB3 GLU 5 -8.661 5.071 8.595 29 HB3 GLU 5 HB2 GLU 5 -8.774 5.804 7.006 30 HG2 GLU 5 HG3 GLU 5 -9.556 3.648 6.038 31 HG3 GLU 5 HG2 GLU 5 -9.434 2.912 7.595 32 H THR 6 H THR 6 -6.413 4.975 9.470 33 HA THR 6 HA THR 6 -5.076 7.413 8.959 34 HB THR 6 HB THR 6 -4.505 5.512 11.252 35 HG1 THR 6 HG2 THR 6 -6.754 5.872 10.997 36 HG21 THR 6 HG21 THR 6 -3.059 7.218 11.673 37 HG22 THR 6 HG22 THR 6 -4.496 8.041 12.246 38 HG23 THR 6 HG23 THR 6 -3.904 8.350 10.623 39 H ALA 7 H ALA 7 -3.956 4.033 9.263 40 HA ALA 7 HA ALA 7 -1.224 4.462 8.992 41 HB1 ALA 7 HB1 ALA 7 -1.522 2.116 7.671 42 HB2 ALA 7 HB2 ALA 7 -3.073 2.190 8.478 43 HB3 ALA 7 HB3 ALA 7 -1.581 2.245 9.423 44 H MET 8 H MET 8 -3.657 3.906 6.442 45 HA MET 8 HA MET 8 -1.803 4.165 4.321 46 HB2 MET 8 HB3 MET 8 -4.802 4.642 4.294 47 HB3 MET 8 HB2 MET 8 -3.786 4.512 2.869 48 HG2 MET 8 HG3 MET 8 -4.241 2.334 4.930 49 HG3 MET 8 HG2 MET 8 -4.790 2.343 3.269 50 HE1 MET 8 HE1 MET 8 -2.046 1.743 1.077 51 HE2 MET 8 HE2 MET 8 -1.790 3.398 1.635 52 HE3 MET 8 HE3 MET 8 -3.429 2.791 1.433 53 H GLU 9 H GLU 9 -3.885 6.545 5.954 54 HA GLU 9 HA GLU 9 -3.072 8.615 4.254 55 HB2 GLU 9 HB3 GLU 9 -4.272 8.772 7.025 56 HB3 GLU 9 HB2 GLU 9 -3.835 10.185 6.062 57 HG2 GLU 9 HG3 GLU 9 -5.281 9.427 4.233 58 HG3 GLU 9 HG2 GLU 9 -5.742 8.010 5.186 59 H THR 10 H THR 10 -1.737 7.286 7.176 60 HA THR 10 HA THR 10 0.124 9.298 7.806 61 HB THR 10 HB THR 10 0.719 6.324 8.046 62 HG1 THR 10 HG2 THR 10 -1.438 6.921 8.840 63 HG21 THR 10 HG21 THR 10 2.119 6.928 9.821 64 HG22 THR 10 HG22 THR 10 1.346 8.490 10.044 65 HG23 THR 10 HG23 THR 10 2.406 8.234 8.676 66 H LEU 11 H LEU 11 0.253 6.587 5.540 67 HA LEU 11 HA LEU 11 2.846 7.139 4.505 68 HB2 LEU 11 HB3 LEU 11 0.448 5.766 3.250 69 HB3 LEU 11 HB2 LEU 11 2.037 5.810 2.521 70 HG LEU 11 HG LEU 11 1.580 4.678 5.305 71 HD11 LEU 11 HD11 LEU 11 2.028 2.915 2.929 72 HD12 LEU 11 HD12 LEU 11 0.398 3.524 3.208 73 HD13 LEU 11 HD13 LEU 11 1.215 2.587 4.452 74 HD21 LEU 11 HD21 LEU 11 3.753 3.723 5.017 75 HD22 LEU 11 HD22 LEU 11 3.969 5.398 4.518 76 HD23 LEU 11 HD23 LEU 11 3.807 4.123 3.316 77 H ILE 12 H ILE 12 -0.412 8.193 3.662 78 HA ILE 12 HA ILE 12 0.196 9.671 1.312 79 HB ILE 12 HB ILE 12 -2.010 10.024 3.373 80 HG12 ILE 12 HG13 ILE 12 -1.963 7.847 2.034 81 HG13 ILE 12 HG12 ILE 12 -3.413 8.836 1.811 82 HG21 ILE 12 HG21 ILE 12 -3.122 11.136 1.294 83 HG22 ILE 12 HG22 ILE 12 -1.438 11.535 0.884 84 HG23 ILE 12 HG23 ILE 12 -2.138 12.030 2.435 85 HD11 ILE 12 HD11 ILE 12 -2.563 7.988 -0.335 86 HD12 ILE 12 HD12 ILE 12 -1.018 8.785 -0.084 87 HD13 ILE 12 HD13 ILE 12 -2.474 9.731 -0.294 88 H ASN 13 H ASN 13 0.032 10.563 4.720 89 HA ASN 13 HA ASN 13 0.479 13.330 4.493 90 HB2 ASN 13 HB3 ASN 13 1.356 11.402 6.656 91 HB3 ASN 13 HB2 ASN 13 1.391 13.149 6.802 92 HD21 ASN 13 HD21 ASN 13 -0.293 11.022 8.213 93 HD22 ASN 13 HD22 ASN 13 -1.887 11.570 8.033 94 H VAL 14 H VAL 14 2.688 10.618 4.869 95 HA VAL 14 HA VAL 14 5.114 12.081 4.796 96 HB VAL 14 HB VAL 14 4.430 9.191 4.197 97 HG11 VAL 14 HG11 VAL 14 6.394 9.506 2.955 98 HG12 VAL 14 HG12 VAL 14 6.956 8.919 4.519 99 HG13 VAL 14 HG13 VAL 14 7.079 10.632 4.135 100 HG21 VAL 14 HG21 VAL 14 4.202 9.999 6.562 101 HG22 VAL 14 HG22 VAL 14 5.886 10.522 6.501 102 HG23 VAL 14 HG23 VAL 14 5.494 8.819 6.353 103 H PHE 15 H PHE 15 3.223 10.388 2.335 104 HA PHE 15 HA PHE 15 4.954 10.790 0.177 105 HB2 PHE 15 HB3 PHE 15 2.943 9.287 0.242 106 HB3 PHE 15 HB2 PHE 15 1.930 10.720 0.083 107 HD1 PHE 15 HD1 PHE 15 4.616 8.750 -1.583 108 HD2 PHE 15 HD2 PHE 15 1.596 11.774 -2.045 109 HE1 PHE 15 HE1 PHE 15 4.918 8.678 -4.035 110 HE2 PHE 15 HE2 PHE 15 1.901 11.694 -4.491 111 HZ PHE 15 HZ PHE 15 3.563 10.149 -5.488 112 H HIS 16 H HIS 16 2.200 12.746 1.294 113 HA HIS 16 HA HIS 16 2.491 14.834 -0.608 114 HB2 HIS 16 HB3 HIS 16 1.349 14.886 2.185 115 HB3 HIS 16 HB2 HIS 16 1.335 16.282 1.126 116 HD1 HIS 16 HD1 HIS 16 0.407 15.285 -1.545 117 HD2 HIS 16 HD2 HIS 16 -1.079 13.763 2.050 118 HE1 HIS 16 HE1 HIS 16 -1.819 14.230 -2.071 119 HE2 HIS 16 HE2 HIS 16 -2.764 13.295 0.081 120 H ALA 17 H ALA 17 3.887 14.297 2.575 121 HA ALA 17 HA ALA 17 5.047 16.759 3.018 122 HB1 ALA 17 HB1 ALA 17 6.535 14.230 3.714 123 HB2 ALA 17 HB2 ALA 17 5.029 14.641 4.531 124 HB3 ALA 17 HB3 ALA 17 6.405 15.728 4.627 125 H HIS 18 H HIS 18 6.414 13.966 1.312 126 HA HIS 18 HA HIS 18 8.726 15.482 0.468 127 HB2 HIS 18 HB3 HIS 18 7.782 12.706 -0.276 128 HB3 HIS 18 HB2 HIS 18 9.268 13.436 -0.874 129 HD1 HIS 18 HD1 HIS 18 11.224 13.953 0.918 130 HD2 HIS 18 HD2 HIS 18 7.905 11.893 2.469 131 HE1 HIS 18 HE1 HIS 18 11.864 13.169 3.185 132 HE2 HIS 18 HE2 HIS 18 9.888 11.905 4.171 133 H SER 19 H SER 19 5.661 14.503 -1.036 134 HA SER 19 HA SER 19 6.240 15.294 -3.668 135 HB2 SER 19 HB3 SER 19 3.597 15.528 -2.192 136 HB3 SER 19 HB2 SER 19 3.823 15.665 -3.919 137 HG SER 19 HG SER 19 4.842 13.507 -3.719 138 H GLY 20 H GLY 20 5.066 17.137 -0.898 139 HA2 GLY 20 HA3 GLY 20 4.579 19.573 -2.172 140 HA3 GLY 20 HA2 GLY 20 5.046 19.401 -0.479 141 H LYS 21 H LYS 21 7.569 18.268 -0.804 142 HA LYS 21 HA LYS 21 9.157 20.614 -1.166 143 HB2 LYS 21 HB3 LYS 21 10.105 17.735 -1.210 144 HB3 LYS 21 HB2 LYS 21 11.047 19.157 -0.815 145 HG2 LYS 21 HG3 LYS 21 8.666 18.147 0.728 146 HG3 LYS 21 HG2 LYS 21 10.348 17.935 1.207 147 HD2 LYS 21 HD3 LYS 21 10.647 20.274 1.605 148 HD3 LYS 21 HD2 LYS 21 9.167 20.712 0.776 149 HE2 LYS 21 HE2 LYS 21 9.477 20.226 3.519 150 HE3 LYS 21 HE1 LYS 21 7.970 20.490 2.645 151 HZ1 LYS 21 HZ1 LYS 21 8.142 18.378 3.981 152 HZ2 LYS 21 HZ2 LYS 21 9.246 17.794 2.885 153 HZ3 LYS 21 HZ3 LYS 21 7.659 18.124 2.391 154 H GLU 22 H GLU 22 8.695 17.694 -3.111 155 HA GLU 22 HA GLU 22 10.475 18.554 -5.129 156 HB2 GLU 22 HB3 GLU 22 8.418 16.306 -5.185 157 HB3 GLU 22 HB2 GLU 22 9.585 16.651 -6.427 158 HG2 GLU 22 HG3 GLU 22 11.426 16.281 -4.898 159 HG3 GLU 22 HG2 GLU 22 10.303 16.149 -3.558 160 H GLY 23 H GLY 23 6.928 18.722 -4.856 161 HA2 GLY 23 HA3 GLY 23 6.612 21.107 -6.154 162 HA3 GLY 23 HA2 GLY 23 6.736 19.949 -7.459 163 H ASP 24 H ASP 24 5.241 18.100 -7.384 164 HA ASP 24 HA ASP 24 2.648 19.049 -7.529 165 HB2 ASP 24 HB3 ASP 24 3.681 16.947 -8.644 166 HB3 ASP 24 HB2 ASP 24 3.206 16.125 -7.174 167 H LYS 25 H LYS 25 0.716 18.376 -6.449 168 HA LYS 25 HA LYS 25 0.920 18.504 -3.576 169 HB2 LYS 25 HB3 LYS 25 -1.594 17.995 -3.690 170 HB3 LYS 25 HB2 LYS 25 -1.088 19.504 -4.439 171 HG2 LYS 25 HG3 LYS 25 -1.172 17.058 -6.181 172 HG3 LYS 25 HG2 LYS 25 -2.695 17.737 -5.603 173 HD2 LYS 25 HD3 LYS 25 -2.108 19.947 -6.501 174 HD3 LYS 25 HD2 LYS 25 -0.573 19.321 -7.076 175 HE2 LYS 25 HE2 LYS 25 -2.057 19.238 -8.959 176 HE3 LYS 25 HE1 LYS 25 -1.816 17.589 -8.354 177 HZ1 LYS 25 HZ1 LYS 25 -4.101 18.947 -7.143 178 HZ2 LYS 25 HZ2 LYS 25 -3.994 17.389 -7.817 179 HZ3 LYS 25 HZ3 LYS 25 -4.236 18.690 -8.790 180 H TYR 26 H TYR 26 0.674 15.992 -5.969 181 HA TYR 26 HA TYR 26 1.453 14.114 -3.905 182 HB2 TYR 26 HB3 TYR 26 -0.304 12.482 -5.044 183 HB3 TYR 26 HB2 TYR 26 -0.726 13.446 -3.637 184 HD1 TYR 26 HD2 TYR 26 -0.704 13.625 -7.431 185 HD2 TYR 26 HD1 TYR 26 -2.614 14.930 -3.778 186 HE1 TYR 26 HE2 TYR 26 -2.413 14.752 -8.714 187 HE2 TYR 26 HE1 TYR 26 -4.326 16.060 -5.122 188 HH TYR 26 HH TYR 26 -5.192 15.490 -7.699 189 H LYS 27 H LYS 27 3.378 14.012 -4.979 190 HA LYS 27 HA LYS 27 3.524 11.875 -6.794 191 HB2 LYS 27 HB3 LYS 27 4.575 14.534 -7.851 192 HB3 LYS 27 HB2 LYS 27 5.006 12.969 -8.481 193 HG2 LYS 27 HG3 LYS 27 2.192 14.135 -8.471 194 HG3 LYS 27 HG2 LYS 27 3.237 13.992 -9.859 195 HD2 LYS 27 HD3 LYS 27 2.183 11.586 -8.272 196 HD3 LYS 27 HD2 LYS 27 1.565 12.160 -9.784 197 HE2 LYS 27 HE2 LYS 27 4.333 11.038 -9.301 198 HE3 LYS 27 HE1 LYS 27 3.044 10.348 -10.266 199 HZ1 LYS 27 HZ1 LYS 27 4.787 12.650 -10.872 200 HZ2 LYS 27 HZ2 LYS 27 3.229 12.606 -11.571 201 HZ3 LYS 27 HZ3 LYS 27 4.328 11.376 -11.857 202 H LEU 28 H LEU 28 5.713 11.043 -6.911 203 HA LEU 28 HA LEU 28 7.497 12.365 -5.015 204 HB2 LEU 28 HB3 LEU 28 6.407 10.541 -3.861 205 HB3 LEU 28 HB2 LEU 28 6.828 9.415 -5.150 206 HG LEU 28 HG LEU 28 9.260 9.958 -4.691 207 HD11 LEU 28 HD11 LEU 28 9.402 10.864 -2.157 208 HD12 LEU 28 HD12 LEU 28 7.934 11.702 -2.656 209 HD13 LEU 28 HD13 LEU 28 9.430 11.943 -3.543 210 HD21 LEU 28 HD21 LEU 28 9.267 8.723 -2.479 211 HD22 LEU 28 HD22 LEU 28 8.390 7.905 -3.778 212 HD23 LEU 28 HD23 LEU 28 7.508 8.783 -2.518 213 H SER 29 H SER 29 9.489 12.579 -5.722 214 HA SER 29 HA SER 29 10.164 11.371 -8.305 215 HB2 SER 29 HB3 SER 29 11.680 13.611 -7.032 216 HB3 SER 29 HB2 SER 29 11.504 13.231 -8.744 217 HG SER 29 HG SER 29 9.561 14.152 -6.898 218 H LYS 30 H LYS 30 12.691 11.085 -8.463 219 HA LYS 30 HA LYS 30 13.281 9.053 -6.504 220 HB2 LYS 30 HB3 LYS 30 15.203 10.065 -8.591 221 HB3 LYS 30 HB2 LYS 30 15.157 8.488 -7.818 222 HG2 LYS 30 HG3 LYS 30 13.174 9.625 -9.794 223 HG3 LYS 30 HG2 LYS 30 14.213 8.258 -10.065 224 HD2 LYS 30 HD3 LYS 30 12.010 8.314 -7.938 225 HD3 LYS 30 HD2 LYS 30 11.829 7.602 -9.513 226 HE2 LYS 30 HE2 LYS 30 13.749 6.694 -7.344 227 HE3 LYS 30 HE1 LYS 30 12.386 5.818 -8.029 228 HZ1 LYS 30 HZ1 LYS 30 14.700 5.284 -8.794 229 HZ2 LYS 30 HZ2 LYS 30 14.690 6.652 -9.716 230 HZ3 LYS 30 HZ3 LYS 30 13.535 5.397 -9.998 231 H LYS 31 H LYS 31 13.689 12.301 -6.438 232 HA LYS 31 HA LYS 31 16.261 12.500 -5.180 233 HB2 LYS 31 HB3 LYS 31 14.702 14.659 -4.187 234 HB3 LYS 31 HB2 LYS 31 15.868 14.689 -5.503 235 HG2 LYS 31 HG3 LYS 31 13.967 14.070 -7.135 236 HG3 LYS 31 HG2 LYS 31 12.947 14.095 -5.681 237 HD2 LYS 31 HD3 LYS 31 13.241 16.384 -5.382 238 HD3 LYS 31 HD2 LYS 31 14.511 16.508 -6.576 239 HE2 LYS 31 HE2 LYS 31 12.740 15.540 -8.245 240 HE3 LYS 31 HE1 LYS 31 11.558 16.017 -7.039 241 HZ1 LYS 31 HZ1 LYS 31 13.549 17.842 -8.326 242 HZ2 LYS 31 HZ2 LYS 31 12.441 18.306 -7.147 243 HZ3 LYS 31 HZ3 LYS 31 11.903 17.773 -8.657 244 H GLU 32 H GLU 32 13.080 13.074 -3.721 245 HA GLU 32 HA GLU 32 14.003 12.538 -1.096 246 HB2 GLU 32 HB3 GLU 32 11.210 12.841 -2.232 247 HB3 GLU 32 HB2 GLU 32 11.599 12.687 -0.522 248 HG2 GLU 32 HG3 GLU 32 12.748 14.841 -2.322 249 HG3 GLU 32 HG2 GLU 32 11.371 15.080 -1.281 250 H LEU 33 H LEU 33 12.362 10.602 -3.527 251 HA LEU 33 HA LEU 33 11.183 8.755 -1.943 252 HB2 LEU 33 HB3 LEU 33 10.730 8.787 -4.303 253 HB3 LEU 33 HB2 LEU 33 12.383 8.352 -4.649 254 HG LEU 33 HG LEU 33 10.471 6.524 -4.757 255 HD11 LEU 33 HD11 LEU 33 12.677 5.255 -3.372 256 HD12 LEU 33 HD12 LEU 33 13.252 6.406 -4.558 257 HD13 LEU 33 HD13 LEU 33 12.155 5.117 -5.040 258 HD21 LEU 33 HD21 LEU 33 11.267 5.685 -2.051 259 HD22 LEU 33 HD22 LEU 33 9.699 5.633 -2.823 260 HD23 LEU 33 HD23 LEU 33 10.204 7.092 -2.019 261 H LYS 34 H LYS 34 14.511 8.328 -3.267 262 HA LYS 34 HA LYS 34 14.794 5.836 -1.947 263 HB2 LYS 34 HB3 LYS 34 16.954 7.709 -2.937 264 HB3 LYS 34 HB2 LYS 34 17.256 6.136 -2.209 265 HG2 LYS 34 HG3 LYS 34 15.758 5.086 -3.937 266 HG3 LYS 34 HG2 LYS 34 15.680 6.644 -4.756 267 HD2 LYS 34 HD3 LYS 34 18.250 5.122 -4.172 268 HD3 LYS 34 HD2 LYS 34 17.408 5.118 -5.708 269 HE2 LYS 34 HE2 LYS 34 18.819 6.850 -6.180 270 HE3 LYS 34 HE1 LYS 34 17.567 7.783 -5.375 271 HZ1 LYS 34 HZ1 LYS 34 20.218 7.000 -4.376 272 HZ2 LYS 34 HZ2 LYS 34 18.983 7.171 -3.226 273 HZ3 LYS 34 HZ3 LYS 34 19.395 8.451 -4.243 274 H GLU 35 H GLU 35 15.577 9.102 -0.987 275 HA GLU 35 HA GLU 35 16.783 8.440 1.503 276 HB2 GLU 35 HB3 GLU 35 15.301 10.904 0.564 277 HB3 GLU 35 HB2 GLU 35 16.157 10.780 2.105 278 HG2 GLU 35 HG3 GLU 35 18.256 10.345 0.948 279 HG3 GLU 35 HG2 GLU 35 17.445 10.342 -0.609 280 H LEU 36 H LEU 36 13.516 9.251 0.450 281 HA LEU 36 HA LEU 36 12.210 9.181 2.920 282 HB2 LEU 36 HB3 LEU 36 10.933 10.156 1.249 283 HB3 LEU 36 HB2 LEU 36 11.434 8.985 0.050 284 HG LEU 36 HG LEU 36 10.012 7.294 0.991 285 HD11 LEU 36 HD11 LEU 36 9.507 7.484 3.203 286 HD12 LEU 36 HD12 LEU 36 8.260 8.620 2.693 287 HD13 LEU 36 HD13 LEU 36 9.821 9.224 3.235 288 HD21 LEU 36 HD21 LEU 36 9.101 9.736 -0.214 289 HD22 LEU 36 HD22 LEU 36 7.859 9.174 0.904 290 HD23 LEU 36 HD23 LEU 36 8.447 8.106 -0.358 291 H LEU 37 H LEU 37 12.633 6.615 0.488 292 HA LEU 37 HA LEU 37 11.164 4.742 1.962 293 HB2 LEU 37 HB3 LEU 37 11.627 4.424 -0.437 294 HB3 LEU 37 HB2 LEU 37 13.336 4.205 -0.097 295 HG LEU 37 HG LEU 37 11.854 2.094 -0.447 296 HD11 LEU 37 HD11 LEU 37 13.435 0.875 0.628 297 HD12 LEU 37 HD12 LEU 37 13.286 1.772 2.135 298 HD13 LEU 37 HD13 LEU 37 14.236 2.429 0.811 299 HD21 LEU 37 HD21 LEU 37 10.520 1.334 1.267 300 HD22 LEU 37 HD22 LEU 37 10.152 3.045 1.312 301 HD23 LEU 37 HD23 LEU 37 11.276 2.337 2.495 302 H GLN 38 H GLN 38 14.666 5.253 1.817 303 HA GLN 38 HA GLN 38 15.249 3.209 3.707 304 HB2 GLN 38 HB3 GLN 38 17.460 4.222 3.891 305 HB3 GLN 38 HB2 GLN 38 17.012 4.108 2.192 306 HG2 GLN 38 HG3 GLN 38 16.238 6.507 2.354 307 HG3 GLN 38 HG2 GLN 38 16.931 6.564 3.964 308 HE21 GLN 38 HE21 GLN 38 19.055 7.329 3.999 309 HE22 GLN 38 HE22 GLN 38 20.136 7.200 2.703 310 H THR 39 H THR 39 14.588 6.641 3.981 311 HA THR 39 HA THR 39 15.221 6.923 6.704 312 HB THR 39 HB THR 39 13.368 8.485 4.928 313 HG1 THR 39 HG2 THR 39 15.279 8.715 4.162 314 HG21 THR 39 HG21 THR 39 12.690 9.223 6.918 315 HG22 THR 39 HG22 THR 39 14.104 10.261 6.752 316 HG23 THR 39 HG23 THR 39 14.172 8.804 7.775 317 H GLU 40 H GLU 40 11.988 6.501 5.175 318 HA GLU 40 HA GLU 40 10.780 6.453 7.748 319 HB2 GLU 40 HB3 GLU 40 9.601 5.697 5.072 320 HB3 GLU 40 HB2 GLU 40 8.700 5.871 6.579 321 HG2 GLU 40 HG3 GLU 40 10.321 8.097 5.275 322 HG3 GLU 40 HG2 GLU 40 8.567 7.900 5.229 323 H LEU 41 H LEU 41 11.679 3.924 5.490 324 HA LEU 41 HA LEU 41 10.572 1.914 7.269 325 HB2 LEU 41 HB3 LEU 41 11.673 1.882 4.504 326 HB3 LEU 41 HB2 LEU 41 11.717 0.400 5.402 327 HG LEU 41 HG LEU 41 9.273 0.660 5.944 328 HD11 LEU 41 HD11 LEU 41 9.542 3.010 4.053 329 HD12 LEU 41 HD12 LEU 41 8.972 3.016 5.726 330 HD13 LEU 41 HD13 LEU 41 8.002 2.266 4.482 331 HD21 LEU 41 HD21 LEU 41 8.622 -0.384 4.004 332 HD22 LEU 41 HD22 LEU 41 10.368 -0.474 3.763 333 HD23 LEU 41 HD23 LEU 41 9.428 0.791 2.971 334 H SER 42 H SER 42 12.489 3.296 8.571 335 HA SER 42 HA SER 42 15.099 2.455 8.342 336 HB2 SER 42 HB3 SER 42 14.770 2.715 11.054 337 HB3 SER 42 HB2 SER 42 15.095 4.020 9.935 338 HG SER 42 HG SER 42 12.417 3.080 10.449 339 H GLY 43 H GLY 43 12.503 0.922 10.267 340 HA2 GLY 43 HA3 GLY 43 14.171 -1.201 11.233 341 HA3 GLY 43 HA2 GLY 43 12.415 -1.137 11.320 342 H PHE 44 H PHE 44 11.848 -0.866 8.631 343 HA PHE 44 HA PHE 44 12.008 -3.596 7.759 344 HB2 PHE 44 HB3 PHE 44 10.899 -1.100 6.515 345 HB3 PHE 44 HB2 PHE 44 11.039 -2.572 5.554 346 HD1 PHE 44 HD2 PHE 44 10.041 -4.718 6.563 347 HD2 PHE 44 HD1 PHE 44 9.044 -0.779 7.954 348 HE1 PHE 44 HE2 PHE 44 7.953 -5.600 7.594 349 HE2 PHE 44 HE1 PHE 44 6.963 -1.683 8.978 350 HZ PHE 44 HZ PHE 44 6.430 -4.084 8.791 351 H LEU 45 H LEU 45 13.547 -0.598 6.840 352 HA LEU 45 HA LEU 45 15.148 -1.631 4.771 353 HB2 LEU 45 HB3 LEU 45 14.888 0.754 5.015 354 HB3 LEU 45 HB2 LEU 45 15.516 0.706 6.652 355 HG LEU 45 HG LEU 45 17.609 -0.076 5.895 356 HD11 LEU 45 HD11 LEU 45 18.106 0.026 3.361 357 HD12 LEU 45 HD12 LEU 45 16.373 0.129 3.104 358 HD13 LEU 45 HD13 LEU 45 17.083 -1.313 3.864 359 HD21 LEU 45 HD21 LEU 45 16.763 2.475 5.738 360 HD22 LEU 45 HD22 LEU 45 17.229 2.230 4.049 361 HD23 LEU 45 HD23 LEU 45 18.414 2.004 5.330 362 H ASP 46 H ASP 46 15.636 -1.222 8.251 363 HA ASP 46 HA ASP 46 18.266 -2.095 8.421 364 HB2 ASP 46 HB3 ASP 46 17.093 -1.085 10.284 365 HB3 ASP 46 HB2 ASP 46 16.013 -2.463 10.405 366 H ALA 47 H ALA 47 15.267 -3.967 8.602 367 HA ALA 47 HA ALA 47 16.566 -6.515 8.796 368 HB1 ALA 47 HB1 ALA 47 14.465 -7.474 8.656 369 HB2 ALA 47 HB2 ALA 47 13.845 -6.201 7.607 370 HB3 ALA 47 HB3 ALA 47 14.089 -5.887 9.333 371 H GLN 48 H GLN 48 15.434 -4.501 6.168 372 HA GLN 48 HA GLN 48 15.888 -6.537 4.176 373 HB2 GLN 48 HB3 GLN 48 15.007 -3.658 3.917 374 HB3 GLN 48 HB2 GLN 48 15.139 -4.796 2.578 375 HG2 GLN 48 HG3 GLN 48 13.408 -5.266 5.036 376 HG3 GLN 48 HG2 GLN 48 12.809 -4.722 3.480 377 HE21 GLN 48 HE21 GLN 48 13.586 -7.474 5.325 378 HE22 GLN 48 HE22 GLN 48 13.502 -8.605 4.068 379 H LYS 49 H LYS 49 18.033 -4.695 5.706 380 HA LYS 49 HA LYS 49 19.542 -3.485 3.663 381 HB2 LYS 49 HB3 LYS 49 20.559 -4.615 6.283 382 HB3 LYS 49 HB2 LYS 49 21.533 -3.640 5.176 383 HG2 LYS 49 HG3 LYS 49 19.769 -1.798 5.357 384 HG3 LYS 49 HG2 LYS 49 19.004 -2.803 6.586 385 HD2 LYS 49 HD3 LYS 49 21.847 -1.831 6.806 386 HD3 LYS 49 HD2 LYS 49 20.461 -1.017 7.528 387 HE2 LYS 49 HE2 LYS 49 19.955 -3.427 8.554 388 HE3 LYS 49 HE1 LYS 49 21.676 -3.659 8.257 389 HZ1 LYS 49 HZ1 LYS 49 21.936 -2.677 10.203 390 HZ2 LYS 49 HZ2 LYS 49 20.339 -2.180 10.254 391 HZ3 LYS 49 HZ3 LYS 49 21.513 -1.202 9.492 392 H ASP 50 H ASP 50 19.602 -6.808 4.777 393 HA ASP 50 HA ASP 50 21.515 -7.423 2.598 394 HB2 ASP 50 HB3 ASP 50 22.396 -7.899 4.865 395 HB3 ASP 50 HB2 ASP 50 21.077 -9.048 5.114 396 H VAL 51 H VAL 51 18.734 -7.156 2.162 397 HA VAL 51 HA VAL 51 17.986 -9.963 1.601 398 HB VAL 51 HB VAL 51 16.164 -7.563 1.985 399 HG11 VAL 51 HG11 VAL 51 15.133 -9.086 0.391 400 HG12 VAL 51 HG12 VAL 51 14.373 -9.339 1.953 401 HG13 VAL 51 HG13 VAL 51 15.572 -10.479 1.376 402 HG21 VAL 51 HG21 VAL 51 15.481 -8.829 4.026 403 HG22 VAL 51 HG22 VAL 51 17.192 -8.417 4.093 404 HG23 VAL 51 HG23 VAL 51 16.690 -10.047 3.655 405 H ASP 52 H ASP 52 18.948 -7.084 0.131 406 HA ASP 52 HA ASP 52 19.221 -6.426 -2.011 407 HB2 ASP 52 HB3 ASP 52 20.052 -8.864 -2.149 408 HB3 ASP 52 HB2 ASP 52 18.528 -9.195 -2.955 409 H ALA 53 H ALA 53 16.271 -8.186 -1.369 410 HA ALA 53 HA ALA 53 14.807 -7.650 -3.652 411 HB1 ALA 53 HB1 ALA 53 13.623 -7.534 -0.868 412 HB2 ALA 53 HB2 ALA 53 14.048 -9.048 -1.677 413 HB3 ALA 53 HB3 ALA 53 12.832 -7.992 -2.372 414 H VAL 54 H VAL 54 15.590 -5.560 -0.985 415 HA VAL 54 HA VAL 54 13.794 -3.466 -1.515 416 HB VAL 54 HB VAL 54 15.136 -3.625 0.574 417 HG11 VAL 54 HG11 VAL 54 17.526 -2.720 -1.029 418 HG12 VAL 54 HG12 VAL 54 17.275 -4.401 -0.533 419 HG13 VAL 54 HG13 VAL 54 17.448 -3.144 0.665 420 HG21 VAL 54 HG21 VAL 54 15.689 -1.251 0.779 421 HG22 VAL 54 HG22 VAL 54 14.211 -1.405 -0.162 422 HG23 VAL 54 HG23 VAL 54 15.739 -1.072 -0.969 423 H ASP 55 H ASP 55 17.019 -4.124 -2.764 424 HA ASP 55 HA ASP 55 17.295 -1.817 -4.380 425 HB2 ASP 55 HB3 ASP 55 19.157 -3.340 -3.860 426 HB3 ASP 55 HB2 ASP 55 18.343 -4.593 -4.814 427 H LYS 56 H LYS 56 16.071 -5.032 -4.957 428 HA LYS 56 HA LYS 56 15.493 -4.771 -7.706 429 HB2 LYS 56 HB3 LYS 56 14.364 -6.567 -5.565 430 HB3 LYS 56 HB2 LYS 56 13.973 -6.700 -7.273 431 HG2 LYS 56 HG3 LYS 56 16.272 -7.080 -7.873 432 HG3 LYS 56 HG2 LYS 56 16.827 -6.767 -6.232 433 HD2 LYS 56 HD3 LYS 56 15.867 -8.632 -5.385 434 HD3 LYS 56 HD2 LYS 56 14.837 -8.993 -6.796 435 HE2 LYS 56 HE2 LYS 56 16.936 -10.462 -6.495 436 HE3 LYS 56 HE1 LYS 56 16.749 -9.708 -8.060 437 HZ1 LYS 56 HZ1 LYS 56 19.014 -9.536 -6.928 438 HZ2 LYS 56 HZ2 LYS 56 18.376 -8.362 -5.925 439 HZ3 LYS 56 HZ3 LYS 56 18.398 -8.153 -7.613 440 H VAL 57 H VAL 57 13.453 -4.352 -4.827 441 HA VAL 57 HA VAL 57 11.116 -3.649 -6.284 442 HB VAL 57 HB VAL 57 11.902 -2.945 -3.433 443 HG11 VAL 57 HG11 VAL 57 9.909 -1.712 -4.714 444 HG12 VAL 57 HG12 VAL 57 9.721 -2.276 -3.042 445 HG13 VAL 57 HG13 VAL 57 9.078 -3.230 -4.365 446 HG21 VAL 57 HG21 VAL 57 11.048 -5.002 -2.761 447 HG22 VAL 57 HG22 VAL 57 11.639 -5.470 -4.348 448 HG23 VAL 57 HG23 VAL 57 9.939 -5.104 -4.119 449 H MET 58 H MET 58 13.712 -1.755 -4.795 450 HA MET 58 HA MET 58 12.682 0.753 -5.674 451 HB2 MET 58 HB3 MET 58 14.296 1.596 -4.370 452 HB3 MET 58 HB2 MET 58 14.815 -0.030 -3.976 453 HG2 MET 58 HG3 MET 58 16.345 0.022 -5.960 454 HG3 MET 58 HG2 MET 58 15.837 1.675 -6.287 455 HE1 MET 58 HE1 MET 58 19.367 2.292 -4.987 456 HE2 MET 58 HE2 MET 58 18.239 2.330 -6.343 457 HE3 MET 58 HE3 MET 58 18.913 0.799 -5.822 458 H LYS 59 H LYS 59 14.346 -1.790 -7.204 459 HA LYS 59 HA LYS 59 15.691 -0.361 -9.226 460 HB2 LYS 59 HB3 LYS 59 15.898 -2.940 -8.641 461 HB3 LYS 59 HB2 LYS 59 14.525 -3.075 -9.708 462 HG2 LYS 59 HG3 LYS 59 16.534 -3.398 -11.027 463 HG3 LYS 59 HG2 LYS 59 15.727 -1.917 -11.496 464 HD2 LYS 59 HD3 LYS 59 18.244 -1.761 -11.228 465 HD3 LYS 59 HD2 LYS 59 17.343 -0.532 -10.376 466 HE2 LYS 59 HE2 LYS 59 17.991 -3.085 -8.903 467 HE3 LYS 59 HE1 LYS 59 19.287 -1.937 -9.198 468 HZ1 LYS 59 HZ1 LYS 59 18.446 -1.286 -7.196 469 HZ2 LYS 59 HZ2 LYS 59 16.858 -1.572 -7.567 470 HZ3 LYS 59 HZ3 LYS 59 17.665 -0.170 -8.213 471 H GLU 60 H GLU 60 12.465 -1.734 -9.051 472 HA GLU 60 HA GLU 60 11.633 -1.050 -11.659 473 HB2 GLU 60 HB3 GLU 60 10.147 -1.198 -9.049 474 HB3 GLU 60 HB2 GLU 60 9.341 -0.950 -10.600 475 HG2 GLU 60 HG3 GLU 60 10.286 -3.106 -11.400 476 HG3 GLU 60 HG2 GLU 60 11.074 -3.322 -9.843 477 H LEU 61 H LEU 61 11.728 0.648 -8.602 478 HA LEU 61 HA LEU 61 10.645 3.095 -9.597 479 HB2 LEU 61 HB3 LEU 61 12.348 2.571 -7.154 480 HB3 LEU 61 HB2 LEU 61 11.550 4.099 -7.512 481 HG LEU 61 HG LEU 61 10.274 1.421 -6.946 482 HD11 LEU 61 HD11 LEU 61 10.081 4.113 -5.640 483 HD12 LEU 61 HD12 LEU 61 10.899 2.674 -5.001 484 HD13 LEU 61 HD13 LEU 61 9.139 2.692 -5.200 485 HD21 LEU 61 HD21 LEU 61 8.877 2.196 -8.649 486 HD22 LEU 61 HD22 LEU 61 9.049 3.904 -8.202 487 HD23 LEU 61 HD23 LEU 61 8.109 2.803 -7.202 488 H ASP 62 H ASP 62 13.896 1.757 -9.358 489 HA ASP 62 HA ASP 62 15.343 4.079 -10.204 490 HB2 ASP 62 HB3 ASP 62 15.932 1.119 -10.616 491 HB3 ASP 62 HB2 ASP 62 16.988 2.422 -11.090 492 H GLU 63 H GLU 63 13.803 1.393 -11.885 493 HA GLU 63 HA GLU 63 14.406 2.232 -14.560 494 HB2 GLU 63 HB3 GLU 63 12.176 0.486 -13.467 495 HB3 GLU 63 HB2 GLU 63 12.601 0.640 -15.161 496 HG2 GLU 63 HG3 GLU 63 14.523 -0.306 -13.015 497 HG3 GLU 63 HG2 GLU 63 13.604 -1.380 -14.050 498 H ASN 64 H ASN 64 11.569 2.442 -12.494 499 HA ASN 64 HA ASN 64 9.961 3.912 -14.282 500 HB2 ASN 64 HB3 ASN 64 9.316 2.503 -12.201 501 HB3 ASN 64 HB2 ASN 64 9.503 4.018 -11.313 502 HD21 ASN 64 HD21 ASN 64 6.984 2.871 -11.450 503 HD22 ASN 64 HD22 ASN 64 5.979 3.793 -12.450 504 H GLY 65 H GLY 65 12.502 4.841 -12.240 505 HA2 GLY 65 HA3 GLY 65 11.747 7.505 -11.637 506 HA3 GLY 65 HA2 GLY 65 13.404 6.881 -11.649 507 H ASP 66 H ASP 66 11.458 6.610 -14.514 508 HA ASP 66 HA ASP 66 13.214 8.101 -16.161 509 HB2 ASP 66 HB3 ASP 66 11.644 6.340 -16.983 510 HB3 ASP 66 HB2 ASP 66 10.302 7.389 -16.566 511 H GLY 67 H GLY 67 10.185 8.735 -14.533 512 HA2 GLY 67 HA3 GLY 67 10.566 11.645 -14.940 513 HA3 GLY 67 HA2 GLY 67 8.991 10.873 -15.029 514 H GLU 68 H GLU 68 8.279 9.658 -13.110 515 HA GLU 68 HA GLU 68 9.385 10.528 -10.541 516 HB2 GLU 68 HB3 GLU 68 6.606 11.234 -11.478 517 HB3 GLU 68 HB2 GLU 68 7.106 11.297 -9.792 518 HG2 GLU 68 HG3 GLU 68 8.826 12.949 -10.322 519 HG3 GLU 68 HG2 GLU 68 8.447 12.859 -12.032 520 H VAL 69 H VAL 69 7.847 9.661 -8.738 521 HA VAL 69 HA VAL 69 6.728 7.065 -9.477 522 HB VAL 69 HB VAL 69 8.777 6.453 -8.461 523 HG11 VAL 69 HG11 VAL 69 9.575 7.421 -6.317 524 HG12 VAL 69 HG12 VAL 69 8.211 8.530 -6.333 525 HG13 VAL 69 HG13 VAL 69 9.444 8.636 -7.585 526 HG21 VAL 69 HG21 VAL 69 8.102 5.544 -6.207 527 HG22 VAL 69 HG22 VAL 69 6.978 5.181 -7.499 528 HG23 VAL 69 HG23 VAL 69 6.593 6.449 -6.335 529 H ASP 70 H ASP 70 4.742 6.678 -8.588 530 HA ASP 70 HA ASP 70 3.564 8.985 -7.215 531 HB2 ASP 70 HB3 ASP 70 1.621 8.542 -8.252 532 HB3 ASP 70 HB2 ASP 70 2.590 7.526 -9.312 533 H PHE 71 H PHE 71 1.572 8.234 -5.845 534 HA PHE 71 HA PHE 71 2.600 7.253 -3.418 535 HB2 PHE 71 HB3 PHE 71 0.653 8.761 -3.508 536 HB3 PHE 71 HB2 PHE 71 -0.276 7.472 -4.285 537 HD1 PHE 71 HD1 PHE 71 1.814 8.093 -1.245 538 HD2 PHE 71 HD2 PHE 71 -1.564 6.059 -2.939 539 HE1 PHE 71 HE1 PHE 71 1.233 7.209 0.991 540 HE2 PHE 71 HE2 PHE 71 -2.151 5.172 -0.679 541 HZ PHE 71 HZ PHE 71 -0.753 5.747 1.278 542 H GLN 72 H GLN 72 0.577 5.774 -5.931 543 HA GLN 72 HA GLN 72 0.091 3.332 -4.623 544 HB2 GLN 72 HB3 GLN 72 0.153 4.005 -7.578 545 HB3 GLN 72 HB2 GLN 72 -0.407 2.476 -6.923 546 HG2 GLN 72 HG3 GLN 72 -2.117 3.599 -5.588 547 HG3 GLN 72 HG2 GLN 72 -1.537 5.169 -6.131 548 HE21 GLN 72 HE21 GLN 72 -2.013 5.798 -8.336 549 HE22 GLN 72 HE22 GLN 72 -3.158 4.978 -9.271 550 H GLU 73 H GLU 73 2.646 4.387 -6.796 551 HA GLU 73 HA GLU 73 4.076 1.899 -6.814 552 HB2 GLU 73 HB3 GLU 73 4.958 4.747 -7.398 553 HB3 GLU 73 HB2 GLU 73 5.974 3.326 -7.628 554 HG2 GLU 73 HG3 GLU 73 4.367 2.369 -9.216 555 HG3 GLU 73 HG2 GLU 73 3.263 3.675 -8.917 556 H TYR 74 H TYR 74 4.180 4.836 -4.885 557 HA TYR 74 HA TYR 74 6.412 4.240 -3.282 558 HB2 TYR 74 HB3 TYR 74 5.583 6.500 -3.316 559 HB3 TYR 74 HB2 TYR 74 4.000 5.945 -2.804 560 HD1 TYR 74 HD1 TYR 74 7.541 5.461 -1.480 561 HD2 TYR 74 HD2 TYR 74 3.456 6.588 -0.646 562 HE1 TYR 74 HE1 TYR 74 8.111 5.835 0.875 563 HE2 TYR 74 HE2 TYR 74 4.057 6.969 1.722 564 HH TYR 74 HH TYR 74 7.338 6.993 2.824 565 H VAL 75 H VAL 75 2.962 3.645 -2.626 566 HA VAL 75 HA VAL 75 3.466 2.466 -0.120 567 HB VAL 75 HB VAL 75 1.161 1.443 -0.320 568 HG11 VAL 75 HG11 VAL 75 0.053 3.604 -0.132 569 HG12 VAL 75 HG12 VAL 75 1.387 4.403 -0.948 570 HG13 VAL 75 HG13 VAL 75 1.626 3.704 0.652 571 HG21 VAL 75 HG21 VAL 75 1.619 2.149 -3.082 572 HG22 VAL 75 HG22 VAL 75 0.248 3.045 -2.487 573 HG23 VAL 75 HG23 VAL 75 0.254 1.281 -2.398 574 H VAL 76 H VAL 76 3.188 0.934 -3.331 575 HA VAL 76 HA VAL 76 3.426 -1.692 -2.295 576 HB VAL 76 HB VAL 76 2.518 -1.247 -4.560 577 HG11 VAL 76 HG11 VAL 76 5.373 -0.457 -5.224 578 HG12 VAL 76 HG12 VAL 76 3.922 0.552 -5.286 579 HG13 VAL 76 HG13 VAL 76 4.104 -0.780 -6.406 580 HG21 VAL 76 HG21 VAL 76 5.038 -2.960 -4.636 581 HG22 VAL 76 HG22 VAL 76 3.660 -3.083 -5.718 582 HG23 VAL 76 HG23 VAL 76 3.470 -3.495 -4.023 583 H LEU 77 H LEU 77 5.726 0.778 -3.167 584 HA LEU 77 HA LEU 77 8.088 -0.748 -3.256 585 HB2 LEU 77 HB3 LEU 77 8.021 1.596 -3.913 586 HB3 LEU 77 HB2 LEU 77 7.614 2.080 -2.280 587 HG LEU 77 HG LEU 77 9.801 1.052 -1.497 588 HD11 LEU 77 HD11 LEU 77 11.452 1.060 -3.613 589 HD12 LEU 77 HD12 LEU 77 9.996 0.452 -4.393 590 HD13 LEU 77 HD13 LEU 77 10.667 -0.376 -2.983 591 HD21 LEU 77 HD21 LEU 77 9.511 3.474 -3.220 592 HD22 LEU 77 HD22 LEU 77 11.161 2.949 -2.860 593 HD23 LEU 77 HD23 LEU 77 10.052 3.317 -1.555 594 H VAL 78 H VAL 78 6.526 0.951 -0.556 595 HA VAL 78 HA VAL 78 8.358 -0.144 1.334 596 HB VAL 78 HB VAL 78 7.059 0.981 3.034 597 HG11 VAL 78 HG11 VAL 78 7.863 3.005 2.345 598 HG12 VAL 78 HG12 VAL 78 6.691 3.084 1.042 599 HG13 VAL 78 HG13 VAL 78 8.207 2.249 0.789 600 HG21 VAL 78 HG21 VAL 78 5.033 1.457 0.835 601 HG22 VAL 78 HG22 VAL 78 4.951 2.156 2.443 602 HG23 VAL 78 HG23 VAL 78 4.761 0.417 2.240 603 H ALA 79 H ALA 79 5.073 -0.893 0.348 604 HA ALA 79 HA ALA 79 4.555 -2.863 2.282 605 HB1 ALA 79 HB1 ALA 79 3.464 -2.991 -0.507 606 HB2 ALA 79 HB2 ALA 79 2.891 -1.801 0.668 607 HB3 ALA 79 HB3 ALA 79 2.730 -3.530 0.997 608 H ALA 80 H ALA 80 6.061 -3.128 -0.922 609 HA ALA 80 HA ALA 80 6.190 -5.921 -1.032 610 HB1 ALA 80 HB1 ALA 80 8.097 -5.599 -2.580 611 HB2 ALA 80 HB2 ALA 80 8.168 -3.898 -2.128 612 HB3 ALA 80 HB3 ALA 80 6.754 -4.529 -2.972 613 H LEU 81 H LEU 81 8.390 -3.537 0.305 614 HA LEU 81 HA LEU 81 10.340 -5.320 1.361 615 HB2 LEU 81 HB3 LEU 81 9.503 -2.534 2.158 616 HB3 LEU 81 HB2 LEU 81 10.883 -3.379 2.859 617 HG LEU 81 HG LEU 81 10.553 -2.885 -0.121 618 HD11 LEU 81 HD11 LEU 81 11.870 -0.993 0.037 619 HD12 LEU 81 HD12 LEU 81 12.506 -1.410 1.625 620 HD13 LEU 81 HD13 LEU 81 10.851 -0.830 1.459 621 HD21 LEU 81 HD21 LEU 81 13.238 -3.208 0.781 622 HD22 LEU 81 HD22 LEU 81 12.335 -4.259 -0.302 623 HD23 LEU 81 HD23 LEU 81 12.326 -4.562 1.425 624 H THR 82 H THR 82 7.387 -3.872 2.590 625 HA THR 82 HA THR 82 7.594 -4.671 5.253 626 HB THR 82 HB THR 82 5.023 -4.382 3.699 627 HG1 THR 82 HG2 THR 82 6.667 -2.571 3.521 628 HG21 THR 82 HG21 THR 82 3.997 -3.926 5.743 629 HG22 THR 82 HG22 THR 82 5.525 -3.564 6.543 630 HG23 THR 82 HG23 THR 82 5.114 -5.222 6.138 631 H VAL 83 H VAL 83 5.867 -6.248 2.548 632 HA VAL 83 HA VAL 83 5.073 -8.491 4.078 633 HB VAL 83 HB VAL 83 3.958 -7.907 1.980 634 HG11 VAL 83 HG11 VAL 83 5.866 -7.176 0.650 635 HG12 VAL 83 HG12 VAL 83 4.965 -8.437 -0.189 636 HG13 VAL 83 HG13 VAL 83 6.487 -8.832 0.594 637 HG21 VAL 83 HG21 VAL 83 5.220 -10.674 1.923 638 HG22 VAL 83 HG22 VAL 83 3.838 -10.168 0.964 639 HG23 VAL 83 HG23 VAL 83 3.705 -10.220 2.717 640 H ALA 84 H ALA 84 7.900 -7.943 2.045 641 HA ALA 84 HA ALA 84 9.010 -10.512 2.177 642 HB1 ALA 84 HB1 ALA 84 10.135 -9.105 0.690 643 HB2 ALA 84 HB2 ALA 84 11.247 -9.190 2.035 644 HB3 ALA 84 HB3 ALA 84 10.220 -7.774 1.844 645 H MET 85 H MET 85 9.601 -7.717 4.306 646 HA MET 85 HA MET 85 11.210 -9.246 6.108 647 HB2 MET 85 HB3 MET 85 11.291 -6.724 5.899 648 HB3 MET 85 HB2 MET 85 9.754 -6.698 6.774 649 HG2 MET 85 HG3 MET 85 10.832 -7.989 8.640 650 HG3 MET 85 HG2 MET 85 12.355 -7.880 7.790 651 HE1 MET 85 HE1 MET 85 9.382 -5.995 9.289 652 HE2 MET 85 HE2 MET 85 10.194 -4.798 10.288 653 HE3 MET 85 HE3 MET 85 10.491 -6.506 10.570 654 H ASN 86 H ASN 86 7.812 -8.225 6.118 655 HA ASN 86 HA ASN 86 7.326 -9.165 8.679 656 HB2 ASN 86 HB3 ASN 86 5.520 -8.334 6.473 657 HB3 ASN 86 HB2 ASN 86 4.834 -9.261 7.796 658 HD21 ASN 86 HD21 ASN 86 5.618 -8.430 10.110 659 HD22 ASN 86 HD22 ASN 86 5.652 -6.750 10.278 660 H ASN 87 H ASN 87 7.303 -10.843 5.668 661 HA ASN 87 HA ASN 87 5.859 -13.126 6.393 662 HB2 ASN 87 HB3 ASN 87 6.948 -12.475 4.106 663 HB3 ASN 87 HB2 ASN 87 8.364 -13.314 4.730 664 HD21 ASN 87 HD21 ASN 87 6.823 -15.360 6.239 665 HD22 ASN 87 HD22 ASN 87 6.132 -16.350 5.060 666 H PHE 88 H PHE 88 9.095 -12.089 7.141 667 HA PHE 88 HA PHE 88 10.164 -14.461 8.136 668 HB2 PHE 88 HB3 PHE 88 11.672 -12.661 7.742 669 HB3 PHE 88 HB2 PHE 88 10.780 -11.596 8.815 670 HD1 PHE 88 HD1 PHE 88 12.363 -15.015 8.986 671 HD2 PHE 88 HD2 PHE 88 11.674 -11.217 10.911 672 HE1 PHE 88 HE1 PHE 88 13.734 -15.733 10.925 673 HE2 PHE 88 HE2 PHE 88 13.041 -11.946 12.833 674 HZ PHE 88 HZ PHE 88 14.074 -14.185 12.849 675 H PHE 89 H PHE 89 8.350 -11.961 9.902 676 HA PHE 89 HA PHE 89 8.854 -12.903 12.455 677 HB2 PHE 89 HB3 PHE 89 6.293 -11.675 11.410 678 HB3 PHE 89 HB2 PHE 89 6.607 -11.958 13.107 679 HD1 PHE 89 HD1 PHE 89 8.908 -11.000 14.035 680 HD2 PHE 89 HD2 PHE 89 6.960 -9.669 10.463 681 HE1 PHE 89 HE1 PHE 89 10.163 -8.885 14.151 682 HE2 PHE 89 HE2 PHE 89 8.228 -7.522 10.568 683 HZ PHE 89 HZ PHE 89 9.839 -7.138 12.431 684 H TRP 90 H TRP 90 6.282 -13.930 10.286 685 HA TRP 90 HA TRP 90 5.156 -15.887 12.064 686 HB2 TRP 90 HB3 TRP 90 4.984 -15.684 9.052 687 HB3 TRP 90 HB2 TRP 90 3.957 -16.641 10.122 688 HD1 TRP 90 HD TRP 90 4.669 -13.066 9.116 689 HE1 TRP 90 HE1 TRP 90 2.843 -11.571 10.020 690 HE3 TRP 90 HE3 TRP 90 2.191 -16.427 12.027 691 HZ2 TRP 90 HZ2 TRP 90 0.550 -11.747 11.793 692 HZ3 TRP 90 HZ3 TRP 90 0.179 -15.737 13.313 693 HH2 TRP 90 HH TRP 90 -0.637 -13.402 13.194 694 H GLU 91 H GLU 91 7.308 -16.020 9.338 695 HA GLU 91 HA GLU 91 7.741 -18.853 9.512 696 HB2 GLU 91 HB3 GLU 91 9.395 -16.731 8.128 697 HB3 GLU 91 HB2 GLU 91 9.678 -18.449 7.979 698 HG2 GLU 91 HG3 GLU 91 7.365 -18.824 7.168 699 HG3 GLU 91 HG2 GLU 91 7.052 -17.115 7.284 700 H ASN 92 H ASN 92 9.108 -16.130 11.087 701 HA ASN 92 HA ASN 92 11.603 -16.848 11.790 702 HB2 ASN 92 HB3 ASN 92 10.465 -14.753 12.522 703 HB3 ASN 92 HB2 ASN 92 9.621 -15.681 13.757 704 HD21 ASN 92 HD21 ASN 92 10.810 -14.202 15.278 705 HD22 ASN 92 HD22 ASN 92 12.406 -14.589 15.707 706 H SER 93 H SER 93 12.488 -18.541 12.717 707 HA SER 93 HA SER 93 11.273 -19.957 14.909 708 HB2 SER 93 HB3 SER 93 11.386 -21.049 12.111 709 HB3 SER 93 HB2 SER 93 11.297 -22.118 13.527 710 HG SER 93 HG SER 93 9.542 -19.947 13.383 711 H1 GLY 1 H GLY 1 9.939 1.227 15.135 712 HA2 GLY 1 HA3 GLY 1 11.788 2.030 13.042 713 HA3 GLY 1 HA2 GLY 1 10.450 1.013 12.525 714 H SER 2 H SER 2 10.112 3.105 11.268 715 HA SER 2 HA SER 2 9.058 5.386 12.643 716 HB2 SER 2 HB3 SER 2 8.629 4.654 9.744 717 HB3 SER 2 HB2 SER 2 8.566 6.259 10.412 718 HG SER 2 HG SER 2 10.638 4.721 9.610 719 H GLU 3 H GLU 3 6.810 6.165 12.492 720 HA GLU 3 HA GLU 3 4.894 4.256 13.232 721 HB2 GLU 3 HB3 GLU 3 4.539 7.056 12.121 722 HB3 GLU 3 HB2 GLU 3 3.206 6.069 12.706 723 HG2 GLU 3 HG3 GLU 3 4.284 5.899 14.919 724 HG3 GLU 3 HG2 GLU 3 5.617 6.898 14.346 725 H LEU 4 H LEU 4 5.945 5.443 10.175 726 HA LEU 4 HA LEU 4 3.816 4.418 8.564 727 HB2 LEU 4 HB3 LEU 4 6.744 4.936 7.886 728 HB3 LEU 4 HB2 LEU 4 5.563 4.382 6.728 729 HG LEU 4 HG LEU 4 5.736 6.766 6.506 730 HD11 LEU 4 HD11 LEU 4 3.192 6.388 8.066 731 HD12 LEU 4 HD12 LEU 4 3.414 5.632 6.488 732 HD13 LEU 4 HD13 LEU 4 3.495 7.385 6.653 733 HD21 LEU 4 HD21 LEU 4 5.521 8.317 8.264 734 HD22 LEU 4 HD22 LEU 4 6.576 7.108 8.927 735 HD23 LEU 4 HD23 LEU 4 4.852 7.149 9.383 736 H GLU 5 H GLU 5 6.847 3.056 9.779 737 HA GLU 5 HA GLU 5 6.586 0.546 8.489 738 HB2 GLU 5 HB3 GLU 5 7.953 1.206 11.135 739 HB3 GLU 5 HB2 GLU 5 8.221 -0.224 10.153 740 HG2 GLU 5 HG3 GLU 5 8.851 1.288 8.243 741 HG3 GLU 5 HG2 GLU 5 8.832 2.632 9.374 742 H THR 6 H THR 6 5.539 1.852 11.578 743 HA THR 6 HA THR 6 4.237 -0.476 12.546 744 HB THR 6 HB THR 6 3.429 2.384 13.109 745 HG1 THR 6 HG2 THR 6 5.795 1.157 13.497 746 HG21 THR 6 HG21 THR 6 3.073 1.254 15.410 747 HG22 THR 6 HG22 THR 6 3.140 -0.266 14.525 748 HG23 THR 6 HG23 THR 6 1.901 0.929 14.139 749 H ALA 7 H ALA 7 3.136 2.304 10.586 750 HA ALA 7 HA ALA 7 0.446 1.569 10.351 751 HB1 ALA 7 HB1 ALA 7 0.429 2.961 8.333 752 HB2 ALA 7 HB2 ALA 7 2.167 2.991 8.302 753 HB3 ALA 7 HB3 ALA 7 1.292 3.785 9.631 754 H MET 8 H MET 8 3.279 0.753 8.378 755 HA MET 8 HA MET 8 1.865 -0.853 6.519 756 HB2 MET 8 HB3 MET 8 4.785 -1.003 7.378 757 HB3 MET 8 HB2 MET 8 4.098 -1.842 5.989 758 HG2 MET 8 HG3 MET 8 4.232 1.173 6.346 759 HG3 MET 8 HG2 MET 8 5.135 0.195 5.199 760 HE1 MET 8 HE1 MET 8 2.726 -1.051 2.676 761 HE2 MET 8 HE2 MET 8 2.724 -1.945 4.179 762 HE3 MET 8 HE3 MET 8 4.227 -1.270 3.585 763 H GLU 9 H GLU 9 3.480 -1.603 9.597 764 HA GLU 9 HA GLU 9 2.958 -4.372 9.441 765 HB2 GLU 9 HB3 GLU 9 3.451 -2.578 11.814 766 HB3 GLU 9 HB2 GLU 9 3.169 -4.307 11.992 767 HG2 GLU 9 HG3 GLU 9 5.082 -4.733 10.430 768 HG3 GLU 9 HG2 GLU 9 5.367 -3.004 10.360 769 H THR 10 H THR 10 1.119 -1.645 10.618 770 HA THR 10 HA THR 10 -0.953 -3.045 11.887 771 HB THR 10 HB THR 10 -1.369 -0.469 10.308 772 HG1 THR 10 HG2 THR 10 0.551 -0.581 11.821 773 HG21 THR 10 HG21 THR 10 -3.192 -1.938 11.688 774 HG22 THR 10 HG22 THR 10 -3.235 -0.192 11.539 775 HG23 THR 10 HG23 THR 10 -2.548 -0.926 12.985 776 H LEU 11 H LEU 11 -0.462 -2.120 8.508 777 HA LEU 11 HA LEU 11 -2.838 -3.273 7.468 778 HB2 LEU 11 HB3 LEU 11 -0.128 -2.758 6.233 779 HB3 LEU 11 HB2 LEU 11 -1.499 -3.361 5.309 780 HG LEU 11 HG LEU 11 -1.630 -0.787 6.921 781 HD11 LEU 11 HD11 LEU 11 0.153 -0.939 4.982 782 HD12 LEU 11 HD12 LEU 11 -0.936 0.442 5.077 783 HD13 LEU 11 HD13 LEU 11 -1.268 -0.855 3.938 784 HD21 LEU 11 HD21 LEU 11 -3.209 -1.191 4.461 785 HD22 LEU 11 HD22 LEU 11 -3.720 -0.551 6.000 786 HD23 LEU 11 HD23 LEU 11 -3.645 -2.303 5.754 787 H ILE 12 H ILE 12 0.434 -4.500 8.008 788 HA ILE 12 HA ILE 12 0.121 -7.044 6.820 789 HB ILE 12 HB ILE 12 1.883 -6.124 9.096 790 HG12 ILE 12 HG13 ILE 12 2.199 -5.119 6.754 791 HG13 ILE 12 HG12 ILE 12 3.607 -5.880 7.456 792 HG21 ILE 12 HG21 ILE 12 1.573 -8.542 9.241 793 HG22 ILE 12 HG22 ILE 12 3.201 -8.105 8.796 794 HG23 ILE 12 HG23 ILE 12 2.092 -8.722 7.564 795 HD11 ILE 12 HD11 ILE 12 3.400 -7.804 6.074 796 HD12 ILE 12 HD12 ILE 12 3.082 -6.440 5.029 797 HD13 ILE 12 HD13 ILE 12 1.744 -7.414 5.596 798 H ASN 13 H ASN 13 -0.310 -5.915 10.117 799 HA ASN 13 HA ASN 13 -0.860 -8.404 11.287 800 HB2 ASN 13 HB3 ASN 13 -1.666 -5.595 12.036 801 HB3 ASN 13 HB2 ASN 13 -2.075 -6.986 13.028 802 HD21 ASN 13 HD21 ASN 13 0.303 -4.653 12.618 803 HD22 ASN 13 HD22 ASN 13 1.587 -5.460 13.367 804 H VAL 14 H VAL 14 -2.999 -5.984 9.863 805 HA VAL 14 HA VAL 14 -5.403 -7.445 10.287 806 HB VAL 14 HB VAL 14 -4.697 -5.344 8.220 807 HG11 VAL 14 HG11 VAL 14 -7.164 -5.103 8.026 808 HG12 VAL 14 HG12 VAL 14 -7.358 -6.556 8.995 809 HG13 VAL 14 HG13 VAL 14 -6.577 -6.646 7.402 810 HG21 VAL 14 HG21 VAL 14 -5.839 -5.313 11.013 811 HG22 VAL 14 HG22 VAL 14 -6.373 -4.109 9.851 812 HG23 VAL 14 HG23 VAL 14 -4.669 -4.213 10.278 813 H PHE 15 H PHE 15 -3.137 -7.228 7.575 814 HA PHE 15 HA PHE 15 -4.493 -8.889 5.785 815 HB2 PHE 15 HB3 PHE 15 -2.563 -7.527 5.162 816 HB3 PHE 15 HB2 PHE 15 -1.506 -8.545 6.130 817 HD1 PHE 15 HD1 PHE 15 -3.604 -8.388 3.081 818 HD2 PHE 15 HD2 PHE 15 -0.907 -10.813 5.404 819 HE1 PHE 15 HE1 PHE 15 -3.372 -9.964 1.187 820 HE2 PHE 15 HE2 PHE 15 -0.692 -12.376 3.504 821 HZ PHE 15 HZ PHE 15 -1.912 -11.956 1.405 822 H HIS 16 H HIS 16 -2.022 -9.725 8.198 823 HA HIS 16 HA HIS 16 -2.102 -12.513 7.621 824 HB2 HIS 16 HB3 HIS 16 -0.994 -10.942 9.948 825 HB3 HIS 16 HB2 HIS 16 -1.035 -12.702 9.958 826 HD1 HIS 16 HD1 HIS 16 0.971 -13.819 8.924 827 HD2 HIS 16 HD2 HIS 16 0.278 -10.023 7.301 828 HE1 HIS 16 HE1 HIS 16 2.772 -13.422 7.199 829 HE2 HIS 16 HE2 HIS 16 2.350 -11.134 6.179 830 H ALA 17 H ALA 17 -3.814 -10.500 9.955 831 HA ALA 17 HA ALA 17 -5.041 -12.505 11.464 832 HB1 ALA 17 HB1 ALA 17 -6.788 -10.883 11.952 833 HB2 ALA 17 HB2 ALA 17 -6.302 -9.896 10.578 834 HB3 ALA 17 HB3 ALA 17 -5.221 -10.072 11.960 835 H HIS 18 H HIS 18 -6.186 -10.935 8.486 836 HA HIS 18 HA HIS 18 -8.433 -12.671 8.188 837 HB2 HIS 18 HB3 HIS 18 -7.020 -10.899 6.172 838 HB3 HIS 18 HB2 HIS 18 -8.468 -11.855 5.850 839 HD1 HIS 18 HD1 HIS 18 -10.704 -11.231 7.195 840 HD2 HIS 18 HD2 HIS 18 -7.525 -8.552 7.707 841 HE1 HIS 18 HE1 HIS 18 -11.653 -9.172 8.283 842 HE2 HIS 18 HE2 HIS 18 -9.757 -7.536 8.609 843 H SER 19 H SER 19 -5.134 -12.730 6.926 844 HA SER 19 HA SER 19 -5.391 -14.838 5.097 845 HB2 SER 19 HB3 SER 19 -3.001 -14.286 6.879 846 HB3 SER 19 HB2 SER 19 -3.014 -15.213 5.398 847 HG SER 19 HG SER 19 -3.733 -12.434 5.633 848 H GLY 20 H GLY 20 -4.642 -14.873 8.565 849 HA2 GLY 20 HA3 GLY 20 -4.314 -17.650 8.823 850 HA3 GLY 20 HA2 GLY 20 -4.752 -16.557 10.138 851 H LYS 21 H LYS 21 -7.151 -15.584 9.058 852 HA LYS 21 HA LYS 21 -8.925 -17.600 9.944 853 HB2 LYS 21 HB3 LYS 21 -9.483 -15.038 8.435 854 HB3 LYS 21 HB2 LYS 21 -10.711 -16.066 9.162 855 HG2 LYS 21 HG3 LYS 21 -8.424 -14.829 10.733 856 HG3 LYS 21 HG2 LYS 21 -10.041 -14.149 10.661 857 HD2 LYS 21 HD3 LYS 21 -10.952 -16.248 11.600 858 HD3 LYS 21 HD2 LYS 21 -9.317 -16.901 11.688 859 HE2 LYS 21 HE2 LYS 21 -8.654 -15.120 13.249 860 HE3 LYS 21 HE1 LYS 21 -10.259 -14.410 13.153 861 HZ1 LYS 21 HZ1 LYS 21 -9.481 -17.014 14.364 862 HZ2 LYS 21 HZ2 LYS 21 -11.072 -16.701 13.915 863 HZ3 LYS 21 HZ3 LYS 21 -10.326 -15.742 15.057 864 H GLU 22 H GLU 22 -8.151 -16.474 6.654 865 HA GLU 22 HA GLU 22 -10.042 -18.270 5.490 866 HB2 GLU 22 HB3 GLU 22 -7.705 -16.822 4.101 867 HB3 GLU 22 HB2 GLU 22 -8.929 -17.793 3.349 868 HG2 GLU 22 HG3 GLU 22 -10.710 -16.338 4.126 869 HG3 GLU 22 HG2 GLU 22 -9.537 -15.437 5.087 870 H GLY 23 H GLY 23 -6.603 -18.568 6.259 871 HA2 GLY 23 HA3 GLY 23 -6.301 -20.965 7.070 872 HA3 GLY 23 HA2 GLY 23 -6.782 -21.426 5.448 873 H ASP 24 H ASP 24 -5.173 -18.930 4.495 874 HA ASP 24 HA ASP 24 -2.790 -20.455 4.002 875 HB2 ASP 24 HB3 ASP 24 -3.832 -18.827 2.340 876 HB3 ASP 24 HB2 ASP 24 -3.146 -17.551 3.323 877 H LYS 25 H LYS 25 -0.624 -19.835 4.478 878 HA LYS 25 HA LYS 25 -0.170 -19.032 7.190 879 HB2 LYS 25 HB3 LYS 25 1.682 -18.974 4.824 880 HB3 LYS 25 HB2 LYS 25 2.155 -18.799 6.508 881 HG2 LYS 25 HG3 LYS 25 1.115 -20.910 7.017 882 HG3 LYS 25 HG2 LYS 25 0.833 -21.200 5.284 883 HD2 LYS 25 HD3 LYS 25 3.583 -20.689 6.513 884 HD3 LYS 25 HD2 LYS 25 2.961 -22.295 6.159 885 HE2 LYS 25 HE2 LYS 25 3.136 -22.050 3.889 886 HE3 LYS 25 HE1 LYS 25 2.896 -20.312 3.904 887 HZ1 LYS 25 HZ1 LYS 25 5.188 -20.870 3.378 888 HZ2 LYS 25 HZ2 LYS 25 5.375 -21.694 4.842 889 HZ3 LYS 25 HZ3 LYS 25 5.113 -20.030 4.826 890 H TYR 26 H TYR 26 0.109 -17.488 4.044 891 HA TYR 26 HA TYR 26 -0.632 -15.122 5.232 892 HB2 TYR 26 HB3 TYR 26 1.666 -14.076 3.949 893 HB3 TYR 26 HB2 TYR 26 1.356 -14.216 5.675 894 HD1 TYR 26 HD2 TYR 26 2.726 -16.077 2.743 895 HD2 TYR 26 HD1 TYR 26 2.514 -15.764 7.004 896 HE1 TYR 26 HE2 TYR 26 4.458 -17.827 2.946 897 HE2 TYR 26 HE1 TYR 26 4.274 -17.535 7.213 898 HH TYR 26 HH TYR 26 6.307 -18.348 5.112 899 H LYS 27 H LYS 27 -2.229 -15.263 3.616 900 HA LYS 27 HA LYS 27 -1.754 -14.049 1.111 901 HB2 LYS 27 HB3 LYS 27 -2.769 -16.922 1.135 902 HB3 LYS 27 HB2 LYS 27 -2.884 -15.857 -0.246 903 HG2 LYS 27 HG3 LYS 27 -0.235 -16.710 1.036 904 HG3 LYS 27 HG2 LYS 27 -0.950 -17.460 -0.358 905 HD2 LYS 27 HD3 LYS 27 -0.434 -14.471 -0.388 906 HD3 LYS 27 HD2 LYS 27 0.845 -15.637 -0.717 907 HE2 LYS 27 HE2 LYS 27 -0.775 -16.712 -2.425 908 HE3 LYS 27 HE1 LYS 27 -1.720 -15.239 -2.242 909 HZ1 LYS 27 HZ1 LYS 27 0.624 -15.667 -3.739 910 HZ2 LYS 27 HZ2 LYS 27 0.906 -14.402 -2.679 911 HZ3 LYS 27 HZ3 LYS 27 -0.403 -14.366 -3.760 912 H LEU 28 H LEU 28 -3.862 -13.375 0.248 913 HA LEU 28 HA LEU 28 -6.036 -13.798 2.199 914 HB2 LEU 28 HB3 LEU 28 -4.996 -11.572 2.388 915 HB3 LEU 28 HB2 LEU 28 -5.364 -11.256 0.699 916 HG LEU 28 HG LEU 28 -7.801 -11.676 1.241 917 HD11 LEU 28 HD11 LEU 28 -8.106 -11.258 3.837 918 HD12 LEU 28 HD12 LEU 28 -6.564 -12.119 3.916 919 HD13 LEU 28 HD13 LEU 28 -7.969 -12.884 3.169 920 HD21 LEU 28 HD21 LEU 28 -7.044 -9.401 1.086 921 HD22 LEU 28 HD22 LEU 28 -6.288 -9.491 2.692 922 HD23 LEU 28 HD23 LEU 28 -8.041 -9.535 2.539 923 H SER 29 H SER 29 -7.923 -14.434 1.340 924 HA SER 29 HA SER 29 -8.082 -14.496 -1.588 925 HB2 SER 29 HB3 SER 29 -10.334 -15.839 -0.420 926 HB3 SER 29 HB2 SER 29 -9.079 -16.465 -1.428 927 HG SER 29 HG SER 29 -8.576 -15.970 1.326 928 H LYS 30 H LYS 30 -10.601 -14.293 -2.233 929 HA LYS 30 HA LYS 30 -11.137 -11.535 -1.550 930 HB2 LYS 30 HB3 LYS 30 -12.876 -13.284 -3.291 931 HB3 LYS 30 HB2 LYS 30 -12.709 -11.530 -3.302 932 HG2 LYS 30 HG3 LYS 30 -10.652 -13.550 -4.165 933 HG3 LYS 30 HG2 LYS 30 -11.448 -12.362 -5.189 934 HD2 LYS 30 HD3 LYS 30 -9.999 -11.058 -2.930 935 HD3 LYS 30 HD2 LYS 30 -8.986 -12.100 -3.923 936 HE2 LYS 30 HE2 LYS 30 -10.832 -10.098 -5.145 937 HE3 LYS 30 HE1 LYS 30 -9.212 -9.658 -4.641 938 HZ1 LYS 30 HZ1 LYS 30 -9.962 -11.706 -6.653 939 HZ2 LYS 30 HZ2 LYS 30 -8.340 -11.506 -6.035 940 HZ3 LYS 30 HZ3 LYS 30 -9.119 -10.266 -6.863 941 H LYS 31 H LYS 31 -11.856 -14.301 -0.001 942 HA LYS 31 HA LYS 31 -14.563 -13.865 0.817 943 HB2 LYS 31 HB3 LYS 31 -12.892 -15.064 2.916 944 HB3 LYS 31 HB2 LYS 31 -14.262 -15.713 2.047 945 HG2 LYS 31 HG3 LYS 31 -12.680 -16.317 0.098 946 HG3 LYS 31 HG2 LYS 31 -11.435 -15.622 1.121 947 HD2 LYS 31 HD3 LYS 31 -11.624 -17.222 2.743 948 HD3 LYS 31 HD2 LYS 31 -13.077 -17.967 2.059 949 HE2 LYS 31 HE2 LYS 31 -10.666 -17.769 0.291 950 HE3 LYS 31 HE1 LYS 31 -10.563 -18.912 1.629 951 HZ1 LYS 31 HZ1 LYS 31 -12.883 -18.868 -0.238 952 HZ2 LYS 31 HZ2 LYS 31 -12.376 -20.122 0.792 953 HZ3 LYS 31 HZ3 LYS 31 -11.477 -19.710 -0.548 954 H GLU 32 H GLU 32 -11.599 -13.480 2.743 955 HA GLU 32 HA GLU 32 -12.796 -11.643 4.541 956 HB2 GLU 32 HB3 GLU 32 -9.946 -12.427 4.017 957 HB3 GLU 32 HB2 GLU 32 -10.435 -11.345 5.323 958 HG2 GLU 32 HG3 GLU 32 -11.412 -14.173 4.910 959 HG3 GLU 32 HG2 GLU 32 -10.154 -13.721 6.052 960 H LEU 33 H LEU 33 -10.710 -11.290 1.711 961 HA LEU 33 HA LEU 33 -9.857 -8.703 2.153 962 HB2 LEU 33 HB3 LEU 33 -8.986 -10.140 0.307 963 HB3 LEU 33 HB2 LEU 33 -10.492 -9.900 -0.547 964 HG LEU 33 HG LEU 33 -8.454 -8.412 -1.182 965 HD11 LEU 33 HD11 LEU 33 -9.889 -7.111 -2.267 966 HD12 LEU 33 HD12 LEU 33 -10.729 -6.601 -0.811 967 HD13 LEU 33 HD13 LEU 33 -11.137 -8.136 -1.575 968 HD21 LEU 33 HD21 LEU 33 -8.119 -6.427 0.052 969 HD22 LEU 33 HD22 LEU 33 -8.114 -7.677 1.288 970 HD23 LEU 33 HD23 LEU 33 -9.531 -6.664 1.061 971 H LYS 34 H LYS 34 -12.802 -9.650 0.381 972 HA LYS 34 HA LYS 34 -13.509 -6.968 -0.194 973 HB2 LYS 34 HB3 LYS 34 -15.285 -9.414 0.016 974 HB3 LYS 34 HB2 LYS 34 -15.813 -7.825 -0.525 975 HG2 LYS 34 HG3 LYS 34 -14.078 -7.862 -2.328 976 HG3 LYS 34 HG2 LYS 34 -13.666 -9.511 -1.866 977 HD2 LYS 34 HD3 LYS 34 -16.561 -8.929 -2.445 978 HD3 LYS 34 HD2 LYS 34 -15.448 -8.969 -3.794 979 HE2 LYS 34 HE2 LYS 34 -16.433 -11.172 -3.431 980 HE3 LYS 34 HE1 LYS 34 -14.706 -11.227 -3.177 981 HZ1 LYS 34 HZ1 LYS 34 -14.941 -11.523 -0.915 982 HZ2 LYS 34 HZ2 LYS 34 -16.329 -12.286 -1.454 983 HZ3 LYS 34 HZ3 LYS 34 -16.440 -10.744 -0.807 984 H GLU 35 H GLU 35 -14.310 -9.110 2.488 985 HA GLU 35 HA GLU 35 -16.008 -7.253 3.829 986 HB2 GLU 35 HB3 GLU 35 -14.477 -9.695 4.788 987 HB3 GLU 35 HB2 GLU 35 -15.610 -8.785 5.781 988 HG2 GLU 35 HG3 GLU 35 -17.434 -9.204 4.220 989 HG3 GLU 35 HG2 GLU 35 -16.333 -10.000 3.108 990 H LEU 36 H LEU 36 -12.615 -8.138 4.088 991 HA LEU 36 HA LEU 36 -11.863 -6.511 6.247 992 HB2 LEU 36 HB3 LEU 36 -10.214 -8.022 5.764 993 HB3 LEU 36 HB2 LEU 36 -10.509 -7.957 4.045 994 HG LEU 36 HG LEU 36 -9.348 -5.831 3.858 995 HD11 LEU 36 HD11 LEU 36 -9.253 -4.540 5.689 996 HD12 LEU 36 HD12 LEU 36 -7.890 -5.535 6.151 997 HD13 LEU 36 HD13 LEU 36 -9.501 -5.894 6.805 998 HD21 LEU 36 HD21 LEU 36 -7.834 -7.452 3.439 999 HD22 LEU 36 HD22 LEU 36 -8.038 -8.247 4.999 1000 HD23 LEU 36 HD23 LEU 36 -7.056 -6.785 4.870 1001 H LEU 37 H LEU 37 -11.651 -5.863 2.762 1002 HA LEU 37 HA LEU 37 -10.439 -3.382 3.123 1003 HB2 LEU 37 HB3 LEU 37 -10.345 -4.526 0.985 1004 HB3 LEU 37 HB2 LEU 37 -12.081 -4.358 0.760 1005 HG LEU 37 HG LEU 37 -10.532 -2.692 -0.475 1006 HD11 LEU 37 HD11 LEU 37 -13.123 -2.494 0.272 1007 HD12 LEU 37 HD12 LEU 37 -12.265 -1.260 -0.637 1008 HD13 LEU 37 HD13 LEU 37 -12.462 -1.080 1.098 1009 HD21 LEU 37 HD21 LEU 37 -9.590 -0.903 0.690 1010 HD22 LEU 37 HD22 LEU 37 -9.237 -2.253 1.757 1011 HD23 LEU 37 HD23 LEU 37 -10.561 -1.154 2.129 1012 H GLN 38 H GLN 38 -13.854 -4.135 2.629 1013 HA GLN 38 HA GLN 38 -14.690 -1.418 2.817 1014 HB2 GLN 38 HB3 GLN 38 -16.950 -2.291 3.053 1015 HB3 GLN 38 HB2 GLN 38 -16.107 -3.184 1.795 1016 HG2 GLN 38 HG3 GLN 38 -15.548 -4.922 3.552 1017 HG3 GLN 38 HG2 GLN 38 -16.666 -4.087 4.637 1018 HE21 GLN 38 HE21 GLN 38 -16.438 -6.051 1.758 1019 HE22 GLN 38 HE22 GLN 38 -18.111 -6.346 1.606 1020 H THR 39 H THR 39 -14.355 -4.027 5.164 1021 HA THR 39 HA THR 39 -15.541 -2.738 7.339 1022 HB THR 39 HB THR 39 -13.434 -4.874 7.183 1023 HG1 THR 39 HG2 THR 39 -15.117 -5.702 6.358 1024 HG21 THR 39 HG21 THR 39 -14.978 -3.790 9.534 1025 HG22 THR 39 HG22 THR 39 -13.248 -4.104 9.342 1026 HG23 THR 39 HG23 THR 39 -14.363 -5.451 9.479 1027 H GLU 40 H GLU 40 -12.035 -3.059 6.577 1028 HA GLU 40 HA GLU 40 -11.286 -1.433 8.794 1029 HB2 GLU 40 HB3 GLU 40 -9.711 -2.304 6.373 1030 HB3 GLU 40 HB2 GLU 40 -9.038 -1.502 7.796 1031 HG2 GLU 40 HG3 GLU 40 -10.539 -4.146 7.866 1032 HG3 GLU 40 HG2 GLU 40 -8.791 -3.949 7.953 1033 H LEU 41 H LEU 41 -11.708 -0.757 5.388 1034 HA LEU 41 HA LEU 41 -10.970 2.046 5.842 1035 HB2 LEU 41 HB3 LEU 41 -11.236 0.295 3.441 1036 HB3 LEU 41 HB2 LEU 41 -11.393 2.010 3.216 1037 HG LEU 41 HG LEU 41 -9.177 2.314 4.454 1038 HD11 LEU 41 HD11 LEU 41 -8.890 0.371 5.710 1039 HD12 LEU 41 HD12 LEU 41 -7.760 0.159 4.380 1040 HD13 LEU 41 HD13 LEU 41 -9.302 -0.690 4.360 1041 HD21 LEU 41 HD21 LEU 41 -7.900 1.966 2.524 1042 HD22 LEU 41 HD22 LEU 41 -9.526 2.087 1.860 1043 HD23 LEU 41 HD23 LEU 41 -8.771 0.504 2.080 1044 H SER 42 H SER 42 -13.383 1.125 7.012 1045 HA SER 42 HA SER 42 -15.673 1.427 5.515 1046 HB2 SER 42 HB3 SER 42 -15.245 2.155 8.425 1047 HB3 SER 42 HB2 SER 42 -16.810 2.072 7.641 1048 HG SER 42 HG SER 42 -14.909 -0.050 8.057 1049 H GLY 43 H GLY 43 -13.776 4.024 7.075 1050 HA2 GLY 43 HA3 GLY 43 -15.558 6.138 6.380 1051 HA3 GLY 43 HA2 GLY 43 -13.874 6.316 6.864 1052 H PHE 44 H PHE 44 -12.604 4.851 4.952 1053 HA PHE 44 HA PHE 44 -12.512 6.600 2.677 1054 HB2 PHE 44 HB3 PHE 44 -11.275 4.001 3.405 1055 HB3 PHE 44 HB2 PHE 44 -11.309 4.397 1.683 1056 HD1 PHE 44 HD2 PHE 44 -10.159 6.512 0.906 1057 HD2 PHE 44 HD1 PHE 44 -9.807 5.054 4.915 1058 HE1 PHE 44 HE2 PHE 44 -8.166 7.934 1.236 1059 HE2 PHE 44 HE1 PHE 44 -7.781 6.481 5.246 1060 HZ PHE 44 HZ PHE 44 -6.971 7.906 3.412 1061 H LEU 45 H LEU 45 -13.899 3.448 3.312 1062 HA LEU 45 HA LEU 45 -14.906 2.842 0.778 1063 HB2 LEU 45 HB3 LEU 45 -14.980 1.038 2.179 1064 HB3 LEU 45 HB2 LEU 45 -15.433 2.001 3.570 1065 HG LEU 45 HG LEU 45 -17.701 2.251 2.716 1066 HD11 LEU 45 HD11 LEU 45 -18.199 1.904 0.612 1067 HD12 LEU 45 HD12 LEU 45 -17.780 0.190 0.715 1068 HD13 LEU 45 HD13 LEU 45 -16.564 1.378 0.228 1069 HD21 LEU 45 HD21 LEU 45 -17.856 -0.564 2.509 1070 HD22 LEU 45 HD22 LEU 45 -18.075 0.424 3.938 1071 HD23 LEU 45 HD23 LEU 45 -16.483 -0.220 3.565 1072 H ASP 46 H ASP 46 -16.467 4.450 3.532 1073 HA ASP 46 HA ASP 46 -18.965 4.821 2.306 1074 HB2 ASP 46 HB3 ASP 46 -18.638 5.047 4.630 1075 HB3 ASP 46 HB2 ASP 46 -17.601 6.474 4.430 1076 H ALA 47 H ALA 47 -16.132 6.905 2.402 1077 HA ALA 47 HA ALA 47 -17.265 8.976 0.778 1078 HB1 ALA 47 HB1 ALA 47 -15.142 9.055 2.281 1079 HB2 ALA 47 HB2 ALA 47 -15.139 9.943 0.756 1080 HB3 ALA 47 HB3 ALA 47 -14.337 8.377 0.873 1081 H GLN 48 H GLN 48 -15.382 6.083 0.163 1082 HA GLN 48 HA GLN 48 -14.744 6.585 -2.473 1083 HB2 GLN 48 HB3 GLN 48 -14.734 4.133 -0.799 1084 HB3 GLN 48 HB2 GLN 48 -14.526 3.944 -2.515 1085 HG2 GLN 48 HG3 GLN 48 -12.896 5.953 -0.951 1086 HG3 GLN 48 HG2 GLN 48 -12.368 4.290 -1.154 1087 HE21 GLN 48 HE21 GLN 48 -14.191 5.489 -3.837 1088 HE22 GLN 48 HE22 GLN 48 -12.865 5.809 -4.848 1089 H LYS 49 H LYS 49 -17.690 5.251 -1.218 1090 HA LYS 49 HA LYS 49 -18.512 3.623 -3.299 1091 HB2 LYS 49 HB3 LYS 49 -20.221 5.425 -1.581 1092 HB3 LYS 49 HB2 LYS 49 -20.863 4.161 -2.629 1093 HG2 LYS 49 HG3 LYS 49 -19.574 2.458 -1.406 1094 HG3 LYS 49 HG2 LYS 49 -18.863 3.702 -0.398 1095 HD2 LYS 49 HD3 LYS 49 -20.598 3.093 1.014 1096 HD3 LYS 49 HD2 LYS 49 -21.424 4.316 0.075 1097 HE2 LYS 49 HE2 LYS 49 -22.836 2.354 0.152 1098 HE3 LYS 49 HE1 LYS 49 -22.245 2.518 -1.492 1099 HZ1 LYS 49 HZ1 LYS 49 -21.600 0.499 0.515 1100 HZ2 LYS 49 HZ2 LYS 49 -20.318 0.969 -0.504 1101 HZ3 LYS 49 HZ3 LYS 49 -21.743 0.368 -1.150 1102 H ASP 50 H ASP 50 -18.979 7.095 -3.010 1103 HA ASP 50 HA ASP 50 -20.459 7.441 -5.427 1104 HB2 ASP 50 HB3 ASP 50 -20.311 9.064 -3.433 1105 HB3 ASP 50 HB2 ASP 50 -18.758 9.550 -4.135 1106 H VAL 51 H VAL 51 -17.121 6.979 -4.803 1107 HA VAL 51 HA VAL 51 -16.103 8.477 -6.969 1108 HB VAL 51 HB VAL 51 -14.860 6.195 -5.440 1109 HG11 VAL 51 HG11 VAL 51 -13.491 6.487 -7.341 1110 HG12 VAL 51 HG12 VAL 51 -12.721 7.529 -6.147 1111 HG13 VAL 51 HG13 VAL 51 -13.760 8.225 -7.380 1112 HG21 VAL 51 HG21 VAL 51 -14.799 9.205 -5.026 1113 HG22 VAL 51 HG22 VAL 51 -13.772 8.086 -4.138 1114 HG23 VAL 51 HG23 VAL 51 -15.521 8.029 -3.943 1115 H ASP 52 H ASP 52 -17.599 5.397 -6.784 1116 HA ASP 52 HA ASP 52 -18.092 3.825 -8.398 1117 HB2 ASP 52 HB3 ASP 52 -18.571 5.788 -9.805 1118 HB3 ASP 52 HB2 ASP 52 -16.907 5.819 -10.365 1119 H ALA 53 H ALA 53 -15.002 5.358 -9.059 1120 HA ALA 53 HA ALA 53 -13.666 3.208 -10.192 1121 HB1 ALA 53 HB1 ALA 53 -12.124 4.984 -8.334 1122 HB2 ALA 53 HB2 ALA 53 -12.868 5.686 -9.772 1123 HB3 ALA 53 HB3 ALA 53 -11.705 4.377 -9.933 1124 H VAL 54 H VAL 54 -14.554 3.715 -6.873 1125 HA VAL 54 HA VAL 54 -12.711 2.048 -5.605 1126 HB VAL 54 HB VAL 54 -14.264 3.466 -4.366 1127 HG11 VAL 54 HG11 VAL 54 -16.621 2.916 -4.144 1128 HG12 VAL 54 HG12 VAL 54 -16.465 1.525 -5.174 1129 HG13 VAL 54 HG13 VAL 54 -16.285 3.152 -5.849 1130 HG21 VAL 54 HG21 VAL 54 -15.325 1.297 -3.001 1131 HG22 VAL 54 HG22 VAL 54 -13.724 1.949 -2.729 1132 HG23 VAL 54 HG23 VAL 54 -13.939 0.574 -3.808 1133 H ASP 55 H ASP 55 -15.759 1.340 -7.209 1134 HA ASP 55 HA ASP 55 -15.785 -1.474 -6.751 1135 HB2 ASP 55 HB3 ASP 55 -17.740 -0.275 -7.658 1136 HB3 ASP 55 HB2 ASP 55 -16.822 0.065 -9.132 1137 H LYS 56 H LYS 56 -14.531 0.544 -9.272 1138 HA LYS 56 HA LYS 56 -13.518 -1.501 -10.930 1139 HB2 LYS 56 HB3 LYS 56 -12.874 1.445 -10.770 1140 HB3 LYS 56 HB2 LYS 56 -12.303 0.361 -12.027 1141 HG2 LYS 56 HG3 LYS 56 -14.578 -0.267 -12.677 1142 HG3 LYS 56 HG2 LYS 56 -15.251 0.703 -11.368 1143 HD2 LYS 56 HD3 LYS 56 -14.521 2.697 -12.322 1144 HD3 LYS 56 HD2 LYS 56 -13.560 1.906 -13.593 1145 HE2 LYS 56 HE2 LYS 56 -15.708 2.691 -14.523 1146 HE3 LYS 56 HE1 LYS 56 -15.681 0.940 -14.515 1147 HZ1 LYS 56 HZ1 LYS 56 -17.752 2.151 -13.598 1148 HZ2 LYS 56 HZ2 LYS 56 -16.901 2.429 -12.199 1149 HZ3 LYS 56 HZ3 LYS 56 -17.179 0.857 -12.735 1150 H VAL 57 H VAL 57 -12.023 0.395 -8.355 1151 HA VAL 57 HA VAL 57 -9.352 -0.611 -8.710 1152 HB VAL 57 HB VAL 57 -10.742 0.478 -6.237 1153 HG11 VAL 57 HG11 VAL 57 -8.481 0.795 -5.342 1154 HG12 VAL 57 HG12 VAL 57 -7.797 0.018 -6.765 1155 HG13 VAL 57 HG13 VAL 57 -8.788 -0.913 -5.648 1156 HG21 VAL 57 HG21 VAL 57 -9.818 2.574 -6.776 1157 HG22 VAL 57 HG22 VAL 57 -10.375 1.992 -8.345 1158 HG23 VAL 57 HG23 VAL 57 -8.666 1.889 -7.911 1159 H MET 58 H MET 58 -12.091 -1.435 -6.726 1160 HA MET 58 HA MET 58 -11.046 -3.765 -5.517 1161 HB2 MET 58 HB3 MET 58 -13.055 -2.685 -4.670 1162 HB3 MET 58 HB2 MET 58 -13.887 -2.957 -6.193 1163 HG2 MET 58 HG3 MET 58 -13.752 -5.274 -5.944 1164 HG3 MET 58 HG2 MET 58 -12.805 -5.197 -4.442 1165 HE1 MET 58 HE1 MET 58 -15.686 -4.236 -6.413 1166 HE2 MET 58 HE2 MET 58 -16.682 -3.240 -5.345 1167 HE3 MET 58 HE3 MET 58 -17.016 -4.947 -5.485 1168 H LYS 59 H LYS 59 -12.590 -3.054 -8.554 1169 HA LYS 59 HA LYS 59 -13.034 -5.687 -9.443 1170 HB2 LYS 59 HB3 LYS 59 -13.852 -3.372 -10.465 1171 HB3 LYS 59 HB2 LYS 59 -12.339 -3.501 -11.346 1172 HG2 LYS 59 HG3 LYS 59 -13.961 -4.524 -12.722 1173 HG3 LYS 59 HG2 LYS 59 -12.953 -5.790 -12.001 1174 HD2 LYS 59 HD3 LYS 59 -15.425 -6.277 -11.963 1175 HD3 LYS 59 HD2 LYS 59 -14.695 -6.372 -10.375 1176 HE2 LYS 59 HE2 LYS 59 -15.865 -3.731 -11.278 1177 HE3 LYS 59 HE1 LYS 59 -16.957 -5.007 -10.804 1178 HZ1 LYS 59 HZ1 LYS 59 -16.599 -3.954 -8.827 1179 HZ2 LYS 59 HZ2 LYS 59 -15.021 -3.564 -9.085 1180 HZ3 LYS 59 HZ3 LYS 59 -15.462 -5.170 -8.697 1181 H GLU 60 H GLU 60 -10.282 -3.488 -9.769 1182 HA GLU 60 HA GLU 60 -8.680 -5.139 -11.417 1183 HB2 GLU 60 HB3 GLU 60 -8.003 -3.141 -9.296 1184 HB3 GLU 60 HB2 GLU 60 -6.769 -3.887 -10.324 1185 HG2 GLU 60 HG3 GLU 60 -7.957 -2.968 -12.318 1186 HG3 GLU 60 HG2 GLU 60 -9.134 -2.222 -11.254 1187 H LEU 61 H LEU 61 -9.139 -4.893 -7.957 1188 HA LEU 61 HA LEU 61 -7.384 -7.037 -7.256 1189 HB2 LEU 61 HB3 LEU 61 -9.627 -5.618 -5.823 1190 HB3 LEU 61 HB2 LEU 61 -8.988 -7.112 -5.179 1191 HG LEU 61 HG LEU 61 -7.954 -4.951 -4.333 1192 HD11 LEU 61 HD11 LEU 61 -5.629 -5.923 -4.402 1193 HD12 LEU 61 HD12 LEU 61 -6.231 -7.176 -5.472 1194 HD13 LEU 61 HD13 LEU 61 -6.871 -7.023 -3.834 1195 HD21 LEU 61 HD21 LEU 61 -6.179 -3.961 -5.700 1196 HD22 LEU 61 HD22 LEU 61 -7.696 -3.847 -6.572 1197 HD23 LEU 61 HD23 LEU 61 -6.510 -5.066 -7.023 1198 H ASP 62 H ASP 62 -10.739 -6.761 -8.200 1199 HA ASP 62 HA ASP 62 -11.483 -9.372 -7.597 1200 HB2 ASP 62 HB3 ASP 62 -13.051 -7.482 -8.253 1201 HB3 ASP 62 HB2 ASP 62 -12.617 -7.831 -9.931 1202 H GLU 63 H GLU 63 -9.894 -8.006 -10.413 1203 HA GLU 63 HA GLU 63 -9.904 -10.138 -12.276 1204 HB2 GLU 63 HB3 GLU 63 -7.463 -8.536 -11.491 1205 HB3 GLU 63 HB2 GLU 63 -7.716 -9.403 -12.984 1206 HG2 GLU 63 HG3 GLU 63 -9.598 -7.894 -13.580 1207 HG3 GLU 63 HG2 GLU 63 -9.334 -7.033 -12.058 1208 H ASN 64 H ASN 64 -7.914 -9.417 -9.548 1209 HA ASN 64 HA ASN 64 -6.162 -11.569 -9.628 1210 HB2 ASN 64 HB3 ASN 64 -5.348 -9.948 -8.320 1211 HB3 ASN 64 HB2 ASN 64 -6.840 -9.469 -7.624 1212 HD21 ASN 64 HD21 ASN 64 -4.019 -11.133 -6.985 1213 HD22 ASN 64 HD22 ASN 64 -4.516 -12.004 -5.619 1214 H GLY 65 H GLY 65 -9.436 -11.767 -9.160 1215 HA2 GLY 65 HA3 GLY 65 -9.765 -13.675 -7.104 1216 HA3 GLY 65 HA2 GLY 65 -10.826 -13.463 -8.495 1217 H ASP 66 H ASP 66 -7.681 -14.018 -9.539 1218 HA ASP 66 HA ASP 66 -8.111 -16.484 -10.776 1219 HB2 ASP 66 HB3 ASP 66 -6.261 -14.716 -11.149 1220 HB3 ASP 66 HB2 ASP 66 -5.451 -15.452 -9.790 1221 H GLY 67 H GLY 67 -6.828 -15.514 -7.675 1222 HA2 GLY 67 HA3 GLY 67 -7.405 -18.105 -6.502 1223 HA3 GLY 67 HA2 GLY 67 -5.699 -17.712 -6.583 1224 H GLU 68 H GLU 68 -4.849 -16.058 -5.362 1225 HA GLU 68 HA GLU 68 -6.622 -14.989 -3.253 1226 HB2 GLU 68 HB3 GLU 68 -3.709 -15.335 -2.774 1227 HB3 GLU 68 HB2 GLU 68 -5.041 -15.467 -1.647 1228 HG2 GLU 68 HG3 GLU 68 -4.445 -17.690 -1.835 1229 HG3 GLU 68 HG2 GLU 68 -5.663 -17.615 -3.091 1230 H VAL 69 H VAL 69 -5.555 -13.117 -2.162 1231 HA VAL 69 HA VAL 69 -4.090 -11.403 -4.020 1232 HB VAL 69 HB VAL 69 -6.174 -10.349 -3.944 1233 HG11 VAL 69 HG11 VAL 69 -7.478 -10.023 -1.834 1234 HG12 VAL 69 HG12 VAL 69 -6.287 -11.015 -0.998 1235 HG13 VAL 69 HG13 VAL 69 -7.277 -11.719 -2.272 1236 HG21 VAL 69 HG21 VAL 69 -4.083 -9.145 -2.232 1237 HG22 VAL 69 HG22 VAL 69 -5.689 -8.631 -1.779 1238 HG23 VAL 69 HG23 VAL 69 -5.138 -8.403 -3.430 1239 H ASP 70 H ASP 70 -2.167 -10.786 -3.208 1240 HA ASP 70 HA ASP 70 -1.569 -11.675 -0.494 1241 HB2 ASP 70 HB3 ASP 70 0.549 -12.037 -1.127 1242 HB3 ASP 70 HB2 ASP 70 -0.149 -12.019 -2.735 1243 H PHE 71 H PHE 71 0.384 -10.199 0.413 1244 HA PHE 71 HA PHE 71 -0.959 -7.976 1.490 1245 HB2 PHE 71 HB3 PHE 71 1.004 -9.102 2.577 1246 HB3 PHE 71 HB2 PHE 71 2.042 -8.302 1.393 1247 HD1 PHE 71 HD1 PHE 71 -0.668 -7.527 3.844 1248 HD2 PHE 71 HD2 PHE 71 2.910 -6.114 1.902 1249 HE1 PHE 71 HE1 PHE 71 -0.706 -5.490 5.228 1250 HE2 PHE 71 HE2 PHE 71 2.852 -4.083 3.322 1251 HZ PHE 71 HZ PHE 71 1.068 -3.766 4.965 1252 H GLN 72 H GLN 72 1.490 -8.232 -1.039 1253 HA GLN 72 HA GLN 72 1.733 -5.463 -1.597 1254 HB2 GLN 72 HB3 GLN 72 2.297 -7.974 -3.116 1255 HB3 GLN 72 HB2 GLN 72 2.525 -6.377 -3.915 1256 HG2 GLN 72 HG3 GLN 72 4.096 -5.849 -2.090 1257 HG3 GLN 72 HG2 GLN 72 3.776 -7.419 -1.354 1258 HE21 GLN 72 HE21 GLN 72 3.629 -7.924 -4.658 1259 HE22 GLN 72 HE22 GLN 72 5.231 -8.389 -4.927 1260 H GLU 73 H GLU 73 -0.403 -7.963 -2.869 1261 HA GLU 73 HA GLU 73 -1.811 -6.213 -4.639 1262 HB2 GLU 73 HB3 GLU 73 -2.503 -8.915 -3.446 1263 HB3 GLU 73 HB2 GLU 73 -3.532 -8.067 -4.598 1264 HG2 GLU 73 HG3 GLU 73 -1.798 -8.074 -6.282 1265 HG3 GLU 73 HG2 GLU 73 -0.627 -8.733 -5.141 1266 H TYR 74 H TYR 74 -2.321 -7.306 -1.323 1267 HA TYR 74 HA TYR 74 -4.806 -6.046 -0.875 1268 HB2 TYR 74 HB3 TYR 74 -4.153 -7.738 0.652 1269 HB3 TYR 74 HB2 TYR 74 -2.631 -6.937 0.996 1270 HD1 TYR 74 HD1 TYR 74 -6.334 -5.963 1.094 1271 HD2 TYR 74 HD2 TYR 74 -2.506 -5.964 3.108 1272 HE1 TYR 74 HE1 TYR 74 -7.330 -4.812 3.006 1273 HE2 TYR 74 HE2 TYR 74 -3.548 -4.804 5.043 1274 HH TYR 74 HH TYR 74 -7.016 -4.188 5.184 1275 H VAL 75 H VAL 75 -1.512 -4.835 -0.185 1276 HA VAL 75 HA VAL 75 -2.454 -2.482 0.986 1277 HB VAL 75 HB VAL 75 -0.170 -1.528 0.544 1278 HG11 VAL 75 HG11 VAL 75 -0.187 -4.291 1.783 1279 HG12 VAL 75 HG12 VAL 75 -0.820 -2.850 2.589 1280 HG13 VAL 75 HG13 VAL 75 0.887 -2.953 2.168 1281 HG21 VAL 75 HG21 VAL 75 1.226 -2.539 -0.939 1282 HG22 VAL 75 HG22 VAL 75 -0.088 -3.620 -1.374 1283 HG23 VAL 75 HG23 VAL 75 1.034 -4.077 -0.105 1284 H VAL 76 H VAL 76 -1.694 -3.177 -2.417 1285 HA VAL 76 HA VAL 76 -1.904 -0.497 -3.232 1286 HB VAL 76 HB VAL 76 -0.783 -2.183 -4.621 1287 HG11 VAL 76 HG11 VAL 76 -2.251 -3.704 -6.012 1288 HG12 VAL 76 HG12 VAL 76 -3.555 -3.374 -4.876 1289 HG13 VAL 76 HG13 VAL 76 -2.052 -4.130 -4.324 1290 HG21 VAL 76 HG21 VAL 76 -3.182 -1.156 -6.160 1291 HG22 VAL 76 HG22 VAL 76 -1.538 -1.387 -6.735 1292 HG23 VAL 76 HG23 VAL 76 -1.899 -0.073 -5.615 1293 H LEU 77 H LEU 77 -4.298 -2.999 -2.757 1294 HA LEU 77 HA LEU 77 -6.483 -1.742 -4.038 1295 HB2 LEU 77 HB3 LEU 77 -6.583 -4.054 -3.283 1296 HB3 LEU 77 HB2 LEU 77 -6.404 -3.547 -1.620 1297 HG LEU 77 HG LEU 77 -8.538 -2.313 -1.691 1298 HD11 LEU 77 HD11 LEU 77 -9.942 -3.039 -3.864 1299 HD12 LEU 77 HD12 LEU 77 -8.338 -2.871 -4.597 1300 HD13 LEU 77 HD13 LEU 77 -9.062 -1.530 -3.726 1301 HD21 LEU 77 HD21 LEU 77 -9.193 -4.343 -0.939 1302 HD22 LEU 77 HD22 LEU 77 -8.349 -5.228 -2.207 1303 HD23 LEU 77 HD23 LEU 77 -9.933 -4.520 -2.521 1304 H VAL 78 H VAL 78 -5.380 -1.630 -0.660 1305 HA VAL 78 HA VAL 78 -7.301 0.373 0.032 1306 HB VAL 78 HB VAL 78 -6.131 0.553 2.174 1307 HG11 VAL 78 HG11 VAL 78 -7.135 -1.917 1.033 1308 HG12 VAL 78 HG12 VAL 78 -7.261 -1.322 2.696 1309 HG13 VAL 78 HG13 VAL 78 -5.878 -2.264 2.210 1310 HG21 VAL 78 HG21 VAL 78 -4.093 -0.736 2.603 1311 HG22 VAL 78 HG22 VAL 78 -3.772 0.368 1.282 1312 HG23 VAL 78 HG23 VAL 78 -4.115 -1.343 0.961 1313 H ALA 79 H ALA 79 -3.897 0.432 -0.882 1314 HA ALA 79 HA ALA 79 -3.531 3.215 -0.495 1315 HB1 ALA 79 HB1 ALA 79 -1.745 1.343 -0.933 1316 HB2 ALA 79 HB2 ALA 79 -1.502 2.989 -1.487 1317 HB3 ALA 79 HB3 ALA 79 -2.040 1.753 -2.632 1318 H ALA 80 H ALA 80 -4.496 1.361 -3.369 1319 HA ALA 80 HA ALA 80 -4.496 3.548 -5.088 1320 HB1 ALA 80 HB1 ALA 80 -6.088 2.176 -6.479 1321 HB2 ALA 80 HB2 ALA 80 -6.144 1.008 -5.159 1322 HB3 ALA 80 HB3 ALA 80 -4.635 1.314 -5.992 1323 H LEU 81 H LEU 81 -6.997 2.157 -3.004 1324 HA LEU 81 HA LEU 81 -9.058 4.030 -3.635 1325 HB2 LEU 81 HB3 LEU 81 -8.559 2.361 -1.153 1326 HB3 LEU 81 HB2 LEU 81 -9.995 3.340 -1.412 1327 HG LEU 81 HG LEU 81 -9.095 1.149 -3.315 1328 HD11 LEU 81 HD11 LEU 81 -9.745 0.109 -1.234 1329 HD12 LEU 81 HD12 LEU 81 -11.050 -0.109 -2.392 1330 HD13 LEU 81 HD13 LEU 81 -11.198 1.109 -1.127 1331 HD21 LEU 81 HD21 LEU 81 -11.488 2.987 -3.163 1332 HD22 LEU 81 HD22 LEU 81 -11.592 1.416 -3.960 1333 HD23 LEU 81 HD23 LEU 81 -10.451 2.622 -4.549 1334 H THR 82 H THR 82 -6.466 3.931 -1.254 1335 HA THR 82 HA THR 82 -7.132 6.323 0.079 1336 HB THR 82 HB THR 82 -4.326 5.293 -0.369 1337 HG1 THR 82 HG2 THR 82 -5.878 3.684 0.474 1338 HG21 THR 82 HG21 THR 82 -3.803 6.419 1.681 1339 HG22 THR 82 HG22 THR 82 -5.504 6.783 1.981 1340 HG23 THR 82 HG23 THR 82 -4.659 7.561 0.651 1341 H VAL 83 H VAL 83 -4.976 5.683 -2.687 1342 HA VAL 83 HA VAL 83 -4.238 8.358 -2.987 1343 HB VAL 83 HB VAL 83 -3.279 6.127 -4.096 1344 HG11 VAL 83 HG11 VAL 83 -3.654 6.292 -6.555 1345 HG12 VAL 83 HG12 VAL 83 -5.132 7.182 -6.227 1346 HG13 VAL 83 HG13 VAL 83 -4.921 5.528 -5.627 1347 HG21 VAL 83 HG21 VAL 83 -2.149 8.298 -4.042 1348 HG22 VAL 83 HG22 VAL 83 -3.158 8.866 -5.380 1349 HG23 VAL 83 HG23 VAL 83 -1.994 7.577 -5.648 1350 H ALA 84 H ALA 84 -6.864 6.495 -4.424 1351 HA ALA 84 HA ALA 84 -7.862 8.458 -6.164 1352 HB1 ALA 84 HB1 ALA 84 -8.625 5.997 -5.867 1353 HB2 ALA 84 HB2 ALA 84 -9.852 7.202 -6.263 1354 HB3 ALA 84 HB3 ALA 84 -9.677 6.631 -4.606 1355 H MET 85 H MET 85 -8.811 7.767 -2.791 1356 HA MET 85 HA MET 85 -10.370 10.139 -2.611 1357 HB2 MET 85 HB3 MET 85 -9.344 8.246 -0.526 1358 HB3 MET 85 HB2 MET 85 -10.070 9.790 -0.059 1359 HG2 MET 85 HG3 MET 85 -12.110 9.239 -1.347 1360 HG3 MET 85 HG2 MET 85 -11.387 7.702 -1.820 1361 HE1 MET 85 HE1 MET 85 -12.738 9.111 2.300 1362 HE2 MET 85 HE2 MET 85 -12.229 10.079 0.927 1363 HE3 MET 85 HE3 MET 85 -11.019 9.318 1.948 1364 H ASN 86 H ASN 86 -7.027 9.399 -1.842 1365 HA ASN 86 HA ASN 86 -6.393 11.787 -0.529 1366 HB2 ASN 86 HB3 ASN 86 -4.826 9.930 -0.596 1367 HB3 ASN 86 HB2 ASN 86 -4.690 10.106 -2.352 1368 HD21 ASN 86 HD21 ASN 86 -2.493 10.760 -2.494 1369 HD22 ASN 86 HD22 ASN 86 -1.906 12.177 -1.798 1370 H ASN 87 H ASN 87 -6.350 10.953 -3.985 1371 HA ASN 87 HA ASN 87 -5.544 13.553 -4.866 1372 HB2 ASN 87 HB3 ASN 87 -5.375 11.613 -6.355 1373 HB3 ASN 87 HB2 ASN 87 -7.132 11.430 -6.326 1374 HD21 ASN 87 HD21 ASN 87 -7.600 11.992 -8.522 1375 HD22 ASN 87 HD22 ASN 87 -7.249 13.522 -9.165 1376 H PHE 88 H PHE 88 -8.641 11.968 -4.327 1377 HA PHE 88 HA PHE 88 -10.247 14.073 -5.222 1378 HB2 PHE 88 HB3 PHE 88 -11.204 11.843 -4.809 1379 HB3 PHE 88 HB2 PHE 88 -10.905 12.054 -3.080 1380 HD1 PHE 88 HD1 PHE 88 -12.530 13.913 -5.918 1381 HD2 PHE 88 HD2 PHE 88 -12.648 12.862 -1.745 1382 HE1 PHE 88 HE1 PHE 88 -14.659 15.141 -5.665 1383 HE2 PHE 88 HE2 PHE 88 -14.777 14.094 -1.504 1384 HZ PHE 88 HZ PHE 88 -15.784 15.233 -3.454 1385 H PHE 89 H PHE 89 -8.933 13.386 -2.020 1386 HA PHE 89 HA PHE 89 -10.174 15.229 -0.454 1387 HB2 PHE 89 HB3 PHE 89 -7.491 14.031 -0.432 1388 HB3 PHE 89 HB2 PHE 89 -7.523 15.629 0.283 1389 HD1 PHE 89 HD2 PHE 89 -9.389 12.361 0.364 1390 HD2 PHE 89 HD1 PHE 89 -8.281 15.932 2.474 1391 HE1 PHE 89 HE2 PHE 89 -10.410 11.458 2.423 1392 HE2 PHE 89 HE1 PHE 89 -9.302 15.027 4.541 1393 HZ PHE 89 HZ PHE 89 -10.368 12.785 4.513 1394 H TRP 90 H TRP 90 -7.558 15.933 -2.728 1395 HA TRP 90 HA TRP 90 -7.543 18.781 -2.266 1396 HB2 TRP 90 HB3 TRP 90 -6.551 17.375 -4.745 1397 HB3 TRP 90 HB2 TRP 90 -6.061 18.945 -4.119 1398 HD1 TRP 90 HD TRP 90 -5.815 15.254 -3.392 1399 HE1 TRP 90 HE1 TRP 90 -3.891 14.812 -1.775 1400 HE3 TRP 90 HE3 TRP 90 -4.536 20.038 -2.360 1401 HZ2 TRP 90 HZ2 TRP 90 -1.965 16.386 -0.203 1402 HZ3 TRP 90 HZ3 TRP 90 -2.667 20.557 -0.824 1403 HH2 TRP 90 HH TRP 90 -1.383 18.720 0.251 1404 H GLU 91 H GLU 91 -9.018 16.666 -4.625 1405 HA GLU 91 HA GLU 91 -10.173 18.733 -6.223 1406 HB2 GLU 91 HB3 GLU 91 -11.052 15.871 -5.839 1407 HB3 GLU 91 HB2 GLU 91 -11.669 16.946 -7.069 1408 HG2 GLU 91 HG3 GLU 91 -9.304 17.262 -7.939 1409 HG3 GLU 91 HG2 GLU 91 -8.784 16.094 -6.771 1410 H ASN 92 H ASN 92 -11.205 16.890 -3.471 1411 HA ASN 92 HA ASN 92 -13.886 17.285 -3.333 1412 HB2 ASN 92 HB3 ASN 92 -12.508 15.976 -1.730 1413 HB3 ASN 92 HB2 ASN 92 -12.040 17.498 -0.960 1414 HD21 ASN 92 HD21 ASN 92 -13.149 16.777 1.042 1415 HD22 ASN 92 HD22 ASN 92 -14.840 16.828 1.123 1416 H SER 93 H SER 93 -14.755 19.202 -3.944 1417 HA SER 93 HA SER 93 -14.777 21.403 -2.153 1418 HB2 SER 93 HB3 SER 93 -13.094 21.530 -4.637 1419 HB3 SER 93 HB2 SER 93 -13.798 22.992 -3.955 1420 HG SER 93 HG SER 93 -12.469 21.130 -2.330 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -10.253 7.454 12.004 2 HA2 GLY 1 HA3 GLY 1 -11.896 6.205 10.316 3 HA3 GLY 1 HA2 GLY 1 -10.450 6.351 9.327 4 H SER 2 H SER 2 -10.681 3.979 9.441 5 HA SER 2 HA SER 2 -10.075 2.559 11.854 6 HB2 SER 2 HB3 SER 2 -10.114 1.845 8.942 7 HB3 SER 2 HB2 SER 2 -9.400 0.768 10.123 8 HG SER 2 HG SER 2 -11.381 0.166 10.168 9 H GLU 3 H GLU 3 -8.123 1.145 12.049 10 HA GLU 3 HA GLU 3 -5.718 2.568 12.158 11 HB2 GLU 3 HB3 GLU 3 -5.954 -0.425 11.733 12 HB3 GLU 3 HB2 GLU 3 -4.657 0.457 12.517 13 HG2 GLU 3 HG3 GLU 3 -5.768 -0.271 14.325 14 HG3 GLU 3 HG2 GLU 3 -6.569 1.279 14.142 15 H LEU 4 H LEU 4 -7.137 0.475 9.764 16 HA LEU 4 HA LEU 4 -4.986 0.277 7.945 17 HB2 LEU 4 HB3 LEU 4 -7.986 0.134 7.596 18 HB3 LEU 4 HB2 LEU 4 -6.891 -0.072 6.253 19 HG LEU 4 HG LEU 4 -7.476 -2.276 7.113 20 HD11 LEU 4 HD11 LEU 4 -5.109 -1.754 6.374 21 HD12 LEU 4 HD12 LEU 4 -5.380 -3.222 7.295 22 HD13 LEU 4 HD13 LEU 4 -4.662 -1.828 8.089 23 HD21 LEU 4 HD21 LEU 4 -7.287 -2.941 9.340 24 HD22 LEU 4 HD22 LEU 4 -7.922 -1.341 9.504 25 HD23 LEU 4 HD23 LEU 4 -6.190 -1.643 9.778 26 H GLU 5 H GLU 5 -7.734 2.498 8.174 27 HA GLU 5 HA GLU 5 -7.063 4.071 5.917 28 HB2 GLU 5 HB3 GLU 5 -8.737 4.650 8.372 29 HB3 GLU 5 HB2 GLU 5 -8.638 5.731 6.995 30 HG2 GLU 5 HG3 GLU 5 -9.425 3.900 5.498 31 HG3 GLU 5 HG2 GLU 5 -9.509 2.838 6.864 32 H THR 6 H THR 6 -6.462 4.413 9.376 33 HA THR 6 HA THR 6 -4.996 6.815 9.191 34 HB THR 6 HB THR 6 -4.658 4.644 11.258 35 HG1 THR 6 HG2 THR 6 -6.652 5.060 11.739 36 HG21 THR 6 HG21 THR 6 -3.210 6.883 11.002 37 HG22 THR 6 HG22 THR 6 -3.682 6.247 12.573 38 HG23 THR 6 HG23 THR 6 -4.595 7.563 11.851 39 H ALA 7 H ALA 7 -3.998 3.392 9.200 40 HA ALA 7 HA ALA 7 -1.237 3.782 9.068 41 HB1 ALA 7 HB1 ALA 7 -1.119 1.532 8.135 42 HB2 ALA 7 HB2 ALA 7 -2.811 1.594 7.682 43 HB3 ALA 7 HB3 ALA 7 -2.360 1.559 9.385 44 H MET 8 H MET 8 -3.636 3.464 6.456 45 HA MET 8 HA MET 8 -1.781 3.926 4.356 46 HB2 MET 8 HB3 MET 8 -4.780 4.354 4.422 47 HB3 MET 8 HB2 MET 8 -3.794 4.400 2.971 48 HG2 MET 8 HG3 MET 8 -4.143 1.999 4.809 49 HG3 MET 8 HG2 MET 8 -4.798 2.175 3.184 50 HE1 MET 8 HE1 MET 8 -3.564 2.738 1.296 51 HE2 MET 8 HE2 MET 8 -2.090 1.895 0.820 52 HE3 MET 8 HE3 MET 8 -1.970 3.489 1.560 53 H GLU 9 H GLU 9 -3.892 6.081 6.246 54 HA GLU 9 HA GLU 9 -3.294 8.360 4.741 55 HB2 GLU 9 HB3 GLU 9 -5.217 8.218 6.424 56 HB3 GLU 9 HB2 GLU 9 -3.999 8.341 7.668 57 HG2 GLU 9 HG3 GLU 9 -3.258 10.497 6.967 58 HG3 GLU 9 HG2 GLU 9 -4.185 10.417 5.484 59 H THR 10 H THR 10 -1.758 6.894 7.528 60 HA THR 10 HA THR 10 0.073 8.924 8.131 61 HB THR 10 HB THR 10 0.690 5.956 8.298 62 HG1 THR 10 HG2 THR 10 -1.392 6.407 9.190 63 HG21 THR 10 HG21 THR 10 1.385 7.946 10.402 64 HG22 THR 10 HG22 THR 10 2.314 8.026 8.914 65 HG23 THR 10 HG23 THR 10 2.278 6.537 9.856 66 H LEU 11 H LEU 11 0.215 6.267 5.791 67 HA LEU 11 HA LEU 11 2.776 6.915 4.763 68 HB2 LEU 11 HB3 LEU 11 0.417 5.489 3.494 69 HB3 LEU 11 HB2 LEU 11 1.987 5.638 2.717 70 HG LEU 11 HG LEU 11 1.632 4.386 5.463 71 HD11 LEU 11 HD11 LEU 11 0.523 3.266 3.276 72 HD12 LEU 11 HD12 LEU 11 1.280 2.335 4.557 73 HD13 LEU 11 HD13 LEU 11 2.180 2.678 3.089 74 HD21 LEU 11 HD21 LEU 11 3.982 5.272 4.555 75 HD22 LEU 11 HD22 LEU 11 3.864 3.893 3.483 76 HD23 LEU 11 HD23 LEU 11 3.854 3.645 5.217 77 H ILE 12 H ILE 12 -0.498 7.932 3.961 78 HA ILE 12 HA ILE 12 0.106 9.501 1.678 79 HB ILE 12 HB ILE 12 -2.113 9.734 3.736 80 HG12 ILE 12 HG13 ILE 12 -2.011 7.661 2.217 81 HG13 ILE 12 HG12 ILE 12 -3.502 8.596 2.142 82 HG21 ILE 12 HG21 ILE 12 -1.595 11.336 1.268 83 HG22 ILE 12 HG22 ILE 12 -2.122 11.841 2.887 84 HG23 ILE 12 HG23 ILE 12 -3.250 11.027 1.818 85 HD11 ILE 12 HD11 ILE 12 -2.870 9.612 0.059 86 HD12 ILE 12 HD12 ILE 12 -2.542 7.904 -0.099 87 HD13 ILE 12 HD13 ILE 12 -1.215 9.012 0.169 88 H ASN 13 H ASN 13 -0.063 10.260 5.119 89 HA ASN 13 HA ASN 13 0.355 13.044 4.969 90 HB2 ASN 13 HB3 ASN 13 1.236 11.087 7.106 91 HB3 ASN 13 HB2 ASN 13 1.249 12.830 7.271 92 HD21 ASN 13 HD21 ASN 13 -0.398 10.639 8.607 93 HD22 ASN 13 HD22 ASN 13 -2.007 11.170 8.481 94 H VAL 14 H VAL 14 2.644 10.353 5.293 95 HA VAL 14 HA VAL 14 4.980 11.991 5.230 96 HB VAL 14 HB VAL 14 4.625 9.042 4.633 97 HG11 VAL 14 HG11 VAL 14 6.690 9.880 3.601 98 HG12 VAL 14 HG12 VAL 14 7.084 8.932 5.034 99 HG13 VAL 14 HG13 VAL 14 7.134 10.685 5.106 100 HG21 VAL 14 HG21 VAL 14 5.820 9.012 6.976 101 HG22 VAL 14 HG22 VAL 14 4.092 9.340 6.924 102 HG23 VAL 14 HG23 VAL 14 5.235 10.665 7.106 103 H PHE 15 H PHE 15 3.185 10.167 2.801 104 HA PHE 15 HA PHE 15 4.914 10.543 0.657 105 HB2 PHE 15 HB3 PHE 15 2.992 9.009 0.634 106 HB3 PHE 15 HB2 PHE 15 1.893 10.388 0.600 107 HD1 PHE 15 HD1 PHE 15 4.531 8.584 -1.284 108 HD2 PHE 15 HD2 PHE 15 1.525 11.656 -1.425 109 HE1 PHE 15 HE1 PHE 15 4.767 8.712 -3.747 110 HE2 PHE 15 HE2 PHE 15 1.766 11.778 -3.859 111 HZ PHE 15 HZ PHE 15 3.386 10.314 -5.038 112 H HIS 16 H HIS 16 2.164 12.538 1.701 113 HA HIS 16 HA HIS 16 2.488 14.518 -0.306 114 HB2 HIS 16 HB3 HIS 16 1.154 14.618 2.394 115 HB3 HIS 16 HB2 HIS 16 1.254 16.039 1.365 116 HD1 HIS 16 HD1 HIS 16 0.695 15.056 -1.377 117 HD2 HIS 16 HD2 HIS 16 -1.318 13.572 1.948 118 HE1 HIS 16 HE1 HIS 16 -1.469 14.048 -2.243 119 HE2 HIS 16 HE2 HIS 16 -2.707 13.123 -0.253 120 H ALA 17 H ALA 17 3.930 14.092 2.830 121 HA ALA 17 HA ALA 17 5.064 16.589 3.235 122 HB1 ALA 17 HB1 ALA 17 5.275 14.181 4.511 123 HB2 ALA 17 HB2 ALA 17 6.272 15.582 4.867 124 HB3 ALA 17 HB3 ALA 17 6.884 14.325 3.807 125 H HIS 18 H HIS 18 6.375 13.830 1.461 126 HA HIS 18 HA HIS 18 8.591 15.295 0.430 127 HB2 HIS 18 HB3 HIS 18 7.419 12.651 -0.377 128 HB3 HIS 18 HB2 HIS 18 8.879 13.352 -1.097 129 HD1 HIS 18 HD1 HIS 18 10.934 13.891 0.655 130 HD2 HIS 18 HD2 HIS 18 7.864 11.410 2.098 131 HE1 HIS 18 HE1 HIS 18 11.794 12.784 2.763 132 HE2 HIS 18 HE2 HIS 18 9.970 11.292 3.647 133 H SER 19 H SER 19 5.368 14.499 -0.872 134 HA SER 19 HA SER 19 5.783 15.391 -3.489 135 HB2 SER 19 HB3 SER 19 3.265 15.825 -1.857 136 HB3 SER 19 HB2 SER 19 3.385 15.866 -3.606 137 HG SER 19 HG SER 19 4.389 13.623 -3.127 138 H GLY 20 H GLY 20 5.252 17.247 -0.579 139 HA2 GLY 20 HA3 GLY 20 4.884 19.795 -1.711 140 HA3 GLY 20 HA2 GLY 20 5.627 19.493 -0.140 141 H LYS 21 H LYS 21 7.708 17.779 -1.488 142 HA LYS 21 HA LYS 21 9.757 19.732 -1.740 143 HB2 LYS 21 HB3 LYS 21 9.723 16.866 -2.727 144 HB3 LYS 21 HB2 LYS 21 11.122 17.876 -2.466 145 HG2 LYS 21 HG3 LYS 21 9.176 17.189 -0.261 146 HG3 LYS 21 HG2 LYS 21 10.646 16.278 -0.548 147 HD2 LYS 21 HD3 LYS 21 11.928 18.436 -0.250 148 HD3 LYS 21 HD2 LYS 21 10.406 19.199 0.180 149 HE2 LYS 21 HE2 LYS 21 11.109 18.598 2.294 150 HE3 LYS 21 HE1 LYS 21 10.170 17.186 1.872 151 HZ1 LYS 21 HZ1 LYS 21 12.279 16.489 2.719 152 HZ2 LYS 21 HZ2 LYS 21 13.105 17.492 1.658 153 HZ3 LYS 21 HZ3 LYS 21 12.286 16.112 1.066 154 H GLU 22 H GLU 22 7.880 17.852 -4.032 155 HA GLU 22 HA GLU 22 9.167 19.246 -6.298 156 HB2 GLU 22 HB3 GLU 22 8.816 17.135 -7.551 157 HB3 GLU 22 HB2 GLU 22 9.592 16.861 -6.038 158 HG2 GLU 22 HG3 GLU 22 7.319 16.442 -4.963 159 HG3 GLU 22 HG2 GLU 22 6.683 16.327 -6.594 160 H GLY 23 H GLY 23 6.062 18.492 -4.892 161 HA2 GLY 23 HA3 GLY 23 4.108 19.687 -5.249 162 HA3 GLY 23 HA2 GLY 23 4.851 20.478 -6.628 163 H ASP 24 H ASP 24 3.872 20.039 -8.475 164 HA ASP 24 HA ASP 24 2.654 19.028 -10.113 165 HB2 ASP 24 HB3 ASP 24 4.326 17.186 -10.021 166 HB3 ASP 24 HB2 ASP 24 3.394 16.407 -8.756 167 H LYS 25 H LYS 25 2.128 17.014 -7.304 168 HA LYS 25 HA LYS 25 -0.104 18.175 -6.309 169 HB2 LYS 25 HB3 LYS 25 -1.753 16.180 -6.954 170 HB3 LYS 25 HB2 LYS 25 -1.725 17.677 -7.871 171 HG2 LYS 25 HG3 LYS 25 0.285 16.062 -9.089 172 HG3 LYS 25 HG2 LYS 25 -1.020 14.958 -8.728 173 HD2 LYS 25 HD3 LYS 25 -1.506 17.590 -10.102 174 HD3 LYS 25 HD2 LYS 25 -1.156 16.124 -10.989 175 HE2 LYS 25 HE2 LYS 25 -3.301 15.430 -10.794 176 HE3 LYS 25 HE1 LYS 25 -3.221 15.540 -9.045 177 HZ1 LYS 25 HZ1 LYS 25 -4.311 17.411 -9.035 178 HZ2 LYS 25 HZ2 LYS 25 -4.728 17.181 -10.653 179 HZ3 LYS 25 HZ3 LYS 25 -3.401 18.150 -10.237 180 H TYR 26 H TYR 26 -0.117 14.734 -6.908 181 HA TYR 26 HA TYR 26 1.057 14.263 -4.216 182 HB2 TYR 26 HB3 TYR 26 -0.414 11.989 -5.288 183 HB3 TYR 26 HB2 TYR 26 -0.573 12.778 -3.729 184 HD1 TYR 26 HD1 TYR 26 -1.697 15.284 -3.908 185 HD2 TYR 26 HD2 TYR 26 -2.316 12.012 -6.657 186 HE1 TYR 26 HE1 TYR 26 -3.797 16.293 -4.643 187 HE2 TYR 26 HE2 TYR 26 -4.423 13.042 -7.387 188 HH TYR 26 HH TYR 26 -5.177 16.126 -6.927 189 H LYS 27 H LYS 27 3.088 14.212 -4.865 190 HA LYS 27 HA LYS 27 3.817 11.935 -6.526 191 HB2 LYS 27 HB3 LYS 27 4.663 14.778 -7.064 192 HB3 LYS 27 HB2 LYS 27 5.527 13.365 -7.644 193 HG2 LYS 27 HG3 LYS 27 2.612 13.940 -8.217 194 HG3 LYS 27 HG2 LYS 27 3.983 14.190 -9.307 195 HD2 LYS 27 HD3 LYS 27 4.528 11.649 -8.704 196 HD3 LYS 27 HD2 LYS 27 2.851 11.591 -8.297 197 HE2 LYS 27 HE2 LYS 27 3.804 11.175 -10.809 198 HE3 LYS 27 HE1 LYS 27 2.146 11.592 -10.395 199 HZ1 LYS 27 HZ1 LYS 27 4.328 13.548 -11.080 200 HZ2 LYS 27 HZ2 LYS 27 2.730 13.996 -10.776 201 HZ3 LYS 27 HZ3 LYS 27 3.127 13.052 -12.137 202 H LEU 28 H LEU 28 5.887 11.274 -6.392 203 HA LEU 28 HA LEU 28 7.488 12.390 -4.266 204 HB2 LEU 28 HB3 LEU 28 6.361 10.638 -3.230 205 HB3 LEU 28 HB2 LEU 28 6.633 9.505 -4.556 206 HG LEU 28 HG LEU 28 9.141 9.841 -4.127 207 HD11 LEU 28 HD11 LEU 28 8.964 11.902 -2.831 208 HD12 LEU 28 HD12 LEU 28 9.746 10.647 -1.869 209 HD13 LEU 28 HD13 LEU 28 8.040 11.045 -1.603 210 HD21 LEU 28 HD21 LEU 28 8.057 7.803 -3.443 211 HD22 LEU 28 HD22 LEU 28 7.362 8.584 -2.027 212 HD23 LEU 28 HD23 LEU 28 9.117 8.325 -2.137 213 H SER 29 H SER 29 9.289 12.925 -5.315 214 HA SER 29 HA SER 29 9.942 11.653 -7.814 215 HB2 SER 29 HB3 SER 29 11.089 13.983 -6.313 216 HB3 SER 29 HB2 SER 29 11.875 13.282 -7.754 217 HG SER 29 HG SER 29 9.155 14.033 -7.616 218 H LYS 30 H LYS 30 12.046 10.865 -8.327 219 HA LYS 30 HA LYS 30 12.842 8.806 -6.507 220 HB2 LYS 30 HB3 LYS 30 14.372 9.824 -8.925 221 HB3 LYS 30 HB2 LYS 30 14.586 8.280 -8.123 222 HG2 LYS 30 HG3 LYS 30 12.023 9.190 -9.404 223 HG3 LYS 30 HG2 LYS 30 13.149 8.150 -10.228 224 HD2 LYS 30 HD3 LYS 30 12.221 7.265 -7.468 225 HD3 LYS 30 HD2 LYS 30 11.094 7.119 -8.794 226 HE2 LYS 30 HE2 LYS 30 13.516 5.583 -8.202 227 HE3 LYS 30 HE1 LYS 30 12.060 5.122 -9.087 228 HZ1 LYS 30 HZ1 LYS 30 12.982 6.421 -11.051 229 HZ2 LYS 30 HZ2 LYS 30 13.995 5.149 -10.584 230 HZ3 LYS 30 HZ3 LYS 30 14.391 6.691 -10.168 231 H LYS 31 H LYS 31 13.450 12.001 -6.460 232 HA LYS 31 HA LYS 31 16.151 11.920 -5.349 233 HB2 LYS 31 HB3 LYS 31 15.080 14.359 -4.573 234 HB3 LYS 31 HB2 LYS 31 16.035 14.078 -6.021 235 HG2 LYS 31 HG3 LYS 31 13.929 13.671 -7.337 236 HG3 LYS 31 HG2 LYS 31 13.020 13.948 -5.818 237 HD2 LYS 31 HD3 LYS 31 13.807 16.200 -5.768 238 HD3 LYS 31 HD2 LYS 31 14.818 15.948 -7.195 239 HE2 LYS 31 HE2 LYS 31 12.698 15.336 -8.470 240 HE3 LYS 31 HE1 LYS 31 11.798 15.803 -7.045 241 HZ1 LYS 31 HZ1 LYS 31 11.876 17.909 -7.741 242 HZ2 LYS 31 HZ2 LYS 31 12.881 17.497 -9.013 243 HZ3 LYS 31 HZ3 LYS 31 13.548 17.911 -7.528 244 H GLU 32 H GLU 32 12.941 12.790 -4.134 245 HA GLU 32 HA GLU 32 13.647 12.640 -1.380 246 HB2 GLU 32 HB3 GLU 32 10.986 12.718 -2.801 247 HB3 GLU 32 HB2 GLU 32 11.179 12.800 -1.050 248 HG2 GLU 32 HG3 GLU 32 12.436 14.751 -3.015 249 HG3 GLU 32 HG2 GLU 32 10.948 15.041 -2.141 250 H LEU 33 H LEU 33 12.119 10.425 -3.687 251 HA LEU 33 HA LEU 33 11.031 8.655 -1.892 252 HB2 LEU 33 HB3 LEU 33 10.508 8.496 -4.278 253 HB3 LEU 33 HB2 LEU 33 12.179 8.085 -4.608 254 HG LEU 33 HG LEU 33 10.427 6.177 -4.583 255 HD11 LEU 33 HD11 LEU 33 12.676 5.349 -2.855 256 HD12 LEU 33 HD12 LEU 33 13.121 6.165 -4.346 257 HD13 LEU 33 HD13 LEU 33 12.128 4.722 -4.396 258 HD21 LEU 33 HD21 LEU 33 10.555 6.835 -1.615 259 HD22 LEU 33 HD22 LEU 33 10.614 5.170 -2.098 260 HD23 LEU 33 HD23 LEU 33 9.257 6.151 -2.598 261 H LYS 34 H LYS 34 14.285 8.541 -3.320 262 HA LYS 34 HA LYS 34 15.002 6.117 -2.143 263 HB2 LYS 34 HB3 LYS 34 17.320 6.697 -2.604 264 HB3 LYS 34 HB2 LYS 34 16.336 7.189 -3.973 265 HG2 LYS 34 HG3 LYS 34 16.261 9.513 -3.074 266 HG3 LYS 34 HG2 LYS 34 17.308 9.016 -1.739 267 HD2 LYS 34 HD3 LYS 34 19.056 8.396 -3.354 268 HD3 LYS 34 HD2 LYS 34 18.025 8.939 -4.679 269 HE2 LYS 34 HE2 LYS 34 17.963 11.223 -3.734 270 HE3 LYS 34 HE1 LYS 34 18.951 10.710 -2.380 271 HZ1 LYS 34 HZ1 LYS 34 20.073 10.159 -5.025 272 HZ2 LYS 34 HZ2 LYS 34 20.797 10.654 -3.606 273 HZ3 LYS 34 HZ3 LYS 34 19.983 11.784 -4.556 274 H GLU 35 H GLU 35 15.400 9.437 -1.030 275 HA GLU 35 HA GLU 35 16.666 8.796 1.436 276 HB2 GLU 35 HB3 GLU 35 15.086 11.192 0.510 277 HB3 GLU 35 HB2 GLU 35 15.874 11.112 2.082 278 HG2 GLU 35 HG3 GLU 35 18.056 10.792 1.007 279 HG3 GLU 35 HG2 GLU 35 17.296 10.788 -0.583 280 H LEU 36 H LEU 36 13.338 9.423 0.451 281 HA LEU 36 HA LEU 36 12.138 9.250 2.965 282 HB2 LEU 36 HB3 LEU 36 10.746 10.135 1.364 283 HB3 LEU 36 HB2 LEU 36 11.263 9.004 0.135 284 HG LEU 36 HG LEU 36 9.998 7.212 1.153 285 HD11 LEU 36 HD11 LEU 36 9.910 9.018 3.440 286 HD12 LEU 36 HD12 LEU 36 9.453 7.317 3.321 287 HD13 LEU 36 HD13 LEU 36 8.271 8.561 2.949 288 HD21 LEU 36 HD21 LEU 36 8.384 7.890 -0.126 289 HD22 LEU 36 HD22 LEU 36 8.893 9.582 0.013 290 HD23 LEU 36 HD23 LEU 36 7.717 8.911 1.146 291 H LEU 37 H LEU 37 12.574 6.715 0.502 292 HA LEU 37 HA LEU 37 11.244 4.789 2.025 293 HB2 LEU 37 HB3 LEU 37 11.573 4.519 -0.388 294 HB3 LEU 37 HB2 LEU 37 13.305 4.343 -0.165 295 HG LEU 37 HG LEU 37 11.851 2.213 -0.472 296 HD11 LEU 37 HD11 LEU 37 14.298 2.417 0.400 297 HD12 LEU 37 HD12 LEU 37 13.439 0.918 0.725 298 HD13 LEU 37 HD13 LEU 37 13.614 2.102 1.990 299 HD21 LEU 37 HD21 LEU 37 10.261 3.064 1.442 300 HD22 LEU 37 HD22 LEU 37 11.475 2.343 2.511 301 HD23 LEU 37 HD23 LEU 37 10.663 1.360 1.312 302 H GLN 38 H GLN 38 14.708 5.427 1.729 303 HA GLN 38 HA GLN 38 15.461 3.367 3.526 304 HB2 GLN 38 HB3 GLN 38 17.653 4.440 3.615 305 HB3 GLN 38 HB2 GLN 38 17.085 4.389 1.949 306 HG2 GLN 38 HG3 GLN 38 16.172 6.760 2.368 307 HG3 GLN 38 HG2 GLN 38 17.160 6.768 3.824 308 HE21 GLN 38 HE21 GLN 38 17.434 6.130 0.314 309 HE22 GLN 38 HE22 GLN 38 19.017 6.727 0.157 310 H THR 39 H THR 39 14.779 6.782 3.928 311 HA THR 39 HA THR 39 15.530 7.024 6.605 312 HB THR 39 HB THR 39 13.511 8.532 4.951 313 HG1 THR 39 HG2 THR 39 15.335 8.885 4.076 314 HG21 THR 39 HG21 THR 39 14.175 8.754 7.766 315 HG22 THR 39 HG22 THR 39 12.922 9.534 6.785 316 HG23 THR 39 HG23 THR 39 14.533 10.247 6.870 317 H GLU 40 H GLU 40 12.282 6.438 5.187 318 HA GLU 40 HA GLU 40 11.131 6.277 7.787 319 HB2 GLU 40 HB3 GLU 40 9.948 5.576 5.101 320 HB3 GLU 40 HB2 GLU 40 9.052 5.649 6.619 321 HG2 GLU 40 HG3 GLU 40 10.583 7.953 5.375 322 HG3 GLU 40 HG2 GLU 40 8.834 7.774 5.398 323 H LEU 41 H LEU 41 12.042 3.796 5.435 324 HA LEU 41 HA LEU 41 11.108 1.727 7.306 325 HB2 LEU 41 HB3 LEU 41 11.977 1.679 4.428 326 HB3 LEU 41 HB2 LEU 41 11.893 0.216 5.360 327 HG LEU 41 HG LEU 41 9.529 0.735 6.017 328 HD11 LEU 41 HD11 LEU 41 9.985 3.060 4.147 329 HD12 LEU 41 HD12 LEU 41 9.320 3.058 5.783 330 HD13 LEU 41 HD13 LEU 41 8.372 2.417 4.457 331 HD21 LEU 41 HD21 LEU 41 10.367 -0.559 3.815 332 HD22 LEU 41 HD22 LEU 41 9.529 0.778 3.028 333 HD23 LEU 41 HD23 LEU 41 8.660 -0.272 4.144 334 H SER 42 H SER 42 13.257 3.234 8.155 335 HA SER 42 HA SER 42 15.790 2.339 7.570 336 HB2 SER 42 HB3 SER 42 16.366 3.052 9.901 337 HB3 SER 42 HB2 SER 42 15.497 4.250 8.954 338 HG SER 42 HG SER 42 13.631 3.777 10.106 339 H GLY 43 H GLY 43 13.495 1.002 9.930 340 HA2 GLY 43 HA3 GLY 43 15.252 -0.982 10.941 341 HA3 GLY 43 HA2 GLY 43 13.500 -0.989 11.119 342 H PHE 44 H PHE 44 12.792 -1.028 8.425 343 HA PHE 44 HA PHE 44 13.162 -3.836 7.864 344 HB2 PHE 44 HB3 PHE 44 11.776 -1.652 6.301 345 HB3 PHE 44 HB2 PHE 44 11.878 -3.315 5.737 346 HD1 PHE 44 HD2 PHE 44 11.418 -5.025 7.964 347 HD2 PHE 44 HD1 PHE 44 9.670 -1.169 7.194 348 HE1 PHE 44 HE2 PHE 44 9.471 -5.612 9.382 349 HE2 PHE 44 HE1 PHE 44 7.737 -1.774 8.612 350 HZ PHE 44 HZ PHE 44 7.649 -4.003 9.703 351 H LEU 45 H LEU 45 14.310 -0.801 6.620 352 HA LEU 45 HA LEU 45 15.607 -1.707 4.354 353 HB2 LEU 45 HB3 LEU 45 15.237 0.612 4.638 354 HB3 LEU 45 HB2 LEU 45 16.127 0.659 6.151 355 HG LEU 45 HG LEU 45 18.132 0.015 5.024 356 HD11 LEU 45 HD11 LEU 45 17.373 -1.253 3.103 357 HD12 LEU 45 HD12 LEU 45 18.125 0.189 2.427 358 HD13 LEU 45 HD13 LEU 45 16.370 0.088 2.535 359 HD21 LEU 45 HD21 LEU 45 18.651 2.158 4.489 360 HD22 LEU 45 HD22 LEU 45 17.003 2.509 4.985 361 HD23 LEU 45 HD23 LEU 45 17.394 2.267 3.267 362 H ASP 46 H ASP 46 16.789 -1.344 7.683 363 HA ASP 46 HA ASP 46 19.445 -1.889 7.202 364 HB2 ASP 46 HB3 ASP 46 18.444 -1.204 9.405 365 HB3 ASP 46 HB2 ASP 46 17.946 -2.873 9.615 366 H ALA 47 H ALA 47 16.817 -4.145 7.846 367 HA ALA 47 HA ALA 47 18.401 -6.525 7.595 368 HB1 ALA 47 HB1 ALA 47 16.317 -7.709 7.537 369 HB2 ALA 47 HB2 ALA 47 15.428 -6.232 7.182 370 HB3 ALA 47 HB3 ALA 47 16.189 -6.451 8.768 371 H GLN 48 H GLN 48 16.410 -4.602 5.426 372 HA GLN 48 HA GLN 48 16.516 -6.385 3.280 373 HB2 GLN 48 HB3 GLN 48 15.921 -3.426 3.299 374 HB3 GLN 48 HB2 GLN 48 15.853 -4.414 1.853 375 HG2 GLN 48 HG3 GLN 48 14.290 -5.052 4.378 376 HG3 GLN 48 HG2 GLN 48 13.614 -4.281 2.943 377 HE21 GLN 48 HE21 GLN 48 14.524 -7.309 4.354 378 HE22 GLN 48 HE22 GLN 48 14.210 -8.257 2.994 379 H LYS 49 H LYS 49 18.862 -4.333 4.423 380 HA LYS 49 HA LYS 49 20.349 -3.817 2.055 381 HB2 LYS 49 HB3 LYS 49 21.414 -4.297 4.852 382 HB3 LYS 49 HB2 LYS 49 22.393 -3.754 3.496 383 HG2 LYS 49 HG3 LYS 49 20.886 -1.777 3.218 384 HG3 LYS 49 HG2 LYS 49 20.006 -2.263 4.659 385 HD2 LYS 49 HD3 LYS 49 22.968 -1.598 4.570 386 HD3 LYS 49 HD2 LYS 49 21.682 -0.536 5.137 387 HE2 LYS 49 HE2 LYS 49 21.121 -2.655 6.698 388 HE3 LYS 49 HE1 LYS 49 22.820 -2.982 6.437 389 HZ1 LYS 49 HZ1 LYS 49 22.156 -0.233 7.122 390 HZ2 LYS 49 HZ2 LYS 49 23.442 -1.209 7.668 391 HZ3 LYS 49 HZ3 LYS 49 21.873 -1.396 8.314 392 H ASP 50 H ASP 50 20.100 -6.616 4.113 393 HA ASP 50 HA ASP 50 22.049 -8.067 2.484 394 HB2 ASP 50 HB3 ASP 50 22.074 -8.200 5.014 395 HB3 ASP 50 HB2 ASP 50 20.568 -9.103 4.901 396 H VAL 51 H VAL 51 19.061 -7.282 1.830 397 HA VAL 51 HA VAL 51 18.258 -10.007 1.030 398 HB VAL 51 HB VAL 51 16.555 -7.611 1.671 399 HG11 VAL 51 HG11 VAL 51 15.291 -8.531 0.015 400 HG12 VAL 51 HG12 VAL 51 14.714 -9.480 1.383 401 HG13 VAL 51 HG13 VAL 51 15.899 -10.169 0.284 402 HG21 VAL 51 HG21 VAL 51 15.660 -9.708 3.217 403 HG22 VAL 51 HG22 VAL 51 16.820 -8.515 3.776 404 HG23 VAL 51 HG23 VAL 51 17.382 -10.052 3.155 405 H ASP 52 H ASP 52 17.994 -10.390 -1.044 406 HA ASP 52 HA ASP 52 18.792 -8.558 -3.052 407 HB2 ASP 52 HB3 ASP 52 19.030 -10.961 -3.322 408 HB3 ASP 52 HB2 ASP 52 17.274 -11.137 -3.272 409 H ALA 53 H ALA 53 15.648 -9.635 -1.923 410 HA ALA 53 HA ALA 53 14.003 -8.870 -3.914 411 HB1 ALA 53 HB1 ALA 53 13.297 -8.410 -1.005 412 HB2 ALA 53 HB2 ALA 53 13.250 -9.979 -1.813 413 HB3 ALA 53 HB3 ALA 53 12.193 -8.683 -2.346 414 H VAL 54 H VAL 54 15.161 -6.651 -1.370 415 HA VAL 54 HA VAL 54 13.596 -4.483 -2.167 416 HB VAL 54 HB VAL 54 14.753 -4.495 -0.004 417 HG11 VAL 54 HG11 VAL 54 16.802 -5.582 -0.493 418 HG12 VAL 54 HG12 VAL 54 17.198 -3.958 0.045 419 HG13 VAL 54 HG13 VAL 54 17.284 -4.347 -1.663 420 HG21 VAL 54 HG21 VAL 54 15.936 -2.205 -1.593 421 HG22 VAL 54 HG22 VAL 54 15.338 -2.181 0.054 422 HG23 VAL 54 HG23 VAL 54 14.207 -2.293 -1.288 423 H ASP 55 H ASP 55 16.724 -5.550 -3.311 424 HA ASP 55 HA ASP 55 17.462 -3.365 -4.918 425 HB2 ASP 55 HB3 ASP 55 18.784 -5.454 -4.420 426 HB3 ASP 55 HB2 ASP 55 17.785 -6.281 -5.622 427 H LYS 56 H LYS 56 15.602 -6.227 -5.602 428 HA LYS 56 HA LYS 56 14.815 -5.546 -8.235 429 HB2 LYS 56 HB3 LYS 56 13.723 -7.534 -6.244 430 HB3 LYS 56 HB2 LYS 56 13.123 -7.370 -7.890 431 HG2 LYS 56 HG3 LYS 56 15.337 -7.782 -8.822 432 HG3 LYS 56 HG2 LYS 56 16.040 -7.866 -7.213 433 HD2 LYS 56 HD3 LYS 56 14.809 -9.776 -6.665 434 HD3 LYS 56 HD2 LYS 56 13.871 -9.784 -8.180 435 HE2 LYS 56 HE2 LYS 56 16.902 -10.011 -7.975 436 HE3 LYS 56 HE1 LYS 56 15.828 -11.398 -8.145 437 HZ1 LYS 56 HZ1 LYS 56 16.441 -9.279 -10.116 438 HZ2 LYS 56 HZ2 LYS 56 14.952 -10.071 -10.185 439 HZ3 LYS 56 HZ3 LYS 56 16.377 -10.946 -10.323 440 H VAL 57 H VAL 57 13.356 -5.015 -5.071 441 HA VAL 57 HA VAL 57 10.841 -4.141 -6.002 442 HB VAL 57 HB VAL 57 12.323 -3.379 -3.468 443 HG11 VAL 57 HG11 VAL 57 10.347 -1.918 -4.233 444 HG12 VAL 57 HG12 VAL 57 10.279 -2.577 -2.602 445 HG13 VAL 57 HG13 VAL 57 9.337 -3.319 -3.895 446 HG21 VAL 57 HG21 VAL 57 10.091 -5.222 -3.168 447 HG22 VAL 57 HG22 VAL 57 11.759 -5.437 -2.671 448 HG23 VAL 57 HG23 VAL 57 11.266 -5.879 -4.300 449 H MET 58 H MET 58 13.831 -2.409 -5.273 450 HA MET 58 HA MET 58 12.947 0.230 -5.807 451 HB2 MET 58 HB3 MET 58 15.690 -0.917 -6.429 452 HB3 MET 58 HB2 MET 58 15.273 0.765 -6.146 453 HG2 MET 58 HG3 MET 58 14.265 -0.436 -3.926 454 HG3 MET 58 HG2 MET 58 15.678 -1.409 -4.228 455 HE1 MET 58 HE1 MET 58 17.866 -0.956 -3.409 456 HE2 MET 58 HE2 MET 58 18.721 0.557 -3.657 457 HE3 MET 58 HE3 MET 58 18.024 -0.274 -5.036 458 H LYS 59 H LYS 59 14.151 -2.340 -7.764 459 HA LYS 59 HA LYS 59 14.419 -1.010 -10.207 460 HB2 LYS 59 HB3 LYS 59 15.505 -3.009 -9.661 461 HB3 LYS 59 HB2 LYS 59 14.036 -3.934 -9.533 462 HG2 LYS 59 HG3 LYS 59 14.896 -4.421 -11.686 463 HG3 LYS 59 HG2 LYS 59 13.517 -3.370 -11.938 464 HD2 LYS 59 HD3 LYS 59 16.127 -1.947 -11.613 465 HD3 LYS 59 HD2 LYS 59 16.031 -2.960 -13.039 466 HE2 LYS 59 HE2 LYS 59 14.463 -0.539 -12.328 467 HE3 LYS 59 HE1 LYS 59 15.161 -0.973 -13.882 468 HZ1 LYS 59 HZ1 LYS 59 12.576 -1.657 -12.726 469 HZ2 LYS 59 HZ2 LYS 59 13.348 -2.927 -13.588 470 HZ3 LYS 59 HZ3 LYS 59 12.966 -1.525 -14.367 471 H GLU 60 H GLU 60 11.726 -2.784 -8.734 472 HA GLU 60 HA GLU 60 10.033 -2.712 -11.004 473 HB2 GLU 60 HB3 GLU 60 9.394 -2.935 -8.059 474 HB3 GLU 60 HB2 GLU 60 8.209 -3.109 -9.345 475 HG2 GLU 60 HG3 GLU 60 10.707 -4.800 -9.063 476 HG3 GLU 60 HG2 GLU 60 9.084 -5.285 -8.605 477 H LEU 61 H LEU 61 10.388 -0.626 -8.198 478 HA LEU 61 HA LEU 61 8.389 1.290 -8.876 479 HB2 LEU 61 HB3 LEU 61 10.754 1.268 -7.039 480 HB3 LEU 61 HB2 LEU 61 9.941 2.783 -7.371 481 HG LEU 61 HG LEU 61 9.126 1.500 -5.346 482 HD11 LEU 61 HD11 LEU 61 6.619 1.695 -6.682 483 HD12 LEU 61 HD12 LEU 61 7.668 2.938 -7.355 484 HD13 LEU 61 HD13 LEU 61 7.382 2.867 -5.621 485 HD21 LEU 61 HD21 LEU 61 7.759 -0.245 -7.442 486 HD22 LEU 61 HD22 LEU 61 7.581 -0.355 -5.703 487 HD23 LEU 61 HD23 LEU 61 9.121 -0.772 -6.444 488 H ASP 62 H ASP 62 11.785 0.994 -9.564 489 HA ASP 62 HA ASP 62 12.278 3.541 -10.464 490 HB2 ASP 62 HB3 ASP 62 13.986 1.772 -10.006 491 HB3 ASP 62 HB2 ASP 62 13.620 1.101 -11.597 492 H GLU 63 H GLU 63 10.866 0.875 -12.291 493 HA GLU 63 HA GLU 63 11.205 1.786 -14.902 494 HB2 GLU 63 HB3 GLU 63 8.718 0.537 -13.723 495 HB3 GLU 63 HB2 GLU 63 9.046 0.703 -15.422 496 HG2 GLU 63 HG3 GLU 63 10.850 -0.829 -13.528 497 HG3 GLU 63 HG2 GLU 63 9.644 -1.549 -14.583 498 H ASN 64 H ASN 64 8.273 2.342 -12.966 499 HA ASN 64 HA ASN 64 7.402 4.459 -14.626 500 HB2 ASN 64 HB3 ASN 64 6.085 2.991 -12.812 501 HB3 ASN 64 HB2 ASN 64 6.552 4.392 -11.816 502 HD21 ASN 64 HD21 ASN 64 6.480 6.411 -13.638 503 HD22 ASN 64 HD22 ASN 64 4.886 6.687 -14.186 504 H GLY 65 H GLY 65 9.277 4.217 -11.692 505 HA2 GLY 65 HA3 GLY 65 9.296 6.917 -10.975 506 HA3 GLY 65 HA2 GLY 65 10.519 5.733 -10.532 507 H ASP 66 H ASP 66 9.498 7.171 -13.611 508 HA ASP 66 HA ASP 66 12.087 7.381 -14.771 509 HB2 ASP 66 HB3 ASP 66 10.075 7.551 -16.143 510 HB3 ASP 66 HB2 ASP 66 9.551 8.977 -15.258 511 H GLY 67 H GLY 67 10.081 9.449 -12.886 512 HA2 GLY 67 HA3 GLY 67 12.400 10.901 -11.886 513 HA3 GLY 67 HA2 GLY 67 11.214 11.898 -12.734 514 H GLU 68 H GLU 68 8.908 10.499 -12.010 515 HA GLU 68 HA GLU 68 8.770 11.078 -9.117 516 HB2 GLU 68 HB3 GLU 68 6.566 11.268 -11.175 517 HB3 GLU 68 HB2 GLU 68 6.515 11.717 -9.480 518 HG2 GLU 68 HG3 GLU 68 7.817 13.542 -9.698 519 HG3 GLU 68 HG2 GLU 68 8.674 13.019 -11.120 520 H VAL 69 H VAL 69 7.476 9.779 -7.880 521 HA VAL 69 HA VAL 69 6.427 7.327 -9.041 522 HB VAL 69 HB VAL 69 8.513 6.615 -8.109 523 HG11 VAL 69 HG11 VAL 69 8.996 7.086 -5.630 524 HG12 VAL 69 HG12 VAL 69 7.807 8.370 -5.770 525 HG13 VAL 69 HG13 VAL 69 9.259 8.397 -6.776 526 HG21 VAL 69 HG21 VAL 69 7.836 5.162 -6.265 527 HG22 VAL 69 HG22 VAL 69 6.638 5.192 -7.545 528 HG23 VAL 69 HG23 VAL 69 6.339 6.083 -6.042 529 H ASP 70 H ASP 70 4.375 6.973 -8.275 530 HA ASP 70 HA ASP 70 3.377 9.131 -6.620 531 HB2 ASP 70 HB3 ASP 70 1.318 8.893 -7.500 532 HB3 ASP 70 HB2 ASP 70 2.285 8.322 -8.840 533 H PHE 71 H PHE 71 1.229 8.334 -5.406 534 HA PHE 71 HA PHE 71 2.173 7.145 -3.046 535 HB2 PHE 71 HB3 PHE 71 0.240 8.696 -3.139 536 HB3 PHE 71 HB2 PHE 71 -0.721 7.427 -3.896 537 HD1 PHE 71 HD1 PHE 71 1.438 8.053 -0.910 538 HD2 PHE 71 HD2 PHE 71 -1.925 5.908 -2.516 539 HE1 PHE 71 HE1 PHE 71 0.963 7.123 1.330 540 HE2 PHE 71 HE2 PHE 71 -2.396 4.981 -0.251 541 HZ PHE 71 HZ PHE 71 -0.954 5.586 1.660 542 H GLN 72 H GLN 72 0.223 5.860 -5.707 543 HA GLN 72 HA GLN 72 -0.333 3.329 -4.599 544 HB2 GLN 72 HB3 GLN 72 -0.056 4.265 -7.463 545 HB3 GLN 72 HB2 GLN 72 -0.638 2.648 -7.031 546 HG2 GLN 72 HG3 GLN 72 -2.486 3.666 -5.765 547 HG3 GLN 72 HG2 GLN 72 -1.865 5.277 -6.149 548 HE21 GLN 72 HE21 GLN 72 -2.118 6.040 -8.377 549 HE22 GLN 72 HE22 GLN 72 -3.171 5.255 -9.447 550 H GLU 73 H GLU 73 2.363 4.546 -6.498 551 HA GLU 73 HA GLU 73 3.763 2.048 -6.564 552 HB2 GLU 73 HB3 GLU 73 4.563 4.891 -7.177 553 HB3 GLU 73 HB2 GLU 73 5.638 3.498 -7.370 554 HG2 GLU 73 HG3 GLU 73 4.128 2.426 -8.891 555 HG3 GLU 73 HG2 GLU 73 2.903 3.652 -8.601 556 H TYR 74 H TYR 74 3.889 4.933 -4.558 557 HA TYR 74 HA TYR 74 6.153 4.274 -3.033 558 HB2 TYR 74 HB3 TYR 74 5.308 6.513 -2.971 559 HB3 TYR 74 HB2 TYR 74 3.746 5.958 -2.385 560 HD1 TYR 74 HD1 TYR 74 7.367 5.415 -1.300 561 HD2 TYR 74 HD2 TYR 74 3.346 6.518 -0.156 562 HE1 TYR 74 HE1 TYR 74 8.097 5.707 1.010 563 HE2 TYR 74 HE2 TYR 74 4.112 6.809 2.176 564 HH TYR 74 HH TYR 74 7.443 6.829 3.045 565 H VAL 75 H VAL 75 2.732 3.510 -2.422 566 HA VAL 75 HA VAL 75 3.210 2.357 0.103 567 HB VAL 75 HB VAL 75 0.969 1.274 -0.178 568 HG11 VAL 75 HG11 VAL 75 -0.235 3.367 -0.040 569 HG12 VAL 75 HG12 VAL 75 1.042 4.223 -0.889 570 HG13 VAL 75 HG13 VAL 75 1.329 3.597 0.733 571 HG21 VAL 75 HG21 VAL 75 0.102 2.802 -2.443 572 HG22 VAL 75 HG22 VAL 75 0.115 1.041 -2.293 573 HG23 VAL 75 HG23 VAL 75 1.496 1.885 -2.948 574 H VAL 76 H VAL 76 3.093 0.888 -3.129 575 HA VAL 76 HA VAL 76 3.351 -1.753 -2.174 576 HB VAL 76 HB VAL 76 3.899 -2.344 -4.459 577 HG11 VAL 76 HG11 VAL 76 1.811 -1.472 -5.532 578 HG12 VAL 76 HG12 VAL 76 1.633 -0.346 -4.192 579 HG13 VAL 76 HG13 VAL 76 1.559 -2.083 -3.903 580 HG21 VAL 76 HG21 VAL 76 4.167 -0.714 -6.206 581 HG22 VAL 76 HG22 VAL 76 5.266 -0.253 -4.915 582 HG23 VAL 76 HG23 VAL 76 3.730 0.603 -5.122 583 H LEU 77 H LEU 77 5.618 0.755 -3.037 584 HA LEU 77 HA LEU 77 7.973 -0.772 -3.134 585 HB2 LEU 77 HB3 LEU 77 7.833 1.564 -3.875 586 HB3 LEU 77 HB2 LEU 77 7.519 2.079 -2.237 587 HG LEU 77 HG LEU 77 9.745 1.297 -1.502 588 HD11 LEU 77 HD11 LEU 77 11.224 0.836 -3.771 589 HD12 LEU 77 HD12 LEU 77 9.735 -0.020 -4.134 590 HD13 LEU 77 HD13 LEU 77 10.638 -0.387 -2.662 591 HD21 LEU 77 HD21 LEU 77 9.314 3.588 -2.681 592 HD22 LEU 77 HD22 LEU 77 10.220 2.878 -4.022 593 HD23 LEU 77 HD23 LEU 77 10.979 3.055 -2.446 594 H VAL 78 H VAL 78 6.455 0.976 -0.450 595 HA VAL 78 HA VAL 78 8.330 -0.067 1.440 596 HB VAL 78 HB VAL 78 7.015 1.049 3.146 597 HG11 VAL 78 HG11 VAL 78 8.277 2.286 1.003 598 HG12 VAL 78 HG12 VAL 78 7.730 3.118 2.460 599 HG13 VAL 78 HG13 VAL 78 6.712 3.084 1.034 600 HG21 VAL 78 HG21 VAL 78 4.895 2.168 2.587 601 HG22 VAL 78 HG22 VAL 78 4.739 0.452 2.268 602 HG23 VAL 78 HG23 VAL 78 4.992 1.584 0.935 603 H ALA 79 H ALA 79 5.041 -0.894 0.486 604 HA ALA 79 HA ALA 79 4.594 -2.854 2.467 605 HB1 ALA 79 HB1 ALA 79 3.487 -2.604 -0.316 606 HB2 ALA 79 HB2 ALA 79 2.716 -2.041 1.164 607 HB3 ALA 79 HB3 ALA 79 2.926 -3.773 0.864 608 H ALA 80 H ALA 80 5.999 -3.091 -0.788 609 HA ALA 80 HA ALA 80 6.239 -5.846 -0.894 610 HB1 ALA 80 HB1 ALA 80 6.777 -4.301 -2.782 611 HB2 ALA 80 HB2 ALA 80 8.027 -5.509 -2.499 612 HB3 ALA 80 HB3 ALA 80 8.255 -3.852 -1.933 613 H LEU 81 H LEU 81 8.458 -3.429 0.394 614 HA LEU 81 HA LEU 81 10.416 -5.243 1.376 615 HB2 LEU 81 HB3 LEU 81 9.687 -2.433 2.235 616 HB3 LEU 81 HB2 LEU 81 11.066 -3.324 2.870 617 HG LEU 81 HG LEU 81 10.648 -2.794 -0.094 618 HD11 LEU 81 HD11 LEU 81 12.012 -1.174 2.036 619 HD12 LEU 81 HD12 LEU 81 11.063 -0.659 0.638 620 HD13 LEU 81 HD13 LEU 81 12.700 -1.248 0.413 621 HD21 LEU 81 HD21 LEU 81 12.489 -4.066 -0.406 622 HD22 LEU 81 HD22 LEU 81 12.359 -4.615 1.260 623 HD23 LEU 81 HD23 LEU 81 13.361 -3.236 0.863 624 H THR 82 H THR 82 7.526 -3.796 2.747 625 HA THR 82 HA THR 82 7.858 -4.721 5.377 626 HB THR 82 HB THR 82 5.210 -4.327 3.969 627 HG1 THR 82 HG2 THR 82 6.714 -2.503 3.744 628 HG21 THR 82 HG21 THR 82 4.284 -4.070 6.082 629 HG22 THR 82 HG22 THR 82 5.832 -3.684 6.836 630 HG23 THR 82 HG23 THR 82 5.462 -5.342 6.376 631 H VAL 83 H VAL 83 6.017 -6.182 2.657 632 HA VAL 83 HA VAL 83 5.343 -8.478 4.171 633 HB VAL 83 HB VAL 83 4.094 -7.823 2.152 634 HG11 VAL 83 HG11 VAL 83 4.963 -8.328 -0.079 635 HG12 VAL 83 HG12 VAL 83 6.514 -8.793 0.607 636 HG13 VAL 83 HG13 VAL 83 5.951 -7.122 0.738 637 HG21 VAL 83 HG21 VAL 83 5.320 -10.598 1.974 638 HG22 VAL 83 HG22 VAL 83 3.842 -10.075 1.180 639 HG23 VAL 83 HG23 VAL 83 3.907 -10.144 2.940 640 H ALA 84 H ALA 84 8.018 -7.778 1.981 641 HA ALA 84 HA ALA 84 9.195 -10.321 1.991 642 HB1 ALA 84 HB1 ALA 84 11.327 -9.139 1.483 643 HB2 ALA 84 HB2 ALA 84 10.557 -7.612 1.875 644 HB3 ALA 84 HB3 ALA 84 9.991 -8.555 0.496 645 H MET 85 H MET 85 9.816 -7.531 4.139 646 HA MET 85 HA MET 85 11.508 -9.017 5.864 647 HB2 MET 85 HB3 MET 85 10.123 -6.384 6.151 648 HB3 MET 85 HB2 MET 85 10.982 -7.095 7.513 649 HG2 MET 85 HG3 MET 85 12.173 -6.545 4.773 650 HG3 MET 85 HG2 MET 85 12.509 -5.626 6.248 651 HE1 MET 85 HE1 MET 85 14.310 -8.053 8.548 652 HE2 MET 85 HE2 MET 85 12.565 -8.092 8.476 653 HE3 MET 85 HE3 MET 85 13.401 -6.550 8.354 654 H ASN 86 H ASN 86 8.037 -8.257 6.022 655 HA ASN 86 HA ASN 86 7.688 -9.408 8.586 656 HB2 ASN 86 HB3 ASN 86 5.998 -7.996 7.064 657 HB3 ASN 86 HB2 ASN 86 5.469 -9.601 6.580 658 HD21 ASN 86 HD21 ASN 86 5.832 -7.453 9.415 659 HD22 ASN 86 HD22 ASN 86 4.746 -8.297 10.386 660 H ASN 87 H ASN 87 7.525 -10.715 5.319 661 HA ASN 87 HA ASN 87 6.868 -13.377 6.027 662 HB2 ASN 87 HB3 ASN 87 6.684 -12.520 3.725 663 HB3 ASN 87 HB2 ASN 87 8.432 -12.330 3.653 664 HD21 ASN 87 HD21 ASN 87 8.215 -13.908 1.770 665 HD22 ASN 87 HD22 ASN 87 8.151 -15.562 2.123 666 H PHE 88 H PHE 88 9.879 -11.620 5.743 667 HA PHE 88 HA PHE 88 11.710 -13.757 6.296 668 HB2 PHE 88 HB3 PHE 88 12.499 -11.604 5.387 669 HB3 PHE 88 HB2 PHE 88 11.923 -10.785 6.827 670 HD1 PHE 88 HD1 PHE 88 14.038 -13.792 6.020 671 HD2 PHE 88 HD2 PHE 88 13.502 -10.249 8.378 672 HE1 PHE 88 HE1 PHE 88 16.198 -14.221 7.146 673 HE2 PHE 88 HE2 PHE 88 15.676 -10.686 9.517 674 HZ PHE 88 HZ PHE 88 17.017 -12.671 8.895 675 H PHE 89 H PHE 89 9.992 -11.492 8.373 676 HA PHE 89 HA PHE 89 11.117 -12.359 10.790 677 HB2 PHE 89 HB3 PHE 89 8.594 -10.965 10.053 678 HB3 PHE 89 HB2 PHE 89 8.704 -11.612 11.670 679 HD1 PHE 89 HD1 PHE 89 10.852 -11.032 13.038 680 HD2 PHE 89 HD2 PHE 89 9.632 -8.871 9.529 681 HE1 PHE 89 HE1 PHE 89 12.259 -9.122 13.725 682 HE2 PHE 89 HE2 PHE 89 11.049 -6.954 10.227 683 HZ PHE 89 HZ PHE 89 12.360 -7.081 12.322 684 H TRP 90 H TRP 90 8.266 -13.561 9.045 685 HA TRP 90 HA TRP 90 7.797 -15.537 11.130 686 HB2 TRP 90 HB3 TRP 90 6.369 -15.326 8.467 687 HB3 TRP 90 HB2 TRP 90 5.849 -16.221 9.891 688 HD1 TRP 90 HD TRP 90 5.747 -12.898 8.295 689 HE1 TRP 90 HE1 TRP 90 4.618 -11.212 9.760 690 HE3 TRP 90 HE3 TRP 90 5.513 -15.600 12.596 691 HZ2 TRP 90 HZ2 TRP 90 3.671 -10.991 12.505 692 HZ3 TRP 90 HZ3 TRP 90 4.480 -14.624 14.636 693 HH2 TRP 90 HH TRP 90 3.557 -12.318 14.582 694 H GLU 91 H GLU 91 7.696 -16.235 7.696 695 HA GLU 91 HA GLU 91 9.217 -18.700 8.325 696 HB2 GLU 91 HB3 GLU 91 7.184 -18.243 6.194 697 HB3 GLU 91 HB2 GLU 91 8.090 -19.726 6.410 698 HG2 GLU 91 HG3 GLU 91 7.234 -19.899 8.772 699 HG3 GLU 91 HG2 GLU 91 6.251 -18.474 8.476 700 H ASN 92 H ASN 92 9.418 -15.985 6.130 701 HA ASN 92 HA ASN 92 10.926 -17.403 4.182 702 HB2 ASN 92 HB3 ASN 92 9.963 -15.301 3.588 703 HB3 ASN 92 HB2 ASN 92 10.924 -14.413 4.756 704 HD21 ASN 92 HD21 ASN 92 12.753 -13.451 3.776 705 HD22 ASN 92 HD22 ASN 92 13.538 -14.079 2.419 706 H SER 93 H SER 93 12.551 -18.584 4.885 707 HA SER 93 HA SER 93 15.049 -17.516 5.577 708 HB2 SER 93 HB3 SER 93 13.162 -18.183 7.788 709 HB3 SER 93 HB2 SER 93 14.861 -18.585 8.005 710 HG SER 93 HG SER 93 13.869 -16.073 7.118 711 H1 GLY 1 H GLY 1 13.290 3.916 14.370 712 HA2 GLY 1 HA3 GLY 1 12.190 3.102 12.500 713 HA3 GLY 1 HA2 GLY 1 11.111 2.229 13.582 714 H SER 2 H SER 2 10.526 3.840 11.164 715 HA SER 2 HA SER 2 9.134 6.192 12.111 716 HB2 SER 2 HB3 SER 2 9.286 4.794 9.453 717 HB3 SER 2 HB2 SER 2 8.170 6.098 9.750 718 HG SER 2 HG SER 2 9.873 7.102 9.084 719 H GLU 3 H GLU 3 6.902 6.535 12.088 720 HA GLU 3 HA GLU 3 5.288 4.512 13.175 721 HB2 GLU 3 HB3 GLU 3 4.172 6.782 11.540 722 HB3 GLU 3 HB2 GLU 3 3.517 6.044 12.998 723 HG2 GLU 3 HG3 GLU 3 4.404 7.882 13.974 724 HG3 GLU 3 HG2 GLU 3 5.846 6.911 14.019 725 H LEU 4 H LEU 4 6.159 5.393 9.970 726 HA LEU 4 HA LEU 4 4.106 4.163 8.484 727 HB2 LEU 4 HB3 LEU 4 7.020 4.551 7.790 728 HB3 LEU 4 HB2 LEU 4 5.762 4.069 6.664 729 HG LEU 4 HG LEU 4 5.908 6.678 8.197 730 HD11 LEU 4 HD11 LEU 4 6.677 5.807 5.538 731 HD12 LEU 4 HD12 LEU 4 7.085 7.273 6.423 732 HD13 LEU 4 HD13 LEU 4 5.573 7.179 5.511 733 HD21 LEU 4 HD21 LEU 4 3.625 6.313 8.177 734 HD22 LEU 4 HD22 LEU 4 3.643 5.368 6.685 735 HD23 LEU 4 HD23 LEU 4 3.835 7.123 6.633 736 H GLU 5 H GLU 5 7.188 2.917 9.784 737 HA GLU 5 HA GLU 5 6.918 0.346 8.632 738 HB2 GLU 5 HB3 GLU 5 8.428 1.255 11.120 739 HB3 GLU 5 HB2 GLU 5 8.542 -0.356 10.432 740 HG2 GLU 5 HG3 GLU 5 9.311 0.604 8.276 741 HG3 GLU 5 HG2 GLU 5 9.233 2.211 8.968 742 H THR 6 H THR 6 5.843 1.782 11.668 743 HA THR 6 HA THR 6 4.631 -0.572 12.719 744 HB THR 6 HB THR 6 3.628 2.251 13.165 745 HG1 THR 6 HG2 THR 6 5.264 2.579 14.495 746 HG21 THR 6 HG21 THR 6 2.644 -0.072 14.089 747 HG22 THR 6 HG22 THR 6 2.640 1.396 15.048 748 HG23 THR 6 HG23 THR 6 3.896 0.188 15.296 749 H ALA 7 H ALA 7 3.463 2.141 10.748 750 HA ALA 7 HA ALA 7 0.802 1.361 10.512 751 HB1 ALA 7 HB1 ALA 7 1.792 3.565 9.789 752 HB2 ALA 7 HB2 ALA 7 0.676 2.844 8.626 753 HB3 ALA 7 HB3 ALA 7 2.402 2.753 8.345 754 H MET 8 H MET 8 3.590 0.601 8.455 755 HA MET 8 HA MET 8 2.131 -0.955 6.610 756 HB2 MET 8 HB3 MET 8 5.065 -1.080 7.312 757 HB3 MET 8 HB2 MET 8 4.343 -1.887 5.931 758 HG2 MET 8 HG3 MET 8 4.407 1.126 6.416 759 HG3 MET 8 HG2 MET 8 5.254 0.231 5.163 760 HE1 MET 8 HE1 MET 8 4.300 -1.271 3.702 761 HE2 MET 8 HE2 MET 8 2.948 -0.830 2.664 762 HE3 MET 8 HE3 MET 8 2.663 -1.885 4.046 763 H GLU 9 H GLU 9 3.843 -1.870 9.599 764 HA GLU 9 HA GLU 9 3.180 -4.593 9.231 765 HB2 GLU 9 HB3 GLU 9 4.044 -3.152 11.754 766 HB3 GLU 9 HB2 GLU 9 3.656 -4.867 11.715 767 HG2 GLU 9 HG3 GLU 9 5.338 -5.214 9.925 768 HG3 GLU 9 HG2 GLU 9 5.744 -3.501 10.020 769 H THR 10 H THR 10 1.556 -1.890 10.690 770 HA THR 10 HA THR 10 -0.552 -3.319 11.923 771 HB THR 10 HB THR 10 -0.866 -0.619 10.568 772 HG1 THR 10 HG2 THR 10 1.019 -0.669 11.943 773 HG21 THR 10 HG21 THR 10 -2.095 -1.254 13.196 774 HG22 THR 10 HG22 THR 10 -2.737 -2.138 11.818 775 HG23 THR 10 HG23 THR 10 -2.738 -0.386 11.811 776 H LEU 11 H LEU 11 -0.048 -2.189 8.614 777 HA LEU 11 HA LEU 11 -2.513 -3.113 7.616 778 HB2 LEU 11 HB3 LEU 11 0.176 -2.757 6.259 779 HB3 LEU 11 HB2 LEU 11 -1.298 -3.169 5.388 780 HG LEU 11 HG LEU 11 -0.972 -0.691 7.113 781 HD11 LEU 11 HD11 LEU 11 0.521 -0.563 5.184 782 HD12 LEU 11 HD12 LEU 11 -0.844 0.526 4.977 783 HD13 LEU 11 HD13 LEU 11 -0.806 -1.002 4.107 784 HD21 LEU 11 HD21 LEU 11 -3.237 -0.779 6.941 785 HD22 LEU 11 HD22 LEU 11 -3.201 -1.943 5.609 786 HD23 LEU 11 HD23 LEU 11 -2.972 -0.225 5.294 787 H ILE 12 H ILE 12 0.672 -4.586 7.986 788 HA ILE 12 HA ILE 12 0.094 -7.101 6.808 789 HB ILE 12 HB ILE 12 2.106 -6.327 8.952 790 HG12 ILE 12 HG13 ILE 12 2.358 -5.352 6.581 791 HG13 ILE 12 HG12 ILE 12 3.727 -6.281 7.185 792 HG21 ILE 12 HG21 ILE 12 3.031 -8.614 7.692 793 HG22 ILE 12 HG22 ILE 12 1.334 -8.948 7.953 794 HG23 ILE 12 HG23 ILE 12 2.375 -8.478 9.314 795 HD11 ILE 12 HD11 ILE 12 3.412 -7.986 5.690 796 HD12 ILE 12 HD12 ILE 12 2.667 -6.714 4.764 797 HD13 ILE 12 HD13 ILE 12 1.656 -7.834 5.664 798 H ASN 13 H ASN 13 -0.105 -5.867 10.088 799 HA ASN 13 HA ASN 13 -0.739 -8.218 11.457 800 HB2 ASN 13 HB3 ASN 13 -1.622 -5.375 12.000 801 HB3 ASN 13 HB2 ASN 13 -1.793 -6.708 13.121 802 HD21 ASN 13 HD21 ASN 13 -0.068 -4.243 13.274 803 HD22 ASN 13 HD22 ASN 13 1.501 -4.822 13.582 804 H VAL 14 H VAL 14 -2.814 -5.814 9.896 805 HA VAL 14 HA VAL 14 -5.284 -7.098 10.460 806 HB VAL 14 HB VAL 14 -4.466 -5.212 8.236 807 HG11 VAL 14 HG11 VAL 14 -7.194 -6.180 9.146 808 HG12 VAL 14 HG12 VAL 14 -6.465 -6.370 7.550 809 HG13 VAL 14 HG13 VAL 14 -6.949 -4.776 8.109 810 HG21 VAL 14 HG21 VAL 14 -4.572 -4.699 10.931 811 HG22 VAL 14 HG22 VAL 14 -6.222 -4.351 10.466 812 HG23 VAL 14 HG23 VAL 14 -4.889 -3.492 9.691 813 H PHE 15 H PHE 15 -3.000 -7.165 7.789 814 HA PHE 15 HA PHE 15 -4.403 -8.850 6.054 815 HB2 PHE 15 HB3 PHE 15 -2.345 -7.521 5.523 816 HB3 PHE 15 HB2 PHE 15 -1.405 -8.706 6.418 817 HD1 PHE 15 HD1 PHE 15 -3.587 -8.193 3.468 818 HD2 PHE 15 HD2 PHE 15 -0.897 -10.881 5.479 819 HE1 PHE 15 HE1 PHE 15 -3.491 -9.624 1.445 820 HE2 PHE 15 HE2 PHE 15 -0.811 -12.285 3.464 821 HZ PHE 15 HZ PHE 15 -2.117 -11.657 1.444 822 H HIS 16 H HIS 16 -1.989 -9.635 8.547 823 HA HIS 16 HA HIS 16 -2.033 -12.463 8.233 824 HB2 HIS 16 HB3 HIS 16 -1.491 -10.815 10.714 825 HB3 HIS 16 HB2 HIS 16 -1.392 -12.566 10.678 826 HD1 HIS 16 HD1 HIS 16 0.190 -13.391 8.391 827 HD2 HIS 16 HD2 HIS 16 0.962 -9.765 10.315 828 HE1 HIS 16 HE1 HIS 16 2.610 -12.729 7.826 829 HE2 HIS 16 HE2 HIS 16 3.066 -10.539 8.964 830 H ALA 17 H ALA 17 -3.958 -10.303 10.227 831 HA ALA 17 HA ALA 17 -5.346 -12.159 11.728 832 HB1 ALA 17 HB1 ALA 17 -7.041 -10.469 12.075 833 HB2 ALA 17 HB2 ALA 17 -6.546 -9.594 10.636 834 HB3 ALA 17 HB3 ALA 17 -5.471 -9.680 12.036 835 H HIS 18 H HIS 18 -6.187 -10.814 8.579 836 HA HIS 18 HA HIS 18 -8.449 -12.509 8.258 837 HB2 HIS 18 HB3 HIS 18 -6.909 -10.871 6.272 838 HB3 HIS 18 HB2 HIS 18 -8.367 -11.809 5.875 839 HD1 HIS 18 HD1 HIS 18 -10.604 -11.192 7.378 840 HD2 HIS 18 HD2 HIS 18 -7.457 -8.426 7.448 841 HE1 HIS 18 HE1 HIS 18 -11.533 -9.058 8.328 842 HE2 HIS 18 HE2 HIS 18 -9.649 -7.361 8.368 843 H SER 19 H SER 19 -5.058 -12.744 7.221 844 HA SER 19 HA SER 19 -5.292 -15.097 5.708 845 HB2 SER 19 HB3 SER 19 -3.027 -14.339 7.590 846 HB3 SER 19 HB2 SER 19 -2.965 -15.515 6.282 847 HG SER 19 HG SER 19 -3.752 -13.584 4.997 848 H GLY 20 H GLY 20 -5.305 -14.462 9.133 849 HA2 GLY 20 HA3 GLY 20 -5.135 -17.059 10.227 850 HA3 GLY 20 HA2 GLY 20 -5.947 -15.666 10.929 851 H LYS 21 H LYS 21 -7.760 -15.226 8.780 852 HA LYS 21 HA LYS 21 -9.960 -16.736 9.689 853 HB2 LYS 21 HB3 LYS 21 -9.634 -15.229 7.084 854 HB3 LYS 21 HB2 LYS 21 -11.141 -15.749 7.788 855 HG2 LYS 21 HG3 LYS 21 -9.237 -14.017 9.342 856 HG3 LYS 21 HG2 LYS 21 -10.434 -13.309 8.266 857 HD2 LYS 21 HD3 LYS 21 -12.198 -14.572 9.545 858 HD3 LYS 21 HD2 LYS 21 -10.937 -15.113 10.649 859 HE2 LYS 21 HE2 LYS 21 -11.531 -13.241 11.786 860 HE3 LYS 21 HE1 LYS 21 -10.356 -12.530 10.718 861 HZ1 LYS 21 HZ1 LYS 21 -12.302 -11.181 10.546 862 HZ2 LYS 21 HZ2 LYS 21 -13.297 -12.514 10.369 863 HZ3 LYS 21 HZ3 LYS 21 -12.263 -12.066 9.097 864 H GLU 22 H GLU 22 -7.991 -16.933 6.755 865 HA GLU 22 HA GLU 22 -9.485 -19.226 5.832 866 HB2 GLU 22 HB3 GLU 22 -8.187 -19.032 3.787 867 HB3 GLU 22 HB2 GLU 22 -8.840 -17.486 4.256 868 HG2 GLU 22 HG3 GLU 22 -6.718 -16.788 5.240 869 HG3 GLU 22 HG2 GLU 22 -5.997 -18.355 4.884 870 H GLY 23 H GLY 23 -6.220 -18.603 7.070 871 HA2 GLY 23 HA3 GLY 23 -5.633 -20.712 8.479 872 HA3 GLY 23 HA2 GLY 23 -5.706 -21.508 6.927 873 H ASP 24 H ASP 24 -4.544 -19.013 5.633 874 HA ASP 24 HA ASP 24 -1.829 -19.893 5.741 875 HB2 ASP 24 HB3 ASP 24 -3.066 -18.759 3.756 876 HB3 ASP 24 HB2 ASP 24 -2.656 -17.259 4.546 877 H LYS 25 H LYS 25 -0.003 -18.682 6.341 878 HA LYS 25 HA LYS 25 -0.292 -17.233 8.817 879 HB2 LYS 25 HB3 LYS 25 2.264 -16.666 8.185 880 HB3 LYS 25 HB2 LYS 25 1.778 -18.174 8.913 881 HG2 LYS 25 HG3 LYS 25 1.796 -17.964 5.893 882 HG3 LYS 25 HG2 LYS 25 3.296 -18.194 6.763 883 HD2 LYS 25 HD3 LYS 25 2.285 -20.187 7.927 884 HD3 LYS 25 HD2 LYS 25 0.879 -20.017 6.902 885 HE2 LYS 25 HE2 LYS 25 1.905 -20.915 5.093 886 HE3 LYS 25 HE1 LYS 25 3.378 -19.999 5.350 887 HZ1 LYS 25 HZ1 LYS 25 2.631 -22.469 6.880 888 HZ2 LYS 25 HZ2 LYS 25 4.007 -21.502 7.083 889 HZ3 LYS 25 HZ3 LYS 25 3.781 -22.336 5.640 890 H TYR 26 H TYR 26 0.330 -16.450 5.440 891 HA TYR 26 HA TYR 26 -0.815 -13.876 5.886 892 HB2 TYR 26 HB3 TYR 26 1.182 -12.808 4.551 893 HB3 TYR 26 HB2 TYR 26 1.215 -12.903 6.296 894 HD1 TYR 26 HD1 TYR 26 2.442 -14.756 7.392 895 HD2 TYR 26 HD2 TYR 26 2.698 -14.091 3.180 896 HE1 TYR 26 HE1 TYR 26 4.484 -16.197 7.293 897 HE2 TYR 26 HE2 TYR 26 4.708 -15.507 3.052 898 HH TYR 26 HH TYR 26 6.588 -16.173 4.835 899 H LYS 27 H LYS 27 -2.322 -14.493 4.497 900 HA LYS 27 HA LYS 27 -1.859 -13.773 1.821 901 HB2 LYS 27 HB3 LYS 27 -3.010 -16.571 2.233 902 HB3 LYS 27 HB2 LYS 27 -2.963 -15.631 0.734 903 HG2 LYS 27 HG3 LYS 27 -0.427 -16.349 2.213 904 HG3 LYS 27 HG2 LYS 27 -1.132 -17.402 1.020 905 HD2 LYS 27 HD3 LYS 27 -0.656 -14.487 0.283 906 HD3 LYS 27 HD2 LYS 27 0.659 -15.632 0.262 907 HE2 LYS 27 HE2 LYS 27 -1.844 -15.696 -1.407 908 HE3 LYS 27 HE1 LYS 27 -0.168 -15.721 -1.934 909 HZ1 LYS 27 HZ1 LYS 27 -0.777 -17.917 -2.129 910 HZ2 LYS 27 HZ2 LYS 27 -1.814 -17.880 -0.816 911 HZ3 LYS 27 HZ3 LYS 27 -0.113 -17.946 -0.578 912 H LEU 28 H LEU 28 -3.957 -13.239 0.832 913 HA LEU 28 HA LEU 28 -6.072 -13.281 2.855 914 HB2 LEU 28 HB3 LEU 28 -5.110 -11.130 2.831 915 HB3 LEU 28 HB2 LEU 28 -5.206 -10.988 1.085 916 HG LEU 28 HG LEU 28 -7.741 -11.236 1.317 917 HD11 LEU 28 HD11 LEU 28 -6.883 -11.118 4.187 918 HD12 LEU 28 HD12 LEU 28 -8.066 -12.191 3.433 919 HD13 LEU 28 HD13 LEU 28 -8.458 -10.488 3.710 920 HD21 LEU 28 HD21 LEU 28 -6.746 -9.040 0.959 921 HD22 LEU 28 HD22 LEU 28 -6.320 -8.931 2.668 922 HD23 LEU 28 HD23 LEU 28 -8.012 -8.893 2.183 923 H SER 29 H SER 29 -7.838 -14.241 2.216 924 HA SER 29 HA SER 29 -8.228 -14.818 -0.598 925 HB2 SER 29 HB3 SER 29 -10.194 -16.122 0.318 926 HB3 SER 29 HB2 SER 29 -8.572 -16.666 0.678 927 HG SER 29 HG SER 29 -8.741 -16.022 2.666 928 H LYS 30 H LYS 30 -10.504 -14.596 -1.400 929 HA LYS 30 HA LYS 30 -11.382 -11.856 -1.092 930 HB2 LYS 30 HB3 LYS 30 -12.887 -14.064 -2.507 931 HB3 LYS 30 HB2 LYS 30 -12.975 -12.340 -2.785 932 HG2 LYS 30 HG3 LYS 30 -10.555 -14.080 -3.342 933 HG3 LYS 30 HG2 LYS 30 -11.652 -13.488 -4.546 934 HD2 LYS 30 HD3 LYS 30 -10.535 -11.309 -2.812 935 HD3 LYS 30 HD2 LYS 30 -9.363 -12.168 -3.761 936 HE2 LYS 30 HE2 LYS 30 -11.640 -10.491 -4.706 937 HE3 LYS 30 HE1 LYS 30 -9.978 -10.535 -5.274 938 HZ1 LYS 30 HZ1 LYS 30 -12.261 -12.190 -6.056 939 HZ2 LYS 30 HZ2 LYS 30 -10.785 -13.018 -6.033 940 HZ3 LYS 30 HZ3 LYS 30 -10.999 -11.673 -6.984 941 H LYS 31 H LYS 31 -11.732 -14.600 0.689 942 HA LYS 31 HA LYS 31 -14.423 -14.709 1.529 943 HB2 LYS 31 HB3 LYS 31 -11.881 -15.179 3.116 944 HB3 LYS 31 HB2 LYS 31 -13.492 -15.750 3.531 945 HG2 LYS 31 HG3 LYS 31 -13.527 -17.114 1.408 946 HG3 LYS 31 HG2 LYS 31 -11.961 -16.468 1.054 947 HD2 LYS 31 HD3 LYS 31 -11.032 -17.419 3.109 948 HD3 LYS 31 HD2 LYS 31 -12.575 -18.199 3.459 949 HE2 LYS 31 HE2 LYS 31 -11.119 -18.516 0.872 950 HE3 LYS 31 HE1 LYS 31 -10.813 -19.607 2.220 951 HZ1 LYS 31 HZ1 LYS 31 -13.630 -19.419 1.842 952 HZ2 LYS 31 HZ2 LYS 31 -12.637 -20.761 1.626 953 HZ3 LYS 31 HZ3 LYS 31 -12.925 -19.735 0.349 954 H GLU 32 H GLU 32 -11.587 -12.982 2.600 955 HA GLU 32 HA GLU 32 -13.116 -11.432 4.582 956 HB2 GLU 32 HB3 GLU 32 -10.160 -11.944 4.265 957 HB3 GLU 32 HB2 GLU 32 -10.929 -11.004 5.545 958 HG2 GLU 32 HG3 GLU 32 -11.622 -13.912 4.996 959 HG3 GLU 32 HG2 GLU 32 -10.370 -13.451 6.110 960 H LEU 33 H LEU 33 -10.886 -11.119 1.829 961 HA LEU 33 HA LEU 33 -10.061 -8.563 2.245 962 HB2 LEU 33 HB3 LEU 33 -9.052 -9.954 0.517 963 HB3 LEU 33 HB2 LEU 33 -10.524 -9.914 -0.420 964 HG LEU 33 HG LEU 33 -8.636 -8.321 -1.167 965 HD11 LEU 33 HD11 LEU 33 -10.985 -6.599 -0.787 966 HD12 LEU 33 HD12 LEU 33 -11.330 -8.173 -1.501 967 HD13 LEU 33 HD13 LEU 33 -10.154 -7.104 -2.246 968 HD21 LEU 33 HD21 LEU 33 -8.810 -6.062 0.022 969 HD22 LEU 33 HD22 LEU 33 -7.898 -7.281 0.852 970 HD23 LEU 33 HD23 LEU 33 -9.527 -6.888 1.393 971 H LYS 34 H LYS 34 -12.887 -9.484 0.292 972 HA LYS 34 HA LYS 34 -13.563 -6.796 -0.316 973 HB2 LYS 34 HB3 LYS 34 -15.763 -7.648 -0.991 974 HB3 LYS 34 HB2 LYS 34 -14.457 -8.598 -1.681 975 HG2 LYS 34 HG3 LYS 34 -14.764 -10.304 0.127 976 HG3 LYS 34 HG2 LYS 34 -16.102 -9.348 0.762 977 HD2 LYS 34 HD3 LYS 34 -17.297 -9.550 -1.358 978 HD3 LYS 34 HD2 LYS 34 -16.008 -10.532 -2.035 979 HE2 LYS 34 HE2 LYS 34 -17.600 -11.249 0.450 980 HE3 LYS 34 HE1 LYS 34 -17.915 -11.851 -1.180 981 HZ1 LYS 34 HZ1 LYS 34 -15.149 -12.224 -0.172 982 HZ2 LYS 34 HZ2 LYS 34 -16.098 -13.145 -1.180 983 HZ3 LYS 34 HZ3 LYS 34 -16.374 -13.200 0.465 984 H GLU 35 H GLU 35 -14.454 -8.934 2.296 985 HA GLU 35 HA GLU 35 -16.400 -7.224 3.490 986 HB2 GLU 35 HB3 GLU 35 -14.664 -9.360 4.771 987 HB3 GLU 35 HB2 GLU 35 -16.171 -8.706 5.399 988 HG2 GLU 35 HG3 GLU 35 -15.915 -10.267 2.789 989 HG3 GLU 35 HG2 GLU 35 -16.498 -10.892 4.303 990 H LEU 36 H LEU 36 -12.976 -7.934 4.162 991 HA LEU 36 HA LEU 36 -12.638 -6.021 6.201 992 HB2 LEU 36 HB3 LEU 36 -10.791 -7.161 6.456 993 HB3 LEU 36 HB2 LEU 36 -10.998 -8.023 4.958 994 HG LEU 36 HG LEU 36 -9.927 -5.860 3.860 995 HD11 LEU 36 HD11 LEU 36 -8.781 -4.398 5.169 996 HD12 LEU 36 HD12 LEU 36 -8.532 -5.549 6.476 997 HD13 LEU 36 HD13 LEU 36 -10.098 -4.759 6.279 998 HD21 LEU 36 HD21 LEU 36 -8.886 -8.304 4.687 999 HD22 LEU 36 HD22 LEU 36 -7.797 -7.136 5.425 1000 HD23 LEU 36 HD23 LEU 36 -8.067 -7.106 3.689 1001 H LEU 37 H LEU 37 -11.938 -5.864 2.738 1002 HA LEU 37 HA LEU 37 -10.678 -3.389 2.847 1003 HB2 LEU 37 HB3 LEU 37 -10.457 -4.831 0.897 1004 HB3 LEU 37 HB2 LEU 37 -12.160 -4.665 0.518 1005 HG LEU 37 HG LEU 37 -10.478 -3.239 -0.819 1006 HD11 LEU 37 HD11 LEU 37 -12.161 -1.840 -1.345 1007 HD12 LEU 37 HD12 LEU 37 -12.441 -1.335 0.314 1008 HD13 LEU 37 HD13 LEU 37 -13.111 -2.854 -0.270 1009 HD21 LEU 37 HD21 LEU 37 -9.363 -2.504 1.449 1010 HD22 LEU 37 HD22 LEU 37 -10.647 -1.286 1.472 1011 HD23 LEU 37 HD23 LEU 37 -9.520 -1.356 0.130 1012 H GLN 38 H GLN 38 -14.082 -4.137 2.196 1013 HA GLN 38 HA GLN 38 -14.831 -1.398 1.942 1014 HB2 GLN 38 HB3 GLN 38 -17.127 -2.157 2.117 1015 HB3 GLN 38 HB2 GLN 38 -16.249 -3.292 1.094 1016 HG2 GLN 38 HG3 GLN 38 -15.913 -4.714 3.157 1017 HG3 GLN 38 HG2 GLN 38 -17.037 -3.649 4.003 1018 HE21 GLN 38 HE21 GLN 38 -16.747 -5.952 1.346 1019 HE22 GLN 38 HE22 GLN 38 -18.416 -6.264 1.204 1020 H THR 39 H THR 39 -14.726 -3.679 4.614 1021 HA THR 39 HA THR 39 -15.983 -2.068 6.541 1022 HB THR 39 HB THR 39 -13.956 -4.278 6.842 1023 HG1 THR 39 HG2 THR 39 -15.668 -5.130 5.936 1024 HG21 THR 39 HG21 THR 39 -14.920 -4.496 9.121 1025 HG22 THR 39 HG22 THR 39 -15.773 -2.962 8.873 1026 HG23 THR 39 HG23 THR 39 -14.004 -3.020 8.855 1027 H GLU 40 H GLU 40 -12.457 -2.650 6.054 1028 HA GLU 40 HA GLU 40 -11.822 -0.780 8.089 1029 HB2 GLU 40 HB3 GLU 40 -10.052 -2.073 6.010 1030 HB3 GLU 40 HB2 GLU 40 -9.486 -1.023 7.305 1031 HG2 GLU 40 HG3 GLU 40 -11.065 -3.567 7.750 1032 HG3 GLU 40 HG2 GLU 40 -9.314 -3.437 7.919 1033 H LEU 41 H LEU 41 -12.001 -0.501 4.625 1034 HA LEU 41 HA LEU 41 -11.161 2.300 4.819 1035 HB2 LEU 41 HB3 LEU 41 -11.404 0.325 2.607 1036 HB3 LEU 41 HB2 LEU 41 -11.582 1.995 2.175 1037 HG LEU 41 HG LEU 41 -9.378 2.462 3.437 1038 HD11 LEU 41 HD11 LEU 41 -7.934 0.370 3.643 1039 HD12 LEU 41 HD12 LEU 41 -9.436 -0.547 3.578 1040 HD13 LEU 41 HD13 LEU 41 -9.168 0.629 4.867 1041 HD21 LEU 41 HD21 LEU 41 -8.077 1.967 1.566 1042 HD22 LEU 41 HD22 LEU 41 -9.690 1.983 0.865 1043 HD23 LEU 41 HD23 LEU 41 -8.906 0.447 1.252 1044 H SER 42 H SER 42 -13.615 1.505 6.027 1045 HA SER 42 HA SER 42 -15.881 1.877 4.486 1046 HB2 SER 42 HB3 SER 42 -15.409 2.705 7.367 1047 HB3 SER 42 HB2 SER 42 -16.971 2.703 6.580 1048 HG SER 42 HG SER 42 -15.227 0.503 7.134 1049 H GLY 43 H GLY 43 -13.837 4.355 6.024 1050 HA2 GLY 43 HA3 GLY 43 -15.435 6.566 5.259 1051 HA3 GLY 43 HA2 GLY 43 -13.730 6.625 5.697 1052 H PHE 44 H PHE 44 -12.620 5.012 3.800 1053 HA PHE 44 HA PHE 44 -12.453 6.736 1.525 1054 HB2 PHE 44 HB3 PHE 44 -11.399 3.967 2.058 1055 HB3 PHE 44 HB2 PHE 44 -11.146 4.781 0.516 1056 HD1 PHE 44 HD2 PHE 44 -9.828 6.847 0.406 1057 HD2 PHE 44 HD1 PHE 44 -10.282 4.678 4.042 1058 HE1 PHE 44 HE2 PHE 44 -7.917 8.119 1.389 1059 HE2 PHE 44 HE1 PHE 44 -8.368 5.931 5.042 1060 HZ PHE 44 HZ PHE 44 -7.197 7.649 3.713 1061 H LEU 45 H LEU 45 -13.991 3.648 2.160 1062 HA LEU 45 HA LEU 45 -15.045 3.203 -0.419 1063 HB2 LEU 45 HB3 LEU 45 -15.147 1.308 0.874 1064 HB3 LEU 45 HB2 LEU 45 -15.564 2.171 2.340 1065 HG LEU 45 HG LEU 45 -17.811 2.540 1.544 1066 HD11 LEU 45 HD11 LEU 45 -17.981 0.791 -0.727 1067 HD12 LEU 45 HD12 LEU 45 -16.693 1.958 -1.047 1068 HD13 LEU 45 HD13 LEU 45 -18.309 2.510 -0.612 1069 HD21 LEU 45 HD21 LEU 45 -17.051 0.320 2.622 1070 HD22 LEU 45 HD22 LEU 45 -17.231 -0.369 1.003 1071 HD23 LEU 45 HD23 LEU 45 -18.621 0.337 1.819 1072 H ASP 46 H ASP 46 -16.403 4.805 2.427 1073 HA ASP 46 HA ASP 46 -18.848 5.503 1.168 1074 HB2 ASP 46 HB3 ASP 46 -18.609 5.503 3.514 1075 HB3 ASP 46 HB2 ASP 46 -17.384 6.781 3.474 1076 H ALA 47 H ALA 47 -15.735 7.094 1.455 1077 HA ALA 47 HA ALA 47 -16.486 9.544 0.237 1078 HB1 ALA 47 HB1 ALA 47 -14.408 9.114 1.652 1079 HB2 ALA 47 HB2 ALA 47 -14.189 10.068 0.191 1080 HB3 ALA 47 HB3 ALA 47 -13.711 8.372 0.212 1081 H GLN 48 H GLN 48 -15.260 6.499 -0.967 1082 HA GLN 48 HA GLN 48 -15.250 7.552 -3.721 1083 HB2 GLN 48 HB3 GLN 48 -13.822 5.167 -2.533 1084 HB3 GLN 48 HB2 GLN 48 -13.729 5.687 -4.214 1085 HG2 GLN 48 HG3 GLN 48 -12.955 7.427 -1.854 1086 HG3 GLN 48 HG2 GLN 48 -11.813 6.540 -2.853 1087 HE21 GLN 48 HE21 GLN 48 -13.918 9.375 -2.777 1088 HE22 GLN 48 HE22 GLN 48 -13.410 9.998 -4.265 1089 H LYS 49 H LYS 49 -17.455 6.192 -1.969 1090 HA LYS 49 HA LYS 49 -18.175 3.733 -3.101 1091 HB2 LYS 49 HB3 LYS 49 -19.203 4.725 -1.070 1092 HB3 LYS 49 HB2 LYS 49 -20.037 5.898 -2.088 1093 HG2 LYS 49 HG3 LYS 49 -20.475 3.245 -3.147 1094 HG3 LYS 49 HG2 LYS 49 -20.838 3.225 -1.437 1095 HD2 LYS 49 HD3 LYS 49 -21.959 5.627 -2.784 1096 HD3 LYS 49 HD2 LYS 49 -22.536 4.114 -3.431 1097 HE2 LYS 49 HE2 LYS 49 -24.043 4.491 -1.724 1098 HE3 LYS 49 HE1 LYS 49 -22.912 3.391 -0.959 1099 HZ1 LYS 49 HZ1 LYS 49 -21.855 5.233 0.160 1100 HZ2 LYS 49 HZ2 LYS 49 -23.502 5.393 0.382 1101 HZ3 LYS 49 HZ3 LYS 49 -22.715 6.364 -0.752 1102 H ASP 50 H ASP 50 -19.048 7.006 -3.974 1103 HA ASP 50 HA ASP 50 -20.514 6.150 -6.358 1104 HB2 ASP 50 HB3 ASP 50 -21.429 7.869 -4.767 1105 HB3 ASP 50 HB2 ASP 50 -20.110 8.926 -5.251 1106 H VAL 51 H VAL 51 -17.489 6.098 -5.972 1107 HA VAL 51 HA VAL 51 -16.736 7.886 -8.187 1108 HB VAL 51 HB VAL 51 -15.125 6.767 -5.897 1109 HG11 VAL 51 HG11 VAL 51 -13.430 6.762 -7.417 1110 HG12 VAL 51 HG12 VAL 51 -13.434 8.487 -7.088 1111 HG13 VAL 51 HG13 VAL 51 -14.246 7.882 -8.519 1112 HG21 VAL 51 HG21 VAL 51 -16.047 9.529 -6.730 1113 HG22 VAL 51 HG22 VAL 51 -14.753 9.304 -5.566 1114 HG23 VAL 51 HG23 VAL 51 -16.372 8.703 -5.214 1115 H ASP 52 H ASP 52 -15.956 7.042 -9.966 1116 HA ASP 52 HA ASP 52 -16.403 4.392 -10.662 1117 HB2 ASP 52 HB3 ASP 52 -16.234 6.252 -12.279 1118 HB3 ASP 52 HB2 ASP 52 -14.521 6.355 -11.936 1119 H ALA 53 H ALA 53 -13.479 5.923 -9.519 1120 HA ALA 53 HA ALA 53 -11.573 4.071 -10.201 1121 HB1 ALA 53 HB1 ALA 53 -11.276 5.211 -7.477 1122 HB2 ALA 53 HB2 ALA 53 -11.457 6.365 -8.797 1123 HB3 ALA 53 HB3 ALA 53 -10.153 5.184 -8.829 1124 H VAL 54 H VAL 54 -13.855 3.879 -7.490 1125 HA VAL 54 HA VAL 54 -12.533 1.851 -6.104 1126 HB VAL 54 HB VAL 54 -14.512 3.170 -5.237 1127 HG11 VAL 54 HG11 VAL 54 -16.312 1.152 -6.569 1128 HG12 VAL 54 HG12 VAL 54 -15.913 2.669 -7.370 1129 HG13 VAL 54 HG13 VAL 54 -16.701 2.685 -5.812 1130 HG21 VAL 54 HG21 VAL 54 -14.066 1.482 -3.729 1131 HG22 VAL 54 HG22 VAL 54 -14.157 0.211 -4.951 1132 HG23 VAL 54 HG23 VAL 54 -15.628 0.903 -4.287 1133 H ASP 55 H ASP 55 -14.810 1.687 -8.763 1134 HA ASP 55 HA ASP 55 -15.099 -1.127 -8.964 1135 HB2 ASP 55 HB3 ASP 55 -16.519 0.405 -10.171 1136 HB3 ASP 55 HB2 ASP 55 -15.107 1.014 -11.082 1137 H LYS 56 H LYS 56 -12.960 1.165 -10.528 1138 HA LYS 56 HA LYS 56 -11.488 -0.633 -12.107 1139 HB2 LYS 56 HB3 LYS 56 -10.766 2.058 -10.954 1140 HB3 LYS 56 HB2 LYS 56 -9.812 1.199 -12.155 1141 HG2 LYS 56 HG3 LYS 56 -11.688 1.185 -13.730 1142 HG3 LYS 56 HG2 LYS 56 -12.726 1.916 -12.510 1143 HD2 LYS 56 HD3 LYS 56 -11.784 3.933 -12.623 1144 HD3 LYS 56 HD2 LYS 56 -10.200 3.396 -13.203 1145 HE2 LYS 56 HE2 LYS 56 -12.729 3.183 -14.883 1146 HE3 LYS 56 HE1 LYS 56 -11.715 4.627 -14.886 1147 HZ1 LYS 56 HZ1 LYS 56 -11.271 2.817 -16.602 1148 HZ2 LYS 56 HZ2 LYS 56 -10.473 1.986 -15.345 1149 HZ3 LYS 56 HZ3 LYS 56 -9.986 3.537 -15.804 1150 H VAL 57 H VAL 57 -10.903 0.628 -8.861 1151 HA VAL 57 HA VAL 57 -8.336 -0.601 -8.562 1152 HB VAL 57 HB VAL 57 -10.304 0.555 -6.568 1153 HG11 VAL 57 HG11 VAL 57 -7.749 -0.908 -6.180 1154 HG12 VAL 57 HG12 VAL 57 -9.111 -0.664 -5.077 1155 HG13 VAL 57 HG13 VAL 57 -7.925 0.598 -5.281 1156 HG21 VAL 57 HG21 VAL 57 -8.469 2.344 -6.484 1157 HG22 VAL 57 HG22 VAL 57 -9.390 2.280 -7.981 1158 HG23 VAL 57 HG23 VAL 57 -7.787 1.577 -7.919 1159 H MET 58 H MET 58 -11.590 -1.318 -7.539 1160 HA MET 58 HA MET 58 -10.991 -3.739 -6.224 1161 HB2 MET 58 HB3 MET 58 -13.005 -2.436 -5.750 1162 HB3 MET 58 HB2 MET 58 -13.581 -2.722 -7.389 1163 HG2 MET 58 HG3 MET 58 -13.621 -4.993 -7.072 1164 HG3 MET 58 HG2 MET 58 -12.977 -4.953 -5.421 1165 HE1 MET 58 HE1 MET 58 -15.329 -3.747 -7.907 1166 HE2 MET 58 HE2 MET 58 -16.485 -2.746 -7.048 1167 HE3 MET 58 HE3 MET 58 -16.832 -4.446 -7.299 1168 H LYS 59 H LYS 59 -12.051 -2.970 -9.512 1169 HA LYS 59 HA LYS 59 -12.875 -5.407 -10.371 1170 HB2 LYS 59 HB3 LYS 59 -13.180 -3.400 -11.707 1171 HB3 LYS 59 HB2 LYS 59 -11.441 -3.281 -11.996 1172 HG2 LYS 59 HG3 LYS 59 -12.530 -4.197 -13.928 1173 HG3 LYS 59 HG2 LYS 59 -11.590 -5.479 -13.181 1174 HD2 LYS 59 HD3 LYS 59 -13.487 -6.579 -12.337 1175 HD3 LYS 59 HD2 LYS 59 -14.474 -5.127 -12.380 1176 HE2 LYS 59 HE2 LYS 59 -15.013 -6.844 -14.160 1177 HE3 LYS 59 HE1 LYS 59 -14.688 -5.205 -14.726 1178 HZ1 LYS 59 HZ1 LYS 59 -12.358 -6.990 -14.564 1179 HZ2 LYS 59 HZ2 LYS 59 -12.749 -5.835 -15.723 1180 HZ3 LYS 59 HZ3 LYS 59 -13.477 -7.346 -15.765 1181 H GLU 60 H GLU 60 -9.518 -4.192 -10.994 1182 HA GLU 60 HA GLU 60 -8.752 -6.720 -11.983 1183 HB2 GLU 60 HB3 GLU 60 -6.399 -5.846 -11.733 1184 HB3 GLU 60 HB2 GLU 60 -7.449 -4.929 -12.802 1185 HG2 GLU 60 HG3 GLU 60 -7.808 -3.235 -11.108 1186 HG3 GLU 60 HG2 GLU 60 -7.033 -4.246 -9.898 1187 H LEU 61 H LEU 61 -8.463 -5.243 -8.815 1188 HA LEU 61 HA LEU 61 -6.850 -7.284 -7.709 1189 HB2 LEU 61 HB3 LEU 61 -8.653 -5.204 -6.534 1190 HB3 LEU 61 HB2 LEU 61 -8.054 -6.484 -5.494 1191 HG LEU 61 HG LEU 61 -6.611 -4.423 -5.509 1192 HD11 LEU 61 HD11 LEU 61 -5.028 -6.709 -6.659 1193 HD12 LEU 61 HD12 LEU 61 -5.786 -6.843 -5.063 1194 HD13 LEU 61 HD13 LEU 61 -4.607 -5.581 -5.382 1195 HD21 LEU 61 HD21 LEU 61 -5.205 -3.971 -7.445 1196 HD22 LEU 61 HD22 LEU 61 -6.883 -3.877 -7.923 1197 HD23 LEU 61 HD23 LEU 61 -5.921 -5.301 -8.347 1198 H ASP 62 H ASP 62 -10.365 -6.906 -7.976 1199 HA ASP 62 HA ASP 62 -10.936 -9.250 -6.533 1200 HB2 ASP 62 HB3 ASP 62 -12.684 -7.612 -6.962 1201 HB3 ASP 62 HB2 ASP 62 -12.591 -7.937 -8.690 1202 H GLU 63 H GLU 63 -10.434 -8.664 -9.989 1203 HA GLU 63 HA GLU 63 -10.848 -11.371 -10.802 1204 HB2 GLU 63 HB3 GLU 63 -9.228 -9.156 -12.046 1205 HB3 GLU 63 HB2 GLU 63 -9.567 -10.704 -12.820 1206 HG2 GLU 63 HG3 GLU 63 -12.029 -10.248 -12.566 1207 HG3 GLU 63 HG2 GLU 63 -11.557 -8.711 -11.846 1208 H ASN 64 H ASN 64 -8.025 -9.494 -9.890 1209 HA ASN 64 HA ASN 64 -6.057 -11.458 -10.337 1210 HB2 ASN 64 HB3 ASN 64 -6.323 -9.144 -8.516 1211 HB3 ASN 64 HB2 ASN 64 -4.877 -10.209 -8.460 1212 HD21 ASN 64 HD21 ASN 64 -4.674 -7.400 -9.232 1213 HD22 ASN 64 HD22 ASN 64 -4.308 -7.331 -10.881 1214 H GLY 65 H GLY 65 -8.084 -10.682 -7.569 1215 HA2 GLY 65 HA3 GLY 65 -7.003 -12.719 -5.871 1216 HA3 GLY 65 HA2 GLY 65 -8.516 -11.861 -5.601 1217 H ASP 66 H ASP 66 -7.396 -13.850 -8.303 1218 HA ASP 66 HA ASP 66 -9.865 -15.112 -8.755 1219 HB2 ASP 66 HB3 ASP 66 -7.923 -14.917 -10.367 1220 HB3 ASP 66 HB2 ASP 66 -7.126 -16.185 -9.454 1221 H GLY 67 H GLY 67 -7.104 -15.833 -6.843 1222 HA2 GLY 67 HA3 GLY 67 -8.556 -18.089 -5.565 1223 HA3 GLY 67 HA2 GLY 67 -6.833 -18.187 -5.907 1224 H GLU 68 H GLU 68 -5.785 -15.884 -5.213 1225 HA GLU 68 HA GLU 68 -6.592 -15.262 -2.442 1226 HB2 GLU 68 HB3 GLU 68 -3.860 -16.135 -3.397 1227 HB3 GLU 68 HB2 GLU 68 -4.165 -15.365 -1.843 1228 HG2 GLU 68 HG3 GLU 68 -5.560 -17.075 -1.140 1229 HG3 GLU 68 HG2 GLU 68 -5.628 -17.884 -2.684 1230 H VAL 69 H VAL 69 -5.690 -13.279 -1.670 1231 HA VAL 69 HA VAL 69 -4.477 -11.644 -3.731 1232 HB VAL 69 HB VAL 69 -6.636 -10.678 -3.522 1233 HG11 VAL 69 HG11 VAL 69 -7.546 -11.686 -1.576 1234 HG12 VAL 69 HG12 VAL 69 -7.496 -9.956 -1.227 1235 HG13 VAL 69 HG13 VAL 69 -6.269 -11.017 -0.562 1236 HG21 VAL 69 HG21 VAL 69 -5.138 -8.967 -1.546 1237 HG22 VAL 69 HG22 VAL 69 -6.137 -8.481 -2.917 1238 HG23 VAL 69 HG23 VAL 69 -4.533 -9.161 -3.192 1239 H ASP 70 H ASP 70 -2.500 -10.972 -3.111 1240 HA ASP 70 HA ASP 70 -1.663 -11.709 -0.424 1241 HB2 ASP 70 HB3 ASP 70 -0.161 -12.633 -1.816 1242 HB3 ASP 70 HB2 ASP 70 -0.255 -11.379 -3.010 1243 H PHE 71 H PHE 71 0.228 -10.252 0.496 1244 HA PHE 71 HA PHE 71 -1.055 -7.987 1.459 1245 HB2 PHE 71 HB3 PHE 71 0.841 -9.108 2.636 1246 HB3 PHE 71 HB2 PHE 71 1.939 -8.421 1.441 1247 HD1 PHE 71 HD1 PHE 71 -0.701 -7.473 3.893 1248 HD2 PHE 71 HD2 PHE 71 2.820 -6.208 1.760 1249 HE1 PHE 71 HE1 PHE 71 -0.644 -5.383 5.201 1250 HE2 PHE 71 HE2 PHE 71 2.865 -4.124 3.107 1251 HZ PHE 71 HZ PHE 71 1.151 -3.708 4.802 1252 H GLN 72 H GLN 72 1.470 -8.255 -1.011 1253 HA GLN 72 HA GLN 72 1.778 -5.499 -1.531 1254 HB2 GLN 72 HB3 GLN 72 2.441 -8.024 -2.953 1255 HB3 GLN 72 HB2 GLN 72 2.422 -6.543 -3.937 1256 HG2 GLN 72 HG3 GLN 72 3.891 -6.830 -1.316 1257 HG3 GLN 72 HG2 GLN 72 4.649 -7.180 -2.868 1258 HE21 GLN 72 HE21 GLN 72 4.980 -5.336 -4.356 1259 HE22 GLN 72 HE22 GLN 72 4.908 -3.749 -3.753 1260 H GLU 73 H GLU 73 -0.428 -7.890 -2.767 1261 HA GLU 73 HA GLU 73 -1.747 -6.192 -4.662 1262 HB2 GLU 73 HB3 GLU 73 -2.518 -8.783 -3.301 1263 HB3 GLU 73 HB2 GLU 73 -3.449 -8.015 -4.595 1264 HG2 GLU 73 HG3 GLU 73 -1.639 -8.195 -6.152 1265 HG3 GLU 73 HG2 GLU 73 -0.510 -8.694 -4.908 1266 H TYR 74 H TYR 74 -2.303 -7.176 -1.329 1267 HA TYR 74 HA TYR 74 -4.782 -5.915 -0.887 1268 HB2 TYR 74 HB3 TYR 74 -4.017 -7.616 0.626 1269 HB3 TYR 74 HB2 TYR 74 -2.559 -6.701 0.967 1270 HD1 TYR 74 HD1 TYR 74 -6.273 -5.837 0.999 1271 HD2 TYR 74 HD2 TYR 74 -2.526 -5.897 3.143 1272 HE1 TYR 74 HE1 TYR 74 -7.355 -4.796 2.927 1273 HE2 TYR 74 HE2 TYR 74 -3.633 -4.852 5.083 1274 HH TYR 74 HH TYR 74 -6.906 -4.733 5.485 1275 H VAL 75 H VAL 75 -1.491 -4.711 -0.204 1276 HA VAL 75 HA VAL 75 -2.397 -2.301 0.913 1277 HB VAL 75 HB VAL 75 -0.064 -1.421 0.438 1278 HG11 VAL 75 HG11 VAL 75 -0.800 -2.628 2.545 1279 HG12 VAL 75 HG12 VAL 75 0.909 -2.793 2.162 1280 HG13 VAL 75 HG13 VAL 75 -0.192 -4.115 1.817 1281 HG21 VAL 75 HG21 VAL 75 1.039 -4.050 -0.050 1282 HG22 VAL 75 HG22 VAL 75 1.307 -2.571 -0.964 1283 HG23 VAL 75 HG23 VAL 75 -0.029 -3.624 -1.374 1284 H VAL 76 H VAL 76 -1.540 -3.023 -2.471 1285 HA VAL 76 HA VAL 76 -1.781 -0.344 -3.334 1286 HB VAL 76 HB VAL 76 -0.573 -2.031 -4.659 1287 HG11 VAL 76 HG11 VAL 76 -3.316 -3.272 -5.020 1288 HG12 VAL 76 HG12 VAL 76 -1.863 -4.010 -4.344 1289 HG13 VAL 76 HG13 VAL 76 -1.935 -3.621 -6.052 1290 HG21 VAL 76 HG21 VAL 76 -2.976 -0.965 -6.190 1291 HG22 VAL 76 HG22 VAL 76 -1.407 -1.380 -6.863 1292 HG23 VAL 76 HG23 VAL 76 -1.557 -0.001 -5.782 1293 H LEU 77 H LEU 77 -4.066 -2.960 -2.993 1294 HA LEU 77 HA LEU 77 -6.225 -1.852 -4.390 1295 HB2 LEU 77 HB3 LEU 77 -6.160 -4.198 -3.594 1296 HB3 LEU 77 HB2 LEU 77 -6.212 -3.629 -1.945 1297 HG LEU 77 HG LEU 77 -8.461 -2.633 -2.327 1298 HD11 LEU 77 HD11 LEU 77 -9.428 -2.428 -4.324 1299 HD12 LEU 77 HD12 LEU 77 -9.032 -4.057 -4.805 1300 HD13 LEU 77 HD13 LEU 77 -7.876 -2.777 -5.081 1301 HD21 LEU 77 HD21 LEU 77 -8.475 -5.503 -3.270 1302 HD22 LEU 77 HD22 LEU 77 -9.671 -4.680 -2.273 1303 HD23 LEU 77 HD23 LEU 77 -8.085 -5.064 -1.606 1304 H VAL 78 H VAL 78 -5.336 -1.648 -0.953 1305 HA VAL 78 HA VAL 78 -7.431 0.225 -0.382 1306 HB VAL 78 HB VAL 78 -6.404 0.486 1.820 1307 HG11 VAL 78 HG11 VAL 78 -7.194 -2.043 0.638 1308 HG12 VAL 78 HG12 VAL 78 -7.469 -1.445 2.280 1309 HG13 VAL 78 HG13 VAL 78 -5.997 -2.317 1.900 1310 HG21 VAL 78 HG21 VAL 78 -4.199 -1.313 0.774 1311 HG22 VAL 78 HG22 VAL 78 -4.326 -0.657 2.395 1312 HG23 VAL 78 HG23 VAL 78 -3.985 0.418 1.054 1313 H ALA 79 H ALA 79 -3.996 0.497 -1.100 1314 HA ALA 79 HA ALA 79 -3.750 3.254 -0.619 1315 HB1 ALA 79 HB1 ALA 79 -1.891 1.511 -1.113 1316 HB2 ALA 79 HB2 ALA 79 -1.711 3.174 -1.661 1317 HB3 ALA 79 HB3 ALA 79 -2.200 1.923 -2.807 1318 H ALA 80 H ALA 80 -4.554 1.544 -3.622 1319 HA ALA 80 HA ALA 80 -4.658 3.862 -5.182 1320 HB1 ALA 80 HB1 ALA 80 -5.932 1.141 -5.518 1321 HB2 ALA 80 HB2 ALA 80 -4.559 1.839 -6.362 1322 HB3 ALA 80 HB3 ALA 80 -6.169 2.450 -6.686 1323 H LEU 81 H LEU 81 -7.078 2.234 -3.221 1324 HA LEU 81 HA LEU 81 -9.251 4.004 -3.806 1325 HB2 LEU 81 HB3 LEU 81 -8.642 2.311 -1.370 1326 HB3 LEU 81 HB2 LEU 81 -10.135 3.213 -1.575 1327 HG LEU 81 HG LEU 81 -9.130 1.133 -3.535 1328 HD11 LEU 81 HD11 LEU 81 -9.687 0.038 -1.466 1329 HD12 LEU 81 HD12 LEU 81 -10.964 -0.277 -2.632 1330 HD13 LEU 81 HD13 LEU 81 -11.219 0.909 -1.349 1331 HD21 LEU 81 HD21 LEU 81 -11.725 1.300 -4.064 1332 HD22 LEU 81 HD22 LEU 81 -10.602 2.439 -4.789 1333 HD23 LEU 81 HD23 LEU 81 -11.557 2.915 -3.380 1334 H THR 82 H THR 82 -6.646 3.954 -1.429 1335 HA THR 82 HA THR 82 -7.435 6.195 0.059 1336 HB THR 82 HB THR 82 -4.572 5.331 -0.429 1337 HG1 THR 82 HG2 THR 82 -6.137 3.597 0.240 1338 HG21 THR 82 HG21 THR 82 -5.794 6.425 2.097 1339 HG22 THR 82 HG22 THR 82 -5.131 7.495 0.860 1340 HG23 THR 82 HG23 THR 82 -4.100 6.311 1.652 1341 H VAL 83 H VAL 83 -5.149 5.926 -2.673 1342 HA VAL 83 HA VAL 83 -4.638 8.707 -2.824 1343 HB VAL 83 HB VAL 83 -3.322 6.696 -3.901 1344 HG11 VAL 83 HG11 VAL 83 -5.135 7.424 -6.211 1345 HG12 VAL 83 HG12 VAL 83 -5.146 5.903 -5.309 1346 HG13 VAL 83 HG13 VAL 83 -3.733 6.359 -6.243 1347 HG21 VAL 83 HG21 VAL 83 -2.607 9.086 -4.044 1348 HG22 VAL 83 HG22 VAL 83 -3.673 9.288 -5.441 1349 HG23 VAL 83 HG23 VAL 83 -2.299 8.200 -5.539 1350 H ALA 84 H ALA 84 -7.000 6.630 -4.410 1351 HA ALA 84 HA ALA 84 -8.106 8.501 -6.179 1352 HB1 ALA 84 HB1 ALA 84 -8.691 6.081 -6.172 1353 HB2 ALA 84 HB2 ALA 84 -10.114 7.119 -6.151 1354 HB3 ALA 84 HB3 ALA 84 -9.584 6.327 -4.671 1355 H MET 85 H MET 85 -9.054 7.732 -2.821 1356 HA MET 85 HA MET 85 -10.991 9.826 -2.686 1357 HB2 MET 85 HB3 MET 85 -10.921 7.885 -1.057 1358 HB3 MET 85 HB2 MET 85 -9.484 8.647 -0.358 1359 HG2 MET 85 HG3 MET 85 -10.779 10.709 0.109 1360 HG3 MET 85 HG2 MET 85 -12.212 9.950 -0.562 1361 HE1 MET 85 HE1 MET 85 -10.001 9.124 3.311 1362 HE2 MET 85 HE2 MET 85 -10.596 10.719 2.900 1363 HE3 MET 85 HE3 MET 85 -9.428 9.935 1.842 1364 H ASN 86 H ASN 86 -7.572 9.560 -1.857 1365 HA ASN 86 HA ASN 86 -7.377 12.030 -0.589 1366 HB2 ASN 86 HB3 ASN 86 -5.616 10.068 -0.801 1367 HB3 ASN 86 HB2 ASN 86 -5.072 11.054 -2.165 1368 HD21 ASN 86 HD21 ASN 86 -6.045 11.536 1.267 1369 HD22 ASN 86 HD22 ASN 86 -4.860 12.692 1.594 1370 H ASN 87 H ASN 87 -7.067 11.124 -3.982 1371 HA ASN 87 HA ASN 87 -6.367 13.659 -5.068 1372 HB2 ASN 87 HB3 ASN 87 -6.228 11.701 -6.464 1373 HB3 ASN 87 HB2 ASN 87 -7.914 11.305 -6.191 1374 HD21 ASN 87 HD21 ASN 87 -6.365 14.460 -7.134 1375 HD22 ASN 87 HD22 ASN 87 -7.293 14.622 -8.533 1376 H PHE 88 H PHE 88 -9.421 12.124 -4.311 1377 HA PHE 88 HA PHE 88 -11.183 14.254 -5.049 1378 HB2 PHE 88 HB3 PHE 88 -12.332 12.290 -4.725 1379 HB3 PHE 88 HB2 PHE 88 -11.423 11.814 -3.297 1380 HD1 PHE 88 HD1 PHE 88 -13.806 14.381 -4.560 1381 HD2 PHE 88 HD2 PHE 88 -12.274 12.301 -1.144 1382 HE1 PHE 88 HE1 PHE 88 -15.546 15.444 -3.133 1383 HE2 PHE 88 HE2 PHE 88 -13.993 13.344 0.278 1384 HZ PHE 88 HZ PHE 88 -15.642 14.933 -0.722 1385 H PHE 89 H PHE 89 -9.572 13.394 -2.062 1386 HA PHE 89 HA PHE 89 -10.750 14.994 -0.251 1387 HB2 PHE 89 HB3 PHE 89 -8.731 13.334 -0.183 1388 HB3 PHE 89 HB2 PHE 89 -7.762 14.792 -0.215 1389 HD1 PHE 89 HD1 PHE 89 -8.266 16.603 1.579 1390 HD2 PHE 89 HD2 PHE 89 -9.755 12.596 1.692 1391 HE1 PHE 89 HE1 PHE 89 -8.719 16.857 3.994 1392 HE2 PHE 89 HE2 PHE 89 -10.224 12.817 4.098 1393 HZ PHE 89 HZ PHE 89 -9.704 14.965 5.278 1394 H TRP 90 H TRP 90 -7.945 15.861 -2.243 1395 HA TRP 90 HA TRP 90 -7.903 18.522 -1.109 1396 HB2 TRP 90 HB3 TRP 90 -6.051 17.490 -3.250 1397 HB3 TRP 90 HB2 TRP 90 -5.779 18.779 -2.080 1398 HD1 TRP 90 HD TRP 90 -5.221 15.195 -2.589 1399 HE1 TRP 90 HE1 TRP 90 -4.478 14.060 -0.467 1400 HE3 TRP 90 HE3 TRP 90 -6.298 18.895 0.748 1401 HZ2 TRP 90 HZ2 TRP 90 -4.341 14.640 2.392 1402 HZ3 TRP 90 HZ3 TRP 90 -5.863 18.571 3.167 1403 HH2 TRP 90 HH TRP 90 -4.886 16.441 3.984 1404 H GLU 91 H GLU 91 -7.520 17.565 -4.472 1405 HA GLU 91 HA GLU 91 -8.804 20.116 -5.234 1406 HB2 GLU 91 HB3 GLU 91 -7.644 19.267 -7.521 1407 HB3 GLU 91 HB2 GLU 91 -6.872 20.325 -6.350 1408 HG2 GLU 91 HG3 GLU 91 -5.753 18.441 -5.271 1409 HG3 GLU 91 HG2 GLU 91 -6.668 17.293 -6.267 1410 H ASN 92 H ASN 92 -8.897 16.688 -6.085 1411 HA ASN 92 HA ASN 92 -10.519 17.034 -8.344 1412 HB2 ASN 92 HB3 ASN 92 -9.183 15.052 -7.996 1413 HB3 ASN 92 HB2 ASN 92 -10.200 14.550 -6.650 1414 HD21 ASN 92 HD21 ASN 92 -9.956 12.816 -8.762 1415 HD22 ASN 92 HD22 ASN 92 -11.384 12.766 -9.684 1416 H SER 93 H SER 93 -12.452 17.850 -8.406 1417 HA SER 93 HA SER 93 -14.716 16.689 -7.340 1418 HB2 SER 93 HB3 SER 93 -13.424 18.699 -5.591 1419 HB3 SER 93 HB2 SER 93 -15.174 18.792 -5.744 1420 HG SER 93 HG SER 93 -13.516 16.638 -4.974 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -11.084 6.292 9.219 2 HA2 GLY 1 HA3 GLY 1 -9.197 7.915 10.115 3 HA3 GLY 1 HA2 GLY 1 -10.393 8.189 11.367 4 H SER 2 H SER 2 -10.172 5.079 9.871 5 HA SER 2 HA SER 2 -9.676 3.756 12.356 6 HB2 SER 2 HB3 SER 2 -9.467 2.569 9.580 7 HB3 SER 2 HB2 SER 2 -9.876 1.747 11.083 8 HG SER 2 HG SER 2 -11.318 3.628 9.551 9 H GLU 3 H GLU 3 -7.786 2.170 12.617 10 HA GLU 3 HA GLU 3 -5.371 3.533 12.518 11 HB2 GLU 3 HB3 GLU 3 -5.888 0.549 12.678 12 HB3 GLU 3 HB2 GLU 3 -4.320 1.325 12.903 13 HG2 GLU 3 HG3 GLU 3 -5.064 1.122 15.075 14 HG3 GLU 3 HG2 GLU 3 -5.515 2.768 14.701 15 H LEU 4 H LEU 4 -6.700 1.100 10.339 16 HA LEU 4 HA LEU 4 -4.445 0.963 8.597 17 HB2 LEU 4 HB3 LEU 4 -7.384 0.387 8.000 18 HB3 LEU 4 HB2 LEU 4 -6.064 0.044 6.921 19 HG LEU 4 HG LEU 4 -6.348 -2.006 7.963 20 HD11 LEU 4 HD11 LEU 4 -4.398 -2.437 9.167 21 HD12 LEU 4 HD12 LEU 4 -4.413 -0.895 9.982 22 HD13 LEU 4 HD13 LEU 4 -3.956 -0.997 8.276 23 HD21 LEU 4 HD21 LEU 4 -7.445 -2.301 9.904 24 HD22 LEU 4 HD22 LEU 4 -7.755 -0.592 9.904 25 HD23 LEU 4 HD23 LEU 4 -6.382 -1.244 10.807 26 H GLU 5 H GLU 5 -7.344 2.901 8.594 27 HA GLU 5 HA GLU 5 -6.830 4.302 6.179 28 HB2 GLU 5 HB3 GLU 5 -8.381 5.091 8.668 29 HB3 GLU 5 HB2 GLU 5 -8.425 5.951 7.131 30 HG2 GLU 5 HG3 GLU 5 -9.227 3.896 5.986 31 HG3 GLU 5 HG2 GLU 5 -9.167 3.034 7.487 32 H THR 6 H THR 6 -6.151 4.955 9.576 33 HA THR 6 HA THR 6 -4.764 7.377 9.214 34 HB THR 6 HB THR 6 -4.260 5.349 11.412 35 HG1 THR 6 HG2 THR 6 -6.496 5.678 11.197 36 HG21 THR 6 HG21 THR 6 -4.142 8.390 11.307 37 HG22 THR 6 HG22 THR 6 -2.764 7.290 11.413 38 HG23 THR 6 HG23 THR 6 -3.894 7.408 12.745 39 H ALA 7 H ALA 7 -3.722 3.978 9.349 40 HA ALA 7 HA ALA 7 -0.976 4.373 9.053 41 HB1 ALA 7 HB1 ALA 7 -1.071 2.072 7.899 42 HB2 ALA 7 HB2 ALA 7 -2.804 2.159 8.143 43 HB3 ALA 7 HB3 ALA 7 -1.726 2.173 9.537 44 H MET 8 H MET 8 -3.503 3.976 6.564 45 HA MET 8 HA MET 8 -1.739 4.368 4.374 46 HB2 MET 8 HB3 MET 8 -4.720 4.859 4.534 47 HB3 MET 8 HB2 MET 8 -3.796 4.826 3.046 48 HG2 MET 8 HG3 MET 8 -4.185 2.502 4.973 49 HG3 MET 8 HG2 MET 8 -4.798 2.642 3.336 50 HE1 MET 8 HE1 MET 8 -3.540 3.170 1.468 51 HE2 MET 8 HE2 MET 8 -2.248 2.033 1.006 52 HE3 MET 8 HE3 MET 8 -1.820 3.628 1.596 53 H GLU 9 H GLU 9 -3.747 6.593 6.264 54 HA GLU 9 HA GLU 9 -3.184 8.922 4.783 55 HB2 GLU 9 HB3 GLU 9 -3.836 8.540 7.714 56 HB3 GLU 9 HB2 GLU 9 -3.678 10.118 6.940 57 HG2 GLU 9 HG3 GLU 9 -5.478 9.614 5.394 58 HG3 GLU 9 HG2 GLU 9 -5.629 7.980 5.992 59 H THR 10 H THR 10 -1.545 7.280 7.413 60 HA THR 10 HA THR 10 0.463 9.207 7.927 61 HB THR 10 HB THR 10 0.880 6.204 8.082 62 HG1 THR 10 HG2 THR 10 -1.134 6.854 9.071 63 HG21 THR 10 HG21 THR 10 1.812 8.230 10.088 64 HG22 THR 10 HG22 THR 10 2.689 8.061 8.572 65 HG23 THR 10 HG23 THR 10 2.507 6.678 9.655 66 H LEU 11 H LEU 11 0.241 6.488 5.681 67 HA LEU 11 HA LEU 11 2.761 6.939 4.461 68 HB2 LEU 11 HB3 LEU 11 0.257 5.589 3.443 69 HB3 LEU 11 HB2 LEU 11 1.755 5.600 2.529 70 HG LEU 11 HG LEU 11 1.501 4.479 5.344 71 HD11 LEU 11 HD11 LEU 11 0.220 3.291 3.413 72 HD12 LEU 11 HD12 LEU 11 1.293 2.349 4.431 73 HD13 LEU 11 HD13 LEU 11 1.828 2.846 2.835 74 HD21 LEU 11 HD21 LEU 11 3.847 5.251 4.582 75 HD22 LEU 11 HD22 LEU 11 3.692 4.098 3.263 76 HD23 LEU 11 HD23 LEU 11 3.680 3.540 4.915 77 H ILE 12 H ILE 12 -0.503 8.143 3.823 78 HA ILE 12 HA ILE 12 0.157 9.595 1.468 79 HB ILE 12 HB ILE 12 -1.952 10.164 3.568 80 HG12 ILE 12 HG13 ILE 12 -2.200 8.017 2.233 81 HG13 ILE 12 HG12 ILE 12 -3.517 9.162 2.003 82 HG21 ILE 12 HG21 ILE 12 -1.349 11.513 0.931 83 HG22 ILE 12 HG22 ILE 12 -1.663 12.253 2.494 84 HG23 ILE 12 HG23 ILE 12 -2.973 11.506 1.600 85 HD11 ILE 12 HD11 ILE 12 -1.153 8.961 0.085 86 HD12 ILE 12 HD12 ILE 12 -2.633 9.893 -0.097 87 HD13 ILE 12 HD13 ILE 12 -2.701 8.146 -0.110 88 H ASN 13 H ASN 13 0.166 10.473 4.879 89 HA ASN 13 HA ASN 13 0.862 13.161 4.522 90 HB2 ASN 13 HB3 ASN 13 1.304 11.251 6.812 91 HB3 ASN 13 HB2 ASN 13 1.954 12.876 6.854 92 HD21 ASN 13 HD21 ASN 13 -0.985 11.019 7.047 93 HD22 ASN 13 HD22 ASN 13 -2.016 12.336 7.369 94 H VAL 14 H VAL 14 2.888 10.302 4.887 95 HA VAL 14 HA VAL 14 5.340 11.741 4.709 96 HB VAL 14 HB VAL 14 4.674 8.834 4.174 97 HG11 VAL 14 HG11 VAL 14 7.127 8.491 4.514 98 HG12 VAL 14 HG12 VAL 14 7.341 10.229 4.504 99 HG13 VAL 14 HG13 VAL 14 6.785 9.405 3.039 100 HG21 VAL 14 HG21 VAL 14 4.280 9.648 6.507 101 HG22 VAL 14 HG22 VAL 14 5.943 10.227 6.557 102 HG23 VAL 14 HG23 VAL 14 5.610 8.510 6.396 103 H PHE 15 H PHE 15 3.381 9.964 2.338 104 HA PHE 15 HA PHE 15 4.965 10.462 0.032 105 HB2 PHE 15 HB3 PHE 15 3.080 8.842 0.131 106 HB3 PHE 15 HB2 PHE 15 1.955 10.182 0.282 107 HD1 PHE 15 HD2 PHE 15 1.526 11.700 -1.603 108 HD2 PHE 15 HD1 PHE 15 4.210 8.367 -2.007 109 HE1 PHE 15 HE2 PHE 15 1.434 11.926 -4.058 110 HE2 PHE 15 HE1 PHE 15 4.119 8.603 -4.470 111 HZ PHE 15 HZ PHE 15 2.728 10.381 -5.495 112 H HIS 16 H HIS 16 2.221 12.170 1.443 113 HA HIS 16 HA HIS 16 1.997 14.279 -0.372 114 HB2 HIS 16 HB3 HIS 16 0.351 13.599 1.383 115 HB3 HIS 16 HB2 HIS 16 1.391 14.337 2.603 116 HD1 HIS 16 HD1 HIS 16 1.975 16.675 0.164 117 HD2 HIS 16 HD2 HIS 16 -1.544 15.619 2.145 118 HE1 HIS 16 HE1 HIS 16 0.373 18.615 -0.097 119 HE2 HIS 16 HE2 HIS 16 -1.749 18.017 1.114 120 H ALA 17 H ALA 17 3.796 14.016 2.694 121 HA ALA 17 HA ALA 17 4.861 16.624 2.626 122 HB1 ALA 17 HB1 ALA 17 5.773 14.093 4.001 123 HB2 ALA 17 HB2 ALA 17 4.996 15.532 4.686 124 HB3 ALA 17 HB3 ALA 17 6.656 15.619 4.130 125 H HIS 18 H HIS 18 6.204 13.531 1.518 126 HA HIS 18 HA HIS 18 8.581 14.739 0.593 127 HB2 HIS 18 HB3 HIS 18 7.413 12.021 0.022 128 HB3 HIS 18 HB2 HIS 18 8.938 12.558 -0.674 129 HD1 HIS 18 HD1 HIS 18 10.891 13.354 1.106 130 HD2 HIS 18 HD2 HIS 18 7.629 11.289 2.749 131 HE1 HIS 18 HE1 HIS 18 11.520 12.736 3.454 132 HE2 HIS 18 HE2 HIS 18 9.566 11.472 4.463 133 H SER 19 H SER 19 5.498 14.149 -0.999 134 HA SER 19 HA SER 19 6.300 14.916 -3.603 135 HB2 SER 19 HB3 SER 19 3.680 15.451 -2.133 136 HB3 SER 19 HB2 SER 19 3.957 15.737 -3.842 137 HG SER 19 HG SER 19 4.688 13.405 -3.745 138 H GLY 20 H GLY 20 5.453 16.684 -0.693 139 HA2 GLY 20 HA3 GLY 20 5.733 19.324 -1.730 140 HA3 GLY 20 HA2 GLY 20 5.812 18.875 -0.029 141 H LYS 21 H LYS 21 7.945 17.007 -0.241 142 HA LYS 21 HA LYS 21 10.185 18.743 -0.008 143 HB2 LYS 21 HB3 LYS 21 10.098 15.745 -0.426 144 HB3 LYS 21 HB2 LYS 21 11.552 16.645 -0.026 145 HG2 LYS 21 HG3 LYS 21 9.046 16.593 1.706 146 HG3 LYS 21 HG2 LYS 21 10.456 15.552 1.942 147 HD2 LYS 21 HD3 LYS 21 11.875 17.504 2.254 148 HD3 LYS 21 HD2 LYS 21 10.494 18.592 2.021 149 HE2 LYS 21 HE2 LYS 21 9.363 17.567 3.974 150 HE3 LYS 21 HE1 LYS 21 10.731 16.486 4.191 151 HZ1 LYS 21 HZ1 LYS 21 11.932 18.084 5.165 152 HZ2 LYS 21 HZ2 LYS 21 10.481 18.867 5.395 153 HZ3 LYS 21 HZ3 LYS 21 11.475 19.297 4.081 154 H GLU 22 H GLU 22 9.185 16.524 -2.604 155 HA GLU 22 HA GLU 22 11.328 17.343 -4.339 156 HB2 GLU 22 HB3 GLU 22 8.757 15.777 -5.041 157 HB3 GLU 22 HB2 GLU 22 10.105 16.122 -6.078 158 HG2 GLU 22 HG3 GLU 22 11.659 14.905 -4.675 159 HG3 GLU 22 HG2 GLU 22 10.412 14.758 -3.448 160 H GLY 23 H GLY 23 7.980 18.293 -3.873 161 HA2 GLY 23 HA3 GLY 23 7.631 20.706 -4.093 162 HA3 GLY 23 HA2 GLY 23 8.468 20.640 -5.638 163 H ASP 24 H ASP 24 6.905 17.892 -5.835 164 HA ASP 24 HA ASP 24 4.807 18.959 -7.461 165 HB2 ASP 24 HB3 ASP 24 5.962 16.686 -7.774 166 HB3 ASP 24 HB2 ASP 24 4.892 16.121 -6.488 167 H LYS 25 H LYS 25 2.618 19.071 -7.047 168 HA LYS 25 HA LYS 25 1.874 19.481 -4.366 169 HB2 LYS 25 HB3 LYS 25 -0.474 19.544 -5.244 170 HB3 LYS 25 HB2 LYS 25 0.638 20.670 -6.014 171 HG2 LYS 25 HG3 LYS 25 0.917 18.529 -7.697 172 HG3 LYS 25 HG2 LYS 25 -0.731 18.268 -7.149 173 HD2 LYS 25 HD3 LYS 25 -0.813 20.964 -7.659 174 HD3 LYS 25 HD2 LYS 25 0.376 20.443 -8.836 175 HE2 LYS 25 HE2 LYS 25 -1.411 19.975 -10.135 176 HE3 LYS 25 HE1 LYS 25 -1.538 18.499 -9.191 177 HZ1 LYS 25 HZ1 LYS 25 -3.398 19.217 -8.228 178 HZ2 LYS 25 HZ2 LYS 25 -3.456 20.390 -9.425 179 HZ3 LYS 25 HZ3 LYS 25 -2.819 20.766 -7.898 180 H TYR 26 H TYR 26 1.509 16.728 -6.529 181 HA TYR 26 HA TYR 26 1.621 14.990 -4.292 182 HB2 TYR 26 HB3 TYR 26 -0.567 13.728 -5.296 183 HB3 TYR 26 HB2 TYR 26 -0.588 14.773 -3.900 184 HD1 TYR 26 HD1 TYR 26 -1.400 17.119 -4.061 185 HD2 TYR 26 HD2 TYR 26 -1.523 14.448 -7.430 186 HE1 TYR 26 HE1 TYR 26 -2.978 18.640 -5.216 187 HE2 TYR 26 HE2 TYR 26 -3.095 15.967 -8.577 188 HH TYR 26 HH TYR 26 -4.926 17.925 -7.535 189 H LYS 27 H LYS 27 3.376 14.244 -5.086 190 HA LYS 27 HA LYS 27 3.154 12.029 -6.811 191 HB2 LYS 27 HB3 LYS 27 4.680 14.431 -7.845 192 HB3 LYS 27 HB2 LYS 27 5.085 12.787 -8.282 193 HG2 LYS 27 HG3 LYS 27 2.391 14.107 -8.765 194 HG3 LYS 27 HG2 LYS 27 3.630 13.770 -9.959 195 HD2 LYS 27 HD3 LYS 27 3.494 11.310 -8.946 196 HD3 LYS 27 HD2 LYS 27 1.874 11.791 -8.541 197 HE2 LYS 27 HE2 LYS 27 3.114 11.743 -11.289 198 HE3 LYS 27 HE1 LYS 27 1.770 10.787 -10.689 199 HZ1 LYS 27 HZ1 LYS 27 0.629 12.411 -11.757 200 HZ2 LYS 27 HZ2 LYS 27 1.809 13.584 -11.582 201 HZ3 LYS 27 HZ3 LYS 27 0.763 13.209 -10.280 202 H LEU 28 H LEU 28 5.161 10.792 -6.822 203 HA LEU 28 HA LEU 28 7.170 11.820 -4.976 204 HB2 LEU 28 HB3 LEU 28 5.861 10.083 -3.825 205 HB3 LEU 28 HB2 LEU 28 6.264 8.925 -5.101 206 HG LEU 28 HG LEU 28 8.696 9.356 -4.604 207 HD11 LEU 28 HD11 LEU 28 8.758 11.456 -3.540 208 HD12 LEU 28 HD12 LEU 28 9.064 10.324 -2.243 209 HD13 LEU 28 HD13 LEU 28 7.458 11.035 -2.421 210 HD21 LEU 28 HD21 LEU 28 7.897 7.355 -3.646 211 HD22 LEU 28 HD22 LEU 28 6.815 8.216 -2.534 212 HD23 LEU 28 HD23 LEU 28 8.561 8.238 -2.278 213 H SER 29 H SER 29 9.079 11.913 -5.897 214 HA SER 29 HA SER 29 9.389 10.601 -8.470 215 HB2 SER 29 HB3 SER 29 11.252 12.718 -7.376 216 HB3 SER 29 HB2 SER 29 10.978 12.211 -9.042 217 HG SER 29 HG SER 29 9.177 13.453 -7.263 218 H LYS 30 H LYS 30 11.986 10.176 -8.785 219 HA LYS 30 HA LYS 30 12.494 8.021 -6.963 220 HB2 LYS 30 HB3 LYS 30 14.425 9.084 -9.017 221 HB3 LYS 30 HB2 LYS 30 14.374 7.463 -8.345 222 HG2 LYS 30 HG3 LYS 30 12.500 8.772 -10.295 223 HG3 LYS 30 HG2 LYS 30 13.349 7.249 -10.494 224 HD2 LYS 30 HD3 LYS 30 11.042 7.731 -8.507 225 HD3 LYS 30 HD2 LYS 30 10.876 6.945 -10.041 226 HE2 LYS 30 HE2 LYS 30 12.540 5.941 -7.709 227 HE3 LYS 30 HE1 LYS 30 11.082 5.232 -8.369 228 HZ1 LYS 30 HZ1 LYS 30 13.268 5.571 -10.299 229 HZ2 LYS 30 HZ2 LYS 30 12.187 4.280 -10.030 230 HZ3 LYS 30 HZ3 LYS 30 13.521 4.485 -9.044 231 H LYS 31 H LYS 31 13.015 11.216 -6.604 232 HA LYS 31 HA LYS 31 15.654 11.098 -5.395 233 HB2 LYS 31 HB3 LYS 31 14.373 13.453 -4.469 234 HB3 LYS 31 HB2 LYS 31 15.559 13.322 -5.755 235 HG2 LYS 31 HG3 LYS 31 13.687 12.888 -7.398 236 HG3 LYS 31 HG2 LYS 31 12.589 13.049 -5.995 237 HD2 LYS 31 HD3 LYS 31 13.263 15.326 -5.712 238 HD3 LYS 31 HD2 LYS 31 14.426 15.198 -7.050 239 HE2 LYS 31 HE2 LYS 31 12.519 14.622 -8.575 240 HE3 LYS 31 HE1 LYS 31 11.422 14.874 -7.218 241 HZ1 LYS 31 HZ1 LYS 31 11.411 16.889 -8.324 242 HZ2 LYS 31 HZ2 LYS 31 13.051 16.856 -8.648 243 HZ3 LYS 31 HZ3 LYS 31 12.516 17.206 -7.080 244 H GLU 32 H GLU 32 12.633 12.246 -3.911 245 HA GLU 32 HA GLU 32 13.460 11.701 -1.274 246 HB2 GLU 32 HB3 GLU 32 10.687 12.117 -2.428 247 HB3 GLU 32 HB2 GLU 32 11.066 12.005 -0.706 248 HG2 GLU 32 HG3 GLU 32 12.352 14.002 -2.570 249 HG3 GLU 32 HG2 GLU 32 10.946 14.341 -1.562 250 H LEU 33 H LEU 33 11.774 9.796 -3.650 251 HA LEU 33 HA LEU 33 10.626 7.933 -1.977 252 HB2 LEU 33 HB3 LEU 33 10.112 8.018 -4.359 253 HB3 LEU 33 HB2 LEU 33 11.735 7.515 -4.766 254 HG LEU 33 HG LEU 33 9.805 5.761 -4.796 255 HD11 LEU 33 HD11 LEU 33 12.438 5.469 -4.808 256 HD12 LEU 33 HD12 LEU 33 11.361 4.090 -4.646 257 HD13 LEU 33 HD13 LEU 33 12.147 4.755 -3.226 258 HD21 LEU 33 HD21 LEU 33 8.973 4.949 -2.830 259 HD22 LEU 33 HD22 LEU 33 9.415 6.486 -2.146 260 HD23 LEU 33 HD23 LEU 33 10.493 5.092 -1.982 261 H LYS 34 H LYS 34 13.900 7.946 -3.348 262 HA LYS 34 HA LYS 34 14.736 5.442 -2.256 263 HB2 LYS 34 HB3 LYS 34 16.330 7.942 -2.799 264 HB3 LYS 34 HB2 LYS 34 16.994 6.364 -2.415 265 HG2 LYS 34 HG3 LYS 34 16.037 5.401 -4.434 266 HG3 LYS 34 HG2 LYS 34 15.293 6.944 -4.875 267 HD2 LYS 34 HD3 LYS 34 18.277 6.423 -4.554 268 HD3 LYS 34 HD2 LYS 34 17.421 6.642 -6.068 269 HE2 LYS 34 HE2 LYS 34 17.844 8.838 -5.899 270 HE3 LYS 34 HE1 LYS 34 16.648 8.925 -4.626 271 HZ1 LYS 34 HZ1 LYS 34 19.491 8.208 -4.062 272 HZ2 LYS 34 HZ2 LYS 34 18.338 8.818 -2.949 273 HZ3 LYS 34 HZ3 LYS 34 18.956 9.791 -4.157 274 H GLU 35 H GLU 35 15.027 8.797 -1.213 275 HA GLU 35 HA GLU 35 16.494 8.196 1.115 276 HB2 GLU 35 HB3 GLU 35 14.997 10.757 0.547 277 HB3 GLU 35 HB2 GLU 35 16.379 10.537 1.614 278 HG2 GLU 35 HG3 GLU 35 16.352 10.314 -1.426 279 HG3 GLU 35 HG2 GLU 35 17.183 11.471 -0.421 280 H LEU 36 H LEU 36 13.130 9.110 0.605 281 HA LEU 36 HA LEU 36 12.454 9.109 3.331 282 HB2 LEU 36 HB3 LEU 36 10.508 9.851 2.622 283 HB3 LEU 36 HB2 LEU 36 11.114 9.812 0.984 284 HG LEU 36 HG LEU 36 10.333 7.278 1.049 285 HD11 LEU 36 HD11 LEU 36 9.469 8.231 3.645 286 HD12 LEU 36 HD12 LEU 36 9.389 6.614 2.961 287 HD13 LEU 36 HD13 LEU 36 8.083 7.745 2.669 288 HD21 LEU 36 HD21 LEU 36 9.326 9.359 -0.161 289 HD22 LEU 36 HD22 LEU 36 8.075 9.280 1.079 290 HD23 LEU 36 HD23 LEU 36 8.364 7.898 0.010 291 H LEU 37 H LEU 37 12.312 6.571 0.893 292 HA LEU 37 HA LEU 37 10.992 4.730 2.537 293 HB2 LEU 37 HB3 LEU 37 11.113 4.341 0.131 294 HB3 LEU 37 HB2 LEU 37 12.866 4.227 0.197 295 HG LEU 37 HG LEU 37 11.556 2.025 0.068 296 HD11 LEU 37 HD11 LEU 37 13.163 1.729 2.497 297 HD12 LEU 37 HD12 LEU 37 13.989 2.607 1.218 298 HD13 LEU 37 HD13 LEU 37 13.357 0.993 0.910 299 HD21 LEU 37 HD21 LEU 37 9.994 2.945 2.067 300 HD22 LEU 37 HD22 LEU 37 11.252 2.189 3.039 301 HD23 LEU 37 HD23 LEU 37 10.356 1.239 1.874 302 H GLN 38 H GLN 38 14.469 5.227 1.976 303 HA GLN 38 HA GLN 38 15.241 3.235 3.868 304 HB2 GLN 38 HB3 GLN 38 17.485 4.231 3.785 305 HB3 GLN 38 HB2 GLN 38 16.857 4.000 2.154 306 HG2 GLN 38 HG3 GLN 38 16.195 6.384 2.114 307 HG3 GLN 38 HG2 GLN 38 16.889 6.612 3.718 308 HE21 GLN 38 HE21 GLN 38 18.693 7.903 3.210 309 HE22 GLN 38 HE22 GLN 38 19.915 7.447 2.134 310 H THR 39 H THR 39 14.685 6.691 4.051 311 HA THR 39 HA THR 39 15.608 7.090 6.673 312 HB THR 39 HB THR 39 13.497 8.551 5.087 313 HG1 THR 39 HG2 THR 39 15.403 8.664 4.056 314 HG21 THR 39 HG21 THR 39 14.986 9.344 7.589 315 HG22 THR 39 HG22 THR 39 13.262 9.071 7.402 316 HG23 THR 39 HG23 THR 39 14.017 10.452 6.603 317 H GLU 40 H GLU 40 12.262 6.543 5.484 318 HA GLU 40 HA GLU 40 11.275 6.618 8.151 319 HB2 GLU 40 HB3 GLU 40 9.869 6.010 5.546 320 HB3 GLU 40 HB2 GLU 40 9.082 6.228 7.114 321 HG2 GLU 40 HG3 GLU 40 10.848 8.305 5.773 322 HG3 GLU 40 HG2 GLU 40 9.088 8.341 5.796 323 H LEU 41 H LEU 41 11.831 3.990 5.875 324 HA LEU 41 HA LEU 41 10.721 2.073 7.791 325 HB2 LEU 41 HB3 LEU 41 11.787 1.846 4.994 326 HB3 LEU 41 HB2 LEU 41 11.659 0.427 5.983 327 HG LEU 41 HG LEU 41 9.253 0.943 6.471 328 HD11 LEU 41 HD11 LEU 41 8.197 2.566 4.774 329 HD12 LEU 41 HD12 LEU 41 9.812 3.233 4.588 330 HD13 LEU 41 HD13 LEU 41 9.023 3.246 6.170 331 HD21 LEU 41 HD21 LEU 41 10.373 -0.141 4.096 332 HD22 LEU 41 HD22 LEU 41 9.049 0.888 3.574 333 HD23 LEU 41 HD23 LEU 41 8.754 -0.397 4.732 334 H SER 42 H SER 42 12.760 3.485 8.867 335 HA SER 42 HA SER 42 15.340 2.644 8.536 336 HB2 SER 42 HB3 SER 42 14.327 3.154 11.303 337 HB3 SER 42 HB2 SER 42 15.776 3.740 10.497 338 HG SER 42 HG SER 42 14.410 5.152 9.248 339 H GLY 43 H GLY 43 12.816 1.158 10.547 340 HA2 GLY 43 HA3 GLY 43 14.531 -0.823 11.700 341 HA3 GLY 43 HA2 GLY 43 12.776 -0.804 11.756 342 H PHE 44 H PHE 44 12.192 -0.781 9.072 343 HA PHE 44 HA PHE 44 12.461 -3.574 8.415 344 HB2 PHE 44 HB3 PHE 44 11.113 -1.257 7.062 345 HB3 PHE 44 HB2 PHE 44 11.345 -2.769 6.192 346 HD1 PHE 44 HD2 PHE 44 10.394 -4.883 7.110 347 HD2 PHE 44 HD1 PHE 44 9.500 -1.063 8.797 348 HE1 PHE 44 HE2 PHE 44 8.434 -5.868 8.278 349 HE2 PHE 44 HE1 PHE 44 7.521 -2.047 9.975 350 HZ PHE 44 HZ PHE 44 7.003 -4.435 9.713 351 H LEU 45 H LEU 45 13.813 -0.566 7.268 352 HA LEU 45 HA LEU 45 15.152 -1.505 5.038 353 HB2 LEU 45 HB3 LEU 45 14.940 0.819 5.395 354 HB3 LEU 45 HB2 LEU 45 15.767 0.747 6.946 355 HG LEU 45 HG LEU 45 17.754 -0.007 5.893 356 HD11 LEU 45 HD11 LEU 45 16.025 0.033 3.409 357 HD12 LEU 45 HD12 LEU 45 17.316 -1.089 3.853 358 HD13 LEU 45 HD13 LEU 45 17.718 0.488 3.210 359 HD21 LEU 45 HD21 LEU 45 17.716 2.276 4.211 360 HD22 LEU 45 HD22 LEU 45 18.252 2.184 5.878 361 HD23 LEU 45 HD23 LEU 45 16.577 2.606 5.519 362 H ASP 46 H ASP 46 16.204 -1.260 8.406 363 HA ASP 46 HA ASP 46 18.799 -2.224 7.973 364 HB2 ASP 46 HB3 ASP 46 18.327 -1.185 10.040 365 HB3 ASP 46 HB2 ASP 46 17.066 -2.329 10.436 366 H ALA 47 H ALA 47 15.829 -3.958 8.747 367 HA ALA 47 HA ALA 47 17.040 -6.531 8.928 368 HB1 ALA 47 HB1 ALA 47 14.224 -5.584 8.568 369 HB2 ALA 47 HB2 ALA 47 14.946 -6.445 9.927 370 HB3 ALA 47 HB3 ALA 47 14.625 -7.295 8.420 371 H GLN 48 H GLN 48 15.509 -4.840 6.233 372 HA GLN 48 HA GLN 48 15.733 -7.114 4.517 373 HB2 GLN 48 HB3 GLN 48 15.125 -5.410 2.665 374 HB3 GLN 48 HB2 GLN 48 13.926 -5.770 3.901 375 HG2 GLN 48 HG3 GLN 48 13.838 -3.531 4.323 376 HG3 GLN 48 HG2 GLN 48 15.472 -3.680 4.965 377 HE21 GLN 48 HE21 GLN 48 17.193 -3.795 3.014 378 HE22 GLN 48 HE22 GLN 48 16.954 -2.575 1.862 379 H LYS 49 H LYS 49 18.120 -5.095 5.520 380 HA LYS 49 HA LYS 49 19.449 -4.383 3.168 381 HB2 LYS 49 HB3 LYS 49 20.745 -5.130 5.799 382 HB3 LYS 49 HB2 LYS 49 21.510 -4.257 4.484 383 HG2 LYS 49 HG3 LYS 49 19.652 -2.509 4.690 384 HG3 LYS 49 HG2 LYS 49 19.220 -3.294 6.203 385 HD2 LYS 49 HD3 LYS 49 21.807 -1.881 5.520 386 HD3 LYS 49 HD2 LYS 49 20.673 -1.474 6.774 387 HE2 LYS 49 HE2 LYS 49 22.604 -3.810 6.727 388 HE3 LYS 49 HE1 LYS 49 22.440 -2.552 7.922 389 HZ1 LYS 49 HZ1 LYS 49 20.082 -4.308 7.542 390 HZ2 LYS 49 HZ2 LYS 49 20.696 -3.569 8.932 391 HZ3 LYS 49 HZ3 LYS 49 21.461 -4.907 8.277 392 H ASP 50 H ASP 50 19.585 -7.368 5.016 393 HA ASP 50 HA ASP 50 21.425 -8.513 3.039 394 HB2 ASP 50 HB3 ASP 50 21.200 -8.779 5.879 395 HB3 ASP 50 HB2 ASP 50 20.980 -10.353 5.141 396 H VAL 51 H VAL 51 18.428 -8.175 2.696 397 HA VAL 51 HA VAL 51 17.717 -11.025 2.320 398 HB VAL 51 HB VAL 51 15.800 -8.687 2.464 399 HG11 VAL 51 HG11 VAL 51 14.263 -10.620 3.157 400 HG12 VAL 51 HG12 VAL 51 15.519 -11.701 2.603 401 HG13 VAL 51 HG13 VAL 51 14.729 -10.599 1.459 402 HG21 VAL 51 HG21 VAL 51 16.662 -10.610 4.642 403 HG22 VAL 51 HG22 VAL 51 15.422 -9.397 4.817 404 HG23 VAL 51 HG23 VAL 51 17.103 -8.904 4.599 405 H ASP 52 H ASP 52 18.940 -8.600 0.580 406 HA ASP 52 HA ASP 52 19.099 -8.040 -1.614 407 HB2 ASP 52 HB3 ASP 52 19.527 -10.488 -1.820 408 HB3 ASP 52 HB2 ASP 52 17.834 -10.708 -2.230 409 H ALA 53 H ALA 53 15.958 -9.425 -0.861 410 HA ALA 53 HA ALA 53 14.468 -8.688 -3.006 411 HB1 ALA 53 HB1 ALA 53 12.585 -8.160 -1.295 412 HB2 ALA 53 HB2 ALA 53 13.746 -8.697 -0.084 413 HB3 ALA 53 HB3 ALA 53 13.228 -9.797 -1.364 414 H VAL 54 H VAL 54 15.745 -6.571 -0.597 415 HA VAL 54 HA VAL 54 14.259 -4.262 -1.219 416 HB VAL 54 HB VAL 54 15.652 -4.341 0.764 417 HG11 VAL 54 HG11 VAL 54 17.583 -5.636 -0.416 418 HG12 VAL 54 HG12 VAL 54 18.014 -4.432 0.762 419 HG13 VAL 54 HG13 VAL 54 18.115 -4.047 -0.958 420 HG21 VAL 54 HG21 VAL 54 16.085 -2.180 -1.278 421 HG22 VAL 54 HG22 VAL 54 17.066 -2.120 0.156 422 HG23 VAL 54 HG23 VAL 54 15.306 -2.083 0.293 423 H ASP 55 H ASP 55 17.217 -5.585 -2.620 424 HA ASP 55 HA ASP 55 17.829 -3.514 -4.451 425 HB2 ASP 55 HB3 ASP 55 19.356 -5.398 -4.017 426 HB3 ASP 55 HB2 ASP 55 18.141 -6.503 -4.705 427 H LYS 56 H LYS 56 15.990 -6.454 -4.797 428 HA LYS 56 HA LYS 56 15.176 -5.989 -7.465 429 HB2 LYS 56 HB3 LYS 56 13.813 -7.742 -5.413 430 HB3 LYS 56 HB2 LYS 56 13.732 -7.899 -7.159 431 HG2 LYS 56 HG3 LYS 56 16.228 -8.256 -5.445 432 HG3 LYS 56 HG2 LYS 56 15.336 -9.517 -6.272 433 HD2 LYS 56 HD3 LYS 56 15.796 -8.438 -8.418 434 HD3 LYS 56 HD2 LYS 56 16.762 -7.210 -7.651 435 HE2 LYS 56 HE2 LYS 56 17.392 -10.151 -7.295 436 HE3 LYS 56 HE1 LYS 56 18.072 -9.192 -8.610 437 HZ1 LYS 56 HZ1 LYS 56 18.481 -8.919 -5.701 438 HZ2 LYS 56 HZ2 LYS 56 18.797 -7.581 -6.757 439 HZ3 LYS 56 HZ3 LYS 56 19.630 -9.053 -6.924 440 H VAL 57 H VAL 57 13.619 -5.405 -4.380 441 HA VAL 57 HA VAL 57 11.146 -4.440 -5.447 442 HB VAL 57 HB VAL 57 12.451 -4.183 -2.727 443 HG11 VAL 57 HG11 VAL 57 10.051 -3.533 -2.056 444 HG12 VAL 57 HG12 VAL 57 9.816 -3.121 -3.750 445 HG13 VAL 57 HG13 VAL 57 11.073 -2.312 -2.795 446 HG21 VAL 57 HG21 VAL 57 10.691 -5.808 -2.078 447 HG22 VAL 57 HG22 VAL 57 11.685 -6.454 -3.381 448 HG23 VAL 57 HG23 VAL 57 10.094 -5.817 -3.739 449 H MET 58 H MET 58 14.112 -2.984 -4.245 450 HA MET 58 HA MET 58 13.359 -0.314 -4.583 451 HB2 MET 58 HB3 MET 58 15.296 -0.911 -3.248 452 HB3 MET 58 HB2 MET 58 16.075 -1.625 -4.663 453 HG2 MET 58 HG3 MET 58 16.279 0.347 -5.714 454 HG3 MET 58 HG2 MET 58 15.253 1.284 -4.606 455 HE1 MET 58 HE1 MET 58 18.040 -1.492 -3.575 456 HE2 MET 58 HE2 MET 58 19.451 -0.499 -3.839 457 HE3 MET 58 HE3 MET 58 18.363 -0.820 -5.180 458 H LYS 59 H LYS 59 14.831 -2.688 -6.776 459 HA LYS 59 HA LYS 59 15.206 -0.795 -8.777 460 HB2 LYS 59 HB3 LYS 59 16.492 -2.834 -8.910 461 HB3 LYS 59 HB2 LYS 59 15.010 -3.776 -9.208 462 HG2 LYS 59 HG3 LYS 59 14.589 -2.671 -11.218 463 HG3 LYS 59 HG2 LYS 59 15.748 -1.405 -10.861 464 HD2 LYS 59 HD3 LYS 59 17.401 -3.529 -10.821 465 HD3 LYS 59 HD2 LYS 59 16.189 -4.202 -11.892 466 HE2 LYS 59 HE2 LYS 59 18.081 -1.981 -12.311 467 HE3 LYS 59 HE1 LYS 59 17.463 -3.152 -13.481 468 HZ1 LYS 59 HZ1 LYS 59 16.464 -1.170 -14.142 469 HZ2 LYS 59 HZ2 LYS 59 16.252 -0.543 -12.641 470 HZ3 LYS 59 HZ3 LYS 59 15.234 -1.814 -13.227 471 H GLU 60 H GLU 60 12.466 -2.797 -8.000 472 HA GLU 60 HA GLU 60 10.955 -2.453 -10.326 473 HB2 GLU 60 HB3 GLU 60 10.333 -2.497 -7.483 474 HB3 GLU 60 HB2 GLU 60 8.979 -2.394 -8.631 475 HG2 GLU 60 HG3 GLU 60 11.085 -4.593 -8.386 476 HG3 GLU 60 HG2 GLU 60 9.399 -4.727 -7.954 477 H LEU 61 H LEU 61 11.446 -0.337 -7.559 478 HA LEU 61 HA LEU 61 9.859 1.817 -8.576 479 HB2 LEU 61 HB3 LEU 61 11.910 1.616 -6.380 480 HB3 LEU 61 HB2 LEU 61 11.378 3.189 -6.960 481 HG LEU 61 HG LEU 61 10.060 2.153 -4.993 482 HD11 LEU 61 HD11 LEU 61 8.962 3.989 -5.715 483 HD12 LEU 61 HD12 LEU 61 7.828 2.809 -6.349 484 HD13 LEU 61 HD13 LEU 61 9.027 3.528 -7.417 485 HD21 LEU 61 HD21 LEU 61 9.829 -0.126 -6.158 486 HD22 LEU 61 HD22 LEU 61 8.684 0.647 -7.259 487 HD23 LEU 61 HD23 LEU 61 8.331 0.552 -5.559 488 H ASP 62 H ASP 62 13.195 0.816 -8.850 489 HA ASP 62 HA ASP 62 14.107 3.067 -10.305 490 HB2 ASP 62 HB3 ASP 62 15.733 1.492 -9.365 491 HB3 ASP 62 HB2 ASP 62 15.064 0.227 -10.388 492 H GLU 63 H GLU 63 12.553 0.050 -11.275 493 HA GLU 63 HA GLU 63 12.637 0.406 -14.113 494 HB2 GLU 63 HB3 GLU 63 10.343 -0.722 -12.466 495 HB3 GLU 63 HB2 GLU 63 10.617 -0.945 -14.166 496 HG2 GLU 63 HG3 GLU 63 12.535 -1.901 -12.030 497 HG3 GLU 63 HG2 GLU 63 11.299 -2.863 -12.839 498 H ASN 64 H ASN 64 10.482 1.397 -11.565 499 HA ASN 64 HA ASN 64 8.699 2.944 -13.136 500 HB2 ASN 64 HB3 ASN 64 7.940 2.237 -11.057 501 HB3 ASN 64 HB2 ASN 64 9.293 2.826 -10.180 502 HD21 ASN 64 HD21 ASN 64 6.582 4.076 -12.119 503 HD22 ASN 64 HD22 ASN 64 6.540 5.601 -11.336 504 H GLY 65 H GLY 65 11.916 3.389 -12.394 505 HA2 GLY 65 HA3 GLY 65 12.168 6.203 -12.161 506 HA3 GLY 65 HA2 GLY 65 13.381 5.089 -12.813 507 H ASP 66 H ASP 66 10.608 4.487 -14.458 508 HA ASP 66 HA ASP 66 11.381 5.532 -16.916 509 HB2 ASP 66 HB3 ASP 66 9.670 3.738 -16.548 510 HB3 ASP 66 HB2 ASP 66 8.612 4.946 -15.895 511 H GLY 67 H GLY 67 9.248 6.645 -14.348 512 HA2 GLY 67 HA3 GLY 67 9.488 9.405 -15.293 513 HA3 GLY 67 HA2 GLY 67 7.871 8.719 -15.189 514 H GLU 68 H GLU 68 6.996 8.241 -13.184 515 HA GLU 68 HA GLU 68 8.417 9.171 -10.767 516 HB2 GLU 68 HB3 GLU 68 5.828 10.307 -11.826 517 HB3 GLU 68 HB2 GLU 68 6.364 10.567 -10.175 518 HG2 GLU 68 HG3 GLU 68 8.357 11.643 -10.880 519 HG3 GLU 68 HG2 GLU 68 8.129 11.278 -12.573 520 H VAL 69 H VAL 69 7.123 8.785 -8.757 521 HA VAL 69 HA VAL 69 5.538 6.343 -9.056 522 HB VAL 69 HB VAL 69 7.482 5.527 -8.091 523 HG11 VAL 69 HG11 VAL 69 7.624 7.947 -6.276 524 HG12 VAL 69 HG12 VAL 69 8.608 7.706 -7.735 525 HG13 VAL 69 HG13 VAL 69 8.785 6.635 -6.359 526 HG21 VAL 69 HG21 VAL 69 6.402 4.526 -6.383 527 HG22 VAL 69 HG22 VAL 69 5.232 5.827 -6.256 528 HG23 VAL 69 HG23 VAL 69 6.742 5.910 -5.366 529 H ASP 70 H ASP 70 3.600 6.342 -8.188 530 HA ASP 70 HA ASP 70 2.778 8.752 -6.757 531 HB2 ASP 70 HB3 ASP 70 0.610 8.422 -7.433 532 HB3 ASP 70 HB2 ASP 70 1.492 7.869 -8.826 533 H PHE 71 H PHE 71 0.670 7.987 -5.401 534 HA PHE 71 HA PHE 71 1.756 7.003 -3.019 535 HB2 PHE 71 HB3 PHE 71 -0.267 8.445 -3.159 536 HB3 PHE 71 HB2 PHE 71 -1.160 7.044 -3.775 537 HD1 PHE 71 HD1 PHE 71 1.227 7.826 -1.001 538 HD2 PHE 71 HD2 PHE 71 -2.406 5.837 -2.180 539 HE1 PHE 71 HE1 PHE 71 0.881 7.079 1.310 540 HE2 PHE 71 HE2 PHE 71 -2.740 5.094 0.161 541 HZ PHE 71 HZ PHE 71 -1.106 5.708 1.901 542 H GLN 72 H GLN 72 -0.222 5.428 -5.502 543 HA GLN 72 HA GLN 72 -0.597 2.954 -4.220 544 HB2 GLN 72 HB3 GLN 72 -0.430 3.707 -7.146 545 HB3 GLN 72 HB2 GLN 72 -0.888 2.102 -6.581 546 HG2 GLN 72 HG3 GLN 72 -2.791 3.009 -5.396 547 HG3 GLN 72 HG2 GLN 72 -2.319 4.661 -5.787 548 HE21 GLN 72 HE21 GLN 72 -2.738 5.430 -7.961 549 HE22 GLN 72 HE22 GLN 72 -3.637 4.523 -9.068 550 H GLU 73 H GLU 73 1.902 4.096 -6.451 551 HA GLU 73 HA GLU 73 3.406 1.672 -6.412 552 HB2 GLU 73 HB3 GLU 73 4.147 4.481 -7.337 553 HB3 GLU 73 HB2 GLU 73 5.167 3.060 -7.530 554 HG2 GLU 73 HG3 GLU 73 3.459 1.889 -8.793 555 HG3 GLU 73 HG2 GLU 73 2.320 3.182 -8.487 556 H TYR 74 H TYR 74 3.496 4.656 -4.591 557 HA TYR 74 HA TYR 74 5.871 4.191 -3.109 558 HB2 TYR 74 HB3 TYR 74 4.944 6.381 -3.105 559 HB3 TYR 74 HB2 TYR 74 3.386 5.789 -2.534 560 HD1 TYR 74 HD1 TYR 74 6.998 5.471 -1.423 561 HD2 TYR 74 HD2 TYR 74 2.917 6.288 -0.335 562 HE1 TYR 74 HE1 TYR 74 7.683 5.817 0.931 563 HE2 TYR 74 HE2 TYR 74 3.606 6.632 2.004 564 HH TYR 74 HH TYR 74 6.054 7.379 3.101 565 H VAL 75 H VAL 75 2.464 3.356 -2.330 566 HA VAL 75 HA VAL 75 3.157 2.255 0.149 567 HB VAL 75 HB VAL 75 0.978 1.210 0.229 568 HG11 VAL 75 HG11 VAL 75 0.084 3.683 -1.065 569 HG12 VAL 75 HG12 VAL 75 1.481 3.948 -0.031 570 HG13 VAL 75 HG13 VAL 75 0.042 3.207 0.628 571 HG21 VAL 75 HG21 VAL 75 0.421 2.172 -2.581 572 HG22 VAL 75 HG22 VAL 75 -0.466 0.978 -1.606 573 HG23 VAL 75 HG23 VAL 75 1.040 0.539 -2.313 574 H VAL 76 H VAL 76 2.923 0.711 -3.030 575 HA VAL 76 HA VAL 76 3.296 -1.894 -2.012 576 HB VAL 76 HB VAL 76 2.367 -1.530 -4.265 577 HG11 VAL 76 HG11 VAL 76 3.870 -0.956 -6.136 578 HG12 VAL 76 HG12 VAL 76 5.162 -0.606 -4.985 579 HG13 VAL 76 HG13 VAL 76 3.669 0.342 -4.979 580 HG21 VAL 76 HG21 VAL 76 4.956 -3.134 -4.205 581 HG22 VAL 76 HG22 VAL 76 3.758 -3.246 -5.480 582 HG23 VAL 76 HG23 VAL 76 3.333 -3.735 -3.842 583 H LEU 77 H LEU 77 5.588 0.588 -2.983 584 HA LEU 77 HA LEU 77 7.904 -1.025 -2.957 585 HB2 LEU 77 HB3 LEU 77 7.951 1.282 -3.808 586 HB3 LEU 77 HB2 LEU 77 7.593 1.886 -2.198 587 HG LEU 77 HG LEU 77 9.734 0.791 -1.378 588 HD11 LEU 77 HD11 LEU 77 10.980 0.688 -4.003 589 HD12 LEU 77 HD12 LEU 77 9.729 -0.534 -3.832 590 HD13 LEU 77 HD13 LEU 77 11.040 -0.421 -2.660 591 HD21 LEU 77 HD21 LEU 77 9.565 3.064 -3.276 592 HD22 LEU 77 HD22 LEU 77 11.190 2.471 -2.892 593 HD23 LEU 77 HD23 LEU 77 10.127 3.016 -1.604 594 H VAL 78 H VAL 78 6.442 0.942 -0.377 595 HA VAL 78 HA VAL 78 8.246 -0.044 1.598 596 HB VAL 78 HB VAL 78 6.782 0.995 3.263 597 HG11 VAL 78 HG11 VAL 78 6.502 3.173 1.387 598 HG12 VAL 78 HG12 VAL 78 8.010 2.351 1.065 599 HG13 VAL 78 HG13 VAL 78 7.675 2.980 2.685 600 HG21 VAL 78 HG21 VAL 78 4.924 1.531 0.929 601 HG22 VAL 78 HG22 VAL 78 4.695 2.106 2.567 602 HG23 VAL 78 HG23 VAL 78 4.572 0.383 2.223 603 H ALA 79 H ALA 79 5.006 -0.958 0.576 604 HA ALA 79 HA ALA 79 4.593 -2.903 2.557 605 HB1 ALA 79 HB1 ALA 79 2.855 -1.947 0.898 606 HB2 ALA 79 HB2 ALA 79 2.773 -3.659 1.305 607 HB3 ALA 79 HB3 ALA 79 3.488 -3.159 -0.216 608 H ALA 80 H ALA 80 5.991 -3.111 -0.675 609 HA ALA 80 HA ALA 80 6.305 -5.878 -0.775 610 HB1 ALA 80 HB1 ALA 80 7.744 -3.589 -2.082 611 HB2 ALA 80 HB2 ALA 80 6.699 -4.814 -2.795 612 HB3 ALA 80 HB3 ALA 80 8.329 -5.246 -2.299 613 H LEU 81 H LEU 81 8.482 -3.361 0.411 614 HA LEU 81 HA LEU 81 10.521 -5.107 1.345 615 HB2 LEU 81 HB3 LEU 81 9.717 -2.321 2.183 616 HB3 LEU 81 HB2 LEU 81 11.123 -3.147 2.832 617 HG LEU 81 HG LEU 81 10.675 -2.690 -0.142 618 HD11 LEU 81 HD11 LEU 81 10.957 -0.533 0.904 619 HD12 LEU 81 HD12 LEU 81 12.467 -0.976 0.116 620 HD13 LEU 81 HD13 LEU 81 12.324 -1.110 1.860 621 HD21 LEU 81 HD21 LEU 81 12.235 -4.422 -0.038 622 HD22 LEU 81 HD22 LEU 81 12.831 -3.924 1.559 623 HD23 LEU 81 HD23 LEU 81 13.303 -3.028 0.129 624 H THR 82 H THR 82 7.630 -3.716 2.826 625 HA THR 82 HA THR 82 8.052 -4.680 5.436 626 HB THR 82 HB THR 82 5.350 -4.299 4.127 627 HG1 THR 82 HG2 THR 82 6.806 -2.459 3.820 628 HG21 THR 82 HG21 THR 82 4.507 -4.059 6.262 629 HG22 THR 82 HG22 THR 82 6.052 -3.564 6.942 630 HG23 THR 82 HG23 THR 82 5.765 -5.258 6.565 631 H VAL 83 H VAL 83 6.131 -6.098 2.743 632 HA VAL 83 HA VAL 83 5.605 -8.459 4.232 633 HB VAL 83 HB VAL 83 4.090 -7.851 2.457 634 HG11 VAL 83 HG11 VAL 83 6.544 -7.918 0.754 635 HG12 VAL 83 HG12 VAL 83 5.098 -6.893 0.661 636 HG13 VAL 83 HG13 VAL 83 5.051 -8.522 0.042 637 HG21 VAL 83 HG21 VAL 83 5.468 -10.408 1.596 638 HG22 VAL 83 HG22 VAL 83 3.776 -10.006 1.441 639 HG23 VAL 83 HG23 VAL 83 4.463 -10.308 3.047 640 H ALA 84 H ALA 84 8.158 -7.525 2.033 641 HA ALA 84 HA ALA 84 9.325 -10.053 1.689 642 HB1 ALA 84 HB1 ALA 84 10.109 -8.241 0.337 643 HB2 ALA 84 HB2 ALA 84 11.461 -8.739 1.356 644 HB3 ALA 84 HB3 ALA 84 10.549 -7.285 1.755 645 H MET 85 H MET 85 10.036 -7.534 4.144 646 HA MET 85 HA MET 85 11.799 -9.264 5.629 647 HB2 MET 85 HB3 MET 85 11.781 -6.757 5.856 648 HB3 MET 85 HB2 MET 85 10.244 -6.905 6.733 649 HG2 MET 85 HG3 MET 85 11.462 -8.531 8.301 650 HG3 MET 85 HG2 MET 85 12.945 -8.040 7.518 651 HE1 MET 85 HE1 MET 85 10.447 -5.885 10.600 652 HE2 MET 85 HE2 MET 85 10.999 -7.556 10.578 653 HE3 MET 85 HE3 MET 85 9.815 -7.030 9.399 654 H ASN 86 H ASN 86 8.390 -8.350 5.885 655 HA ASN 86 HA ASN 86 8.031 -9.741 8.237 656 HB2 ASN 86 HB3 ASN 86 6.022 -8.687 6.274 657 HB3 ASN 86 HB2 ASN 86 5.487 -9.669 7.617 658 HD21 ASN 86 HD21 ASN 86 4.724 -6.978 7.584 659 HD22 ASN 86 HD22 ASN 86 5.540 -6.158 8.828 660 H ASN 87 H ASN 87 8.195 -10.866 5.048 661 HA ASN 87 HA ASN 87 6.776 -13.238 4.976 662 HB2 ASN 87 HB3 ASN 87 8.220 -12.467 3.134 663 HB3 ASN 87 HB2 ASN 87 9.648 -12.772 4.111 664 HD21 ASN 87 HD21 ASN 87 8.817 -14.045 1.513 665 HD22 ASN 87 HD22 ASN 87 8.780 -15.706 1.817 666 H PHE 88 H PHE 88 9.843 -12.526 6.585 667 HA PHE 88 HA PHE 88 10.266 -15.069 7.770 668 HB2 PHE 88 HB3 PHE 88 12.030 -13.367 7.539 669 HB3 PHE 88 HB2 PHE 88 11.191 -12.313 8.651 670 HD1 PHE 88 HD1 PHE 88 12.468 -15.853 8.455 671 HD2 PHE 88 HD2 PHE 88 11.772 -12.393 10.896 672 HE1 PHE 88 HE1 PHE 88 13.593 -16.965 10.350 673 HE2 PHE 88 HE2 PHE 88 12.894 -13.507 12.796 674 HZ PHE 88 HZ PHE 88 13.810 -15.801 12.527 675 H PHE 89 H PHE 89 8.644 -12.136 8.847 676 HA PHE 89 HA PHE 89 8.137 -12.831 11.498 677 HB2 PHE 89 HB3 PHE 89 7.263 -10.780 9.693 678 HB3 PHE 89 HB2 PHE 89 5.933 -11.287 10.690 679 HD1 PHE 89 HD1 PHE 89 6.711 -11.768 13.264 680 HD2 PHE 89 HD2 PHE 89 8.597 -9.030 10.548 681 HE1 PHE 89 HE1 PHE 89 7.646 -10.522 15.177 682 HE2 PHE 89 HE2 PHE 89 9.537 -7.783 12.466 683 HZ PHE 89 HZ PHE 89 9.061 -8.532 14.790 684 H TRP 90 H TRP 90 5.934 -13.307 8.720 685 HA TRP 90 HA TRP 90 3.763 -14.260 10.276 686 HB2 TRP 90 HB3 TRP 90 4.309 -15.548 7.603 687 HB3 TRP 90 HB2 TRP 90 2.787 -15.112 8.344 688 HD1 TRP 90 HD TRP 90 5.769 -13.606 6.602 689 HE1 TRP 90 HE1 TRP 90 5.101 -11.360 5.499 690 HE3 TRP 90 HE3 TRP 90 1.069 -13.135 8.452 691 HZ2 TRP 90 HZ2 TRP 90 2.838 -9.605 5.434 692 HZ3 TRP 90 HZ3 TRP 90 -0.318 -11.167 7.867 693 HH2 TRP 90 HH TRP 90 0.559 -9.412 6.367 694 H GLU 91 H GLU 91 6.387 -15.993 8.751 695 HA GLU 91 HA GLU 91 5.671 -18.550 9.797 696 HB2 GLU 91 HB3 GLU 91 8.233 -17.514 8.607 697 HB3 GLU 91 HB2 GLU 91 7.899 -19.190 8.985 698 HG2 GLU 91 HG3 GLU 91 5.948 -19.240 7.544 699 HG3 GLU 91 HG2 GLU 91 6.135 -17.536 7.166 700 H ASN 92 H ASN 92 7.839 -15.935 10.750 701 HA ASN 92 HA ASN 92 9.510 -17.161 12.443 702 HB2 ASN 92 HB3 ASN 92 9.613 -14.741 12.040 703 HB3 ASN 92 HB2 ASN 92 8.202 -14.518 13.083 704 HD21 ASN 92 HD21 ASN 92 11.616 -15.236 13.068 705 HD22 ASN 92 HD22 ASN 92 11.834 -15.190 14.749 706 H SER 93 H SER 93 9.295 -18.485 14.004 707 HA SER 93 HA SER 93 7.812 -18.073 16.338 708 HB2 SER 93 HB3 SER 93 6.580 -19.731 14.164 709 HB3 SER 93 HB2 SER 93 6.300 -20.174 15.855 710 HG SER 93 HG SER 93 5.970 -17.588 14.729 711 H1 GLY 1 H GLY 1 12.829 4.676 13.240 712 HA2 GLY 1 HA3 GLY 1 11.810 2.929 11.488 713 HA3 GLY 1 HA2 GLY 1 11.286 2.226 13.010 714 H SER 2 H SER 2 10.380 4.287 10.603 715 HA SER 2 HA SER 2 9.074 6.262 12.219 716 HB2 SER 2 HB3 SER 2 9.009 5.707 9.266 717 HB3 SER 2 HB2 SER 2 8.187 7.048 10.059 718 HG SER 2 HG SER 2 10.044 7.887 9.606 719 H GLU 3 H GLU 3 6.762 6.807 11.787 720 HA GLU 3 HA GLU 3 5.074 4.870 12.821 721 HB2 GLU 3 HB3 GLU 3 4.217 7.166 11.043 722 HB3 GLU 3 HB2 GLU 3 3.286 6.394 12.315 723 HG2 GLU 3 HG3 GLU 3 4.038 8.173 13.532 724 HG3 GLU 3 HG2 GLU 3 5.427 7.136 13.794 725 H LEU 4 H LEU 4 6.104 5.439 9.612 726 HA LEU 4 HA LEU 4 4.010 4.209 8.157 727 HB2 LEU 4 HB3 LEU 4 6.980 4.284 7.499 728 HB3 LEU 4 HB2 LEU 4 5.721 3.787 6.408 729 HG LEU 4 HG LEU 4 5.918 5.988 5.742 730 HD11 LEU 4 HD11 LEU 4 4.065 7.246 6.477 731 HD12 LEU 4 HD12 LEU 4 4.082 6.530 8.073 732 HD13 LEU 4 HD13 LEU 4 3.555 5.576 6.676 733 HD21 LEU 4 HD21 LEU 4 7.204 7.434 6.868 734 HD22 LEU 4 HD22 LEU 4 7.341 6.282 8.165 735 HD23 LEU 4 HD23 LEU 4 6.072 7.506 8.210 736 H GLU 5 H GLU 5 6.873 2.894 9.727 737 HA GLU 5 HA GLU 5 6.557 0.254 8.795 738 HB2 GLU 5 HB3 GLU 5 7.651 1.308 11.394 739 HB3 GLU 5 HB2 GLU 5 7.867 -0.348 10.833 740 HG2 GLU 5 HG3 GLU 5 8.971 0.675 8.721 741 HG3 GLU 5 HG2 GLU 5 8.856 2.196 9.536 742 H THR 6 H THR 6 5.317 1.950 11.641 743 HA THR 6 HA THR 6 3.809 -0.234 12.682 744 HB THR 6 HB THR 6 3.074 2.693 12.940 745 HG1 THR 6 HG2 THR 6 5.375 1.523 13.594 746 HG21 THR 6 HG21 THR 6 1.644 0.658 13.806 747 HG22 THR 6 HG22 THR 6 1.894 2.046 14.827 748 HG23 THR 6 HG23 THR 6 2.852 0.583 15.078 749 H ALA 7 H ALA 7 3.055 2.458 10.512 750 HA ALA 7 HA ALA 7 0.356 1.914 10.049 751 HB1 ALA 7 HB1 ALA 7 1.650 3.939 9.268 752 HB2 ALA 7 HB2 ALA 7 0.574 3.245 8.056 753 HB3 ALA 7 HB3 ALA 7 2.297 2.931 7.974 754 H MET 8 H MET 8 3.219 0.824 8.253 755 HA MET 8 HA MET 8 1.785 -0.842 6.466 756 HB2 MET 8 HB3 MET 8 4.699 -0.945 7.315 757 HB3 MET 8 HB2 MET 8 4.013 -1.842 5.963 758 HG2 MET 8 HG3 MET 8 4.128 1.192 6.239 759 HG3 MET 8 HG2 MET 8 5.012 0.205 5.090 760 HE1 MET 8 HE1 MET 8 2.951 -0.845 2.510 761 HE2 MET 8 HE2 MET 8 2.313 -1.833 3.809 762 HE3 MET 8 HE3 MET 8 4.036 -1.431 3.785 763 H GLU 9 H GLU 9 3.377 -1.434 9.582 764 HA GLU 9 HA GLU 9 2.921 -4.202 9.602 765 HB2 GLU 9 HB3 GLU 9 3.410 -2.232 11.822 766 HB3 GLU 9 HB2 GLU 9 3.201 -3.955 12.131 767 HG2 GLU 9 HG3 GLU 9 5.058 -4.481 10.650 768 HG3 GLU 9 HG2 GLU 9 5.281 -2.801 10.225 769 H THR 10 H THR 10 0.972 -1.459 10.644 770 HA THR 10 HA THR 10 -1.004 -2.910 12.010 771 HB THR 10 HB THR 10 -1.617 -0.462 10.324 772 HG1 THR 10 HG2 THR 10 0.344 -0.429 11.849 773 HG21 THR 10 HG21 THR 10 -3.369 -1.872 11.657 774 HG22 THR 10 HG22 THR 10 -3.380 -0.118 11.797 775 HG23 THR 10 HG23 THR 10 -2.638 -1.105 13.063 776 H LEU 11 H LEU 11 -0.626 -2.053 8.606 777 HA LEU 11 HA LEU 11 -2.946 -3.389 7.654 778 HB2 LEU 11 HB3 LEU 11 -0.329 -2.682 6.287 779 HB3 LEU 11 HB2 LEU 11 -1.708 -3.393 5.455 780 HG LEU 11 HG LEU 11 -1.912 -0.803 7.031 781 HD11 LEU 11 HD11 LEU 11 -1.743 0.364 4.925 782 HD12 LEU 11 HD12 LEU 11 -1.532 -1.129 4.044 783 HD13 LEU 11 HD13 LEU 11 -0.273 -0.571 5.162 784 HD21 LEU 11 HD21 LEU 11 -4.055 -2.182 6.414 785 HD22 LEU 11 HD22 LEU 11 -3.624 -1.843 4.752 786 HD23 LEU 11 HD23 LEU 11 -3.981 -0.518 5.845 787 H ILE 12 H ILE 12 0.399 -4.409 8.199 788 HA ILE 12 HA ILE 12 0.162 -7.014 7.118 789 HB ILE 12 HB ILE 12 1.949 -5.959 9.348 790 HG12 ILE 12 HG13 ILE 12 2.163 -5.070 6.934 791 HG13 ILE 12 HG12 ILE 12 3.630 -5.681 7.659 792 HG21 ILE 12 HG21 ILE 12 3.293 -8.107 8.495 793 HG22 ILE 12 HG22 ILE 12 1.648 -8.698 8.304 794 HG23 ILE 12 HG23 ILE 12 2.200 -8.104 9.855 795 HD11 ILE 12 HD11 ILE 12 3.524 -7.707 6.376 796 HD12 ILE 12 HD12 ILE 12 3.075 -6.433 5.271 797 HD13 ILE 12 HD13 ILE 12 1.826 -7.452 5.952 798 H ASN 13 H ASN 13 -0.318 -5.740 10.378 799 HA ASN 13 HA ASN 13 -0.974 -8.188 11.633 800 HB2 ASN 13 HB3 ASN 13 -1.667 -5.317 12.272 801 HB3 ASN 13 HB2 ASN 13 -2.206 -6.656 13.274 802 HD21 ASN 13 HD21 ASN 13 0.492 -4.631 12.556 803 HD22 ASN 13 HD22 ASN 13 1.612 -5.417 13.556 804 H VAL 14 H VAL 14 -2.933 -5.739 10.062 805 HA VAL 14 HA VAL 14 -5.468 -6.988 10.427 806 HB VAL 14 HB VAL 14 -4.385 -4.995 8.437 807 HG11 VAL 14 HG11 VAL 14 -7.305 -5.752 8.776 808 HG12 VAL 14 HG12 VAL 14 -6.287 -6.388 7.481 809 HG13 VAL 14 HG13 VAL 14 -6.572 -4.658 7.605 810 HG21 VAL 14 HG21 VAL 14 -6.256 -4.821 10.810 811 HG22 VAL 14 HG22 VAL 14 -5.910 -3.508 9.706 812 HG23 VAL 14 HG23 VAL 14 -4.624 -4.159 10.722 813 H PHE 15 H PHE 15 -3.116 -7.029 7.810 814 HA PHE 15 HA PHE 15 -4.464 -8.744 6.053 815 HB2 PHE 15 HB3 PHE 15 -2.412 -7.428 5.522 816 HB3 PHE 15 HB2 PHE 15 -1.476 -8.529 6.524 817 HD1 PHE 15 HD2 PHE 15 -1.121 -10.857 5.859 818 HD2 PHE 15 HD1 PHE 15 -3.342 -8.140 3.378 819 HE1 PHE 15 HE2 PHE 15 -0.938 -12.427 3.991 820 HE2 PHE 15 HE1 PHE 15 -3.162 -9.722 1.496 821 HZ PHE 15 HZ PHE 15 -1.949 -11.882 1.809 822 H HIS 16 H HIS 16 -2.185 -9.328 8.656 823 HA HIS 16 HA HIS 16 -1.888 -12.098 8.598 824 HB2 HIS 16 HB3 HIS 16 -1.155 -10.023 10.311 825 HB3 HIS 16 HB2 HIS 16 -2.206 -10.995 11.305 826 HD1 HIS 16 HD1 HIS 16 -1.529 -13.818 10.702 827 HD2 HIS 16 HD2 HIS 16 1.391 -10.836 10.700 828 HE1 HIS 16 HE1 HIS 16 0.693 -14.974 11.070 829 HE2 HIS 16 HE2 HIS 16 2.480 -13.148 11.094 830 H ALA 17 H ALA 17 -4.314 -10.152 10.284 831 HA ALA 17 HA ALA 17 -5.709 -12.329 11.401 832 HB1 ALA 17 HB1 ALA 17 -6.002 -10.091 12.308 833 HB2 ALA 17 HB2 ALA 17 -7.550 -10.745 11.808 834 HB3 ALA 17 HB3 ALA 17 -6.740 -9.550 10.795 835 H HIS 18 H HIS 18 -6.335 -10.485 8.433 836 HA HIS 18 HA HIS 18 -8.709 -11.888 7.820 837 HB2 HIS 18 HB3 HIS 18 -6.918 -10.146 6.130 838 HB3 HIS 18 HB2 HIS 18 -8.340 -10.937 5.471 839 HD1 HIS 18 HD1 HIS 18 -10.732 -10.300 6.595 840 HD2 HIS 18 HD2 HIS 18 -7.489 -7.903 7.738 841 HE1 HIS 18 HE1 HIS 18 -11.691 -8.214 7.707 842 HE2 HIS 18 HE2 HIS 18 -9.746 -6.751 8.401 843 H SER 19 H SER 19 -5.350 -12.496 6.847 844 HA SER 19 HA SER 19 -5.803 -14.490 4.939 845 HB2 SER 19 HB3 SER 19 -3.649 -14.307 7.050 846 HB3 SER 19 HB2 SER 19 -3.612 -15.444 5.718 847 HG SER 19 HG SER 19 -3.894 -13.473 4.381 848 H GLY 20 H GLY 20 -5.707 -14.673 8.442 849 HA2 GLY 20 HA3 GLY 20 -5.980 -17.455 8.755 850 HA3 GLY 20 HA2 GLY 20 -6.443 -16.235 9.934 851 H LYS 21 H LYS 21 -8.380 -14.889 8.323 852 HA LYS 21 HA LYS 21 -10.599 -16.397 9.053 853 HB2 LYS 21 HB3 LYS 21 -10.373 -13.984 7.276 854 HB3 LYS 21 HB2 LYS 21 -11.913 -14.723 7.706 855 HG2 LYS 21 HG3 LYS 21 -11.360 -14.510 10.111 856 HG3 LYS 21 HG2 LYS 21 -9.843 -13.743 9.675 857 HD2 LYS 21 HD3 LYS 21 -10.987 -11.888 8.631 858 HD3 LYS 21 HD2 LYS 21 -12.557 -12.635 8.895 859 HE2 LYS 21 HE2 LYS 21 -10.666 -12.139 11.156 860 HE3 LYS 21 HE1 LYS 21 -11.763 -10.842 10.629 861 HZ1 LYS 21 HZ1 LYS 21 -13.624 -12.162 11.209 862 HZ2 LYS 21 HZ2 LYS 21 -12.535 -12.380 12.489 863 HZ3 LYS 21 HZ3 LYS 21 -12.717 -13.576 11.305 864 H GLU 22 H GLU 22 -9.168 -15.849 5.826 865 HA GLU 22 HA GLU 22 -11.099 -17.541 4.506 866 HB2 GLU 22 HB3 GLU 22 -8.416 -16.492 3.495 867 HB3 GLU 22 HB2 GLU 22 -9.611 -17.353 2.562 868 HG2 GLU 22 HG3 GLU 22 -11.292 -15.598 2.969 869 HG3 GLU 22 HG2 GLU 22 -10.128 -14.841 4.060 870 H GLY 23 H GLY 23 -7.774 -17.900 5.667 871 HA2 GLY 23 HA3 GLY 23 -7.748 -20.220 6.827 872 HA3 GLY 23 HA2 GLY 23 -7.958 -20.796 5.181 873 H ASP 24 H ASP 24 -6.167 -18.545 4.176 874 HA ASP 24 HA ASP 24 -3.796 -20.084 4.172 875 HB2 ASP 24 HB3 ASP 24 -4.465 -18.291 2.422 876 HB3 ASP 24 HB2 ASP 24 -3.783 -17.142 3.551 877 H LYS 25 H LYS 25 -1.882 -19.897 5.205 878 HA LYS 25 HA LYS 25 -1.902 -18.920 7.853 879 HB2 LYS 25 HB3 LYS 25 0.630 -19.293 7.697 880 HB3 LYS 25 HB2 LYS 25 -0.410 -20.689 7.451 881 HG2 LYS 25 HG3 LYS 25 -0.185 -20.413 4.967 882 HG3 LYS 25 HG2 LYS 25 0.865 -19.027 5.245 883 HD2 LYS 25 HD3 LYS 25 2.448 -20.500 6.487 884 HD3 LYS 25 HD2 LYS 25 1.404 -21.860 6.150 885 HE2 LYS 25 HE2 LYS 25 1.918 -21.899 3.862 886 HE3 LYS 25 HE1 LYS 25 2.362 -20.195 3.840 887 HZ1 LYS 25 HZ1 LYS 25 4.361 -20.663 4.988 888 HZ2 LYS 25 HZ2 LYS 25 4.268 -21.724 3.683 889 HZ3 LYS 25 HZ3 LYS 25 3.972 -22.283 5.239 890 H TYR 26 H TYR 26 -0.601 -17.617 4.865 891 HA TYR 26 HA TYR 26 -1.095 -14.993 5.827 892 HB2 TYR 26 HB3 TYR 26 1.378 -14.246 5.147 893 HB3 TYR 26 HB2 TYR 26 0.973 -14.760 6.778 894 HD1 TYR 26 HD1 TYR 26 1.588 -16.910 7.606 895 HD2 TYR 26 HD2 TYR 26 2.671 -15.745 3.643 896 HE1 TYR 26 HE1 TYR 26 3.190 -18.808 7.499 897 HE2 TYR 26 HE2 TYR 26 4.263 -17.636 3.505 898 HH TYR 26 HH TYR 26 5.629 -19.079 5.414 899 H LYS 27 H LYS 27 -2.431 -14.961 4.068 900 HA LYS 27 HA LYS 27 -1.447 -13.768 1.748 901 HB2 LYS 27 HB3 LYS 27 -2.720 -16.503 1.321 902 HB3 LYS 27 HB2 LYS 27 -2.476 -15.331 0.052 903 HG2 LYS 27 HG3 LYS 27 -0.296 -16.708 1.659 904 HG3 LYS 27 HG2 LYS 27 -0.738 -17.048 0.016 905 HD2 LYS 27 HD3 LYS 27 0.165 -14.199 0.707 906 HD3 LYS 27 HD2 LYS 27 1.318 -15.479 0.493 907 HE2 LYS 27 HE2 LYS 27 0.207 -16.019 -1.739 908 HE3 LYS 27 HE1 LYS 27 -0.672 -14.512 -1.580 909 HZ1 LYS 27 HZ1 LYS 27 2.316 -14.683 -1.478 910 HZ2 LYS 27 HZ2 LYS 27 1.433 -13.254 -1.663 911 HZ3 LYS 27 HZ3 LYS 27 1.446 -14.414 -2.866 912 H LEU 28 H LEU 28 -3.437 -13.229 0.272 913 HA LEU 28 HA LEU 28 -5.839 -13.351 1.931 914 HB2 LEU 28 HB3 LEU 28 -4.856 -11.113 2.064 915 HB3 LEU 28 HB2 LEU 28 -4.966 -10.924 0.314 916 HG LEU 28 HG LEU 28 -7.449 -11.335 0.523 917 HD11 LEU 28 HD11 LEU 28 -8.098 -10.736 3.080 918 HD12 LEU 28 HD12 LEU 28 -6.616 -11.642 3.373 919 HD13 LEU 28 HD13 LEU 28 -7.943 -12.376 2.476 920 HD21 LEU 28 HD21 LEU 28 -6.140 -9.049 2.004 921 HD22 LEU 28 HD22 LEU 28 -7.879 -9.136 1.644 922 HD23 LEU 28 HD23 LEU 28 -6.711 -9.064 0.326 923 H SER 29 H SER 29 -7.553 -14.112 0.950 924 HA SER 29 HA SER 29 -7.395 -14.652 -1.924 925 HB2 SER 29 HB3 SER 29 -9.667 -15.748 -0.426 926 HB3 SER 29 HB2 SER 29 -8.563 -16.494 -1.570 927 HG SER 29 HG SER 29 -8.026 -15.810 1.129 928 H LYS 30 H LYS 30 -9.869 -14.658 -2.746 929 HA LYS 30 HA LYS 30 -10.430 -11.828 -2.794 930 HB2 LYS 30 HB3 LYS 30 -11.981 -13.991 -4.201 931 HB3 LYS 30 HB2 LYS 30 -11.840 -12.300 -4.651 932 HG2 LYS 30 HG3 LYS 30 -9.788 -14.501 -4.929 933 HG3 LYS 30 HG2 LYS 30 -10.327 -13.353 -6.139 934 HD2 LYS 30 HD3 LYS 30 -8.720 -12.440 -3.692 935 HD3 LYS 30 HD2 LYS 30 -7.976 -13.005 -5.161 936 HE2 LYS 30 HE2 LYS 30 -10.094 -11.021 -5.686 937 HE3 LYS 30 HE1 LYS 30 -8.786 -10.417 -4.690 938 HZ1 LYS 30 HZ1 LYS 30 -7.233 -10.723 -6.302 939 HZ2 LYS 30 HZ2 LYS 30 -8.567 -10.428 -7.313 940 HZ3 LYS 30 HZ3 LYS 30 -8.014 -11.997 -7.036 941 H LYS 31 H LYS 31 -11.402 -14.149 -0.717 942 HA LYS 31 HA LYS 31 -14.235 -13.541 -0.496 943 HB2 LYS 31 HB3 LYS 31 -12.805 -14.752 1.845 944 HB3 LYS 31 HB2 LYS 31 -14.314 -15.183 1.067 945 HG2 LYS 31 HG3 LYS 31 -13.127 -16.270 -0.808 946 HG3 LYS 31 HG2 LYS 31 -11.633 -15.652 -0.192 947 HD2 LYS 31 HD3 LYS 31 -11.830 -16.992 1.843 948 HD3 LYS 31 HD2 LYS 31 -13.333 -17.680 1.239 949 HE2 LYS 31 HE2 LYS 31 -10.857 -17.680 -0.391 950 HE3 LYS 31 HE1 LYS 31 -11.085 -18.987 0.726 951 HZ1 LYS 31 HZ1 LYS 31 -13.380 -18.321 -0.997 952 HZ2 LYS 31 HZ2 LYS 31 -12.827 -19.831 -0.519 953 HZ3 LYS 31 HZ3 LYS 31 -12.055 -19.001 -1.776 954 H GLU 32 H GLU 32 -11.541 -13.214 1.770 955 HA GLU 32 HA GLU 32 -12.832 -11.333 3.455 956 HB2 GLU 32 HB3 GLU 32 -10.002 -12.280 3.186 957 HB3 GLU 32 HB2 GLU 32 -10.441 -11.020 4.341 958 HG2 GLU 32 HG3 GLU 32 -11.773 -13.724 4.198 959 HG3 GLU 32 HG2 GLU 32 -10.417 -13.349 5.270 960 H LEU 33 H LEU 33 -10.641 -11.005 0.772 961 HA LEU 33 HA LEU 33 -9.669 -8.492 1.289 962 HB2 LEU 33 HB3 LEU 33 -8.805 -9.866 -0.512 963 HB3 LEU 33 HB2 LEU 33 -10.327 -9.715 -1.374 964 HG LEU 33 HG LEU 33 -8.301 -8.238 -2.102 965 HD11 LEU 33 HD11 LEU 33 -10.759 -6.574 -1.718 966 HD12 LEU 33 HD12 LEU 33 -10.886 -8.042 -2.674 967 HD13 LEU 33 HD13 LEU 33 -9.741 -6.783 -3.129 968 HD21 LEU 33 HD21 LEU 33 -7.771 -6.354 -0.901 969 HD22 LEU 33 HD22 LEU 33 -8.184 -7.385 0.460 970 HD23 LEU 33 HD23 LEU 33 -9.347 -6.211 -0.146 971 H LYS 34 H LYS 34 -12.676 -9.229 -0.478 972 HA LYS 34 HA LYS 34 -13.300 -6.527 -1.072 973 HB2 LYS 34 HB3 LYS 34 -15.195 -8.847 -0.564 974 HB3 LYS 34 HB2 LYS 34 -15.614 -7.322 -1.324 975 HG2 LYS 34 HG3 LYS 34 -14.013 -7.775 -3.161 976 HG3 LYS 34 HG2 LYS 34 -13.595 -9.315 -2.404 977 HD2 LYS 34 HD3 LYS 34 -16.200 -9.764 -2.488 978 HD3 LYS 34 HD2 LYS 34 -16.171 -8.501 -3.708 979 HE2 LYS 34 HE2 LYS 34 -15.859 -10.357 -5.047 980 HE3 LYS 34 HE1 LYS 34 -14.182 -9.932 -4.736 981 HZ1 LYS 34 HZ1 LYS 34 -14.106 -11.614 -2.945 982 HZ2 LYS 34 HZ2 LYS 34 -14.697 -12.325 -4.335 983 HZ3 LYS 34 HZ3 LYS 34 -15.749 -11.882 -3.120 984 H GLU 35 H GLU 35 -14.157 -8.679 1.558 985 HA GLU 35 HA GLU 35 -15.746 -6.833 3.008 986 HB2 GLU 35 HB3 GLU 35 -14.507 -9.135 4.445 987 HB3 GLU 35 HB2 GLU 35 -16.175 -8.564 4.442 988 HG2 GLU 35 HG3 GLU 35 -16.062 -9.344 1.857 989 HG3 GLU 35 HG2 GLU 35 -14.781 -10.350 2.539 990 H LEU 36 H LEU 36 -12.431 -7.879 3.169 991 HA LEU 36 HA LEU 36 -11.583 -6.633 5.531 992 HB2 LEU 36 HB3 LEU 36 -10.040 -8.157 4.718 993 HB3 LEU 36 HB2 LEU 36 -10.325 -7.707 3.052 994 HG LEU 36 HG LEU 36 -9.080 -5.710 3.260 995 HD11 LEU 36 HD11 LEU 36 -8.793 -4.737 5.240 996 HD12 LEU 36 HD12 LEU 36 -7.716 -6.052 5.772 997 HD13 LEU 36 HD13 LEU 36 -9.447 -6.124 6.107 998 HD21 LEU 36 HD21 LEU 36 -6.845 -6.963 4.222 999 HD22 LEU 36 HD22 LEU 36 -7.547 -7.170 2.621 1000 HD23 LEU 36 HD23 LEU 36 -7.919 -8.333 3.902 1001 H LEU 37 H LEU 37 -11.565 -5.497 2.180 1002 HA LEU 37 HA LEU 37 -10.340 -3.051 2.799 1003 HB2 LEU 37 HB3 LEU 37 -10.343 -3.863 0.510 1004 HB3 LEU 37 HB2 LEU 37 -12.100 -3.814 0.439 1005 HG LEU 37 HG LEU 37 -10.790 -1.903 -0.676 1006 HD11 LEU 37 HD11 LEU 37 -13.316 -1.973 0.419 1007 HD12 LEU 37 HD12 LEU 37 -12.672 -0.658 -0.547 1008 HD13 LEU 37 HD13 LEU 37 -12.621 -0.549 1.198 1009 HD21 LEU 37 HD21 LEU 37 -9.347 -1.657 1.523 1010 HD22 LEU 37 HD22 LEU 37 -10.694 -0.657 2.061 1011 HD23 LEU 37 HD23 LEU 37 -9.812 -0.232 0.611 1012 H GLN 38 H GLN 38 -13.785 -3.857 2.492 1013 HA GLN 38 HA GLN 38 -14.638 -1.211 3.145 1014 HB2 GLN 38 HB3 GLN 38 -16.858 -2.196 3.630 1015 HB3 GLN 38 HB2 GLN 38 -16.236 -2.761 2.084 1016 HG2 GLN 38 HG3 GLN 38 -15.536 -4.827 3.057 1017 HG3 GLN 38 HG2 GLN 38 -15.979 -4.312 4.689 1018 HE21 GLN 38 HE21 GLN 38 -17.910 -5.363 5.269 1019 HE22 GLN 38 HE22 GLN 38 -19.212 -5.607 4.214 1020 H THR 39 H THR 39 -13.931 -4.050 5.052 1021 HA THR 39 HA THR 39 -14.967 -3.185 7.489 1022 HB THR 39 HB THR 39 -12.726 -5.097 6.871 1023 HG1 THR 39 HG2 THR 39 -14.530 -5.876 6.022 1024 HG21 THR 39 HG21 THR 39 -13.694 -6.005 9.191 1025 HG22 THR 39 HG22 THR 39 -13.971 -4.268 9.442 1026 HG23 THR 39 HG23 THR 39 -12.358 -4.871 9.057 1027 H GLU 40 H GLU 40 -11.603 -2.955 6.309 1028 HA GLU 40 HA GLU 40 -10.818 -1.595 8.746 1029 HB2 GLU 40 HB3 GLU 40 -9.117 -1.915 6.296 1030 HB3 GLU 40 HB2 GLU 40 -8.610 -1.706 7.962 1031 HG2 GLU 40 HG3 GLU 40 -10.079 -4.152 6.907 1032 HG3 GLU 40 HG2 GLU 40 -8.342 -4.015 7.253 1033 H LEU 41 H LEU 41 -11.415 -0.670 5.450 1034 HA LEU 41 HA LEU 41 -10.622 2.105 5.982 1035 HB2 LEU 41 HB3 LEU 41 -11.295 0.483 3.588 1036 HB3 LEU 41 HB2 LEU 41 -11.487 2.198 3.447 1037 HG LEU 41 HG LEU 41 -9.099 2.464 4.337 1038 HD11 LEU 41 HD11 LEU 41 -7.702 0.338 3.895 1039 HD12 LEU 41 HD12 LEU 41 -9.226 -0.537 4.062 1040 HD13 LEU 41 HD13 LEU 41 -8.609 0.435 5.400 1041 HD21 LEU 41 HD21 LEU 41 -8.511 0.943 1.956 1042 HD22 LEU 41 HD22 LEU 41 -8.545 2.683 2.161 1043 HD23 LEU 41 HD23 LEU 41 -10.018 1.816 1.715 1044 H SER 42 H SER 42 -12.732 1.346 7.544 1045 HA SER 42 HA SER 42 -15.271 1.480 6.581 1046 HB2 SER 42 HB3 SER 42 -14.368 2.762 9.148 1047 HB3 SER 42 HB2 SER 42 -15.974 2.154 8.787 1048 HG SER 42 HG SER 42 -15.093 0.056 8.663 1049 H GLY 43 H GLY 43 -13.252 4.295 7.466 1050 HA2 GLY 43 HA3 GLY 43 -15.262 6.250 6.891 1051 HA3 GLY 43 HA2 GLY 43 -13.548 6.548 7.136 1052 H PHE 44 H PHE 44 -12.472 4.959 5.189 1053 HA PHE 44 HA PHE 44 -12.743 6.574 2.822 1054 HB2 PHE 44 HB3 PHE 44 -11.223 4.118 3.516 1055 HB3 PHE 44 HB2 PHE 44 -11.368 4.511 1.803 1056 HD1 PHE 44 HD2 PHE 44 -10.337 6.621 0.953 1057 HD2 PHE 44 HD1 PHE 44 -9.907 5.392 5.038 1058 HE1 PHE 44 HE2 PHE 44 -8.444 8.215 1.242 1059 HE2 PHE 44 HE1 PHE 44 -8.015 6.980 5.317 1060 HZ PHE 44 HZ PHE 44 -7.292 8.382 3.423 1061 H LEU 45 H LEU 45 -13.950 3.459 3.841 1062 HA LEU 45 HA LEU 45 -15.051 2.536 1.457 1063 HB2 LEU 45 HB3 LEU 45 -15.090 0.918 3.085 1064 HB3 LEU 45 HB2 LEU 45 -15.508 2.055 4.354 1065 HG LEU 45 HG LEU 45 -17.780 2.209 3.527 1066 HD11 LEU 45 HD11 LEU 45 -18.259 1.694 1.423 1067 HD12 LEU 45 HD12 LEU 45 -18.034 -0.011 1.778 1068 HD13 LEU 45 HD13 LEU 45 -16.690 0.943 1.146 1069 HD21 LEU 45 HD21 LEU 45 -18.074 -0.556 3.656 1070 HD22 LEU 45 HD22 LEU 45 -18.054 0.557 5.017 1071 HD23 LEU 45 HD23 LEU 45 -16.575 -0.248 4.524 1072 H ASP 46 H ASP 46 -16.486 4.562 3.973 1073 HA ASP 46 HA ASP 46 -18.993 4.782 2.673 1074 HB2 ASP 46 HB3 ASP 46 -18.635 5.308 5.012 1075 HB3 ASP 46 HB2 ASP 46 -17.732 6.758 4.571 1076 H ALA 47 H ALA 47 -16.091 6.754 2.587 1077 HA ALA 47 HA ALA 47 -17.161 8.767 0.879 1078 HB1 ALA 47 HB1 ALA 47 -14.297 8.022 1.498 1079 HB2 ALA 47 HB2 ALA 47 -15.242 9.321 2.203 1080 HB3 ALA 47 HB3 ALA 47 -14.766 9.400 0.502 1081 H GLN 48 H GLN 48 -15.295 5.817 0.203 1082 HA GLN 48 HA GLN 48 -15.012 6.444 -2.567 1083 HB2 GLN 48 HB3 GLN 48 -14.329 4.048 -2.852 1084 HB3 GLN 48 HB2 GLN 48 -13.410 4.901 -1.621 1085 HG2 GLN 48 HG3 GLN 48 -14.066 3.483 -0.052 1086 HG3 GLN 48 HG2 GLN 48 -15.777 3.743 -0.449 1087 HE21 GLN 48 HE21 GLN 48 -16.733 1.765 -0.922 1088 HE22 GLN 48 HE22 GLN 48 -15.986 0.489 -1.750 1089 H LYS 49 H LYS 49 -17.725 5.582 -0.896 1090 HA LYS 49 HA LYS 49 -19.008 3.762 -2.599 1091 HB2 LYS 49 HB3 LYS 49 -20.247 6.036 -1.042 1092 HB3 LYS 49 HB2 LYS 49 -21.128 4.716 -1.792 1093 HG2 LYS 49 HG3 LYS 49 -19.659 3.125 -0.399 1094 HG3 LYS 49 HG2 LYS 49 -19.185 4.539 0.523 1095 HD2 LYS 49 HD3 LYS 49 -21.903 3.268 0.303 1096 HD3 LYS 49 HD2 LYS 49 -21.012 3.694 1.757 1097 HE2 LYS 49 HE2 LYS 49 -22.321 5.668 -0.176 1098 HE3 LYS 49 HE1 LYS 49 -22.882 5.227 1.425 1099 HZ1 LYS 49 HZ1 LYS 49 -20.173 6.451 1.032 1100 HZ2 LYS 49 HZ2 LYS 49 -21.103 6.325 2.460 1101 HZ3 LYS 49 HZ3 LYS 49 -21.588 7.327 1.202 1102 H ASP 50 H ASP 50 -18.680 7.222 -2.686 1103 HA ASP 50 HA ASP 50 -20.090 7.326 -5.279 1104 HB2 ASP 50 HB3 ASP 50 -20.968 8.692 -3.299 1105 HB3 ASP 50 HB2 ASP 50 -19.522 9.680 -3.496 1106 H VAL 51 H VAL 51 -17.443 6.434 -5.124 1107 HA VAL 51 HA VAL 51 -16.060 8.614 -6.566 1108 HB VAL 51 HB VAL 51 -14.937 6.417 -4.823 1109 HG11 VAL 51 HG11 VAL 51 -13.575 8.221 -6.805 1110 HG12 VAL 51 HG12 VAL 51 -13.401 6.469 -6.610 1111 HG13 VAL 51 HG13 VAL 51 -12.712 7.563 -5.421 1112 HG21 VAL 51 HG21 VAL 51 -14.630 9.438 -4.693 1113 HG22 VAL 51 HG22 VAL 51 -13.982 8.291 -3.548 1114 HG23 VAL 51 HG23 VAL 51 -15.730 8.520 -3.670 1115 H ASP 52 H ASP 52 -15.482 8.174 -8.585 1116 HA ASP 52 HA ASP 52 -16.565 6.020 -10.011 1117 HB2 ASP 52 HB3 ASP 52 -16.060 8.165 -11.017 1118 HB3 ASP 52 HB2 ASP 52 -14.339 7.900 -10.728 1119 H ALA 53 H ALA 53 -13.327 6.569 -8.815 1120 HA ALA 53 HA ALA 53 -11.957 4.645 -10.256 1121 HB1 ALA 53 HB1 ALA 53 -10.563 6.142 -9.202 1122 HB2 ALA 53 HB2 ALA 53 -10.316 4.692 -8.249 1123 HB3 ALA 53 HB3 ALA 53 -11.382 5.973 -7.645 1124 H VAL 54 H VAL 54 -13.678 4.170 -7.208 1125 HA VAL 54 HA VAL 54 -12.473 1.841 -6.405 1126 HB VAL 54 HB VAL 54 -14.085 2.963 -4.964 1127 HG11 VAL 54 HG11 VAL 54 -15.663 3.361 -7.090 1128 HG12 VAL 54 HG12 VAL 54 -16.286 3.316 -5.453 1129 HG13 VAL 54 HG13 VAL 54 -16.440 1.899 -6.467 1130 HG21 VAL 54 HG21 VAL 54 -13.723 0.345 -4.956 1131 HG22 VAL 54 HG22 VAL 54 -15.390 0.304 -5.520 1132 HG23 VAL 54 HG23 VAL 54 -14.998 1.054 -3.978 1133 H ASP 55 H ASP 55 -15.179 2.141 -8.670 1134 HA ASP 55 HA ASP 55 -15.562 -0.625 -9.110 1135 HB2 ASP 55 HB3 ASP 55 -17.078 1.293 -9.828 1136 HB3 ASP 55 HB2 ASP 55 -15.974 1.535 -11.180 1137 H LYS 56 H LYS 56 -13.484 1.780 -10.536 1138 HA LYS 56 HA LYS 56 -12.384 0.119 -12.610 1139 HB2 LYS 56 HB3 LYS 56 -10.907 2.459 -11.414 1140 HB3 LYS 56 HB2 LYS 56 -10.930 1.900 -13.069 1141 HG2 LYS 56 HG3 LYS 56 -13.249 3.208 -11.618 1142 HG3 LYS 56 HG2 LYS 56 -12.226 3.962 -12.824 1143 HD2 LYS 56 HD3 LYS 56 -12.916 2.276 -14.465 1144 HD3 LYS 56 HD2 LYS 56 -14.043 1.570 -13.323 1145 HE2 LYS 56 HE2 LYS 56 -14.119 4.455 -14.284 1146 HE3 LYS 56 HE1 LYS 56 -15.215 3.185 -14.804 1147 HZ1 LYS 56 HZ1 LYS 56 -14.977 3.834 -11.884 1148 HZ2 LYS 56 HZ2 LYS 56 -16.307 3.189 -12.734 1149 HZ3 LYS 56 HZ3 LYS 56 -15.872 4.779 -12.915 1150 H VAL 57 H VAL 57 -11.334 1.076 -9.377 1151 HA VAL 57 HA VAL 57 -8.829 -0.166 -9.399 1152 HB VAL 57 HB VAL 57 -10.638 0.559 -7.080 1153 HG11 VAL 57 HG11 VAL 57 -9.043 -1.208 -6.392 1154 HG12 VAL 57 HG12 VAL 57 -8.647 0.336 -5.660 1155 HG13 VAL 57 HG13 VAL 57 -7.718 -0.241 -7.044 1156 HG21 VAL 57 HG21 VAL 57 -8.089 1.871 -8.027 1157 HG22 VAL 57 HG22 VAL 57 -9.311 2.552 -6.951 1158 HG23 VAL 57 HG23 VAL 57 -9.653 2.352 -8.666 1159 H MET 58 H MET 58 -11.935 -1.412 -8.282 1160 HA MET 58 HA MET 58 -10.907 -3.809 -7.215 1161 HB2 MET 58 HB3 MET 58 -13.201 -4.700 -7.370 1162 HB3 MET 58 HB2 MET 58 -13.165 -3.102 -6.641 1163 HG2 MET 58 HG3 MET 58 -13.804 -2.066 -8.780 1164 HG3 MET 58 HG2 MET 58 -13.759 -3.645 -9.572 1165 HE1 MET 58 HE1 MET 58 -15.585 -2.650 -5.857 1166 HE2 MET 58 HE2 MET 58 -16.717 -1.721 -6.808 1167 HE3 MET 58 HE3 MET 58 -15.009 -1.407 -6.981 1168 H LYS 59 H LYS 59 -11.164 -2.806 -10.454 1169 HA LYS 59 HA LYS 59 -11.742 -5.237 -11.715 1170 HB2 LYS 59 HB3 LYS 59 -11.703 -3.062 -12.936 1171 HB3 LYS 59 HB2 LYS 59 -9.957 -3.032 -12.746 1172 HG2 LYS 59 HG3 LYS 59 -10.241 -3.920 -14.895 1173 HG3 LYS 59 HG2 LYS 59 -9.921 -5.352 -13.952 1174 HD2 LYS 59 HD3 LYS 59 -12.797 -4.451 -14.346 1175 HD3 LYS 59 HD2 LYS 59 -11.960 -5.247 -15.655 1176 HE2 LYS 59 HE2 LYS 59 -12.849 -6.397 -13.030 1177 HE3 LYS 59 HE1 LYS 59 -12.902 -7.078 -14.635 1178 HZ1 LYS 59 HZ1 LYS 59 -10.423 -7.424 -14.507 1179 HZ2 LYS 59 HZ2 LYS 59 -11.386 -8.229 -13.392 1180 HZ3 LYS 59 HZ3 LYS 59 -10.473 -6.924 -12.863 1181 H GLU 60 H GLU 60 -8.644 -3.713 -10.822 1182 HA GLU 60 HA GLU 60 -6.986 -5.771 -11.760 1183 HB2 GLU 60 HB3 GLU 60 -6.640 -3.768 -9.537 1184 HB3 GLU 60 HB2 GLU 60 -5.385 -4.889 -10.038 1185 HG2 GLU 60 HG3 GLU 60 -4.852 -3.010 -11.317 1186 HG3 GLU 60 HG2 GLU 60 -5.802 -3.958 -12.444 1187 H LEU 61 H LEU 61 -8.635 -5.272 -8.697 1188 HA LEU 61 HA LEU 61 -7.510 -7.532 -7.416 1189 HB2 LEU 61 HB3 LEU 61 -10.029 -5.942 -6.951 1190 HB3 LEU 61 HB2 LEU 61 -9.771 -7.440 -6.083 1191 HG LEU 61 HG LEU 61 -8.943 -5.369 -4.887 1192 HD11 LEU 61 HD11 LEU 61 -7.083 -6.486 -3.939 1193 HD12 LEU 61 HD12 LEU 61 -6.683 -7.301 -5.437 1194 HD13 LEU 61 HD13 LEU 61 -8.105 -7.791 -4.525 1195 HD21 LEU 61 HD21 LEU 61 -6.768 -5.467 -7.035 1196 HD22 LEU 61 HD22 LEU 61 -6.751 -4.472 -5.605 1197 HD23 LEU 61 HD23 LEU 61 -7.970 -4.188 -6.843 1198 H ASP 62 H ASP 62 -10.297 -7.001 -9.449 1199 HA ASP 62 HA ASP 62 -11.218 -9.680 -9.454 1200 HB2 ASP 62 HB3 ASP 62 -12.683 -7.949 -10.224 1201 HB3 ASP 62 HB2 ASP 62 -11.578 -7.488 -11.494 1202 H GLU 63 H GLU 63 -8.921 -7.882 -11.500 1203 HA GLU 63 HA GLU 63 -8.340 -9.948 -13.375 1204 HB2 GLU 63 HB3 GLU 63 -6.460 -7.854 -12.194 1205 HB3 GLU 63 HB2 GLU 63 -6.133 -8.808 -13.606 1206 HG2 GLU 63 HG3 GLU 63 -8.371 -6.763 -13.352 1207 HG3 GLU 63 HG2 GLU 63 -6.853 -6.631 -14.198 1208 H ASN 64 H ASN 64 -7.074 -9.000 -10.305 1209 HA ASN 64 HA ASN 64 -5.231 -11.130 -9.892 1210 HB2 ASN 64 HB3 ASN 64 -4.990 -9.039 -8.767 1211 HB3 ASN 64 HB2 ASN 64 -6.567 -9.137 -8.058 1212 HD21 ASN 64 HD21 ASN 64 -3.376 -10.747 -7.929 1213 HD22 ASN 64 HD22 ASN 64 -3.614 -11.401 -6.380 1214 H GLY 65 H GLY 65 -8.448 -11.399 -10.366 1215 HA2 GLY 65 HA3 GLY 65 -9.170 -13.106 -8.133 1216 HA3 GLY 65 HA2 GLY 65 -10.104 -12.803 -9.594 1217 H ASP 66 H ASP 66 -7.296 -13.395 -10.892 1218 HA ASP 66 HA ASP 66 -7.781 -16.107 -11.636 1219 HB2 ASP 66 HB3 ASP 66 -5.500 -14.221 -11.953 1220 HB3 ASP 66 HB2 ASP 66 -5.232 -15.928 -12.273 1221 H GLY 67 H GLY 67 -5.806 -14.524 -9.247 1222 HA2 GLY 67 HA3 GLY 67 -5.231 -17.151 -8.023 1223 HA3 GLY 67 HA2 GLY 67 -3.997 -15.905 -8.235 1224 H GLU 68 H GLU 68 -3.522 -15.208 -6.319 1225 HA GLU 68 HA GLU 68 -5.705 -14.418 -4.509 1226 HB2 GLU 68 HB3 GLU 68 -3.025 -15.629 -3.855 1227 HB3 GLU 68 HB2 GLU 68 -4.060 -14.878 -2.655 1228 HG2 GLU 68 HG3 GLU 68 -5.847 -16.406 -3.092 1229 HG3 GLU 68 HG2 GLU 68 -5.008 -17.179 -4.430 1230 H VAL 69 H VAL 69 -4.871 -12.928 -2.818 1231 HA VAL 69 HA VAL 69 -3.169 -10.838 -3.987 1232 HB VAL 69 HB VAL 69 -5.286 -9.840 -4.132 1233 HG11 VAL 69 HG11 VAL 69 -6.047 -11.136 -1.495 1234 HG12 VAL 69 HG12 VAL 69 -6.573 -11.695 -3.080 1235 HG13 VAL 69 HG13 VAL 69 -7.095 -10.131 -2.482 1236 HG21 VAL 69 HG21 VAL 69 -4.720 -8.038 -2.883 1237 HG22 VAL 69 HG22 VAL 69 -3.719 -9.003 -1.792 1238 HG23 VAL 69 HG23 VAL 69 -5.424 -8.813 -1.491 1239 H ASP 70 H ASP 70 -1.573 -10.142 -2.574 1240 HA ASP 70 HA ASP 70 -1.996 -10.975 0.165 1241 HB2 ASP 70 HB3 ASP 70 0.250 -11.665 0.585 1242 HB3 ASP 70 HB2 ASP 70 -0.309 -12.501 -0.842 1243 H PHE 71 H PHE 71 0.456 -9.814 1.010 1244 HA PHE 71 HA PHE 71 -0.716 -7.448 1.843 1245 HB2 PHE 71 HB3 PHE 71 1.174 -8.648 2.959 1246 HB3 PHE 71 HB2 PHE 71 2.252 -7.961 1.742 1247 HD1 PHE 71 HD1 PHE 71 -0.462 -6.926 4.092 1248 HD2 PHE 71 HD2 PHE 71 3.281 -5.875 2.250 1249 HE1 PHE 71 HE1 PHE 71 -0.382 -4.870 5.427 1250 HE2 PHE 71 HE2 PHE 71 3.343 -3.806 3.615 1251 HZ PHE 71 HZ PHE 71 1.521 -3.300 5.196 1252 H GLN 72 H GLN 72 1.568 -8.085 -0.773 1253 HA GLN 72 HA GLN 72 1.960 -5.373 -1.514 1254 HB2 GLN 72 HB3 GLN 72 2.372 -7.991 -2.906 1255 HB3 GLN 72 HB2 GLN 72 2.705 -6.459 -3.767 1256 HG2 GLN 72 HG3 GLN 72 4.267 -5.894 -1.920 1257 HG3 GLN 72 HG2 GLN 72 3.873 -7.446 -1.166 1258 HE21 GLN 72 HE21 GLN 72 4.736 -9.407 -2.200 1259 HE22 GLN 72 HE22 GLN 72 5.931 -9.303 -3.405 1260 H GLU 73 H GLU 73 -0.413 -7.792 -2.705 1261 HA GLU 73 HA GLU 73 -1.628 -5.887 -4.490 1262 HB2 GLU 73 HB3 GLU 73 -2.664 -8.539 -3.411 1263 HB3 GLU 73 HB2 GLU 73 -3.549 -7.512 -4.537 1264 HG2 GLU 73 HG3 GLU 73 -2.480 -8.944 -6.000 1265 HG3 GLU 73 HG2 GLU 73 -1.332 -7.620 -5.928 1266 H TYR 74 H TYR 74 -2.196 -6.918 -1.183 1267 HA TYR 74 HA TYR 74 -4.644 -5.604 -0.766 1268 HB2 TYR 74 HB3 TYR 74 -3.937 -7.303 0.755 1269 HB3 TYR 74 HB2 TYR 74 -2.468 -6.422 1.156 1270 HD1 TYR 74 HD1 TYR 74 -6.106 -5.406 0.943 1271 HD2 TYR 74 HD2 TYR 74 -2.551 -5.670 3.359 1272 HE1 TYR 74 HE1 TYR 74 -7.274 -4.283 2.802 1273 HE2 TYR 74 HE2 TYR 74 -3.730 -4.550 5.217 1274 HH TYR 74 HH TYR 74 -7.069 -4.149 5.316 1275 H VAL 75 H VAL 75 -1.336 -4.417 -0.120 1276 HA VAL 75 HA VAL 75 -2.225 -1.985 0.975 1277 HB VAL 75 HB VAL 75 0.093 -1.138 0.509 1278 HG11 VAL 75 HG11 VAL 75 1.050 -2.442 2.229 1279 HG12 VAL 75 HG12 VAL 75 0.162 -3.880 1.778 1280 HG13 VAL 75 HG13 VAL 75 -0.674 -2.542 2.549 1281 HG21 VAL 75 HG21 VAL 75 1.435 -2.214 -0.976 1282 HG22 VAL 75 HG22 VAL 75 0.095 -3.291 -1.382 1283 HG23 VAL 75 HG23 VAL 75 1.215 -3.737 -0.132 1284 H VAL 76 H VAL 76 -1.455 -2.790 -2.404 1285 HA VAL 76 HA VAL 76 -1.700 -0.136 -3.311 1286 HB VAL 76 HB VAL 76 -0.525 -1.818 -4.647 1287 HG11 VAL 76 HG11 VAL 76 -1.757 -3.806 -4.250 1288 HG12 VAL 76 HG12 VAL 76 -1.907 -3.462 -5.964 1289 HG13 VAL 76 HG13 VAL 76 -3.257 -3.127 -4.886 1290 HG21 VAL 76 HG21 VAL 76 -1.755 0.200 -5.707 1291 HG22 VAL 76 HG22 VAL 76 -2.956 -0.969 -6.246 1292 HG23 VAL 76 HG23 VAL 76 -1.297 -1.119 -6.783 1293 H LEU 77 H LEU 77 -4.053 -2.727 -2.910 1294 HA LEU 77 HA LEU 77 -6.196 -1.520 -4.286 1295 HB2 LEU 77 HB3 LEU 77 -6.287 -3.853 -3.543 1296 HB3 LEU 77 HB2 LEU 77 -6.262 -3.330 -1.865 1297 HG LEU 77 HG LEU 77 -8.404 -2.124 -2.163 1298 HD11 LEU 77 HD11 LEU 77 -9.648 -2.799 -4.373 1299 HD12 LEU 77 HD12 LEU 77 -8.003 -2.898 -5.019 1300 HD13 LEU 77 HD13 LEU 77 -8.587 -1.404 -4.292 1301 HD21 LEU 77 HD21 LEU 77 -9.849 -4.159 -2.639 1302 HD22 LEU 77 HD22 LEU 77 -8.635 -4.369 -1.383 1303 HD23 LEU 77 HD23 LEU 77 -8.366 -5.048 -2.989 1304 H VAL 78 H VAL 78 -5.310 -1.388 -0.834 1305 HA VAL 78 HA VAL 78 -7.376 0.477 -0.236 1306 HB VAL 78 HB VAL 78 -6.328 0.717 1.949 1307 HG11 VAL 78 HG11 VAL 78 -7.103 -1.337 2.552 1308 HG12 VAL 78 HG12 VAL 78 -5.830 -2.158 1.659 1309 HG13 VAL 78 HG13 VAL 78 -7.295 -1.675 0.826 1310 HG21 VAL 78 HG21 VAL 78 -3.931 0.741 1.135 1311 HG22 VAL 78 HG22 VAL 78 -4.078 -0.989 0.832 1312 HG23 VAL 78 HG23 VAL 78 -4.202 -0.372 2.467 1313 H ALA 79 H ALA 79 -3.969 0.787 -1.040 1314 HA ALA 79 HA ALA 79 -3.826 3.598 -0.683 1315 HB1 ALA 79 HB1 ALA 79 -1.785 2.359 -0.850 1316 HB2 ALA 79 HB2 ALA 79 -1.872 3.475 -2.220 1317 HB3 ALA 79 HB3 ALA 79 -2.237 1.762 -2.449 1318 H ALA 80 H ALA 80 -4.652 1.578 -3.470 1319 HA ALA 80 HA ALA 80 -4.822 3.610 -5.362 1320 HB1 ALA 80 HB1 ALA 80 -4.957 1.315 -6.085 1321 HB2 ALA 80 HB2 ALA 80 -6.468 2.109 -6.528 1322 HB3 ALA 80 HB3 ALA 80 -6.421 1.047 -5.124 1323 H LEU 81 H LEU 81 -7.266 2.263 -3.184 1324 HA LEU 81 HA LEU 81 -9.332 4.096 -3.855 1325 HB2 LEU 81 HB3 LEU 81 -8.821 2.431 -1.382 1326 HB3 LEU 81 HB2 LEU 81 -10.265 3.406 -1.597 1327 HG LEU 81 HG LEU 81 -9.380 1.274 -3.574 1328 HD11 LEU 81 HD11 LEU 81 -11.370 0.021 -2.609 1329 HD12 LEU 81 HD12 LEU 81 -11.325 1.135 -1.260 1330 HD13 LEU 81 HD13 LEU 81 -9.930 0.086 -1.602 1331 HD21 LEU 81 HD21 LEU 81 -10.842 2.629 -4.785 1332 HD22 LEU 81 HD22 LEU 81 -11.712 3.169 -3.354 1333 HD23 LEU 81 HD23 LEU 81 -11.999 1.559 -4.003 1334 H THR 82 H THR 82 -6.789 4.101 -1.382 1335 HA THR 82 HA THR 82 -7.616 6.477 -0.113 1336 HB THR 82 HB THR 82 -4.745 5.529 -0.286 1337 HG1 THR 82 HG2 THR 82 -6.231 3.794 0.306 1338 HG21 THR 82 HG21 THR 82 -4.364 7.022 1.373 1339 HG22 THR 82 HG22 THR 82 -5.740 6.445 2.292 1340 HG23 THR 82 HG23 THR 82 -5.969 7.676 1.073 1341 H VAL 83 H VAL 83 -5.164 5.954 -2.681 1342 HA VAL 83 HA VAL 83 -4.529 8.676 -2.962 1343 HB VAL 83 HB VAL 83 -3.286 6.569 -3.929 1344 HG11 VAL 83 HG11 VAL 83 -4.936 5.648 -5.296 1345 HG12 VAL 83 HG12 VAL 83 -3.695 6.299 -6.363 1346 HG13 VAL 83 HG13 VAL 83 -5.215 7.142 -6.187 1347 HG21 VAL 83 HG21 VAL 83 -2.141 7.958 -5.550 1348 HG22 VAL 83 HG22 VAL 83 -2.528 8.963 -4.163 1349 HG23 VAL 83 HG23 VAL 83 -3.492 9.077 -5.639 1350 H ALA 84 H ALA 84 -6.913 6.643 -4.593 1351 HA ALA 84 HA ALA 84 -7.908 8.563 -6.387 1352 HB1 ALA 84 HB1 ALA 84 -8.541 6.142 -6.422 1353 HB2 ALA 84 HB2 ALA 84 -9.937 7.233 -6.426 1354 HB3 ALA 84 HB3 ALA 84 -9.477 6.408 -4.948 1355 H MET 85 H MET 85 -8.850 7.731 -3.078 1356 HA MET 85 HA MET 85 -10.847 9.716 -2.789 1357 HB2 MET 85 HB3 MET 85 -10.581 7.714 -1.281 1358 HB3 MET 85 HB2 MET 85 -9.132 8.452 -0.660 1359 HG2 MET 85 HG3 MET 85 -11.024 8.977 0.837 1360 HG3 MET 85 HG2 MET 85 -10.400 10.445 0.116 1361 HE1 MET 85 HE1 MET 85 -14.089 8.141 -1.335 1362 HE2 MET 85 HE2 MET 85 -12.874 7.540 -0.214 1363 HE3 MET 85 HE3 MET 85 -12.475 7.740 -1.916 1364 H ASN 86 H ASN 86 -7.394 9.644 -2.112 1365 HA ASN 86 HA ASN 86 -7.251 12.069 -0.749 1366 HB2 ASN 86 HB3 ASN 86 -5.166 10.526 -2.288 1367 HB3 ASN 86 HB2 ASN 86 -4.837 12.110 -1.587 1368 HD21 ASN 86 HD21 ASN 86 -5.510 12.341 0.815 1369 HD22 ASN 86 HD22 ASN 86 -5.195 10.994 1.801 1370 H ASN 87 H ASN 87 -7.143 11.381 -4.199 1371 HA ASN 87 HA ASN 87 -6.201 13.716 -5.288 1372 HB2 ASN 87 HB3 ASN 87 -6.958 11.831 -6.649 1373 HB3 ASN 87 HB2 ASN 87 -8.638 12.213 -6.267 1374 HD21 ASN 87 HD21 ASN 87 -9.511 13.153 -8.116 1375 HD22 ASN 87 HD22 ASN 87 -8.751 14.362 -9.031 1376 H PHE 88 H PHE 88 -9.419 13.132 -4.030 1377 HA PHE 88 HA PHE 88 -10.572 15.700 -4.430 1378 HB2 PHE 88 HB3 PHE 88 -12.163 14.168 -3.864 1379 HB3 PHE 88 HB2 PHE 88 -11.101 13.288 -2.762 1380 HD1 PHE 88 HD1 PHE 88 -13.070 16.444 -3.143 1381 HD2 PHE 88 HD2 PHE 88 -11.145 13.704 -0.450 1382 HE1 PHE 88 HE1 PHE 88 -14.080 17.617 -1.215 1383 HE2 PHE 88 HE2 PHE 88 -12.152 14.889 1.481 1384 HZ PHE 88 HZ PHE 88 -13.616 16.841 1.099 1385 H PHE 89 H PHE 89 -8.816 14.220 -1.722 1386 HA PHE 89 HA PHE 89 -9.086 16.168 0.170 1387 HB2 PHE 89 HB3 PHE 89 -7.970 13.780 0.129 1388 HB3 PHE 89 HB2 PHE 89 -6.512 14.709 -0.074 1389 HD1 PHE 89 HD1 PHE 89 -5.818 16.431 1.572 1390 HD2 PHE 89 HD2 PHE 89 -9.188 13.874 2.214 1391 HE1 PHE 89 HE1 PHE 89 -5.816 17.041 3.988 1392 HE2 PHE 89 HE2 PHE 89 -9.225 14.436 4.547 1393 HZ PHE 89 HZ PHE 89 -7.523 16.048 5.501 1394 H TRP 90 H TRP 90 -6.413 15.813 -2.167 1395 HA TRP 90 HA TRP 90 -4.752 17.803 -1.115 1396 HB2 TRP 90 HB3 TRP 90 -4.959 17.375 -4.092 1397 HB3 TRP 90 HB2 TRP 90 -3.566 17.871 -3.138 1398 HD1 TRP 90 HD TRP 90 -5.758 14.910 -3.871 1399 HE1 TRP 90 HE1 TRP 90 -4.460 12.734 -3.375 1400 HE3 TRP 90 HE3 TRP 90 -1.582 16.892 -1.821 1401 HZ2 TRP 90 HZ2 TRP 90 -1.948 11.958 -2.232 1402 HZ3 TRP 90 HZ3 TRP 90 0.258 15.437 -1.059 1403 HH2 TRP 90 HH TRP 90 0.078 12.981 -1.245 1404 H GLU 91 H GLU 91 -7.272 18.078 -3.546 1405 HA GLU 91 HA GLU 91 -6.840 20.962 -3.696 1406 HB2 GLU 91 HB3 GLU 91 -8.555 19.208 -5.463 1407 HB3 GLU 91 HB2 GLU 91 -8.122 20.894 -5.726 1408 HG2 GLU 91 HG3 GLU 91 -5.693 20.256 -5.735 1409 HG3 GLU 91 HG2 GLU 91 -6.160 18.586 -5.585 1410 H ASN 92 H ASN 92 -8.712 18.953 -1.899 1411 HA ASN 92 HA ASN 92 -11.278 20.023 -2.049 1412 HB2 ASN 92 HB3 ASN 92 -10.948 18.105 -0.632 1413 HB3 ASN 92 HB2 ASN 92 -9.733 18.987 0.316 1414 HD21 ASN 92 HD21 ASN 92 -13.229 19.007 -0.458 1415 HD22 ASN 92 HD22 ASN 92 -13.698 19.791 0.968 1416 H SER 93 H SER 93 -11.936 22.056 -1.791 1417 HA SER 93 HA SER 93 -10.837 23.783 0.245 1418 HB2 SER 93 HB3 SER 93 -10.321 24.244 -2.688 1419 HB3 SER 93 HB2 SER 93 -10.067 25.478 -1.446 1420 HG SER 93 HG SER 93 -8.947 23.031 -0.865 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -9.386 8.274 12.455 2 HA2 GLY 1 HA3 GLY 1 -11.375 7.330 10.545 3 HA3 GLY 1 HA2 GLY 1 -9.757 7.571 9.914 4 H SER 2 H SER 2 -10.614 5.093 9.763 5 HA SER 2 HA SER 2 -10.115 3.485 12.051 6 HB2 SER 2 HB3 SER 2 -9.811 2.580 9.188 7 HB3 SER 2 HB2 SER 2 -10.360 1.675 10.597 8 HG SER 2 HG SER 2 -11.608 3.716 9.105 9 H GLU 3 H GLU 3 -8.215 2.061 12.360 10 HA GLU 3 HA GLU 3 -5.809 3.438 12.210 11 HB2 GLU 3 HB3 GLU 3 -6.345 0.483 12.479 12 HB3 GLU 3 HB2 GLU 3 -4.755 1.199 12.649 13 HG2 GLU 3 HG3 GLU 3 -5.408 1.214 14.827 14 HG3 GLU 3 HG2 GLU 3 -5.945 2.815 14.358 15 H LEU 4 H LEU 4 -7.172 1.027 10.016 16 HA LEU 4 HA LEU 4 -4.906 0.851 8.297 17 HB2 LEU 4 HB3 LEU 4 -7.886 0.413 7.814 18 HB3 LEU 4 HB2 LEU 4 -6.700 0.294 6.536 19 HG LEU 4 HG LEU 4 -6.951 -1.932 7.289 20 HD11 LEU 4 HD11 LEU 4 -4.836 -2.557 7.897 21 HD12 LEU 4 HD12 LEU 4 -4.579 -1.192 8.969 22 HD13 LEU 4 HD13 LEU 4 -4.548 -0.971 7.208 23 HD21 LEU 4 HD21 LEU 4 -8.092 -1.126 9.432 24 HD22 LEU 4 HD22 LEU 4 -6.487 -1.135 10.177 25 HD23 LEU 4 HD23 LEU 4 -7.187 -2.616 9.526 26 H GLU 5 H GLU 5 -7.724 2.937 8.337 27 HA GLU 5 HA GLU 5 -7.077 4.430 6.018 28 HB2 GLU 5 HB3 GLU 5 -8.734 5.127 8.465 29 HB3 GLU 5 HB2 GLU 5 -8.669 6.083 6.984 30 HG2 GLU 5 HG3 GLU 5 -9.507 4.219 5.666 31 HG3 GLU 5 HG2 GLU 5 -9.487 3.157 7.059 32 H THR 6 H THR 6 -6.469 4.884 9.453 33 HA THR 6 HA THR 6 -5.074 7.338 9.266 34 HB THR 6 HB THR 6 -4.540 5.190 11.325 35 HG1 THR 6 HG2 THR 6 -6.839 5.621 10.953 36 HG21 THR 6 HG21 THR 6 -4.459 8.225 11.352 37 HG22 THR 6 HG22 THR 6 -3.092 7.132 11.437 38 HG23 THR 6 HG23 THR 6 -4.226 7.209 12.777 39 H ALA 7 H ALA 7 -3.988 3.951 9.294 40 HA ALA 7 HA ALA 7 -1.250 4.405 9.080 41 HB1 ALA 7 HB1 ALA 7 -3.016 2.140 8.144 42 HB2 ALA 7 HB2 ALA 7 -1.931 2.184 9.523 43 HB3 ALA 7 HB3 ALA 7 -1.276 2.116 7.890 44 H MET 8 H MET 8 -3.710 3.978 6.542 45 HA MET 8 HA MET 8 -1.885 4.316 4.413 46 HB2 MET 8 HB3 MET 8 -4.895 4.754 4.431 47 HB3 MET 8 HB2 MET 8 -3.890 4.691 2.995 48 HG2 MET 8 HG3 MET 8 -4.263 2.407 4.983 49 HG3 MET 8 HG2 MET 8 -4.847 2.483 3.333 50 HE1 MET 8 HE1 MET 8 -2.334 1.785 1.090 51 HE2 MET 8 HE2 MET 8 -1.884 3.427 1.546 52 HE3 MET 8 HE3 MET 8 -3.600 2.965 1.509 53 H GLU 9 H GLU 9 -3.949 6.647 6.152 54 HA GLU 9 HA GLU 9 -3.141 8.847 4.543 55 HB2 GLU 9 HB3 GLU 9 -4.318 8.779 7.334 56 HB3 GLU 9 HB2 GLU 9 -3.939 10.277 6.483 57 HG2 GLU 9 HG3 GLU 9 -5.427 9.553 4.602 58 HG3 GLU 9 HG2 GLU 9 -5.826 8.106 5.518 59 H THR 10 H THR 10 -1.826 7.329 7.373 60 HA THR 10 HA THR 10 0.163 9.252 7.977 61 HB THR 10 HB THR 10 0.448 6.239 8.249 62 HG1 THR 10 HG2 THR 10 -1.517 7.037 9.154 63 HG21 THR 10 HG21 THR 10 2.322 6.694 9.390 64 HG22 THR 10 HG22 THR 10 1.503 7.849 10.420 65 HG23 THR 10 HG23 THR 10 2.196 8.373 8.897 66 H LEU 11 H LEU 11 0.111 6.529 5.694 67 HA LEU 11 HA LEU 11 2.728 6.990 4.663 68 HB2 LEU 11 HB3 LEU 11 0.305 5.644 3.451 69 HB3 LEU 11 HB2 LEU 11 1.861 5.724 2.639 70 HG LEU 11 HG LEU 11 1.509 4.531 5.420 71 HD11 LEU 11 HD11 LEU 11 1.755 2.354 4.248 72 HD12 LEU 11 HD12 LEU 11 1.543 3.177 2.712 73 HD13 LEU 11 HD13 LEU 11 0.227 3.156 3.900 74 HD21 LEU 11 HD21 LEU 11 3.872 5.355 4.259 75 HD22 LEU 11 HD22 LEU 11 3.702 3.768 3.547 76 HD23 LEU 11 HD23 LEU 11 3.726 3.931 5.286 77 H ILE 12 H ILE 12 -0.452 8.255 3.839 78 HA ILE 12 HA ILE 12 0.309 9.689 1.513 79 HB ILE 12 HB ILE 12 -1.833 10.282 3.579 80 HG12 ILE 12 HG13 ILE 12 -2.102 8.137 2.214 81 HG13 ILE 12 HG12 ILE 12 -3.392 9.319 2.003 82 HG21 ILE 12 HG21 ILE 12 -1.892 11.506 0.839 83 HG22 ILE 12 HG22 ILE 12 -0.987 12.273 2.118 84 HG23 ILE 12 HG23 ILE 12 -2.690 11.960 2.329 85 HD11 ILE 12 HD11 ILE 12 -2.852 9.754 -0.150 86 HD12 ILE 12 HD12 ILE 12 -2.191 8.139 -0.074 87 HD13 ILE 12 HD13 ILE 12 -1.116 9.521 0.053 88 H ASN 13 H ASN 13 0.209 10.598 4.921 89 HA ASN 13 HA ASN 13 0.907 13.297 4.611 90 HB2 ASN 13 HB3 ASN 13 1.274 11.373 6.901 91 HB3 ASN 13 HB2 ASN 13 1.845 13.030 6.999 92 HD21 ASN 13 HD21 ASN 13 -1.091 11.052 6.767 93 HD22 ASN 13 HD22 ASN 13 -2.151 12.323 7.108 94 H VAL 14 H VAL 14 2.923 10.448 5.061 95 HA VAL 14 HA VAL 14 5.413 11.843 4.925 96 HB VAL 14 HB VAL 14 4.738 8.928 4.434 97 HG11 VAL 14 HG11 VAL 14 6.866 8.557 3.911 98 HG12 VAL 14 HG12 VAL 14 7.446 9.492 5.287 99 HG13 VAL 14 HG13 VAL 14 7.122 10.297 3.761 100 HG21 VAL 14 HG21 VAL 14 4.309 9.255 6.709 101 HG22 VAL 14 HG22 VAL 14 5.447 10.590 6.823 102 HG23 VAL 14 HG23 VAL 14 6.046 8.944 6.749 103 H PHE 15 H PHE 15 3.356 10.143 2.611 104 HA PHE 15 HA PHE 15 4.981 10.287 0.341 105 HB2 PHE 15 HB3 PHE 15 2.824 9.023 0.521 106 HB3 PHE 15 HB2 PHE 15 1.970 10.562 0.484 107 HD1 PHE 15 HD1 PHE 15 4.225 8.339 -1.460 108 HD2 PHE 15 HD2 PHE 15 1.564 11.712 -1.571 109 HE1 PHE 15 HE1 PHE 15 4.277 8.300 -3.933 110 HE2 PHE 15 HE2 PHE 15 1.622 11.671 -4.054 111 HZ PHE 15 HZ PHE 15 2.969 9.974 -5.227 112 H HIS 16 H HIS 16 2.541 12.516 1.560 113 HA HIS 16 HA HIS 16 3.079 14.528 -0.398 114 HB2 HIS 16 HB3 HIS 16 1.509 14.567 2.139 115 HB3 HIS 16 HB2 HIS 16 1.837 16.069 1.290 116 HD1 HIS 16 HD1 HIS 16 1.784 14.139 -1.519 117 HD2 HIS 16 HD2 HIS 16 -1.263 15.046 1.207 118 HE1 HIS 16 HE1 HIS 16 -0.416 13.834 -2.738 119 HE2 HIS 16 HE2 HIS 16 -2.268 14.406 -1.080 120 H ALA 17 H ALA 17 4.364 13.938 2.789 121 HA ALA 17 HA ALA 17 5.702 16.370 3.157 122 HB1 ALA 17 HB1 ALA 17 6.956 13.694 3.810 123 HB2 ALA 17 HB2 ALA 17 5.632 14.363 4.773 124 HB3 ALA 17 HB3 ALA 17 7.156 15.233 4.641 125 H HIS 18 H HIS 18 6.615 13.484 1.346 126 HA HIS 18 HA HIS 18 8.966 14.765 0.311 127 HB2 HIS 18 HB3 HIS 18 7.681 12.143 -0.463 128 HB3 HIS 18 HB2 HIS 18 9.149 12.821 -1.192 129 HD1 HIS 18 HD1 HIS 18 11.290 13.183 0.417 130 HD2 HIS 18 HD2 HIS 18 8.107 11.038 2.103 131 HE1 HIS 18 HE1 HIS 18 12.172 12.116 2.519 132 HE2 HIS 18 HE2 HIS 18 10.270 10.810 3.570 133 H SER 19 H SER 19 5.637 14.331 -0.845 134 HA SER 19 HA SER 19 5.944 15.203 -3.501 135 HB2 SER 19 HB3 SER 19 3.702 16.047 -1.621 136 HB3 SER 19 HB2 SER 19 3.648 16.100 -3.352 137 HG SER 19 HG SER 19 4.096 13.739 -3.219 138 H GLY 20 H GLY 20 5.997 16.939 -0.486 139 HA2 GLY 20 HA3 GLY 20 5.941 19.602 -1.423 140 HA3 GLY 20 HA2 GLY 20 6.664 19.019 0.085 141 H LYS 21 H LYS 21 8.531 17.247 -1.158 142 HA LYS 21 HA LYS 21 10.767 18.973 -1.316 143 HB2 LYS 21 HB3 LYS 21 10.498 16.150 -2.373 144 HB3 LYS 21 HB2 LYS 21 11.986 16.988 -1.972 145 HG2 LYS 21 HG3 LYS 21 9.799 16.559 0.055 146 HG3 LYS 21 HG2 LYS 21 11.093 15.393 -0.152 147 HD2 LYS 21 HD3 LYS 21 12.732 17.238 0.326 148 HD3 LYS 21 HD2 LYS 21 11.375 18.321 0.607 149 HE2 LYS 21 HE2 LYS 21 11.952 17.526 2.764 150 HE3 LYS 21 HE1 LYS 21 10.511 16.650 2.286 151 HZ1 LYS 21 HZ1 LYS 21 13.133 15.625 2.770 152 HZ2 LYS 21 HZ2 LYS 21 12.510 15.040 1.295 153 HZ3 LYS 21 HZ3 LYS 21 11.660 14.833 2.750 154 H GLU 22 H GLU 22 8.954 17.195 -3.744 155 HA GLU 22 HA GLU 22 10.467 18.422 -5.906 156 HB2 GLU 22 HB3 GLU 22 8.874 16.974 -7.326 157 HB3 GLU 22 HB2 GLU 22 10.080 16.207 -6.344 158 HG2 GLU 22 HG3 GLU 22 8.524 15.126 -5.042 159 HG3 GLU 22 HG2 GLU 22 7.662 16.597 -4.748 160 H GLY 23 H GLY 23 7.093 18.285 -4.785 161 HA2 GLY 23 HA3 GLY 23 5.654 20.064 -4.602 162 HA3 GLY 23 HA2 GLY 23 6.784 21.045 -5.508 163 H ASP 24 H ASP 24 5.567 17.952 -6.815 164 HA ASP 24 HA ASP 24 4.518 19.143 -9.208 165 HB2 ASP 24 HB3 ASP 24 4.982 16.638 -8.930 166 HB3 ASP 24 HB2 ASP 24 3.628 16.569 -7.849 167 H LYS 25 H LYS 25 3.215 18.072 -6.217 168 HA LYS 25 HA LYS 25 1.771 19.722 -5.098 169 HB2 LYS 25 HB3 LYS 25 -0.540 19.829 -5.881 170 HB3 LYS 25 HB2 LYS 25 0.544 20.656 -6.987 171 HG2 LYS 25 HG3 LYS 25 0.466 18.535 -8.454 172 HG3 LYS 25 HG2 LYS 25 -0.737 17.905 -7.339 173 HD2 LYS 25 HD3 LYS 25 -2.191 19.831 -7.733 174 HD3 LYS 25 HD2 LYS 25 -0.998 20.504 -8.841 175 HE2 LYS 25 HE2 LYS 25 -1.422 18.976 -10.488 176 HE3 LYS 25 HE1 LYS 25 -1.974 17.712 -9.380 177 HZ1 LYS 25 HZ1 LYS 25 -4.030 18.631 -9.229 178 HZ2 LYS 25 HZ2 LYS 25 -3.671 19.040 -10.840 179 HZ3 LYS 25 HZ3 LYS 25 -3.544 20.201 -9.620 180 H TYR 26 H TYR 26 0.859 16.792 -6.763 181 HA TYR 26 HA TYR 26 1.116 15.443 -4.278 182 HB2 TYR 26 HB3 TYR 26 -1.134 14.175 -4.780 183 HB3 TYR 26 HB2 TYR 26 -1.101 15.619 -3.775 184 HD1 TYR 26 HD2 TYR 26 -1.845 14.337 -7.186 185 HD2 TYR 26 HD1 TYR 26 -2.150 17.650 -4.489 186 HE1 TYR 26 HE2 TYR 26 -3.397 15.430 -8.736 187 HE2 TYR 26 HE1 TYR 26 -3.732 18.768 -6.048 188 HH TYR 26 HH TYR 26 -5.365 17.236 -8.349 189 H LYS 27 H LYS 27 2.761 14.460 -5.154 190 HA LYS 27 HA LYS 27 2.333 12.017 -6.508 191 HB2 LYS 27 HB3 LYS 27 3.953 14.203 -7.913 192 HB3 LYS 27 HB2 LYS 27 4.160 12.479 -8.195 193 HG2 LYS 27 HG3 LYS 27 1.453 13.801 -8.571 194 HG3 LYS 27 HG2 LYS 27 2.646 13.791 -9.819 195 HD2 LYS 27 HD3 LYS 27 1.805 11.212 -8.469 196 HD3 LYS 27 HD2 LYS 27 1.014 11.824 -9.911 197 HE2 LYS 27 HE2 LYS 27 3.875 11.927 -10.334 198 HE3 LYS 27 HE1 LYS 27 3.444 10.321 -9.769 199 HZ1 LYS 27 HZ1 LYS 27 1.956 10.035 -11.596 200 HZ2 LYS 27 HZ2 LYS 27 3.363 10.749 -12.229 201 HZ3 LYS 27 HZ3 LYS 27 2.001 11.683 -11.986 202 H LEU 28 H LEU 28 4.734 11.088 -6.748 203 HA LEU 28 HA LEU 28 6.485 12.433 -4.879 204 HB2 LEU 28 HB3 LEU 28 5.660 10.647 -3.544 205 HB3 LEU 28 HB2 LEU 28 5.902 9.451 -4.812 206 HG LEU 28 HG LEU 28 8.392 10.028 -4.732 207 HD11 LEU 28 HD11 LEU 28 8.795 11.981 -3.712 208 HD12 LEU 28 HD12 LEU 28 8.772 10.987 -2.254 209 HD13 LEU 28 HD13 LEU 28 7.335 11.899 -2.714 210 HD21 LEU 28 HD21 LEU 28 8.833 8.692 -2.822 211 HD22 LEU 28 HD22 LEU 28 7.334 8.058 -3.527 212 HD23 LEU 28 HD23 LEU 28 7.277 9.077 -2.086 213 H SER 29 H SER 29 8.345 12.838 -5.783 214 HA SER 29 HA SER 29 8.899 11.665 -8.362 215 HB2 SER 29 HB3 SER 29 10.855 13.261 -8.332 216 HB3 SER 29 HB2 SER 29 9.265 13.973 -8.248 217 HG SER 29 HG SER 29 9.545 14.492 -6.221 218 H LYS 30 H LYS 30 11.042 10.847 -8.797 219 HA LYS 30 HA LYS 30 11.705 8.747 -6.922 220 HB2 LYS 30 HB3 LYS 30 13.333 9.617 -9.305 221 HB3 LYS 30 HB2 LYS 30 13.317 8.034 -8.534 222 HG2 LYS 30 HG3 LYS 30 10.964 9.304 -9.986 223 HG3 LYS 30 HG2 LYS 30 11.968 8.062 -10.657 224 HD2 LYS 30 HD3 LYS 30 10.468 7.656 -8.040 225 HD3 LYS 30 HD2 LYS 30 9.797 7.240 -9.597 226 HE2 LYS 30 HE2 LYS 30 12.180 6.049 -8.221 227 HE3 LYS 30 HE1 LYS 30 10.779 5.225 -8.879 228 HZ1 LYS 30 HZ1 LYS 30 12.137 4.864 -10.689 229 HZ2 LYS 30 HZ2 LYS 30 13.239 5.958 -10.158 230 HZ3 LYS 30 HZ3 LYS 30 11.888 6.477 -11.084 231 H LYS 31 H LYS 31 12.392 11.946 -7.040 232 HA LYS 31 HA LYS 31 15.101 12.247 -6.495 233 HB2 LYS 31 HB3 LYS 31 12.747 13.758 -5.347 234 HB3 LYS 31 HB2 LYS 31 14.410 14.329 -5.391 235 HG2 LYS 31 HG3 LYS 31 14.331 14.249 -7.909 236 HG3 LYS 31 HG2 LYS 31 12.705 13.646 -7.766 237 HD2 LYS 31 HD3 LYS 31 12.036 15.677 -6.530 238 HD3 LYS 31 HD2 LYS 31 13.627 16.356 -6.817 239 HE2 LYS 31 HE2 LYS 31 11.940 15.306 -9.042 240 HE3 LYS 31 HE1 LYS 31 11.743 16.968 -8.484 241 HZ1 LYS 31 HZ1 LYS 31 14.168 17.314 -8.913 242 HZ2 LYS 31 HZ2 LYS 31 13.287 16.963 -10.282 243 HZ3 LYS 31 HZ3 LYS 31 14.262 15.765 -9.609 244 H GLU 32 H GLU 32 12.324 11.904 -4.388 245 HA GLU 32 HA GLU 32 13.933 11.754 -1.961 246 HB2 GLU 32 HB3 GLU 32 10.970 11.937 -2.466 247 HB3 GLU 32 HB2 GLU 32 11.742 11.935 -0.883 248 HG2 GLU 32 HG3 GLU 32 12.475 13.947 -3.031 249 HG3 GLU 32 HG2 GLU 32 11.182 14.242 -1.907 250 H LEU 33 H LEU 33 12.009 9.722 -4.011 251 HA LEU 33 HA LEU 33 10.921 7.972 -2.242 252 HB2 LEU 33 HB3 LEU 33 10.399 8.043 -4.631 253 HB3 LEU 33 HB2 LEU 33 11.970 7.329 -4.970 254 HG LEU 33 HG LEU 33 9.922 5.743 -4.946 255 HD11 LEU 33 HD11 LEU 33 12.555 5.281 -4.626 256 HD12 LEU 33 HD12 LEU 33 11.341 4.017 -4.644 257 HD13 LEU 33 HD13 LEU 33 11.954 4.611 -3.111 258 HD21 LEU 33 HD21 LEU 33 10.413 5.787 -1.937 259 HD22 LEU 33 HD22 LEU 33 9.169 4.926 -2.832 260 HD23 LEU 33 HD23 LEU 33 9.088 6.668 -2.705 261 H LYS 34 H LYS 34 14.094 7.574 -3.825 262 HA LYS 34 HA LYS 34 14.698 5.100 -2.653 263 HB2 LYS 34 HB3 LYS 34 16.972 5.470 -3.308 264 HB3 LYS 34 HB2 LYS 34 15.993 6.231 -4.550 265 HG2 LYS 34 HG3 LYS 34 16.313 8.466 -3.399 266 HG3 LYS 34 HG2 LYS 34 17.338 7.635 -2.216 267 HD2 LYS 34 HD3 LYS 34 18.855 6.946 -4.021 268 HD3 LYS 34 HD2 LYS 34 17.929 7.878 -5.191 269 HE2 LYS 34 HE2 LYS 34 19.254 9.028 -2.690 270 HE3 LYS 34 HE1 LYS 34 19.915 9.126 -4.316 271 HZ1 LYS 34 HZ1 LYS 34 17.224 10.088 -4.300 272 HZ2 LYS 34 HZ2 LYS 34 18.665 10.858 -4.728 273 HZ3 LYS 34 HZ3 LYS 34 18.159 10.898 -3.129 274 H GLU 35 H GLU 35 15.305 8.376 -1.620 275 HA GLU 35 HA GLU 35 16.720 7.809 0.787 276 HB2 GLU 35 HB3 GLU 35 15.138 10.250 -0.109 277 HB3 GLU 35 HB2 GLU 35 16.242 10.170 1.259 278 HG2 GLU 35 HG3 GLU 35 18.143 9.704 -0.137 279 HG3 GLU 35 HG2 GLU 35 17.128 9.457 -1.546 280 H LEU 36 H LEU 36 13.410 8.572 -0.057 281 HA LEU 36 HA LEU 36 12.221 8.719 2.468 282 HB2 LEU 36 HB3 LEU 36 10.932 9.595 0.740 283 HB3 LEU 36 HB2 LEU 36 11.349 8.275 -0.333 284 HG LEU 36 HG LEU 36 9.893 6.755 0.838 285 HD11 LEU 36 HD11 LEU 36 8.271 8.367 2.445 286 HD12 LEU 36 HD12 LEU 36 9.904 8.905 2.832 287 HD13 LEU 36 HD13 LEU 36 9.470 7.208 3.015 288 HD21 LEU 36 HD21 LEU 36 8.609 7.587 -0.756 289 HD22 LEU 36 HD22 LEU 36 8.943 9.278 -0.346 290 HD23 LEU 36 HD23 LEU 36 7.717 8.368 0.546 291 H LEU 37 H LEU 37 12.411 5.982 0.217 292 HA LEU 37 HA LEU 37 10.899 4.305 1.844 293 HB2 LEU 37 HB3 LEU 37 11.209 3.753 -0.484 294 HB3 LEU 37 HB2 LEU 37 12.946 3.650 -0.294 295 HG LEU 37 HG LEU 37 11.603 1.467 -0.422 296 HD11 LEU 37 HD11 LEU 37 13.997 2.151 0.910 297 HD12 LEU 37 HD12 LEU 37 13.502 0.569 0.372 298 HD13 LEU 37 HD13 LEU 37 13.139 1.083 2.020 299 HD21 LEU 37 HD21 LEU 37 10.053 2.481 1.561 300 HD22 LEU 37 HD22 LEU 37 11.241 1.603 2.528 301 HD23 LEU 37 HD23 LEU 37 10.312 0.761 1.314 302 H GLN 38 H GLN 38 14.410 4.633 1.594 303 HA GLN 38 HA GLN 38 14.953 2.723 3.626 304 HB2 GLN 38 HB3 GLN 38 17.239 3.673 3.671 305 HB3 GLN 38 HB2 GLN 38 16.699 3.377 2.021 306 HG2 GLN 38 HG3 GLN 38 16.119 5.758 1.795 307 HG3 GLN 38 HG2 GLN 38 16.660 6.063 3.441 308 HE21 GLN 38 HE21 GLN 38 18.629 7.142 3.220 309 HE22 GLN 38 HE22 GLN 38 19.888 6.617 2.205 310 H THR 39 H THR 39 14.485 6.199 3.638 311 HA THR 39 HA THR 39 15.137 6.669 6.344 312 HB THR 39 HB THR 39 13.294 8.115 4.450 313 HG1 THR 39 HG2 THR 39 15.248 8.246 3.660 314 HG21 THR 39 HG21 THR 39 12.746 8.707 6.713 315 HG22 THR 39 HG22 THR 39 13.538 10.018 5.910 316 HG23 THR 39 HG23 THR 39 14.441 9.046 7.107 317 H GLU 40 H GLU 40 11.934 6.188 4.822 318 HA GLU 40 HA GLU 40 10.596 6.233 7.318 319 HB2 GLU 40 HB3 GLU 40 9.831 5.642 4.506 320 HB3 GLU 40 HB2 GLU 40 8.765 5.075 5.791 321 HG2 GLU 40 HG3 GLU 40 8.386 7.487 4.849 322 HG3 GLU 40 HG2 GLU 40 8.321 7.212 6.577 323 H LEU 41 H LEU 41 11.750 3.564 5.333 324 HA LEU 41 HA LEU 41 10.685 1.703 7.316 325 HB2 LEU 41 HB3 LEU 41 11.677 1.424 4.522 326 HB3 LEU 41 HB2 LEU 41 11.770 0.023 5.558 327 HG LEU 41 HG LEU 41 9.348 0.346 6.172 328 HD11 LEU 41 HD11 LEU 41 8.014 1.769 4.604 329 HD12 LEU 41 HD12 LEU 41 9.533 2.466 4.034 330 HD13 LEU 41 HD13 LEU 41 9.042 2.667 5.711 331 HD21 LEU 41 HD21 LEU 41 10.284 -1.111 4.198 332 HD22 LEU 41 HD22 LEU 41 9.558 0.127 3.178 333 HD23 LEU 41 HD23 LEU 41 8.553 -0.798 4.295 334 H SER 42 H SER 42 12.606 3.192 8.470 335 HA SER 42 HA SER 42 15.230 2.350 8.135 336 HB2 SER 42 HB3 SER 42 14.172 3.019 10.860 337 HB3 SER 42 HB2 SER 42 15.732 3.384 10.172 338 HG SER 42 HG SER 42 14.067 4.613 8.545 339 H GLY 43 H GLY 43 12.688 1.036 10.243 340 HA2 GLY 43 HA3 GLY 43 14.351 -0.964 11.430 341 HA3 GLY 43 HA2 GLY 43 12.593 -0.891 11.470 342 H PHE 44 H PHE 44 12.020 -0.930 8.779 343 HA PHE 44 HA PHE 44 12.212 -3.740 8.286 344 HB2 PHE 44 HB3 PHE 44 10.982 -1.478 6.719 345 HB3 PHE 44 HB2 PHE 44 11.094 -3.098 6.039 346 HD1 PHE 44 HD2 PHE 44 10.393 -4.986 7.823 347 HD2 PHE 44 HD1 PHE 44 8.981 -0.950 7.827 348 HE1 PHE 44 HE2 PHE 44 8.407 -5.704 9.091 349 HE2 PHE 44 HE1 PHE 44 6.977 -1.658 9.116 350 HZ PHE 44 HZ PHE 44 6.688 -4.031 9.746 351 H LEU 45 H LEU 45 13.676 -0.890 6.898 352 HA LEU 45 HA LEU 45 15.039 -2.155 4.809 353 HB2 LEU 45 HB3 LEU 45 14.811 0.233 4.815 354 HB3 LEU 45 HB2 LEU 45 15.627 0.351 6.372 355 HG LEU 45 HG LEU 45 17.592 -0.474 5.506 356 HD11 LEU 45 HD11 LEU 45 16.101 -0.617 2.816 357 HD12 LEU 45 HD12 LEU 45 16.860 -1.976 3.661 358 HD13 LEU 45 HD13 LEU 45 17.853 -0.741 2.910 359 HD21 LEU 45 HD21 LEU 45 16.707 2.002 5.108 360 HD22 LEU 45 HD22 LEU 45 16.961 1.562 3.413 361 HD23 LEU 45 HD23 LEU 45 18.307 1.530 4.535 362 H ASP 46 H ASP 46 15.999 -1.401 8.126 363 HA ASP 46 HA ASP 46 18.628 -2.444 7.963 364 HB2 ASP 46 HB3 ASP 46 17.998 -0.949 9.744 365 HB3 ASP 46 HB2 ASP 46 16.798 -2.100 10.342 366 H ALA 47 H ALA 47 15.567 -3.851 8.967 367 HA ALA 47 HA ALA 47 16.555 -6.234 9.999 368 HB1 ALA 47 HB1 ALA 47 14.372 -5.910 10.597 369 HB2 ALA 47 HB2 ALA 47 14.165 -7.092 9.311 370 HB3 ALA 47 HB3 ALA 47 13.896 -5.375 8.986 371 H GLN 48 H GLN 48 15.480 -5.604 6.661 372 HA GLN 48 HA GLN 48 16.592 -8.263 5.962 373 HB2 GLN 48 HB3 GLN 48 15.029 -8.023 3.887 374 HB3 GLN 48 HB2 GLN 48 14.333 -8.511 5.427 375 HG2 GLN 48 HG3 GLN 48 12.911 -6.878 4.549 376 HG3 GLN 48 HG2 GLN 48 13.813 -6.002 5.784 377 HE21 GLN 48 HE21 GLN 48 15.144 -4.265 5.040 378 HE22 GLN 48 HE22 GLN 48 15.285 -3.853 3.393 379 H LYS 49 H LYS 49 18.357 -6.169 6.084 380 HA LYS 49 HA LYS 49 18.898 -4.991 3.546 381 HB2 LYS 49 HB3 LYS 49 20.748 -5.743 5.821 382 HB3 LYS 49 HB2 LYS 49 21.246 -4.874 4.367 383 HG2 LYS 49 HG3 LYS 49 19.645 -3.047 4.889 384 HG3 LYS 49 HG2 LYS 49 19.111 -3.955 6.304 385 HD2 LYS 49 HD3 LYS 49 20.638 -2.379 7.150 386 HD3 LYS 49 HD2 LYS 49 21.539 -3.887 7.130 387 HE2 LYS 49 HE2 LYS 49 21.689 -2.107 4.696 388 HE3 LYS 49 HE1 LYS 49 22.574 -1.640 6.140 389 HZ1 LYS 49 HZ1 LYS 49 23.678 -3.133 4.409 390 HZ2 LYS 49 HZ2 LYS 49 22.847 -4.421 5.155 391 HZ3 LYS 49 HZ3 LYS 49 23.920 -3.460 6.032 392 H ASP 50 H ASP 50 19.788 -7.976 5.107 393 HA ASP 50 HA ASP 50 21.611 -8.876 3.161 394 HB2 ASP 50 HB3 ASP 50 21.388 -9.731 5.533 395 HB3 ASP 50 HB2 ASP 50 20.023 -10.689 4.982 396 H VAL 51 H VAL 51 18.184 -8.784 3.112 397 HA VAL 51 HA VAL 51 17.890 -10.958 1.231 398 HB VAL 51 HB VAL 51 15.890 -8.777 1.782 399 HG11 VAL 51 HG11 VAL 51 15.566 -10.523 -0.064 400 HG12 VAL 51 HG12 VAL 51 14.269 -10.397 1.119 401 HG13 VAL 51 HG13 VAL 51 15.418 -11.723 1.222 402 HG21 VAL 51 HG21 VAL 51 16.558 -9.602 3.995 403 HG22 VAL 51 HG22 VAL 51 16.498 -11.265 3.414 404 HG23 VAL 51 HG23 VAL 51 15.007 -10.338 3.577 405 H ASP 52 H ASP 52 18.940 -10.620 -0.600 406 HA ASP 52 HA ASP 52 19.741 -8.293 -1.793 407 HB2 ASP 52 HB3 ASP 52 20.397 -10.560 -2.542 408 HB3 ASP 52 HB2 ASP 52 18.773 -10.742 -3.218 409 H ALA 53 H ALA 53 16.621 -9.761 -1.843 410 HA ALA 53 HA ALA 53 15.423 -8.450 -3.982 411 HB1 ALA 53 HB1 ALA 53 13.306 -8.864 -2.939 412 HB2 ALA 53 HB2 ALA 53 14.044 -9.058 -1.359 413 HB3 ALA 53 HB3 ALA 53 14.336 -10.260 -2.628 414 H VAL 54 H VAL 54 16.302 -7.221 -0.792 415 HA VAL 54 HA VAL 54 14.621 -4.975 -0.760 416 HB VAL 54 HB VAL 54 16.026 -5.763 1.180 417 HG11 VAL 54 HG11 VAL 54 18.310 -4.257 -0.109 418 HG12 VAL 54 HG12 VAL 54 18.189 -6.021 -0.185 419 HG13 VAL 54 HG13 VAL 54 18.314 -5.207 1.359 420 HG21 VAL 54 HG21 VAL 54 16.814 -3.353 1.796 421 HG22 VAL 54 HG22 VAL 54 15.101 -3.646 1.576 422 HG23 VAL 54 HG23 VAL 54 16.035 -2.869 0.290 423 H ASP 55 H ASP 55 17.796 -5.484 -2.130 424 HA ASP 55 HA ASP 55 18.271 -2.852 -3.137 425 HB2 ASP 55 HB3 ASP 55 19.920 -4.801 -2.999 426 HB3 ASP 55 HB2 ASP 55 19.126 -5.418 -4.454 427 H LYS 56 H LYS 56 16.927 -5.749 -4.564 428 HA LYS 56 HA LYS 56 16.309 -4.642 -7.078 429 HB2 LYS 56 HB3 LYS 56 15.297 -7.110 -5.669 430 HB3 LYS 56 HB2 LYS 56 14.833 -6.671 -7.312 431 HG2 LYS 56 HG3 LYS 56 17.146 -6.656 -8.058 432 HG3 LYS 56 HG2 LYS 56 17.715 -6.981 -6.409 433 HD2 LYS 56 HD3 LYS 56 16.769 -9.095 -6.398 434 HD3 LYS 56 HD2 LYS 56 15.874 -8.873 -7.925 435 HE2 LYS 56 HE2 LYS 56 18.019 -10.238 -8.131 436 HE3 LYS 56 HE1 LYS 56 17.976 -8.821 -9.165 437 HZ1 LYS 56 HZ1 LYS 56 19.360 -9.054 -6.532 438 HZ2 LYS 56 HZ2 LYS 56 19.266 -7.617 -7.414 439 HZ3 LYS 56 HZ3 LYS 56 20.099 -8.923 -8.026 440 H VAL 57 H VAL 57 14.399 -4.989 -4.134 441 HA VAL 57 HA VAL 57 11.919 -4.157 -5.191 442 HB VAL 57 HB VAL 57 13.110 -3.818 -2.414 443 HG11 VAL 57 HG11 VAL 57 10.423 -3.101 -3.531 444 HG12 VAL 57 HG12 VAL 57 11.409 -2.305 -2.287 445 HG13 VAL 57 HG13 VAL 57 10.532 -3.784 -1.904 446 HG21 VAL 57 HG21 VAL 57 12.463 -6.159 -3.634 447 HG22 VAL 57 HG22 VAL 57 10.886 -5.713 -3.003 448 HG23 VAL 57 HG23 VAL 57 12.256 -5.888 -1.904 449 H MET 58 H MET 58 14.609 -2.394 -3.776 450 HA MET 58 HA MET 58 13.584 0.244 -4.004 451 HB2 MET 58 HB3 MET 58 16.464 -0.683 -4.248 452 HB3 MET 58 HB2 MET 58 15.924 0.931 -3.843 453 HG2 MET 58 HG3 MET 58 14.763 -1.148 -2.166 454 HG3 MET 58 HG2 MET 58 16.504 -1.062 -2.013 455 HE1 MET 58 HE1 MET 58 17.799 0.610 -1.684 456 HE2 MET 58 HE2 MET 58 17.547 1.554 -0.226 457 HE3 MET 58 HE3 MET 58 17.377 2.330 -1.795 458 H LYS 59 H LYS 59 15.483 -1.821 -6.128 459 HA LYS 59 HA LYS 59 15.884 0.017 -8.229 460 HB2 LYS 59 HB3 LYS 59 17.217 -1.984 -7.853 461 HB3 LYS 59 HB2 LYS 59 15.826 -2.973 -8.241 462 HG2 LYS 59 HG3 LYS 59 15.629 -2.073 -10.466 463 HG3 LYS 59 HG2 LYS 59 16.914 -0.930 -10.188 464 HD2 LYS 59 HD3 LYS 59 17.921 -2.730 -11.429 465 HD3 LYS 59 HD2 LYS 59 18.451 -2.962 -9.776 466 HE2 LYS 59 HE2 LYS 59 17.729 -5.106 -10.560 467 HE3 LYS 59 HE1 LYS 59 16.502 -4.545 -9.438 468 HZ1 LYS 59 HZ1 LYS 59 15.141 -5.101 -11.160 469 HZ2 LYS 59 HZ2 LYS 59 16.297 -4.972 -12.326 470 HZ3 LYS 59 HZ3 LYS 59 15.489 -3.587 -11.791 471 H GLU 60 H GLU 60 13.632 -2.668 -7.867 472 HA GLU 60 HA GLU 60 12.482 -2.495 -10.378 473 HB2 GLU 60 HB3 GLU 60 11.664 -3.572 -7.776 474 HB3 GLU 60 HB2 GLU 60 10.594 -3.854 -9.172 475 HG2 GLU 60 HG3 GLU 60 12.492 -4.931 -10.322 476 HG3 GLU 60 HG2 GLU 60 13.559 -4.600 -8.963 477 H LEU 61 H LEU 61 11.358 -1.098 -7.341 478 HA LEU 61 HA LEU 61 9.095 0.128 -8.531 479 HB2 LEU 61 HB3 LEU 61 10.542 0.499 -5.944 480 HB3 LEU 61 HB2 LEU 61 9.345 1.694 -6.426 481 HG LEU 61 HG LEU 61 8.413 -0.205 -5.006 482 HD11 LEU 61 HD11 LEU 61 6.637 0.764 -5.967 483 HD12 LEU 61 HD12 LEU 61 6.580 -0.691 -6.938 484 HD13 LEU 61 HD13 LEU 61 7.328 0.765 -7.584 485 HD21 LEU 61 HD21 LEU 61 8.087 -2.370 -6.011 486 HD22 LEU 61 HD22 LEU 61 9.796 -2.004 -6.143 487 HD23 LEU 61 HD23 LEU 61 8.742 -1.840 -7.553 488 H ASP 62 H ASP 62 12.434 1.106 -8.011 489 HA ASP 62 HA ASP 62 12.131 3.750 -8.877 490 HB2 ASP 62 HB3 ASP 62 14.165 3.074 -7.779 491 HB3 ASP 62 HB2 ASP 62 14.575 1.979 -9.082 492 H GLU 63 H GLU 63 12.794 0.752 -10.635 493 HA GLU 63 HA GLU 63 13.149 1.957 -13.159 494 HB2 GLU 63 HB3 GLU 63 12.213 -0.831 -12.451 495 HB3 GLU 63 HB2 GLU 63 12.600 -0.295 -14.089 496 HG2 GLU 63 HG3 GLU 63 14.871 0.360 -13.341 497 HG3 GLU 63 HG2 GLU 63 14.434 -0.215 -11.736 498 H ASN 64 H ASN 64 10.321 0.758 -11.483 499 HA ASN 64 HA ASN 64 8.387 1.276 -13.531 500 HB2 ASN 64 HB3 ASN 64 8.382 0.850 -10.645 501 HB3 ASN 64 HB2 ASN 64 6.963 1.708 -11.339 502 HD21 ASN 64 HD21 ASN 64 8.752 -0.714 -13.231 503 HD22 ASN 64 HD22 ASN 64 7.555 -1.909 -13.164 504 H GLY 65 H GLY 65 9.644 3.171 -10.844 505 HA2 GLY 65 HA3 GLY 65 8.052 5.451 -11.450 506 HA3 GLY 65 HA2 GLY 65 9.413 5.437 -10.336 507 H ASP 66 H ASP 66 9.077 4.766 -13.794 508 HA ASP 66 HA ASP 66 11.588 5.901 -14.462 509 HB2 ASP 66 HB3 ASP 66 10.011 4.301 -15.864 510 HB3 ASP 66 HB2 ASP 66 9.338 5.811 -16.443 511 H GLY 67 H GLY 67 8.358 7.115 -14.305 512 HA2 GLY 67 HA3 GLY 67 9.222 9.836 -15.120 513 HA3 GLY 67 HA2 GLY 67 7.560 9.281 -14.937 514 H GLU 68 H GLU 68 7.076 8.445 -12.664 515 HA GLU 68 HA GLU 68 8.364 9.975 -10.512 516 HB2 GLU 68 HB3 GLU 68 5.376 9.900 -10.829 517 HB3 GLU 68 HB2 GLU 68 6.290 10.856 -9.685 518 HG2 GLU 68 HG3 GLU 68 5.798 12.474 -11.284 519 HG3 GLU 68 HG2 GLU 68 7.352 11.924 -11.876 520 H VAL 69 H VAL 69 7.053 9.284 -8.400 521 HA VAL 69 HA VAL 69 6.214 6.515 -8.693 522 HB VAL 69 HB VAL 69 8.292 6.294 -7.562 523 HG11 VAL 69 HG11 VAL 69 7.358 8.636 -5.922 524 HG12 VAL 69 HG12 VAL 69 8.791 8.568 -6.940 525 HG13 VAL 69 HG13 VAL 69 8.709 7.627 -5.439 526 HG21 VAL 69 HG21 VAL 69 7.652 5.375 -5.425 527 HG22 VAL 69 HG22 VAL 69 6.281 5.133 -6.509 528 HG23 VAL 69 HG23 VAL 69 6.246 6.433 -5.323 529 H ASP 70 H ASP 70 4.172 6.251 -7.964 530 HA ASP 70 HA ASP 70 2.974 8.569 -6.614 531 HB2 ASP 70 HB3 ASP 70 1.592 8.361 -8.322 532 HB3 ASP 70 HB2 ASP 70 1.973 6.694 -8.651 533 H PHE 71 H PHE 71 0.937 7.911 -5.294 534 HA PHE 71 HA PHE 71 1.937 6.877 -2.901 535 HB2 PHE 71 HB3 PHE 71 0.018 8.428 -3.052 536 HB3 PHE 71 HB2 PHE 71 -0.952 7.117 -3.715 537 HD1 PHE 71 HD1 PHE 71 1.174 7.973 -0.770 538 HD2 PHE 71 HD2 PHE 71 -2.112 5.640 -2.262 539 HE1 PHE 71 HE1 PHE 71 0.698 7.182 1.511 540 HE2 PHE 71 HE2 PHE 71 -2.589 4.860 0.042 541 HZ PHE 71 HZ PHE 71 -1.184 5.629 1.924 542 H GLN 72 H GLN 72 -0.157 5.383 -5.342 543 HA GLN 72 HA GLN 72 -0.586 2.916 -4.023 544 HB2 GLN 72 HB3 GLN 72 -0.553 3.692 -6.939 545 HB3 GLN 72 HB2 GLN 72 -0.955 2.063 -6.412 546 HG2 GLN 72 HG3 GLN 72 -2.825 2.916 -5.117 547 HG3 GLN 72 HG2 GLN 72 -2.381 4.585 -5.496 548 HE21 GLN 72 HE21 GLN 72 -2.906 5.374 -7.621 549 HE22 GLN 72 HE22 GLN 72 -3.839 4.490 -8.721 550 H GLU 73 H GLU 73 1.848 4.095 -6.219 551 HA GLU 73 HA GLU 73 3.409 1.716 -6.450 552 HB2 GLU 73 HB3 GLU 73 4.087 4.644 -6.868 553 HB3 GLU 73 HB2 GLU 73 5.099 3.286 -7.348 554 HG2 GLU 73 HG3 GLU 73 3.444 2.431 -8.861 555 HG3 GLU 73 HG2 GLU 73 2.224 3.529 -8.236 556 H TYR 74 H TYR 74 3.511 4.578 -4.407 557 HA TYR 74 HA TYR 74 5.881 4.033 -3.011 558 HB2 TYR 74 HB3 TYR 74 4.947 6.239 -2.935 559 HB3 TYR 74 HB2 TYR 74 3.444 5.625 -2.260 560 HD1 TYR 74 HD1 TYR 74 7.097 5.177 -1.386 561 HD2 TYR 74 HD2 TYR 74 3.155 6.256 -0.041 562 HE1 TYR 74 HE1 TYR 74 7.964 5.507 0.891 563 HE2 TYR 74 HE2 TYR 74 4.027 6.605 2.242 564 HH TYR 74 HH TYR 74 7.447 6.560 2.955 565 H VAL 75 H VAL 75 2.501 3.237 -2.156 566 HA VAL 75 HA VAL 75 3.176 2.102 0.296 567 HB VAL 75 HB VAL 75 0.963 1.095 0.336 568 HG11 VAL 75 HG11 VAL 75 1.561 3.867 -0.069 569 HG12 VAL 75 HG12 VAL 75 0.238 3.168 0.850 570 HG13 VAL 75 HG13 VAL 75 0.027 3.528 -0.857 571 HG21 VAL 75 HG21 VAL 75 -0.484 1.046 -1.553 572 HG22 VAL 75 HG22 VAL 75 1.013 0.434 -2.181 573 HG23 VAL 75 HG23 VAL 75 0.544 2.120 -2.480 574 H VAL 76 H VAL 76 2.907 0.621 -2.907 575 HA VAL 76 HA VAL 76 3.240 -2.027 -1.971 576 HB VAL 76 HB VAL 76 2.284 -1.579 -4.185 577 HG11 VAL 76 HG11 VAL 76 5.042 -0.494 -4.816 578 HG12 VAL 76 HG12 VAL 76 3.472 0.294 -4.962 579 HG13 VAL 76 HG13 VAL 76 3.898 -1.007 -6.055 580 HG21 VAL 76 HG21 VAL 76 4.897 -3.117 -4.447 581 HG22 VAL 76 HG22 VAL 76 3.434 -3.326 -5.407 582 HG23 VAL 76 HG23 VAL 76 3.429 -3.758 -3.704 583 H LEU 77 H LEU 77 5.528 0.469 -2.929 584 HA LEU 77 HA LEU 77 7.826 -1.132 -2.970 585 HB2 LEU 77 HB3 LEU 77 7.868 1.188 -3.814 586 HB3 LEU 77 HB2 LEU 77 7.511 1.776 -2.216 587 HG LEU 77 HG LEU 77 9.635 0.964 -1.321 588 HD11 LEU 77 HD11 LEU 77 11.319 -0.045 -2.765 589 HD12 LEU 77 HD12 LEU 77 10.201 -0.087 -4.109 590 HD13 LEU 77 HD13 LEU 77 9.896 -1.062 -2.666 591 HD21 LEU 77 HD21 LEU 77 11.196 2.230 -3.022 592 HD22 LEU 77 HD22 LEU 77 9.974 3.120 -2.128 593 HD23 LEU 77 HD23 LEU 77 9.675 2.657 -3.808 594 H VAL 78 H VAL 78 6.360 0.744 -0.346 595 HA VAL 78 HA VAL 78 8.242 -0.198 1.569 596 HB VAL 78 HB VAL 78 6.830 0.816 3.269 597 HG11 VAL 78 HG11 VAL 78 6.502 2.902 1.230 598 HG12 VAL 78 HG12 VAL 78 8.057 2.125 1.097 599 HG13 VAL 78 HG13 VAL 78 7.568 2.882 2.627 600 HG21 VAL 78 HG21 VAL 78 4.588 0.155 2.244 601 HG22 VAL 78 HG22 VAL 78 4.907 1.374 1.010 602 HG23 VAL 78 HG23 VAL 78 4.693 1.865 2.675 603 H ALA 79 H ALA 79 4.992 -1.215 0.651 604 HA ALA 79 HA ALA 79 4.722 -3.200 2.629 605 HB1 ALA 79 HB1 ALA 79 2.814 -2.474 1.350 606 HB2 ALA 79 HB2 ALA 79 3.035 -4.209 1.128 607 HB3 ALA 79 HB3 ALA 79 3.537 -3.084 -0.139 608 H ALA 80 H ALA 80 6.144 -3.208 -0.592 609 HA ALA 80 HA ALA 80 6.561 -5.932 -0.902 610 HB1 ALA 80 HB1 ALA 80 8.339 -3.659 -1.799 611 HB2 ALA 80 HB2 ALA 80 6.977 -4.283 -2.700 612 HB3 ALA 80 HB3 ALA 80 8.399 -5.296 -2.444 613 H LEU 81 H LEU 81 8.680 -3.473 0.495 614 HA LEU 81 HA LEU 81 10.666 -5.297 1.438 615 HB2 LEU 81 HB3 LEU 81 9.906 -2.521 2.363 616 HB3 LEU 81 HB2 LEU 81 11.322 -3.401 2.928 617 HG LEU 81 HG LEU 81 10.760 -2.727 0.023 618 HD11 LEU 81 HD11 LEU 81 11.662 -1.009 2.036 619 HD12 LEU 81 HD12 LEU 81 11.803 -0.793 0.293 620 HD13 LEU 81 HD13 LEU 81 13.127 -1.521 1.190 621 HD21 LEU 81 HD21 LEU 81 12.876 -4.305 1.440 622 HD22 LEU 81 HD22 LEU 81 13.370 -3.302 0.072 623 HD23 LEU 81 HD23 LEU 81 12.166 -4.555 -0.153 624 H THR 82 H THR 82 7.767 -3.864 2.843 625 HA THR 82 HA THR 82 8.129 -4.863 5.435 626 HB THR 82 HB THR 82 5.443 -4.399 4.133 627 HG1 THR 82 HG2 THR 82 6.941 -2.584 3.866 628 HG21 THR 82 HG21 THR 82 6.084 -3.671 6.942 629 HG22 THR 82 HG22 THR 82 5.901 -5.388 6.579 630 HG23 THR 82 HG23 THR 82 4.584 -4.271 6.249 631 H VAL 83 H VAL 83 6.282 -6.265 2.689 632 HA VAL 83 HA VAL 83 5.455 -8.534 4.149 633 HB VAL 83 HB VAL 83 4.379 -7.852 1.998 634 HG11 VAL 83 HG11 VAL 83 6.364 -7.248 0.733 635 HG12 VAL 83 HG12 VAL 83 5.387 -8.431 -0.129 636 HG13 VAL 83 HG13 VAL 83 6.862 -8.940 0.661 637 HG21 VAL 83 HG21 VAL 83 3.725 -10.033 2.449 638 HG22 VAL 83 HG22 VAL 83 5.366 -10.676 2.410 639 HG23 VAL 83 HG23 VAL 83 4.536 -10.241 0.919 640 H ALA 84 H ALA 84 8.261 -7.982 2.070 641 HA ALA 84 HA ALA 84 9.358 -10.580 2.325 642 HB1 ALA 84 HB1 ALA 84 10.285 -9.186 0.619 643 HB2 ALA 84 HB2 ALA 84 11.554 -9.408 1.814 644 HB3 ALA 84 HB3 ALA 84 10.653 -7.902 1.769 645 H MET 85 H MET 85 9.999 -7.592 4.163 646 HA MET 85 HA MET 85 11.847 -8.779 5.943 647 HB2 MET 85 HB3 MET 85 11.335 -6.225 5.569 648 HB3 MET 85 HB2 MET 85 10.064 -6.529 6.725 649 HG2 MET 85 HG3 MET 85 12.714 -7.601 7.521 650 HG3 MET 85 HG2 MET 85 12.558 -5.854 7.489 651 HE1 MET 85 HE1 MET 85 11.115 -8.987 10.135 652 HE2 MET 85 HE2 MET 85 12.427 -8.009 10.738 653 HE3 MET 85 HE3 MET 85 12.559 -8.749 9.147 654 H ASN 86 H ASN 86 8.395 -8.041 6.298 655 HA ASN 86 HA ASN 86 8.224 -8.939 8.927 656 HB2 ASN 86 HB3 ASN 86 6.539 -7.548 7.426 657 HB3 ASN 86 HB2 ASN 86 5.812 -9.134 7.184 658 HD21 ASN 86 HD21 ASN 86 5.350 -6.495 8.983 659 HD22 ASN 86 HD22 ASN 86 4.864 -7.165 10.453 660 H ASN 87 H ASN 87 8.044 -10.592 5.900 661 HA ASN 87 HA ASN 87 6.913 -13.034 6.480 662 HB2 ASN 87 HB3 ASN 87 8.161 -12.138 4.315 663 HB3 ASN 87 HB2 ASN 87 9.520 -13.003 5.011 664 HD21 ASN 87 HD21 ASN 87 7.751 -15.102 6.232 665 HD22 ASN 87 HD22 ASN 87 7.259 -16.062 4.932 666 H PHE 88 H PHE 88 10.042 -11.786 7.457 667 HA PHE 88 HA PHE 88 11.253 -14.146 8.375 668 HB2 PHE 88 HB3 PHE 88 11.502 -11.264 9.265 669 HB3 PHE 88 HB2 PHE 88 12.406 -12.550 10.020 670 HD1 PHE 88 HD2 PHE 88 11.620 -11.281 6.549 671 HD2 PHE 88 HD1 PHE 88 14.499 -13.124 9.167 672 HE1 PHE 88 HE2 PHE 88 13.294 -11.215 4.753 673 HE2 PHE 88 HE1 PHE 88 16.180 -13.052 7.357 674 HZ PHE 88 HZ PHE 88 15.594 -12.105 5.153 675 H PHE 89 H PHE 89 9.085 -11.867 9.997 676 HA PHE 89 HA PHE 89 9.086 -13.166 12.530 677 HB2 PHE 89 HB3 PHE 89 7.116 -11.267 11.237 678 HB3 PHE 89 HB2 PHE 89 6.943 -11.879 12.871 679 HD1 PHE 89 HD1 PHE 89 9.073 -11.646 14.431 680 HD2 PHE 89 HD2 PHE 89 8.390 -9.321 10.886 681 HE1 PHE 89 HE1 PHE 89 10.660 -9.937 15.252 682 HE2 PHE 89 HE2 PHE 89 9.983 -7.604 11.709 683 HZ PHE 89 HZ PHE 89 11.116 -7.907 13.884 684 H TRP 90 H TRP 90 7.027 -13.405 9.689 685 HA TRP 90 HA TRP 90 5.071 -15.146 10.792 686 HB2 TRP 90 HB3 TRP 90 5.929 -15.214 7.905 687 HB3 TRP 90 HB2 TRP 90 4.335 -15.516 8.586 688 HD1 TRP 90 HD TRP 90 4.897 -12.766 10.531 689 HE1 TRP 90 HE1 TRP 90 4.321 -10.564 9.495 690 HE3 TRP 90 HE3 TRP 90 4.787 -14.170 5.629 691 HZ2 TRP 90 HZ2 TRP 90 3.822 -9.467 6.868 692 HZ3 TRP 90 HZ3 TRP 90 4.249 -12.518 3.867 693 HH2 TRP 90 HH TRP 90 3.769 -10.159 4.479 694 H GLU 91 H GLU 91 7.967 -15.639 9.023 695 HA GLU 91 HA GLU 91 7.835 -18.484 8.830 696 HB2 GLU 91 HB3 GLU 91 10.097 -16.571 8.692 697 HB3 GLU 91 HB2 GLU 91 10.206 -18.257 8.136 698 HG2 GLU 91 HG3 GLU 91 7.902 -16.701 7.137 699 HG3 GLU 91 HG2 GLU 91 9.408 -16.115 6.503 700 H ASN 92 H ASN 92 9.676 -16.318 10.976 701 HA ASN 92 HA ASN 92 10.217 -18.640 12.713 702 HB2 ASN 92 HB3 ASN 92 12.210 -17.364 12.150 703 HB3 ASN 92 HB2 ASN 92 11.467 -15.878 12.738 704 HD21 ASN 92 HD21 ASN 92 11.404 -19.190 14.245 705 HD22 ASN 92 HD22 ASN 92 12.139 -18.660 15.667 706 H SER 93 H SER 93 8.447 -18.934 13.846 707 HA SER 93 HA SER 93 7.790 -17.225 15.998 708 HB2 SER 93 HB3 SER 93 6.209 -17.030 13.469 709 HB3 SER 93 HB2 SER 93 5.325 -16.986 14.993 710 HG SER 93 HG SER 93 7.171 -15.258 13.831 711 H1 GLY 1 H GLY 1 9.336 1.024 14.925 712 HA2 GLY 1 HA3 GLY 1 11.704 1.863 13.440 713 HA3 GLY 1 HA2 GLY 1 10.477 1.026 12.505 714 H SER 2 H SER 2 10.178 2.964 11.312 715 HA SER 2 HA SER 2 9.305 5.409 12.470 716 HB2 SER 2 HB3 SER 2 8.657 4.383 9.713 717 HB3 SER 2 HB2 SER 2 8.745 6.051 10.210 718 HG SER 2 HG SER 2 10.599 4.436 9.314 719 H GLU 3 H GLU 3 7.159 6.330 12.267 720 HA GLU 3 HA GLU 3 5.070 4.742 13.301 721 HB2 GLU 3 HB3 GLU 3 5.026 7.345 11.756 722 HB3 GLU 3 HB2 GLU 3 3.615 6.637 12.531 723 HG2 GLU 3 HG3 GLU 3 4.763 6.715 14.712 724 HG3 GLU 3 HG2 GLU 3 6.184 7.415 13.956 725 H LEU 4 H LEU 4 6.131 5.589 10.139 726 HA LEU 4 HA LEU 4 3.944 4.627 8.618 727 HB2 LEU 4 HB3 LEU 4 6.885 4.903 7.895 728 HB3 LEU 4 HB2 LEU 4 5.634 4.447 6.775 729 HG LEU 4 HG LEU 4 6.239 6.903 6.768 730 HD11 LEU 4 HD11 LEU 4 3.473 7.257 7.234 731 HD12 LEU 4 HD12 LEU 4 3.688 5.642 6.554 732 HD13 LEU 4 HD13 LEU 4 4.358 7.058 5.731 733 HD21 LEU 4 HD21 LEU 4 6.388 7.332 9.202 734 HD22 LEU 4 HD22 LEU 4 4.639 6.968 9.387 735 HD23 LEU 4 HD23 LEU 4 5.157 8.329 8.476 736 H GLU 5 H GLU 5 6.936 3.147 9.822 737 HA GLU 5 HA GLU 5 6.511 0.595 8.658 738 HB2 GLU 5 HB3 GLU 5 8.105 1.401 11.129 739 HB3 GLU 5 HB2 GLU 5 8.165 -0.168 10.340 740 HG2 GLU 5 HG3 GLU 5 8.870 0.921 8.217 741 HG3 GLU 5 HG2 GLU 5 8.851 2.464 9.024 742 H THR 6 H THR 6 5.657 2.105 11.706 743 HA THR 6 HA THR 6 4.348 -0.117 12.888 744 HB THR 6 HB THR 6 3.622 2.814 13.240 745 HG1 THR 6 HG2 THR 6 5.348 2.996 14.549 746 HG21 THR 6 HG21 THR 6 2.105 1.744 14.555 747 HG22 THR 6 HG22 THR 6 3.450 1.643 15.678 748 HG23 THR 6 HG23 THR 6 3.051 0.268 14.653 749 H ALA 7 H ALA 7 3.267 2.541 10.786 750 HA ALA 7 HA ALA 7 0.566 1.824 10.565 751 HB1 ALA 7 HB1 ALA 7 0.493 3.241 8.661 752 HB2 ALA 7 HB2 ALA 7 2.202 3.041 8.327 753 HB3 ALA 7 HB3 ALA 7 1.678 3.962 9.743 754 H MET 8 H MET 8 3.388 0.919 8.596 755 HA MET 8 HA MET 8 1.978 -0.805 6.839 756 HB2 MET 8 HB3 MET 8 4.892 -0.874 7.640 757 HB3 MET 8 HB2 MET 8 4.201 -1.807 6.328 758 HG2 MET 8 HG3 MET 8 4.272 1.235 6.499 759 HG3 MET 8 HG2 MET 8 5.181 0.201 5.397 760 HE1 MET 8 HE1 MET 8 4.236 -1.523 4.112 761 HE2 MET 8 HE2 MET 8 2.974 -1.175 2.933 762 HE3 MET 8 HE3 MET 8 2.555 -2.001 4.422 763 H GLU 9 H GLU 9 3.630 -1.385 9.905 764 HA GLU 9 HA GLU 9 3.191 -4.170 9.909 765 HB2 GLU 9 HB3 GLU 9 4.235 -2.226 11.763 766 HB3 GLU 9 HB2 GLU 9 3.096 -3.265 12.607 767 HG2 GLU 9 HG3 GLU 9 5.089 -4.518 10.756 768 HG3 GLU 9 HG2 GLU 9 5.637 -4.005 12.344 769 H THR 10 H THR 10 1.284 -1.419 10.945 770 HA THR 10 HA THR 10 -0.855 -2.871 12.097 771 HB THR 10 HB THR 10 -1.150 -0.221 10.626 772 HG1 THR 10 HG2 THR 10 0.633 -0.089 12.057 773 HG21 THR 10 HG21 THR 10 -3.082 -1.705 11.757 774 HG22 THR 10 HG22 THR 10 -3.054 0.049 11.849 775 HG23 THR 10 HG23 THR 10 -2.476 -0.906 13.207 776 H LEU 11 H LEU 11 -0.156 -1.820 8.787 777 HA LEU 11 HA LEU 11 -2.490 -2.899 7.586 778 HB2 LEU 11 HB3 LEU 11 0.297 -2.409 6.499 779 HB3 LEU 11 HB2 LEU 11 -1.026 -2.984 5.498 780 HG LEU 11 HG LEU 11 -1.206 -0.423 7.120 781 HD11 LEU 11 HD11 LEU 11 0.028 -0.947 4.443 782 HD12 LEU 11 HD12 LEU 11 0.486 0.208 5.701 783 HD13 LEU 11 HD13 LEU 11 -0.904 0.530 4.684 784 HD21 LEU 11 HD21 LEU 11 -3.237 -1.822 5.935 785 HD22 LEU 11 HD22 LEU 11 -2.652 -0.916 4.557 786 HD23 LEU 11 HD23 LEU 11 -3.183 -0.060 5.995 787 H ILE 12 H ILE 12 0.723 -4.246 8.266 788 HA ILE 12 HA ILE 12 0.335 -6.791 7.046 789 HB ILE 12 HB ILE 12 2.102 -5.986 9.386 790 HG12 ILE 12 HG13 ILE 12 2.533 -4.919 7.082 791 HG13 ILE 12 HG12 ILE 12 3.884 -5.821 7.783 792 HG21 ILE 12 HG21 ILE 12 2.040 -8.254 9.666 793 HG22 ILE 12 HG22 ILE 12 3.364 -8.120 8.527 794 HG23 ILE 12 HG23 ILE 12 1.763 -8.592 7.961 795 HD11 ILE 12 HD11 ILE 12 3.498 -7.674 6.325 796 HD12 ILE 12 HD12 ILE 12 3.426 -6.243 5.339 797 HD13 ILE 12 HD13 ILE 12 1.935 -7.054 5.785 798 H ASN 13 H ASN 13 -0.129 -5.667 10.351 799 HA ASN 13 HA ASN 13 -0.896 -8.132 11.468 800 HB2 ASN 13 HB3 ASN 13 -1.505 -5.276 12.252 801 HB3 ASN 13 HB2 ASN 13 -2.100 -6.636 13.181 802 HD21 ASN 13 HD21 ASN 13 0.737 -4.811 12.395 803 HD22 ASN 13 HD22 ASN 13 1.823 -5.597 13.430 804 H VAL 14 H VAL 14 -2.786 -5.521 10.009 805 HA VAL 14 HA VAL 14 -5.343 -6.721 10.340 806 HB VAL 14 HB VAL 14 -4.306 -4.677 8.366 807 HG11 VAL 14 HG11 VAL 14 -6.417 -5.879 7.614 808 HG12 VAL 14 HG12 VAL 14 -6.597 -4.151 7.863 809 HG13 VAL 14 HG13 VAL 14 -7.188 -5.271 9.080 810 HG21 VAL 14 HG21 VAL 14 -6.138 -4.079 10.658 811 HG22 VAL 14 HG22 VAL 14 -4.891 -3.059 9.944 812 HG23 VAL 14 HG23 VAL 14 -4.444 -4.359 11.025 813 H PHE 15 H PHE 15 -3.008 -6.667 7.683 814 HA PHE 15 HA PHE 15 -4.493 -8.092 5.805 815 HB2 PHE 15 HB3 PHE 15 -2.425 -6.904 5.288 816 HB3 PHE 15 HB2 PHE 15 -1.504 -8.042 6.257 817 HD1 PHE 15 HD1 PHE 15 -3.684 -7.761 3.245 818 HD2 PHE 15 HD2 PHE 15 -0.794 -10.144 5.357 819 HE1 PHE 15 HE1 PHE 15 -3.459 -9.252 1.278 820 HE2 PHE 15 HE2 PHE 15 -0.585 -11.628 3.395 821 HZ PHE 15 HZ PHE 15 -1.925 -11.175 1.347 822 H HIS 16 H HIS 16 -2.127 -9.244 8.181 823 HA HIS 16 HA HIS 16 -2.712 -11.956 7.554 824 HB2 HIS 16 HB3 HIS 16 -0.977 -10.759 9.679 825 HB3 HIS 16 HB2 HIS 16 -1.336 -12.491 9.637 826 HD1 HIS 16 HD1 HIS 16 -1.517 -12.528 6.357 827 HD2 HIS 16 HD2 HIS 16 1.693 -11.201 8.721 828 HE1 HIS 16 HE1 HIS 16 0.577 -12.724 4.946 829 HE2 HIS 16 HE2 HIS 16 2.522 -11.948 6.358 830 H ALA 17 H ALA 17 -4.019 -9.775 9.854 831 HA ALA 17 HA ALA 17 -5.374 -11.660 11.474 832 HB1 ALA 17 HB1 ALA 17 -5.428 -9.238 11.982 833 HB2 ALA 17 HB2 ALA 17 -7.057 -9.880 11.821 834 HB3 ALA 17 HB3 ALA 17 -6.348 -8.945 10.506 835 H HIS 18 H HIS 18 -6.033 -10.242 8.318 836 HA HIS 18 HA HIS 18 -8.404 -11.781 7.965 837 HB2 HIS 18 HB3 HIS 18 -6.868 -10.009 6.068 838 HB3 HIS 18 HB2 HIS 18 -8.217 -11.018 5.547 839 HD1 HIS 18 HD1 HIS 18 -10.598 -10.588 6.636 840 HD2 HIS 18 HD2 HIS 18 -7.673 -7.740 7.591 841 HE1 HIS 18 HE1 HIS 18 -11.808 -8.592 7.682 842 HE2 HIS 18 HE2 HIS 18 -10.032 -6.857 8.261 843 H SER 19 H SER 19 -5.007 -12.111 6.962 844 HA SER 19 HA SER 19 -5.195 -14.231 5.162 845 HB2 SER 19 HB3 SER 19 -3.093 -14.023 7.354 846 HB3 SER 19 HB2 SER 19 -2.975 -14.940 5.879 847 HG SER 19 HG SER 19 -3.199 -12.942 4.735 848 H GLY 20 H GLY 20 -5.463 -14.235 8.636 849 HA2 GLY 20 HA3 GLY 20 -5.291 -16.956 9.164 850 HA3 GLY 20 HA2 GLY 20 -6.235 -15.814 10.117 851 H LYS 21 H LYS 21 -8.056 -15.081 7.973 852 HA LYS 21 HA LYS 21 -10.012 -17.084 8.354 853 HB2 LYS 21 HB3 LYS 21 -9.821 -14.758 6.491 854 HB3 LYS 21 HB2 LYS 21 -11.209 -15.844 6.472 855 HG2 LYS 21 HG3 LYS 21 -11.961 -14.245 7.990 856 HG3 LYS 21 HG2 LYS 21 -11.207 -15.370 9.083 857 HD2 LYS 21 HD3 LYS 21 -9.207 -14.068 9.242 858 HD3 LYS 21 HD2 LYS 21 -9.723 -13.062 7.880 859 HE2 LYS 21 HE2 LYS 21 -11.501 -13.246 10.266 860 HE3 LYS 21 HE1 LYS 21 -10.076 -12.223 10.384 861 HZ1 LYS 21 HZ1 LYS 21 -12.431 -11.509 9.310 862 HZ2 LYS 21 HZ2 LYS 21 -11.545 -11.868 7.905 863 HZ3 LYS 21 HZ3 LYS 21 -10.969 -10.721 9.052 864 H GLU 22 H GLU 22 -7.929 -16.288 5.566 865 HA GLU 22 HA GLU 22 -8.382 -18.991 4.550 866 HB2 GLU 22 HB3 GLU 22 -8.713 -17.574 2.220 867 HB3 GLU 22 HB2 GLU 22 -9.983 -18.342 3.150 868 HG2 GLU 22 HG3 GLU 22 -10.886 -16.265 3.097 869 HG3 GLU 22 HG2 GLU 22 -9.882 -15.938 4.486 870 H GLY 23 H GLY 23 -6.874 -15.909 3.913 871 HA2 GLY 23 HA3 GLY 23 -5.177 -16.540 1.884 872 HA3 GLY 23 HA2 GLY 23 -4.874 -15.277 3.059 873 H ASP 24 H ASP 24 -4.723 -18.842 3.042 874 HA ASP 24 HA ASP 24 -3.170 -20.291 3.988 875 HB2 ASP 24 HB3 ASP 24 -2.336 -19.460 1.663 876 HB3 ASP 24 HB2 ASP 24 -1.146 -18.560 2.582 877 H LYS 25 H LYS 25 -0.356 -19.716 4.583 878 HA LYS 25 HA LYS 25 -0.762 -18.690 7.246 879 HB2 LYS 25 HB3 LYS 25 1.932 -18.420 6.908 880 HB3 LYS 25 HB2 LYS 25 1.162 -19.863 7.535 881 HG2 LYS 25 HG3 LYS 25 1.069 -20.814 5.291 882 HG3 LYS 25 HG2 LYS 25 1.823 -19.361 4.606 883 HD2 LYS 25 HD3 LYS 25 3.777 -19.758 6.173 884 HD3 LYS 25 HD2 LYS 25 3.019 -21.271 6.607 885 HE2 LYS 25 HE2 LYS 25 3.225 -22.154 4.385 886 HE3 LYS 25 HE1 LYS 25 3.707 -20.586 3.739 887 HZ1 LYS 25 HZ1 LYS 25 5.681 -20.655 5.053 888 HZ2 LYS 25 HZ2 LYS 25 5.618 -22.062 4.122 889 HZ3 LYS 25 HZ3 LYS 25 5.263 -22.119 5.767 890 H TYR 26 H TYR 26 0.781 -17.434 4.321 891 HA TYR 26 HA TYR 26 0.114 -14.803 5.329 892 HB2 TYR 26 HB3 TYR 26 2.409 -14.204 3.922 893 HB3 TYR 26 HB2 TYR 26 2.242 -14.299 5.670 894 HD1 TYR 26 HD2 TYR 26 3.035 -16.382 2.652 895 HD2 TYR 26 HD1 TYR 26 3.392 -15.842 6.847 896 HE1 TYR 26 HE2 TYR 26 4.639 -18.242 2.696 897 HE2 TYR 26 HE1 TYR 26 5.094 -17.754 6.954 898 HH TYR 26 HH TYR 26 6.750 -18.766 5.021 899 H LYS 27 H LYS 27 -1.599 -14.683 3.920 900 HA LYS 27 HA LYS 27 -1.077 -13.541 1.411 901 HB2 LYS 27 HB3 LYS 27 -2.563 -16.220 1.345 902 HB3 LYS 27 HB2 LYS 27 -2.591 -14.990 0.082 903 HG2 LYS 27 HG3 LYS 27 -0.096 -16.408 1.025 904 HG3 LYS 27 HG2 LYS 27 -1.036 -16.818 -0.376 905 HD2 LYS 27 HD3 LYS 27 -0.602 -13.982 -0.590 906 HD3 LYS 27 HD2 LYS 27 0.939 -14.716 -0.185 907 HE2 LYS 27 HE2 LYS 27 -0.782 -15.153 -2.590 908 HE3 LYS 27 HE1 LYS 27 0.940 -14.863 -2.523 909 HZ1 LYS 27 HZ1 LYS 27 0.918 -17.079 -2.927 910 HZ2 LYS 27 HZ2 LYS 27 -0.587 -17.316 -2.196 911 HZ3 LYS 27 HZ3 LYS 27 0.815 -17.230 -1.235 912 H LEU 28 H LEU 28 -3.482 -13.395 0.329 913 HA LEU 28 HA LEU 28 -5.536 -13.293 2.337 914 HB2 LEU 28 HB3 LEU 28 -4.642 -11.060 2.461 915 HB3 LEU 28 HB2 LEU 28 -4.725 -10.846 0.723 916 HG LEU 28 HG LEU 28 -7.250 -11.269 0.935 917 HD11 LEU 28 HD11 LEU 28 -8.000 -10.626 3.340 918 HD12 LEU 28 HD12 LEU 28 -6.412 -11.230 3.816 919 HD13 LEU 28 HD13 LEU 28 -7.558 -12.297 2.997 920 HD21 LEU 28 HD21 LEU 28 -6.322 -9.001 0.658 921 HD22 LEU 28 HD22 LEU 28 -6.042 -8.915 2.404 922 HD23 LEU 28 HD23 LEU 28 -7.694 -9.029 1.771 923 H SER 29 H SER 29 -7.464 -13.937 1.418 924 HA SER 29 HA SER 29 -7.393 -14.357 -1.495 925 HB2 SER 29 HB3 SER 29 -9.529 -15.631 0.166 926 HB3 SER 29 HB2 SER 29 -8.641 -16.192 -1.238 927 HG SER 29 HG SER 29 -7.669 -15.897 1.398 928 H LYS 30 H LYS 30 -9.531 -14.055 -2.613 929 HA LYS 30 HA LYS 30 -10.403 -11.381 -2.097 930 HB2 LYS 30 HB3 LYS 30 -11.768 -13.453 -3.826 931 HB3 LYS 30 HB2 LYS 30 -11.978 -11.718 -3.897 932 HG2 LYS 30 HG3 LYS 30 -9.395 -13.200 -4.507 933 HG3 LYS 30 HG2 LYS 30 -10.557 -12.525 -5.644 934 HD2 LYS 30 HD3 LYS 30 -9.719 -10.479 -3.701 935 HD3 LYS 30 HD2 LYS 30 -8.349 -11.160 -4.528 936 HE2 LYS 30 HE2 LYS 30 -10.666 -9.672 -5.669 937 HE3 LYS 30 HE1 LYS 30 -8.959 -9.415 -5.980 938 HZ1 LYS 30 HZ1 LYS 30 -10.797 -10.864 -7.486 939 HZ2 LYS 30 HZ2 LYS 30 -9.726 -12.056 -6.953 940 HZ3 LYS 30 HZ3 LYS 30 -9.198 -10.766 -7.856 941 H LYS 31 H LYS 31 -11.118 -14.277 -0.670 942 HA LYS 31 HA LYS 31 -13.923 -14.194 -0.293 943 HB2 LYS 31 HB3 LYS 31 -11.888 -15.225 1.698 944 HB3 LYS 31 HB2 LYS 31 -13.525 -15.770 1.454 945 HG2 LYS 31 HG3 LYS 31 -12.953 -16.596 -0.826 946 HG3 LYS 31 HG2 LYS 31 -11.326 -16.009 -0.609 947 HD2 LYS 31 HD3 LYS 31 -11.246 -17.489 1.517 948 HD3 LYS 31 HD2 LYS 31 -12.623 -18.332 0.821 949 HE2 LYS 31 HE2 LYS 31 -10.024 -17.823 -0.600 950 HE3 LYS 31 HE1 LYS 31 -10.378 -19.339 0.210 951 HZ1 LYS 31 HZ1 LYS 31 -12.329 -18.344 -1.759 952 HZ2 LYS 31 HZ2 LYS 31 -11.912 -19.928 -1.370 953 HZ3 LYS 31 HZ3 LYS 31 -10.886 -18.988 -2.345 954 H GLU 32 H GLU 32 -11.157 -13.124 1.630 955 HA GLU 32 HA GLU 32 -12.747 -11.613 3.538 956 HB2 GLU 32 HB3 GLU 32 -9.796 -12.142 3.219 957 HB3 GLU 32 HB2 GLU 32 -10.486 -11.170 4.518 958 HG2 GLU 32 HG3 GLU 32 -11.393 -13.940 3.921 959 HG3 GLU 32 HG2 GLU 32 -10.025 -13.611 4.949 960 H LEU 33 H LEU 33 -10.321 -11.019 1.021 961 HA LEU 33 HA LEU 33 -9.654 -8.452 1.585 962 HB2 LEU 33 HB3 LEU 33 -8.557 -9.754 -0.184 963 HB3 LEU 33 HB2 LEU 33 -9.988 -9.606 -1.182 964 HG LEU 33 HG LEU 33 -8.022 -7.974 -1.653 965 HD11 LEU 33 HD11 LEU 33 -9.489 -6.845 -2.836 966 HD12 LEU 33 HD12 LEU 33 -10.347 -6.241 -1.427 967 HD13 LEU 33 HD13 LEU 33 -10.750 -7.815 -2.100 968 HD21 LEU 33 HD21 LEU 33 -9.320 -6.340 0.568 969 HD22 LEU 33 HD22 LEU 33 -7.863 -6.010 -0.332 970 HD23 LEU 33 HD23 LEU 33 -7.867 -7.303 0.847 971 H LYS 34 H LYS 34 -12.341 -9.393 -0.501 972 HA LYS 34 HA LYS 34 -13.190 -6.788 -1.103 973 HB2 LYS 34 HB3 LYS 34 -15.394 -7.786 -1.608 974 HB3 LYS 34 HB2 LYS 34 -14.082 -8.687 -2.347 975 HG2 LYS 34 HG3 LYS 34 -14.156 -10.310 -0.385 976 HG3 LYS 34 HG2 LYS 34 -15.543 -9.394 0.206 977 HD2 LYS 34 HD3 LYS 34 -16.900 -9.995 -1.635 978 HD3 LYS 34 HD2 LYS 34 -15.527 -10.580 -2.555 979 HE2 LYS 34 HE2 LYS 34 -17.014 -12.341 -1.445 980 HE3 LYS 34 HE1 LYS 34 -15.275 -12.514 -1.224 981 HZ1 LYS 34 HZ1 LYS 34 -15.433 -11.973 1.007 982 HZ2 LYS 34 HZ2 LYS 34 -16.950 -12.645 0.765 983 HZ3 LYS 34 HZ3 LYS 34 -16.796 -10.966 0.802 984 H GLU 35 H GLU 35 -14.022 -8.935 1.522 985 HA GLU 35 HA GLU 35 -15.946 -7.241 2.808 986 HB2 GLU 35 HB3 GLU 35 -14.229 -9.356 4.142 987 HB3 GLU 35 HB2 GLU 35 -15.812 -8.784 4.630 988 HG2 GLU 35 HG3 GLU 35 -15.251 -10.346 2.080 989 HG3 GLU 35 HG2 GLU 35 -15.928 -10.993 3.542 990 H LEU 36 H LEU 36 -12.580 -8.018 3.250 991 HA LEU 36 HA LEU 36 -11.938 -6.487 5.493 992 HB2 LEU 36 HB3 LEU 36 -10.347 -8.081 5.005 993 HB3 LEU 36 HB2 LEU 36 -10.502 -7.844 3.285 994 HG LEU 36 HG LEU 36 -9.231 -5.745 3.434 995 HD11 LEU 36 HD11 LEU 36 -8.968 -4.716 5.293 996 HD12 LEU 36 HD12 LEU 36 -8.019 -6.042 5.978 997 HD13 LEU 36 HD13 LEU 36 -9.777 -5.980 6.233 998 HD21 LEU 36 HD21 LEU 36 -7.152 -7.144 4.668 999 HD22 LEU 36 HD22 LEU 36 -7.588 -7.136 2.971 1000 HD23 LEU 36 HD23 LEU 36 -8.221 -8.403 4.033 1001 H LEU 37 H LEU 37 -11.564 -5.708 2.053 1002 HA LEU 37 HA LEU 37 -10.342 -3.259 2.547 1003 HB2 LEU 37 HB3 LEU 37 -10.141 -4.278 0.363 1004 HB3 LEU 37 HB2 LEU 37 -11.870 -4.214 0.098 1005 HG LEU 37 HG LEU 37 -10.393 -2.447 -1.047 1006 HD11 LEU 37 HD11 LEU 37 -12.334 -1.403 -1.371 1007 HD12 LEU 37 HD12 LEU 37 -12.370 -0.792 0.278 1008 HD13 LEU 37 HD13 LEU 37 -13.043 -2.372 -0.093 1009 HD21 LEU 37 HD21 LEU 37 -9.265 -1.951 1.323 1010 HD22 LEU 37 HD22 LEU 37 -10.637 -0.858 1.497 1011 HD23 LEU 37 HD23 LEU 37 -9.532 -0.667 0.156 1012 H GLN 38 H GLN 38 -13.767 -3.988 1.917 1013 HA GLN 38 HA GLN 38 -14.566 -1.281 2.198 1014 HB2 GLN 38 HB3 GLN 38 -16.880 -2.137 2.411 1015 HB3 GLN 38 HB2 GLN 38 -16.050 -2.909 1.060 1016 HG2 GLN 38 HG3 GLN 38 -15.687 -4.913 2.413 1017 HG3 GLN 38 HG2 GLN 38 -16.336 -4.107 3.836 1018 HE21 GLN 38 HE21 GLN 38 -17.548 -4.214 0.442 1019 HE22 GLN 38 HE22 GLN 38 -19.071 -4.807 0.878 1020 H THR 39 H THR 39 -14.270 -3.953 4.436 1021 HA THR 39 HA THR 39 -15.532 -2.761 6.628 1022 HB THR 39 HB THR 39 -13.369 -4.860 6.507 1023 HG1 THR 39 HG2 THR 39 -15.118 -5.557 5.465 1024 HG21 THR 39 HG21 THR 39 -15.074 -3.855 8.783 1025 HG22 THR 39 HG22 THR 39 -13.338 -4.180 8.689 1026 HG23 THR 39 HG23 THR 39 -14.468 -5.523 8.720 1027 H GLU 40 H GLU 40 -11.995 -2.933 5.893 1028 HA GLU 40 HA GLU 40 -11.386 -1.388 8.201 1029 HB2 GLU 40 HB3 GLU 40 -9.537 -1.894 5.871 1030 HB3 GLU 40 HB2 GLU 40 -9.108 -1.465 7.525 1031 HG2 GLU 40 HG3 GLU 40 -10.494 -4.038 6.721 1032 HG3 GLU 40 HG2 GLU 40 -8.772 -3.837 7.128 1033 H LEU 41 H LEU 41 -11.642 -0.589 4.788 1034 HA LEU 41 HA LEU 41 -11.028 2.227 5.372 1035 HB2 LEU 41 HB3 LEU 41 -11.215 0.595 2.860 1036 HB3 LEU 41 HB2 LEU 41 -11.340 2.322 2.768 1037 HG LEU 41 HG LEU 41 -9.175 2.490 4.146 1038 HD11 LEU 41 HD11 LEU 41 -7.710 0.444 3.936 1039 HD12 LEU 41 HD12 LEU 41 -9.163 -0.466 3.552 1040 HD13 LEU 41 HD13 LEU 41 -9.009 0.345 5.115 1041 HD21 LEU 41 HD21 LEU 41 -7.822 2.412 2.229 1042 HD22 LEU 41 HD22 LEU 41 -9.420 2.631 1.533 1043 HD23 LEU 41 HD23 LEU 41 -8.673 1.033 1.548 1044 H SER 42 H SER 42 -13.387 1.111 6.423 1045 HA SER 42 HA SER 42 -15.640 1.467 4.861 1046 HB2 SER 42 HB3 SER 42 -16.468 2.089 7.438 1047 HB3 SER 42 HB2 SER 42 -16.381 0.489 6.738 1048 HG SER 42 HG SER 42 -14.583 0.085 7.847 1049 H GLY 43 H GLY 43 -13.783 3.848 6.702 1050 HA2 GLY 43 HA3 GLY 43 -15.635 5.977 6.384 1051 HA3 GLY 43 HA2 GLY 43 -13.930 6.128 6.792 1052 H PHE 44 H PHE 44 -12.757 4.919 4.603 1053 HA PHE 44 HA PHE 44 -12.879 7.009 2.619 1054 HB2 PHE 44 HB3 PHE 44 -11.427 4.373 2.721 1055 HB3 PHE 44 HB2 PHE 44 -11.490 5.300 1.235 1056 HD1 PHE 44 HD2 PHE 44 -11.188 8.067 1.985 1057 HD2 PHE 44 HD1 PHE 44 -9.352 4.595 3.732 1058 HE1 PHE 44 HE2 PHE 44 -9.297 9.457 2.791 1059 HE2 PHE 44 HE1 PHE 44 -7.471 5.999 4.527 1060 HZ PHE 44 HZ PHE 44 -7.448 8.412 4.058 1061 H LEU 45 H LEU 45 -13.941 3.679 2.822 1062 HA LEU 45 HA LEU 45 -14.851 3.416 0.217 1063 HB2 LEU 45 HB3 LEU 45 -14.611 1.454 1.455 1064 HB3 LEU 45 HB2 LEU 45 -15.569 2.056 2.793 1065 HG LEU 45 HG LEU 45 -17.539 2.079 1.479 1066 HD11 LEU 45 HD11 LEU 45 -15.628 1.447 -0.747 1067 HD12 LEU 45 HD12 LEU 45 -17.066 2.482 -0.726 1068 HD13 LEU 45 HD13 LEU 45 -17.250 0.738 -0.847 1069 HD21 LEU 45 HD21 LEU 45 -16.469 -0.089 2.513 1070 HD22 LEU 45 HD22 LEU 45 -16.456 -0.623 0.821 1071 HD23 LEU 45 HD23 LEU 45 -17.975 -0.185 1.602 1072 H ASP 46 H ASP 46 -16.635 4.280 3.136 1073 HA ASP 46 HA ASP 46 -19.138 4.538 1.913 1074 HB2 ASP 46 HB3 ASP 46 -18.705 4.302 4.169 1075 HB3 ASP 46 HB2 ASP 46 -18.104 5.974 4.334 1076 H ALA 47 H ALA 47 -16.524 6.761 2.300 1077 HA ALA 47 HA ALA 47 -17.841 9.115 1.585 1078 HB1 ALA 47 HB1 ALA 47 -15.737 10.087 1.320 1079 HB2 ALA 47 HB2 ALA 47 -14.999 8.563 0.825 1080 HB3 ALA 47 HB3 ALA 47 -15.460 8.814 2.511 1081 H GLN 48 H GLN 48 -16.311 6.618 -0.420 1082 HA GLN 48 HA GLN 48 -17.434 7.976 -2.802 1083 HB2 GLN 48 HB3 GLN 48 -15.430 6.974 -4.061 1084 HB3 GLN 48 HB2 GLN 48 -15.132 8.362 -3.022 1085 HG2 GLN 48 HG3 GLN 48 -13.425 6.873 -2.532 1086 HG3 GLN 48 HG2 GLN 48 -14.538 6.631 -1.189 1087 HE21 GLN 48 HE21 GLN 48 -15.760 4.569 -1.186 1088 HE22 GLN 48 HE22 GLN 48 -15.287 3.300 -2.205 1089 H LYS 49 H LYS 49 -18.865 5.928 -1.467 1090 HA LYS 49 HA LYS 49 -18.551 3.404 -2.795 1091 HB2 LYS 49 HB3 LYS 49 -21.032 4.692 -1.614 1092 HB3 LYS 49 HB2 LYS 49 -20.994 3.066 -2.273 1093 HG2 LYS 49 HG3 LYS 49 -19.246 2.416 -0.634 1094 HG3 LYS 49 HG2 LYS 49 -19.244 4.063 -0.024 1095 HD2 LYS 49 HD3 LYS 49 -20.711 3.176 1.524 1096 HD3 LYS 49 HD2 LYS 49 -21.887 3.561 0.275 1097 HE2 LYS 49 HE2 LYS 49 -20.637 0.865 0.891 1098 HE3 LYS 49 HE1 LYS 49 -22.335 1.304 0.931 1099 HZ1 LYS 49 HZ1 LYS 49 -22.247 1.635 -1.498 1100 HZ2 LYS 49 HZ2 LYS 49 -21.890 0.080 -1.009 1101 HZ3 LYS 49 HZ3 LYS 49 -20.641 1.079 -1.517 1102 H ASP 50 H ASP 50 -20.256 6.343 -3.500 1103 HA ASP 50 HA ASP 50 -21.683 5.462 -5.785 1104 HB2 ASP 50 HB3 ASP 50 -22.179 7.506 -4.369 1105 HB3 ASP 50 HB2 ASP 50 -20.832 8.281 -5.199 1106 H VAL 51 H VAL 51 -18.428 6.627 -5.345 1107 HA VAL 51 HA VAL 51 -18.065 7.577 -7.991 1108 HB VAL 51 HB VAL 51 -15.835 6.835 -6.115 1109 HG11 VAL 51 HG11 VAL 51 -15.135 9.178 -7.210 1110 HG12 VAL 51 HG12 VAL 51 -16.166 8.619 -8.497 1111 HG13 VAL 51 HG13 VAL 51 -14.772 7.647 -7.982 1112 HG21 VAL 51 HG21 VAL 51 -17.447 9.416 -6.123 1113 HG22 VAL 51 HG22 VAL 51 -16.107 9.033 -5.051 1114 HG23 VAL 51 HG23 VAL 51 -17.631 8.171 -4.891 1115 H ASP 52 H ASP 52 -16.647 6.816 -9.578 1116 HA ASP 52 HA ASP 52 -16.962 4.128 -10.371 1117 HB2 ASP 52 HB3 ASP 52 -15.268 6.424 -11.234 1118 HB3 ASP 52 HB2 ASP 52 -14.937 4.841 -11.880 1119 H ALA 53 H ALA 53 -14.283 5.808 -8.850 1120 HA ALA 53 HA ALA 53 -12.230 4.113 -9.266 1121 HB1 ALA 53 HB1 ALA 53 -11.093 5.015 -7.421 1122 HB2 ALA 53 HB2 ALA 53 -12.576 5.356 -6.544 1123 HB3 ALA 53 HB3 ALA 53 -12.154 6.304 -7.982 1124 H VAL 54 H VAL 54 -14.455 3.750 -6.482 1125 HA VAL 54 HA VAL 54 -13.099 1.575 -5.430 1126 HB VAL 54 HB VAL 54 -14.797 2.765 -4.140 1127 HG11 VAL 54 HG11 VAL 54 -16.979 1.364 -5.656 1128 HG12 VAL 54 HG12 VAL 54 -16.383 2.951 -6.179 1129 HG13 VAL 54 HG13 VAL 54 -17.078 2.756 -4.590 1130 HG21 VAL 54 HG21 VAL 54 -15.913 0.810 -3.115 1131 HG22 VAL 54 HG22 VAL 54 -14.236 0.436 -3.481 1132 HG23 VAL 54 HG23 VAL 54 -15.520 -0.166 -4.523 1133 H ASP 55 H ASP 55 -15.783 1.555 -7.744 1134 HA ASP 55 HA ASP 55 -15.978 -1.268 -7.969 1135 HB2 ASP 55 HB3 ASP 55 -17.689 0.154 -8.978 1136 HB3 ASP 55 HB2 ASP 55 -16.469 0.845 -10.066 1137 H LYS 56 H LYS 56 -14.225 1.107 -9.834 1138 HA LYS 56 HA LYS 56 -12.987 -0.690 -11.618 1139 HB2 LYS 56 HB3 LYS 56 -12.320 2.142 -10.834 1140 HB3 LYS 56 HB2 LYS 56 -11.563 1.269 -12.164 1141 HG2 LYS 56 HG3 LYS 56 -13.693 0.936 -13.272 1142 HG3 LYS 56 HG2 LYS 56 -14.574 1.642 -11.925 1143 HD2 LYS 56 HD3 LYS 56 -13.402 3.731 -12.263 1144 HD3 LYS 56 HD2 LYS 56 -12.590 3.121 -13.716 1145 HE2 LYS 56 HE2 LYS 56 -15.612 3.276 -13.308 1146 HE3 LYS 56 HE1 LYS 56 -14.680 4.451 -14.228 1147 HZ1 LYS 56 HZ1 LYS 56 -14.997 1.558 -14.839 1148 HZ2 LYS 56 HZ2 LYS 56 -13.974 2.621 -15.704 1149 HZ3 LYS 56 HZ3 LYS 56 -15.636 2.853 -15.692 1150 H VAL 57 H VAL 57 -11.851 0.759 -8.596 1151 HA VAL 57 HA VAL 57 -9.171 -0.126 -8.770 1152 HB VAL 57 HB VAL 57 -10.924 0.674 -6.429 1153 HG11 VAL 57 HG11 VAL 57 -9.387 -0.734 -5.389 1154 HG12 VAL 57 HG12 VAL 57 -8.640 0.857 -5.253 1155 HG13 VAL 57 HG13 VAL 57 -8.066 -0.288 -6.475 1156 HG21 VAL 57 HG21 VAL 57 -9.823 2.758 -6.582 1157 HG22 VAL 57 HG22 VAL 57 -10.024 2.310 -8.270 1158 HG23 VAL 57 HG23 VAL 57 -8.469 2.084 -7.487 1159 H MET 58 H MET 58 -12.027 -1.411 -7.248 1160 HA MET 58 HA MET 58 -10.916 -3.813 -6.291 1161 HB2 MET 58 HB3 MET 58 -13.030 -3.113 -5.434 1162 HB3 MET 58 HB2 MET 58 -13.713 -2.963 -7.050 1163 HG2 MET 58 HG3 MET 58 -13.647 -5.240 -7.395 1164 HG3 MET 58 HG2 MET 58 -12.746 -5.603 -5.911 1165 HE1 MET 58 HE1 MET 58 -15.571 -3.995 -7.577 1166 HE2 MET 58 HE2 MET 58 -16.337 -3.185 -6.216 1167 HE3 MET 58 HE3 MET 58 -17.011 -4.699 -6.801 1168 H LYS 59 H LYS 59 -12.328 -2.807 -9.335 1169 HA LYS 59 HA LYS 59 -12.468 -5.325 -10.633 1170 HB2 LYS 59 HB3 LYS 59 -13.360 -2.826 -11.320 1171 HB3 LYS 59 HB2 LYS 59 -11.856 -2.848 -12.136 1172 HG2 LYS 59 HG3 LYS 59 -13.509 -3.646 -13.683 1173 HG3 LYS 59 HG2 LYS 59 -12.354 -4.914 -13.286 1174 HD2 LYS 59 HD3 LYS 59 -15.042 -5.347 -13.282 1175 HD3 LYS 59 HD2 LYS 59 -13.926 -6.227 -12.271 1176 HE2 LYS 59 HE2 LYS 59 -15.978 -5.313 -11.079 1177 HE3 LYS 59 HE1 LYS 59 -14.476 -4.879 -10.316 1178 HZ1 LYS 59 HZ1 LYS 59 -14.910 -2.687 -10.685 1179 HZ2 LYS 59 HZ2 LYS 59 -16.442 -3.156 -11.055 1180 HZ3 LYS 59 HZ3 LYS 59 -15.333 -2.934 -12.308 1181 H GLU 60 H GLU 60 -10.015 -2.780 -10.648 1182 HA GLU 60 HA GLU 60 -8.262 -3.992 -12.464 1183 HB2 GLU 60 HB3 GLU 60 -7.861 -1.999 -10.289 1184 HB3 GLU 60 HB2 GLU 60 -6.546 -2.465 -11.364 1185 HG2 GLU 60 HG3 GLU 60 -9.224 -1.282 -12.235 1186 HG3 GLU 60 HG2 GLU 60 -7.702 -0.406 -12.124 1187 H LEU 61 H LEU 61 -8.314 -4.077 -8.907 1188 HA LEU 61 HA LEU 61 -5.954 -5.763 -8.807 1189 HB2 LEU 61 HB3 LEU 61 -7.798 -4.619 -6.734 1190 HB3 LEU 61 HB2 LEU 61 -6.631 -5.856 -6.307 1191 HG LEU 61 HG LEU 61 -5.841 -3.423 -6.005 1192 HD11 LEU 61 HD11 LEU 61 -4.046 -4.796 -5.835 1193 HD12 LEU 61 HD12 LEU 61 -3.623 -4.048 -7.367 1194 HD13 LEU 61 HD13 LEU 61 -4.374 -5.632 -7.354 1195 HD21 LEU 61 HD21 LEU 61 -5.154 -2.187 -7.918 1196 HD22 LEU 61 HD22 LEU 61 -6.787 -2.705 -8.295 1197 HD23 LEU 61 HD23 LEU 61 -5.397 -3.542 -9.009 1198 H ASP 62 H ASP 62 -9.220 -6.328 -9.276 1199 HA ASP 62 HA ASP 62 -9.568 -8.693 -7.817 1200 HB2 ASP 62 HB3 ASP 62 -11.487 -7.532 -8.770 1201 HB3 ASP 62 HB2 ASP 62 -10.942 -7.908 -10.398 1202 H GLU 63 H GLU 63 -8.246 -8.076 -10.971 1203 HA GLU 63 HA GLU 63 -8.265 -10.650 -12.080 1204 HB2 GLU 63 HB3 GLU 63 -6.252 -8.404 -12.504 1205 HB3 GLU 63 HB2 GLU 63 -6.441 -9.842 -13.499 1206 HG2 GLU 63 HG3 GLU 63 -8.719 -9.243 -14.105 1207 HG3 GLU 63 HG2 GLU 63 -8.659 -7.902 -12.944 1208 H ASN 64 H ASN 64 -5.674 -9.041 -10.256 1209 HA ASN 64 HA ASN 64 -3.922 -11.294 -10.195 1210 HB2 ASN 64 HB3 ASN 64 -4.161 -8.743 -8.743 1211 HB3 ASN 64 HB2 ASN 64 -3.240 -10.043 -7.955 1212 HD21 ASN 64 HD21 ASN 64 -2.907 -7.465 -10.112 1213 HD22 ASN 64 HD22 ASN 64 -1.495 -7.960 -10.906 1214 H GLY 65 H GLY 65 -6.430 -10.109 -8.093 1215 HA2 GLY 65 HA3 GLY 65 -6.120 -12.173 -6.132 1216 HA3 GLY 65 HA2 GLY 65 -7.482 -11.066 -6.294 1217 H ASP 66 H ASP 66 -6.231 -13.246 -8.789 1218 HA ASP 66 HA ASP 66 -8.784 -14.267 -9.455 1219 HB2 ASP 66 HB3 ASP 66 -7.072 -14.374 -11.105 1220 HB3 ASP 66 HB2 ASP 66 -5.985 -15.263 -10.047 1221 H GLY 67 H GLY 67 -6.255 -15.338 -7.355 1222 HA2 GLY 67 HA3 GLY 67 -8.131 -17.274 -6.121 1223 HA3 GLY 67 HA2 GLY 67 -6.472 -17.736 -6.455 1224 H GLU 68 H GLU 68 -5.154 -15.371 -5.835 1225 HA GLU 68 HA GLU 68 -5.722 -14.953 -2.964 1226 HB2 GLU 68 HB3 GLU 68 -3.092 -15.679 -4.266 1227 HB3 GLU 68 HB2 GLU 68 -3.260 -15.135 -2.602 1228 HG2 GLU 68 HG3 GLU 68 -4.448 -17.043 -1.952 1229 HG3 GLU 68 HG2 GLU 68 -4.897 -17.470 -3.590 1230 H VAL 69 H VAL 69 -4.890 -13.025 -2.144 1231 HA VAL 69 HA VAL 69 -3.695 -11.184 -4.034 1232 HB VAL 69 HB VAL 69 -5.893 -10.307 -3.888 1233 HG11 VAL 69 HG11 VAL 69 -5.730 -10.855 -0.925 1234 HG12 VAL 69 HG12 VAL 69 -6.869 -11.539 -2.088 1235 HG13 VAL 69 HG13 VAL 69 -6.973 -9.838 -1.640 1236 HG21 VAL 69 HG21 VAL 69 -4.113 -8.628 -3.523 1237 HG22 VAL 69 HG22 VAL 69 -4.279 -8.834 -1.774 1238 HG23 VAL 69 HG23 VAL 69 -5.609 -8.164 -2.718 1239 H ASP 70 H ASP 70 -1.815 -10.417 -3.239 1240 HA ASP 70 HA ASP 70 -1.059 -11.327 -0.563 1241 HB2 ASP 70 HB3 ASP 70 0.504 -11.987 -2.137 1242 HB3 ASP 70 HB2 ASP 70 0.483 -10.451 -2.971 1243 H PHE 71 H PHE 71 0.590 -9.886 0.599 1244 HA PHE 71 HA PHE 71 -0.806 -7.686 1.604 1245 HB2 PHE 71 HB3 PHE 71 0.938 -8.864 2.884 1246 HB3 PHE 71 HB2 PHE 71 2.169 -8.221 1.801 1247 HD1 PHE 71 HD1 PHE 71 -0.667 -7.092 3.944 1248 HD2 PHE 71 HD2 PHE 71 3.215 -6.138 2.366 1249 HE1 PHE 71 HE1 PHE 71 -0.617 -5.050 5.313 1250 HE2 PHE 71 HE2 PHE 71 3.247 -4.073 3.776 1251 HZ PHE 71 HZ PHE 71 1.355 -3.542 5.226 1252 H GLN 72 H GLN 72 1.852 -7.883 -0.710 1253 HA GLN 72 HA GLN 72 2.277 -5.116 -1.134 1254 HB2 GLN 72 HB3 GLN 72 2.624 -7.572 -2.828 1255 HB3 GLN 72 HB2 GLN 72 3.082 -5.968 -3.455 1256 HG2 GLN 72 HG3 GLN 72 4.612 -5.763 -1.567 1257 HG3 GLN 72 HG2 GLN 72 4.052 -7.318 -0.941 1258 HE21 GLN 72 HE21 GLN 72 6.434 -5.931 -2.993 1259 HE22 GLN 72 HE22 GLN 72 6.897 -7.356 -3.782 1260 H GLU 73 H GLU 73 0.083 -7.445 -2.600 1261 HA GLU 73 HA GLU 73 -1.124 -5.630 -4.424 1262 HB2 GLU 73 HB3 GLU 73 -2.027 -8.305 -3.318 1263 HB3 GLU 73 HB2 GLU 73 -2.828 -7.440 -4.628 1264 HG2 GLU 73 HG3 GLU 73 -0.702 -7.471 -5.953 1265 HG3 GLU 73 HG2 GLU 73 0.072 -8.297 -4.639 1266 H TYR 74 H TYR 74 -1.845 -6.756 -1.179 1267 HA TYR 74 HA TYR 74 -4.374 -5.561 -0.833 1268 HB2 TYR 74 HB3 TYR 74 -3.669 -7.234 0.715 1269 HB3 TYR 74 HB2 TYR 74 -2.234 -6.314 1.140 1270 HD1 TYR 74 HD1 TYR 74 -5.998 -5.736 1.078 1271 HD2 TYR 74 HD2 TYR 74 -2.277 -5.244 3.205 1272 HE1 TYR 74 HE1 TYR 74 -7.194 -4.673 2.951 1273 HE2 TYR 74 HE2 TYR 74 -3.501 -4.192 5.084 1274 HH TYR 74 HH TYR 74 -6.700 -4.399 5.575 1275 H VAL 75 H VAL 75 -1.145 -4.289 -0.003 1276 HA VAL 75 HA VAL 75 -2.161 -1.911 1.079 1277 HB VAL 75 HB VAL 75 0.059 -0.963 0.936 1278 HG11 VAL 75 HG11 VAL 75 1.036 -2.380 2.477 1279 HG12 VAL 75 HG12 VAL 75 0.606 -3.839 1.604 1280 HG13 VAL 75 HG13 VAL 75 -0.614 -2.970 2.531 1281 HG21 VAL 75 HG21 VAL 75 1.823 -1.863 -0.317 1282 HG22 VAL 75 HG22 VAL 75 0.518 -2.019 -1.430 1283 HG23 VAL 75 HG23 VAL 75 1.063 -3.431 -0.507 1284 H VAL 76 H VAL 76 -1.191 -2.651 -2.251 1285 HA VAL 76 HA VAL 76 -1.538 0.014 -3.134 1286 HB VAL 76 HB VAL 76 -0.184 -1.510 -4.458 1287 HG11 VAL 76 HG11 VAL 76 -2.775 -3.047 -4.826 1288 HG12 VAL 76 HG12 VAL 76 -1.243 -3.622 -4.154 1289 HG13 VAL 76 HG13 VAL 76 -1.365 -3.245 -5.861 1290 HG21 VAL 76 HG21 VAL 76 -2.609 -0.901 -6.155 1291 HG22 VAL 76 HG22 VAL 76 -0.911 -0.792 -6.589 1292 HG23 VAL 76 HG23 VAL 76 -1.616 0.396 -5.495 1293 H LEU 77 H LEU 77 -3.693 -2.746 -2.900 1294 HA LEU 77 HA LEU 77 -5.836 -1.648 -4.311 1295 HB2 LEU 77 HB3 LEU 77 -5.799 -4.010 -3.712 1296 HB3 LEU 77 HB2 LEU 77 -5.861 -3.604 -2.008 1297 HG LEU 77 HG LEU 77 -8.099 -2.591 -2.284 1298 HD11 LEU 77 HD11 LEU 77 -7.897 -1.763 -4.575 1299 HD12 LEU 77 HD12 LEU 77 -9.296 -2.810 -4.424 1300 HD13 LEU 77 HD13 LEU 77 -7.832 -3.418 -5.184 1301 HD21 LEU 77 HD21 LEU 77 -9.059 -4.887 -3.496 1302 HD22 LEU 77 HD22 LEU 77 -8.705 -4.699 -1.794 1303 HD23 LEU 77 HD23 LEU 77 -7.497 -5.415 -2.866 1304 H VAL 78 H VAL 78 -5.120 -1.576 -0.828 1305 HA VAL 78 HA VAL 78 -7.338 0.134 -0.246 1306 HB VAL 78 HB VAL 78 -6.403 0.398 1.974 1307 HG11 VAL 78 HG11 VAL 78 -7.046 -1.706 2.514 1308 HG12 VAL 78 HG12 VAL 78 -5.666 -2.421 1.693 1309 HG13 VAL 78 HG13 VAL 78 -7.123 -2.048 0.786 1310 HG21 VAL 78 HG21 VAL 78 -4.208 -0.825 2.470 1311 HG22 VAL 78 HG22 VAL 78 -4.047 0.687 1.585 1312 HG23 VAL 78 HG23 VAL 78 -3.954 -0.866 0.731 1313 H ALA 79 H ALA 79 -3.935 0.676 -0.935 1314 HA ALA 79 HA ALA 79 -3.896 3.448 -0.453 1315 HB1 ALA 79 HB1 ALA 79 -2.317 1.710 -2.305 1316 HB2 ALA 79 HB2 ALA 79 -1.803 2.395 -0.752 1317 HB3 ALA 79 HB3 ALA 79 -2.006 3.435 -2.161 1318 H ALA 80 H ALA 80 -4.751 1.559 -3.315 1319 HA ALA 80 HA ALA 80 -4.945 3.651 -5.094 1320 HB1 ALA 80 HB1 ALA 80 -6.666 2.178 -6.270 1321 HB2 ALA 80 HB2 ALA 80 -6.458 1.046 -4.924 1322 HB3 ALA 80 HB3 ALA 80 -5.101 1.439 -5.955 1323 H LEU 81 H LEU 81 -7.424 2.251 -2.979 1324 HA LEU 81 HA LEU 81 -9.471 4.171 -3.545 1325 HB2 LEU 81 HB3 LEU 81 -8.974 2.406 -1.140 1326 HB3 LEU 81 HB2 LEU 81 -10.390 3.436 -1.321 1327 HG LEU 81 HG LEU 81 -9.590 1.325 -3.349 1328 HD11 LEU 81 HD11 LEU 81 -10.569 -0.227 -2.109 1329 HD12 LEU 81 HD12 LEU 81 -12.024 0.746 -1.924 1330 HD13 LEU 81 HD13 LEU 81 -10.700 0.920 -0.779 1331 HD21 LEU 81 HD21 LEU 81 -12.249 1.768 -3.640 1332 HD22 LEU 81 HD22 LEU 81 -11.033 2.645 -4.562 1333 HD23 LEU 81 HD23 LEU 81 -11.751 3.373 -3.127 1334 H THR 82 H THR 82 -6.898 3.943 -1.138 1335 HA THR 82 HA THR 82 -7.617 6.222 0.343 1336 HB THR 82 HB THR 82 -4.799 5.227 -0.076 1337 HG1 THR 82 HG2 THR 82 -6.303 3.512 0.533 1338 HG21 THR 82 HG21 THR 82 -5.700 6.131 2.577 1339 HG22 THR 82 HG22 THR 82 -5.699 7.388 1.341 1340 HG23 THR 82 HG23 THR 82 -4.223 6.508 1.695 1341 H VAL 83 H VAL 83 -5.293 5.851 -2.361 1342 HA VAL 83 HA VAL 83 -4.589 8.569 -2.437 1343 HB VAL 83 HB VAL 83 -3.469 6.458 -3.578 1344 HG11 VAL 83 HG11 VAL 83 -5.326 7.379 -5.782 1345 HG12 VAL 83 HG12 VAL 83 -5.193 5.780 -5.040 1346 HG13 VAL 83 HG13 VAL 83 -3.873 6.410 -5.998 1347 HG21 VAL 83 HG21 VAL 83 -2.528 8.782 -3.601 1348 HG22 VAL 83 HG22 VAL 83 -3.541 9.131 -5.007 1349 HG23 VAL 83 HG23 VAL 83 -2.277 7.916 -5.118 1350 H ALA 84 H ALA 84 -7.082 6.707 -4.101 1351 HA ALA 84 HA ALA 84 -8.072 8.765 -5.748 1352 HB1 ALA 84 HB1 ALA 84 -8.825 6.499 -6.080 1353 HB2 ALA 84 HB2 ALA 84 -10.220 7.489 -5.650 1354 HB3 ALA 84 HB3 ALA 84 -9.489 6.429 -4.445 1355 H MET 85 H MET 85 -9.182 7.727 -2.506 1356 HA MET 85 HA MET 85 -10.957 9.925 -2.213 1357 HB2 MET 85 HB3 MET 85 -9.744 8.021 -0.234 1358 HB3 MET 85 HB2 MET 85 -10.751 9.359 0.303 1359 HG2 MET 85 HG3 MET 85 -11.559 7.183 -1.649 1360 HG3 MET 85 HG2 MET 85 -12.152 7.379 -0.001 1361 HE1 MET 85 HE1 MET 85 -13.075 9.499 0.910 1362 HE2 MET 85 HE2 MET 85 -14.081 10.635 0.020 1363 HE3 MET 85 HE3 MET 85 -12.344 10.825 -0.017 1364 H ASN 86 H ASN 86 -7.619 9.425 -1.189 1365 HA ASN 86 HA ASN 86 -7.444 11.893 0.179 1366 HB2 ASN 86 HB3 ASN 86 -5.800 9.809 0.169 1367 HB3 ASN 86 HB2 ASN 86 -5.002 10.741 -1.101 1368 HD21 ASN 86 HD21 ASN 86 -6.474 11.401 2.163 1369 HD22 ASN 86 HD22 ASN 86 -5.207 12.407 2.641 1370 H ASN 87 H ASN 87 -6.881 10.966 -3.202 1371 HA ASN 87 HA ASN 87 -5.952 13.496 -4.063 1372 HB2 ASN 87 HB3 ASN 87 -5.733 11.581 -5.546 1373 HB3 ASN 87 HB2 ASN 87 -7.478 11.369 -5.597 1374 HD21 ASN 87 HD21 ASN 87 -5.819 14.544 -5.718 1375 HD22 ASN 87 HD22 ASN 87 -6.330 14.929 -7.284 1376 H PHE 88 H PHE 88 -9.155 12.145 -3.664 1377 HA PHE 88 HA PHE 88 -10.556 14.402 -4.640 1378 HB2 PHE 88 HB3 PHE 88 -11.270 12.127 -2.795 1379 HB3 PHE 88 HB2 PHE 88 -12.332 13.521 -2.916 1380 HD1 PHE 88 HD2 PHE 88 -10.236 11.775 -5.542 1381 HD2 PHE 88 HD1 PHE 88 -14.184 12.904 -4.214 1382 HE1 PHE 88 HE2 PHE 88 -11.182 10.903 -7.618 1383 HE2 PHE 88 HE1 PHE 88 -15.122 12.020 -6.330 1384 HZ PHE 88 HZ PHE 88 -13.619 11.018 -8.036 1385 H PHE 89 H PHE 89 -9.285 13.516 -1.470 1386 HA PHE 89 HA PHE 89 -10.245 15.801 -0.102 1387 HB2 PHE 89 HB3 PHE 89 -7.975 13.915 0.490 1388 HB3 PHE 89 HB2 PHE 89 -8.235 15.353 1.454 1389 HD1 PHE 89 HD1 PHE 89 -10.704 15.757 2.311 1390 HD2 PHE 89 HD2 PHE 89 -9.194 11.917 1.062 1391 HE1 PHE 89 HE1 PHE 89 -12.485 14.631 3.587 1392 HE2 PHE 89 HE2 PHE 89 -10.990 10.807 2.339 1393 HZ PHE 89 HZ PHE 89 -12.634 12.153 3.603 1394 H TRP 90 H TRP 90 -7.148 15.296 -1.831 1395 HA TRP 90 HA TRP 90 -5.996 17.789 -1.064 1396 HB2 TRP 90 HB3 TRP 90 -5.573 16.636 -3.826 1397 HB3 TRP 90 HB2 TRP 90 -4.441 17.544 -2.833 1398 HD1 TRP 90 HD TRP 90 -5.017 15.758 -0.176 1399 HE1 TRP 90 HE1 TRP 90 -3.976 13.427 -0.078 1400 HE3 TRP 90 HE3 TRP 90 -4.104 14.953 -5.129 1401 HZ2 TRP 90 HZ2 TRP 90 -2.883 11.469 -1.822 1402 HZ3 TRP 90 HZ3 TRP 90 -3.049 12.825 -5.882 1403 HH2 TRP 90 HH TRP 90 -2.441 11.094 -4.240 1404 H GLU 91 H GLU 91 -7.729 16.818 -3.897 1405 HA GLU 91 HA GLU 91 -7.882 19.468 -5.001 1406 HB2 GLU 91 HB3 GLU 91 -9.237 16.926 -5.688 1407 HB3 GLU 91 HB2 GLU 91 -9.404 18.377 -6.690 1408 HG2 GLU 91 HG3 GLU 91 -6.928 18.469 -6.970 1409 HG3 GLU 91 HG2 GLU 91 -6.765 17.026 -5.978 1410 H ASN 92 H ASN 92 -10.315 17.362 -3.455 1411 HA ASN 92 HA ASN 92 -12.142 19.664 -3.307 1412 HB2 ASN 92 HB3 ASN 92 -13.220 17.612 -4.063 1413 HB3 ASN 92 HB2 ASN 92 -12.610 16.736 -2.653 1414 HD21 ASN 92 HD21 ASN 92 -13.397 17.534 -0.510 1415 HD22 ASN 92 HD22 ASN 92 -14.933 18.251 -0.408 1416 H SER 93 H SER 93 -11.409 20.880 -1.735 1417 HA SER 93 HA SER 93 -11.127 19.679 0.927 1418 HB2 SER 93 HB3 SER 93 -9.108 20.855 -0.760 1419 HB3 SER 93 HB2 SER 93 -9.223 21.745 0.772 1420 HG SER 93 HG SER 93 -8.903 18.913 0.339 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -12.096 5.812 8.445 2 HA2 GLY 1 HA3 GLY 1 -10.766 7.067 9.909 3 HA3 GLY 1 HA2 GLY 1 -11.999 6.920 11.166 4 H SER 2 H SER 2 -11.329 4.055 9.488 5 HA SER 2 HA SER 2 -10.529 2.645 11.766 6 HB2 SER 2 HB3 SER 2 -9.797 1.653 9.060 7 HB3 SER 2 HB2 SER 2 -10.558 0.830 10.398 8 HG SER 2 HG SER 2 -11.697 1.801 8.316 9 H GLU 3 H GLU 3 -8.421 1.263 11.697 10 HA GLU 3 HA GLU 3 -6.182 2.997 11.805 11 HB2 GLU 3 HB3 GLU 3 -6.339 -0.032 11.771 12 HB3 GLU 3 HB2 GLU 3 -4.843 0.872 11.923 13 HG2 GLU 3 HG3 GLU 3 -5.556 1.949 13.877 14 HG3 GLU 3 HG2 GLU 3 -7.190 1.238 13.819 15 H LEU 4 H LEU 4 -7.438 0.780 9.391 16 HA LEU 4 HA LEU 4 -5.246 0.770 7.630 17 HB2 LEU 4 HB3 LEU 4 -8.196 0.430 7.303 18 HB3 LEU 4 HB2 LEU 4 -7.182 0.483 5.886 19 HG LEU 4 HG LEU 4 -7.701 -1.865 7.027 20 HD11 LEU 4 HD11 LEU 4 -5.124 -2.369 6.472 21 HD12 LEU 4 HD12 LEU 4 -5.352 -0.824 5.626 22 HD13 LEU 4 HD13 LEU 4 -6.401 -2.192 5.278 23 HD21 LEU 4 HD21 LEU 4 -6.968 -1.377 9.292 24 HD22 LEU 4 HD22 LEU 4 -5.369 -0.823 8.735 25 HD23 LEU 4 HD23 LEU 4 -5.835 -2.492 8.564 26 H GLU 5 H GLU 5 -8.080 2.958 7.702 27 HA GLU 5 HA GLU 5 -7.208 4.512 5.505 28 HB2 GLU 5 HB3 GLU 5 -8.993 5.213 7.856 29 HB3 GLU 5 HB2 GLU 5 -8.720 6.250 6.461 30 HG2 GLU 5 HG3 GLU 5 -9.586 4.518 4.943 31 HG3 GLU 5 HG2 GLU 5 -9.798 3.420 6.303 32 H THR 6 H THR 6 -6.777 4.824 8.965 33 HA THR 6 HA THR 6 -5.245 7.193 8.904 34 HB THR 6 HB THR 6 -5.033 5.022 10.999 35 HG1 THR 6 HG2 THR 6 -7.198 5.368 10.752 36 HG21 THR 6 HG21 THR 6 -4.480 7.970 10.836 37 HG22 THR 6 HG22 THR 6 -3.522 6.702 11.558 38 HG23 THR 6 HG23 THR 6 -4.970 7.282 12.384 39 H ALA 7 H ALA 7 -4.266 3.752 8.961 40 HA ALA 7 HA ALA 7 -1.498 4.212 9.010 41 HB1 ALA 7 HB1 ALA 7 -1.433 1.935 7.777 42 HB2 ALA 7 HB2 ALA 7 -3.176 1.924 7.983 43 HB3 ALA 7 HB3 ALA 7 -2.111 1.974 9.401 44 H MET 8 H MET 8 -3.749 3.809 6.303 45 HA MET 8 HA MET 8 -1.793 4.113 4.293 46 HB2 MET 8 HB3 MET 8 -4.777 4.656 4.213 47 HB3 MET 8 HB2 MET 8 -3.734 4.592 2.804 48 HG2 MET 8 HG3 MET 8 -4.213 2.309 4.748 49 HG3 MET 8 HG2 MET 8 -4.820 2.402 3.108 50 HE1 MET 8 HE1 MET 8 -1.682 3.277 1.390 51 HE2 MET 8 HE2 MET 8 -3.432 3.070 1.328 52 HE3 MET 8 HE3 MET 8 -2.370 1.735 0.838 53 H GLU 9 H GLU 9 -3.881 6.489 5.951 54 HA GLU 9 HA GLU 9 -2.895 8.623 4.415 55 HB2 GLU 9 HB3 GLU 9 -4.335 8.654 7.067 56 HB3 GLU 9 HB2 GLU 9 -3.766 10.125 6.286 57 HG2 GLU 9 HG3 GLU 9 -5.025 9.522 4.236 58 HG3 GLU 9 HG2 GLU 9 -5.626 8.089 5.057 59 H THR 10 H THR 10 -1.782 7.072 7.297 60 HA THR 10 HA THR 10 0.161 8.942 8.129 61 HB THR 10 HB THR 10 0.502 5.917 8.189 62 HG1 THR 10 HG2 THR 10 -1.598 6.721 8.992 63 HG21 THR 10 HG21 THR 10 2.137 6.276 9.704 64 HG22 THR 10 HG22 THR 10 1.283 7.572 10.503 65 HG23 THR 10 HG23 THR 10 2.206 7.901 9.044 66 H LEU 11 H LEU 11 0.222 6.362 5.717 67 HA LEU 11 HA LEU 11 2.865 6.882 4.729 68 HB2 LEU 11 HB3 LEU 11 0.459 5.571 3.460 69 HB3 LEU 11 HB2 LEU 11 2.044 5.639 2.706 70 HG LEU 11 HG LEU 11 1.529 4.407 5.441 71 HD11 LEU 11 HD11 LEU 11 2.234 2.705 3.123 72 HD12 LEU 11 HD12 LEU 11 0.604 3.360 3.121 73 HD13 LEU 11 HD13 LEU 11 1.164 2.400 4.485 74 HD21 LEU 11 HD21 LEU 11 3.869 5.103 5.188 75 HD22 LEU 11 HD22 LEU 11 3.942 4.416 3.569 76 HD23 LEU 11 HD23 LEU 11 3.772 3.368 4.965 77 H ILE 12 H ILE 12 -0.362 8.089 3.907 78 HA ILE 12 HA ILE 12 0.322 9.463 1.543 79 HB ILE 12 HB ILE 12 -1.811 10.107 3.600 80 HG12 ILE 12 HG13 ILE 12 -1.922 7.871 2.274 81 HG13 ILE 12 HG12 ILE 12 -3.334 8.926 2.161 82 HG21 ILE 12 HG21 ILE 12 -1.257 11.329 0.910 83 HG22 ILE 12 HG22 ILE 12 -1.538 12.129 2.460 84 HG23 ILE 12 HG23 ILE 12 -2.856 11.330 1.641 85 HD11 ILE 12 HD11 ILE 12 -2.281 7.865 0.011 86 HD12 ILE 12 HD12 ILE 12 -1.163 9.233 0.101 87 HD13 ILE 12 HD13 ILE 12 -2.897 9.500 -0.015 88 H ASN 13 H ASN 13 0.265 10.513 4.900 89 HA ASN 13 HA ASN 13 0.892 13.227 4.452 90 HB2 ASN 13 HB3 ASN 13 1.366 11.437 6.848 91 HB3 ASN 13 HB2 ASN 13 1.767 13.148 6.833 92 HD21 ASN 13 HD21 ASN 13 -0.877 10.880 6.907 93 HD22 ASN 13 HD22 ASN 13 -2.119 12.011 7.109 94 H VAL 14 H VAL 14 2.934 10.425 4.959 95 HA VAL 14 HA VAL 14 5.408 11.812 4.835 96 HB VAL 14 HB VAL 14 4.662 8.944 4.189 97 HG11 VAL 14 HG11 VAL 14 6.718 9.376 3.013 98 HG12 VAL 14 HG12 VAL 14 7.146 8.571 4.529 99 HG13 VAL 14 HG13 VAL 14 7.363 10.294 4.376 100 HG21 VAL 14 HG21 VAL 14 5.522 8.448 6.359 101 HG22 VAL 14 HG22 VAL 14 4.373 9.784 6.565 102 HG23 VAL 14 HG23 VAL 14 6.116 10.095 6.587 103 H PHE 15 H PHE 15 3.374 10.183 2.447 104 HA PHE 15 HA PHE 15 4.994 10.608 0.183 105 HB2 PHE 15 HB3 PHE 15 3.033 9.076 0.240 106 HB3 PHE 15 HB2 PHE 15 1.973 10.484 0.296 107 HD1 PHE 15 HD1 PHE 15 4.555 8.742 -1.765 108 HD2 PHE 15 HD2 PHE 15 1.457 11.735 -1.691 109 HE1 PHE 15 HE1 PHE 15 4.656 8.927 -4.232 110 HE2 PHE 15 HE2 PHE 15 1.575 11.907 -4.157 111 HZ PHE 15 HZ PHE 15 3.164 10.512 -5.419 112 H HIS 16 H HIS 16 2.346 12.547 1.526 113 HA HIS 16 HA HIS 16 2.573 14.618 -0.421 114 HB2 HIS 16 HB3 HIS 16 1.079 14.335 2.137 115 HB3 HIS 16 HB2 HIS 16 1.430 15.972 1.602 116 HD1 HIS 16 HD1 HIS 16 -0.162 16.941 -0.003 117 HD2 HIS 16 HD2 HIS 16 -0.111 12.773 -0.226 118 HE1 HIS 16 HE1 HIS 16 -1.878 16.286 -1.771 119 HE2 HIS 16 HE2 HIS 16 -1.842 13.752 -1.927 120 H ALA 17 H ALA 17 3.933 14.262 2.822 121 HA ALA 17 HA ALA 17 5.123 16.783 3.030 122 HB1 ALA 17 HB1 ALA 17 6.609 15.807 4.650 123 HB2 ALA 17 HB2 ALA 17 6.335 14.185 4.031 124 HB3 ALA 17 HB3 ALA 17 5.029 15.058 4.849 125 H HIS 18 H HIS 18 6.350 13.789 1.599 126 HA HIS 18 HA HIS 18 8.700 15.110 0.659 127 HB2 HIS 18 HB3 HIS 18 7.637 12.354 0.070 128 HB3 HIS 18 HB2 HIS 18 9.108 13.048 -0.650 129 HD1 HIS 18 HD1 HIS 18 11.165 13.597 0.904 130 HD2 HIS 18 HD2 HIS 18 7.950 11.747 2.869 131 HE1 HIS 18 HE1 HIS 18 11.977 12.938 3.199 132 HE2 HIS 18 HE2 HIS 18 10.050 11.819 4.399 133 H SER 19 H SER 19 5.535 14.458 -0.683 134 HA SER 19 HA SER 19 6.076 14.905 -3.407 135 HB2 SER 19 HB3 SER 19 3.626 15.718 -1.808 136 HB3 SER 19 HB2 SER 19 3.703 15.737 -3.552 137 HG SER 19 HG SER 19 4.253 13.433 -1.923 138 H GLY 20 H GLY 20 5.527 17.176 -0.771 139 HA2 GLY 20 HA3 GLY 20 5.459 19.597 -2.201 140 HA3 GLY 20 HA2 GLY 20 5.997 19.401 -0.539 141 H LYS 21 H LYS 21 8.091 17.463 -1.549 142 HA LYS 21 HA LYS 21 10.213 19.291 -1.387 143 HB2 LYS 21 HB3 LYS 21 10.271 16.446 -2.379 144 HB3 LYS 21 HB2 LYS 21 11.639 17.374 -1.803 145 HG2 LYS 21 HG3 LYS 21 9.176 16.844 -0.139 146 HG3 LYS 21 HG2 LYS 21 10.619 15.859 -0.035 147 HD2 LYS 21 HD3 LYS 21 11.797 18.203 0.436 148 HD3 LYS 21 HD2 LYS 21 10.150 18.709 0.774 149 HE2 LYS 21 HE2 LYS 21 11.025 18.005 2.841 150 HE3 LYS 21 HE1 LYS 21 9.921 16.755 2.330 151 HZ1 LYS 21 HZ1 LYS 21 12.049 15.638 1.268 152 HZ2 LYS 21 HZ2 LYS 21 11.786 15.547 2.930 153 HZ3 LYS 21 HZ3 LYS 21 12.873 16.663 2.334 154 H GLU 22 H GLU 22 8.941 17.532 -4.213 155 HA GLU 22 HA GLU 22 11.022 18.716 -5.832 156 HB2 GLU 22 HB3 GLU 22 10.212 17.223 -7.657 157 HB3 GLU 22 HB2 GLU 22 10.624 16.404 -6.173 158 HG2 GLU 22 HG3 GLU 22 8.601 15.482 -6.074 159 HG3 GLU 22 HG2 GLU 22 7.817 17.026 -5.950 160 H GLY 23 H GLY 23 7.470 18.552 -6.459 161 HA2 GLY 23 HA3 GLY 23 7.192 21.315 -6.852 162 HA3 GLY 23 HA2 GLY 23 7.597 20.595 -8.389 163 H ASP 24 H ASP 24 6.188 18.099 -8.003 164 HA ASP 24 HA ASP 24 3.713 18.911 -9.036 165 HB2 ASP 24 HB3 ASP 24 4.816 16.648 -9.441 166 HB3 ASP 24 HB2 ASP 24 4.221 16.196 -7.853 167 H LYS 25 H LYS 25 1.610 18.681 -8.232 168 HA LYS 25 HA LYS 25 1.147 19.525 -5.585 169 HB2 LYS 25 HB3 LYS 25 -1.172 18.661 -5.989 170 HB3 LYS 25 HB2 LYS 25 -0.641 19.941 -7.100 171 HG2 LYS 25 HG3 LYS 25 -0.017 18.132 -8.755 172 HG3 LYS 25 HG2 LYS 25 -0.656 16.928 -7.655 173 HD2 LYS 25 HD3 LYS 25 -2.873 18.111 -7.780 174 HD3 LYS 25 HD2 LYS 25 -2.177 19.145 -9.014 175 HE2 LYS 25 HE2 LYS 25 -2.000 17.448 -10.603 176 HE3 LYS 25 HE1 LYS 25 -1.904 16.184 -9.387 177 HZ1 LYS 25 HZ1 LYS 25 -4.190 16.912 -10.769 178 HZ2 LYS 25 HZ2 LYS 25 -4.438 17.465 -9.171 179 HZ3 LYS 25 HZ3 LYS 25 -4.051 15.878 -9.465 180 H TYR 26 H TYR 26 1.189 16.295 -7.065 181 HA TYR 26 HA TYR 26 1.967 15.199 -4.577 182 HB2 TYR 26 HB3 TYR 26 0.128 13.413 -4.550 183 HB3 TYR 26 HB2 TYR 26 -0.262 14.999 -3.901 184 HD1 TYR 26 HD2 TYR 26 -0.802 12.664 -6.761 185 HD2 TYR 26 HD1 TYR 26 -1.804 16.497 -5.067 186 HE1 TYR 26 HE2 TYR 26 -2.656 12.863 -8.334 187 HE2 TYR 26 HE1 TYR 26 -3.677 16.695 -6.653 188 HH TYR 26 HH TYR 26 -5.099 15.313 -8.058 189 H LYS 27 H LYS 27 3.716 14.562 -5.607 190 HA LYS 27 HA LYS 27 3.570 11.993 -6.775 191 HB2 LYS 27 HB3 LYS 27 4.852 14.261 -8.344 192 HB3 LYS 27 HB2 LYS 27 5.123 12.568 -8.694 193 HG2 LYS 27 HG3 LYS 27 2.398 13.911 -8.742 194 HG3 LYS 27 HG2 LYS 27 3.340 13.615 -10.186 195 HD2 LYS 27 HD3 LYS 27 2.471 11.346 -8.307 196 HD3 LYS 27 HD2 LYS 27 1.502 11.924 -9.627 197 HE2 LYS 27 HE2 LYS 27 4.243 10.696 -9.823 198 HE3 LYS 27 HE1 LYS 27 2.754 10.063 -10.459 199 HZ1 LYS 27 HZ1 LYS 27 3.829 11.055 -12.258 200 HZ2 LYS 27 HZ2 LYS 27 4.257 12.462 -11.434 201 HZ3 LYS 27 HZ3 LYS 27 2.637 12.160 -11.874 202 H LEU 28 H LEU 28 5.720 10.993 -6.698 203 HA LEU 28 HA LEU 28 7.403 12.445 -4.771 204 HB2 LEU 28 HB3 LEU 28 6.155 10.588 -3.805 205 HB3 LEU 28 HB2 LEU 28 6.877 9.475 -4.974 206 HG LEU 28 HG LEU 28 9.142 10.189 -4.065 207 HD11 LEU 28 HD11 LEU 28 7.307 11.635 -2.164 208 HD12 LEU 28 HD12 LEU 28 8.707 12.269 -3.030 209 HD13 LEU 28 HD13 LEU 28 8.928 11.139 -1.686 210 HD21 LEU 28 HD21 LEU 28 7.180 8.977 -2.092 211 HD22 LEU 28 HD22 LEU 28 8.930 8.833 -2.029 212 HD23 LEU 28 HD23 LEU 28 8.035 8.085 -3.355 213 H SER 29 H SER 29 9.297 12.930 -5.555 214 HA SER 29 HA SER 29 10.297 11.820 -8.006 215 HB2 SER 29 HB3 SER 29 12.186 13.386 -7.493 216 HB3 SER 29 HB2 SER 29 10.621 14.134 -7.648 217 HG SER 29 HG SER 29 10.750 14.726 -5.598 218 H LYS 30 H LYS 30 12.419 10.857 -8.172 219 HA LYS 30 HA LYS 30 12.971 8.912 -6.101 220 HB2 LYS 30 HB3 LYS 30 14.797 9.692 -8.373 221 HB3 LYS 30 HB2 LYS 30 14.789 8.163 -7.508 222 HG2 LYS 30 HG3 LYS 30 12.697 9.238 -9.423 223 HG3 LYS 30 HG2 LYS 30 13.675 7.805 -9.640 224 HD2 LYS 30 HD3 LYS 30 11.645 8.074 -7.367 225 HD3 LYS 30 HD2 LYS 30 11.267 7.347 -8.911 226 HE2 LYS 30 HE2 LYS 30 13.485 6.371 -7.071 227 HE3 LYS 30 HE1 LYS 30 11.889 5.651 -7.230 228 HZ1 LYS 30 HZ1 LYS 30 13.493 6.030 -9.679 229 HZ2 LYS 30 HZ2 LYS 30 12.370 4.812 -9.296 230 HZ3 LYS 30 HZ3 LYS 30 13.913 4.804 -8.613 231 H LYS 31 H LYS 31 13.461 12.132 -6.387 232 HA LYS 31 HA LYS 31 16.032 12.611 -5.271 233 HB2 LYS 31 HB3 LYS 31 13.418 14.115 -4.920 234 HB3 LYS 31 HB2 LYS 31 15.022 14.735 -4.593 235 HG2 LYS 31 HG3 LYS 31 15.653 14.482 -6.961 236 HG3 LYS 31 HG2 LYS 31 14.090 13.779 -7.287 237 HD2 LYS 31 HD3 LYS 31 13.010 15.890 -6.480 238 HD3 LYS 31 HD2 LYS 31 14.599 16.619 -6.358 239 HE2 LYS 31 HE2 LYS 31 13.556 15.326 -8.843 240 HE3 LYS 31 HE1 LYS 31 13.388 17.056 -8.556 241 HZ1 LYS 31 HZ1 LYS 31 15.359 16.924 -9.753 242 HZ2 LYS 31 HZ2 LYS 31 15.854 15.486 -9.092 243 HZ3 LYS 31 HZ3 LYS 31 15.981 16.933 -8.198 244 H GLU 32 H GLU 32 12.775 12.196 -4.020 245 HA GLU 32 HA GLU 32 13.660 12.150 -1.245 246 HB2 GLU 32 HB3 GLU 32 10.923 12.082 -2.493 247 HB3 GLU 32 HB2 GLU 32 11.286 12.296 -0.775 248 HG2 GLU 32 HG3 GLU 32 12.251 14.144 -2.976 249 HG3 GLU 32 HG2 GLU 32 10.828 14.465 -2.025 250 H LEU 33 H LEU 33 11.938 10.158 -3.609 251 HA LEU 33 HA LEU 33 10.880 8.279 -1.982 252 HB2 LEU 33 HB3 LEU 33 10.421 8.300 -4.388 253 HB3 LEU 33 HB2 LEU 33 12.051 7.736 -4.707 254 HG LEU 33 HG LEU 33 10.150 5.971 -4.744 255 HD11 LEU 33 HD11 LEU 33 12.845 5.767 -4.282 256 HD12 LEU 33 HD12 LEU 33 11.735 4.449 -4.568 257 HD13 LEU 33 HD13 LEU 33 12.153 4.883 -2.921 258 HD21 LEU 33 HD21 LEU 33 9.498 6.896 -2.240 259 HD22 LEU 33 HD22 LEU 33 10.595 5.588 -1.829 260 HD23 LEU 33 HD23 LEU 33 9.177 5.269 -2.820 261 H LYS 34 H LYS 34 14.155 7.965 -3.362 262 HA LYS 34 HA LYS 34 14.618 5.524 -1.992 263 HB2 LYS 34 HB3 LYS 34 17.130 6.251 -2.266 264 HB3 LYS 34 HB2 LYS 34 16.187 5.757 -3.663 265 HG2 LYS 34 HG3 LYS 34 16.028 7.881 -4.512 266 HG3 LYS 34 HG2 LYS 34 16.193 8.721 -2.974 267 HD2 LYS 34 HD3 LYS 34 18.606 8.144 -2.921 268 HD3 LYS 34 HD2 LYS 34 18.419 7.192 -4.373 269 HE2 LYS 34 HE2 LYS 34 19.341 9.578 -4.589 270 HE3 LYS 34 HE1 LYS 34 18.114 9.080 -5.739 271 HZ1 LYS 34 HZ1 LYS 34 17.740 11.286 -4.773 272 HZ2 LYS 34 HZ2 LYS 34 17.518 10.664 -3.233 273 HZ3 LYS 34 HZ3 LYS 34 16.453 10.247 -4.544 274 H GLU 35 H GLU 35 15.409 8.869 -1.199 275 HA GLU 35 HA GLU 35 16.831 8.271 1.144 276 HB2 GLU 35 HB3 GLU 35 15.572 10.836 0.136 277 HB3 GLU 35 HB2 GLU 35 16.679 10.711 1.501 278 HG2 GLU 35 HG3 GLU 35 18.423 9.770 0.153 279 HG3 GLU 35 HG2 GLU 35 17.387 9.655 -1.254 280 H LEU 36 H LEU 36 13.511 9.319 0.556 281 HA LEU 36 HA LEU 36 12.728 9.335 3.289 282 HB2 LEU 36 HB3 LEU 36 10.946 10.281 2.391 283 HB3 LEU 36 HB2 LEU 36 11.485 9.934 0.764 284 HG LEU 36 HG LEU 36 10.414 7.591 1.096 285 HD11 LEU 36 HD11 LEU 36 9.675 8.961 3.629 286 HD12 LEU 36 HD12 LEU 36 9.896 7.225 3.298 287 HD13 LEU 36 HD13 LEU 36 8.418 8.020 2.830 288 HD21 LEU 36 HD21 LEU 36 8.391 8.375 0.262 289 HD22 LEU 36 HD22 LEU 36 9.460 9.740 -0.054 290 HD23 LEU 36 HD23 LEU 36 8.373 9.775 1.332 291 H LEU 37 H LEU 37 12.637 6.879 0.735 292 HA LEU 37 HA LEU 37 11.213 4.988 2.203 293 HB2 LEU 37 HB3 LEU 37 11.494 4.761 -0.195 294 HB3 LEU 37 HB2 LEU 37 13.240 4.573 -0.034 295 HG LEU 37 HG LEU 37 11.804 2.466 -0.404 296 HD11 LEU 37 HD11 LEU 37 14.218 2.777 0.811 297 HD12 LEU 37 HD12 LEU 37 13.477 1.228 0.493 298 HD13 LEU 37 HD13 LEU 37 13.327 1.953 2.089 299 HD21 LEU 37 HD21 LEU 37 10.108 3.187 1.335 300 HD22 LEU 37 HD22 LEU 37 11.274 2.725 2.571 301 HD23 LEU 37 HD23 LEU 37 10.650 1.522 1.457 302 H GLN 38 H GLN 38 14.745 5.486 1.908 303 HA GLN 38 HA GLN 38 15.361 3.342 3.677 304 HB2 GLN 38 HB3 GLN 38 17.595 4.315 3.876 305 HB3 GLN 38 HB2 GLN 38 17.117 4.197 2.180 306 HG2 GLN 38 HG3 GLN 38 16.507 6.555 2.175 307 HG3 GLN 38 HG2 GLN 38 16.923 6.740 3.867 308 HE21 GLN 38 HE21 GLN 38 19.329 5.110 3.807 309 HE22 GLN 38 HE22 GLN 38 20.491 5.939 2.906 310 H THR 39 H THR 39 14.907 6.798 4.215 311 HA THR 39 HA THR 39 15.656 6.700 6.905 312 HB THR 39 HB THR 39 14.587 8.693 5.086 313 HG1 THR 39 HG2 THR 39 16.582 8.940 5.887 314 HG21 THR 39 HG21 THR 39 12.614 8.782 6.383 315 HG22 THR 39 HG22 THR 39 13.612 10.132 6.922 316 HG23 THR 39 HG23 THR 39 13.472 8.698 7.922 317 H GLU 40 H GLU 40 12.372 6.653 5.468 318 HA GLU 40 HA GLU 40 11.169 6.446 8.032 319 HB2 GLU 40 HB3 GLU 40 9.977 5.803 5.326 320 HB3 GLU 40 HB2 GLU 40 9.080 6.039 6.819 321 HG2 GLU 40 HG3 GLU 40 10.796 8.160 5.438 322 HG3 GLU 40 HG2 GLU 40 9.047 8.055 5.460 323 H LEU 41 H LEU 41 11.985 4.038 5.563 324 HA LEU 41 HA LEU 41 11.030 1.892 7.329 325 HB2 LEU 41 HB3 LEU 41 11.782 1.973 4.413 326 HB3 LEU 41 HB2 LEU 41 11.748 0.478 5.277 327 HG LEU 41 HG LEU 41 9.410 0.913 6.052 328 HD11 LEU 41 HD11 LEU 41 8.135 2.656 4.726 329 HD12 LEU 41 HD12 LEU 41 9.686 3.305 4.209 330 HD13 LEU 41 HD13 LEU 41 9.258 3.285 5.922 331 HD21 LEU 41 HD21 LEU 41 10.206 -0.230 3.727 332 HD22 LEU 41 HD22 LEU 41 9.267 1.115 3.078 333 HD23 LEU 41 HD23 LEU 41 8.509 -0.040 4.157 334 H SER 42 H SER 42 13.428 3.486 7.843 335 HA SER 42 HA SER 42 15.783 2.280 7.109 336 HB2 SER 42 HB3 SER 42 16.400 3.165 9.587 337 HB3 SER 42 HB2 SER 42 16.229 4.198 8.201 338 HG SER 42 HG SER 42 14.325 4.906 8.926 339 H GLY 43 H GLY 43 13.468 1.337 9.561 340 HA2 GLY 43 HA3 GLY 43 15.059 -0.645 10.871 341 HA3 GLY 43 HA2 GLY 43 13.303 -0.510 10.884 342 H PHE 44 H PHE 44 12.611 -0.780 8.289 343 HA PHE 44 HA PHE 44 12.906 -3.619 7.879 344 HB2 PHE 44 HB3 PHE 44 11.620 -1.447 6.231 345 HB3 PHE 44 HB2 PHE 44 11.795 -3.073 5.602 346 HD1 PHE 44 HD2 PHE 44 11.050 -4.974 7.314 347 HD2 PHE 44 HD1 PHE 44 9.685 -0.953 7.342 348 HE1 PHE 44 HE2 PHE 44 9.013 -5.699 8.574 349 HE2 PHE 44 HE1 PHE 44 7.626 -1.662 8.600 350 HZ PHE 44 HZ PHE 44 7.314 -4.025 9.210 351 H LEU 45 H LEU 45 14.135 -0.725 6.373 352 HA LEU 45 HA LEU 45 15.486 -1.980 4.270 353 HB2 LEU 45 HB3 LEU 45 15.061 0.370 4.234 354 HB3 LEU 45 HB2 LEU 45 15.992 0.629 5.699 355 HG LEU 45 HG LEU 45 17.961 -0.159 4.658 356 HD11 LEU 45 HD11 LEU 45 17.871 -0.343 2.018 357 HD12 LEU 45 HD12 LEU 45 16.144 -0.545 2.232 358 HD13 LEU 45 HD13 LEU 45 17.272 -1.712 2.945 359 HD21 LEU 45 HD21 LEU 45 17.242 2.245 4.513 360 HD22 LEU 45 HD22 LEU 45 16.743 1.910 2.827 361 HD23 LEU 45 HD23 LEU 45 18.434 1.766 3.300 362 H ASP 46 H ASP 46 16.614 -1.052 7.505 363 HA ASP 46 HA ASP 46 19.241 -2.108 7.161 364 HB2 ASP 46 HB3 ASP 46 18.861 -0.507 8.763 365 HB3 ASP 46 HB2 ASP 46 17.648 -1.475 9.641 366 H ALA 47 H ALA 47 16.232 -3.422 8.438 367 HA ALA 47 HA ALA 47 17.321 -5.786 9.480 368 HB1 ALA 47 HB1 ALA 47 14.579 -4.999 8.603 369 HB2 ALA 47 HB2 ALA 47 15.153 -5.384 10.223 370 HB3 ALA 47 HB3 ALA 47 14.901 -6.671 9.041 371 H GLN 48 H GLN 48 16.078 -5.101 6.229 372 HA GLN 48 HA GLN 48 17.369 -7.595 5.367 373 HB2 GLN 48 HB3 GLN 48 15.462 -7.681 3.577 374 HB3 GLN 48 HB2 GLN 48 15.143 -8.306 5.191 375 HG2 GLN 48 HG3 GLN 48 13.305 -7.024 4.707 376 HG3 GLN 48 HG2 GLN 48 14.248 -5.882 5.667 377 HE21 GLN 48 HE21 GLN 48 14.952 -3.977 4.569 378 HE22 GLN 48 HE22 GLN 48 14.632 -3.657 2.920 379 H LYS 49 H LYS 49 18.620 -5.121 5.244 380 HA LYS 49 HA LYS 49 18.378 -3.828 2.760 381 HB2 LYS 49 HB3 LYS 49 19.819 -3.146 4.839 382 HB3 LYS 49 HB2 LYS 49 21.057 -4.169 4.134 383 HG2 LYS 49 HG3 LYS 49 20.894 -2.882 2.008 384 HG3 LYS 49 HG2 LYS 49 19.695 -1.858 2.815 385 HD2 LYS 49 HD3 LYS 49 21.278 -1.167 4.498 386 HD3 LYS 49 HD2 LYS 49 22.537 -2.209 3.835 387 HE2 LYS 49 HE2 LYS 49 21.276 0.237 2.529 388 HE3 LYS 49 HE1 LYS 49 22.941 -0.017 3.086 389 HZ1 LYS 49 HZ1 LYS 49 21.746 -1.725 0.949 390 HZ2 LYS 49 HZ2 LYS 49 23.374 -1.505 1.320 391 HZ3 LYS 49 HZ3 LYS 49 22.469 -0.258 0.628 392 H ASP 50 H ASP 50 20.390 -6.481 3.835 393 HA ASP 50 HA ASP 50 21.750 -6.913 1.370 394 HB2 ASP 50 HB3 ASP 50 22.520 -7.723 3.707 395 HB3 ASP 50 HB2 ASP 50 21.411 -9.046 3.450 396 H VAL 51 H VAL 51 18.652 -7.860 2.450 397 HA VAL 51 HA VAL 51 18.424 -10.349 1.263 398 HB VAL 51 HB VAL 51 16.247 -8.312 1.828 399 HG11 VAL 51 HG11 VAL 51 14.824 -10.452 1.916 400 HG12 VAL 51 HG12 VAL 51 16.097 -11.223 0.984 401 HG13 VAL 51 HG13 VAL 51 15.225 -9.836 0.321 402 HG21 VAL 51 HG21 VAL 51 15.909 -9.796 3.835 403 HG22 VAL 51 HG22 VAL 51 17.496 -9.016 3.821 404 HG23 VAL 51 HG23 VAL 51 17.343 -10.699 3.360 405 H ASP 52 H ASP 52 19.096 -7.612 -0.387 406 HA ASP 52 HA ASP 52 19.196 -7.102 -2.589 407 HB2 ASP 52 HB3 ASP 52 20.149 -9.384 -2.658 408 HB3 ASP 52 HB2 ASP 52 18.541 -10.015 -2.990 409 H ALA 53 H ALA 53 16.375 -9.065 -1.819 410 HA ALA 53 HA ALA 53 14.719 -8.448 -3.968 411 HB1 ALA 53 HB1 ALA 53 14.114 -10.024 -2.142 412 HB2 ALA 53 HB2 ALA 53 12.830 -8.856 -2.467 413 HB3 ALA 53 HB3 ALA 53 13.865 -8.652 -1.060 414 H VAL 54 H VAL 54 15.576 -6.565 -1.158 415 HA VAL 54 HA VAL 54 13.789 -4.426 -1.540 416 HB VAL 54 HB VAL 54 14.903 -4.507 0.580 417 HG11 VAL 54 HG11 VAL 54 17.426 -4.140 0.650 418 HG12 VAL 54 HG12 VAL 54 17.500 -4.647 -1.011 419 HG13 VAL 54 HG13 VAL 54 16.895 -5.750 0.246 420 HG21 VAL 54 HG21 VAL 54 14.880 -2.165 -0.885 421 HG22 VAL 54 HG22 VAL 54 16.583 -2.316 -0.497 422 HG23 VAL 54 HG23 VAL 54 15.400 -2.276 0.798 423 H ASP 55 H ASP 55 16.973 -5.100 -2.878 424 HA ASP 55 HA ASP 55 17.275 -2.666 -4.344 425 HB2 ASP 55 HB3 ASP 55 19.155 -4.263 -4.014 426 HB3 ASP 55 HB2 ASP 55 18.316 -5.439 -4.984 427 H LYS 56 H LYS 56 15.954 -5.821 -5.115 428 HA LYS 56 HA LYS 56 15.200 -5.198 -7.785 429 HB2 LYS 56 HB3 LYS 56 14.293 -7.410 -5.935 430 HB3 LYS 56 HB2 LYS 56 13.735 -7.242 -7.587 431 HG2 LYS 56 HG3 LYS 56 15.883 -8.725 -6.996 432 HG3 LYS 56 HG2 LYS 56 15.785 -7.849 -8.525 433 HD2 LYS 56 HD3 LYS 56 17.087 -5.953 -7.414 434 HD3 LYS 56 HD2 LYS 56 17.217 -6.995 -5.986 435 HE2 LYS 56 HE2 LYS 56 18.401 -8.683 -7.406 436 HE3 LYS 56 HE1 LYS 56 18.332 -7.546 -8.743 437 HZ1 LYS 56 HZ1 LYS 56 19.426 -5.896 -7.103 438 HZ2 LYS 56 HZ2 LYS 56 20.402 -7.122 -7.752 439 HZ3 LYS 56 HZ3 LYS 56 19.764 -7.279 -6.178 440 H VAL 57 H VAL 57 13.497 -4.991 -4.748 441 HA VAL 57 HA VAL 57 10.953 -4.314 -5.855 442 HB VAL 57 HB VAL 57 12.188 -3.807 -3.125 443 HG11 VAL 57 HG11 VAL 57 10.397 -2.154 -3.730 444 HG12 VAL 57 HG12 VAL 57 9.991 -3.183 -2.368 445 HG13 VAL 57 HG13 VAL 57 9.293 -3.508 -3.968 446 HG21 VAL 57 HG21 VAL 57 11.637 -6.224 -3.909 447 HG22 VAL 57 HG22 VAL 57 9.950 -5.698 -3.877 448 HG23 VAL 57 HG23 VAL 57 10.904 -5.662 -2.404 449 H MET 58 H MET 58 13.730 -2.564 -4.650 450 HA MET 58 HA MET 58 12.860 0.072 -5.112 451 HB2 MET 58 HB3 MET 58 14.751 -0.383 -3.691 452 HB3 MET 58 HB2 MET 58 15.635 -1.153 -5.008 453 HG2 MET 58 HG3 MET 58 15.586 0.878 -6.240 454 HG3 MET 58 HG2 MET 58 14.805 1.763 -4.907 455 HE1 MET 58 HE1 MET 58 15.565 1.745 -2.660 456 HE2 MET 58 HE2 MET 58 17.231 2.071 -2.199 457 HE3 MET 58 HE3 MET 58 16.655 0.400 -2.228 458 H LYS 59 H LYS 59 14.398 -2.354 -7.104 459 HA LYS 59 HA LYS 59 15.207 -0.779 -9.256 460 HB2 LYS 59 HB3 LYS 59 15.963 -3.090 -9.000 461 HB3 LYS 59 HB2 LYS 59 14.320 -3.687 -9.248 462 HG2 LYS 59 HG3 LYS 59 15.610 -3.931 -11.261 463 HG3 LYS 59 HG2 LYS 59 14.381 -2.690 -11.515 464 HD2 LYS 59 HD3 LYS 59 15.905 -0.948 -11.494 465 HD3 LYS 59 HD2 LYS 59 17.086 -1.818 -10.531 466 HE2 LYS 59 HE2 LYS 59 17.539 -1.448 -13.065 467 HE3 LYS 59 HE1 LYS 59 17.890 -3.001 -12.312 468 HZ1 LYS 59 HZ1 LYS 59 16.379 -2.693 -14.529 469 HZ2 LYS 59 HZ2 LYS 59 15.146 -2.871 -13.394 470 HZ3 LYS 59 HZ3 LYS 59 16.371 -4.026 -13.545 471 H GLU 60 H GLU 60 12.146 -2.417 -8.637 472 HA GLU 60 HA GLU 60 10.865 -1.745 -11.072 473 HB2 GLU 60 HB3 GLU 60 9.750 -2.184 -8.294 474 HB3 GLU 60 HB2 GLU 60 8.772 -2.040 -9.740 475 HG2 GLU 60 HG3 GLU 60 9.867 -3.976 -10.755 476 HG3 GLU 60 HG2 GLU 60 10.940 -4.111 -9.352 477 H LEU 61 H LEU 61 11.144 -0.078 -7.984 478 HA LEU 61 HA LEU 61 9.603 2.205 -8.703 479 HB2 LEU 61 HB3 LEU 61 11.635 1.636 -6.573 480 HB3 LEU 61 HB2 LEU 61 11.145 3.292 -6.850 481 HG LEU 61 HG LEU 61 9.868 1.940 -5.084 482 HD11 LEU 61 HD11 LEU 61 7.719 3.007 -5.670 483 HD12 LEU 61 HD12 LEU 61 8.302 3.337 -7.288 484 HD13 LEU 61 HD13 LEU 61 9.071 4.103 -5.886 485 HD21 LEU 61 HD21 LEU 61 9.572 -0.095 -6.531 486 HD22 LEU 61 HD22 LEU 61 8.429 0.817 -7.535 487 HD23 LEU 61 HD23 LEU 61 8.072 0.501 -5.857 488 H ASP 62 H ASP 62 13.038 1.411 -8.978 489 HA ASP 62 HA ASP 62 13.681 3.916 -10.242 490 HB2 ASP 62 HB3 ASP 62 15.194 1.363 -9.879 491 HB3 ASP 62 HB2 ASP 62 15.728 2.541 -11.060 492 H GLU 63 H GLU 63 12.750 0.828 -11.539 493 HA GLU 63 HA GLU 63 13.104 1.641 -14.245 494 HB2 GLU 63 HB3 GLU 63 11.178 -0.408 -13.066 495 HB3 GLU 63 HB2 GLU 63 11.493 -0.164 -14.767 496 HG2 GLU 63 HG3 GLU 63 13.896 -0.687 -14.466 497 HG3 GLU 63 HG2 GLU 63 13.620 -0.823 -12.739 498 H ASN 64 H ASN 64 10.366 1.648 -12.034 499 HA ASN 64 HA ASN 64 8.473 2.858 -13.780 500 HB2 ASN 64 HB3 ASN 64 8.076 1.642 -11.569 501 HB3 ASN 64 HB2 ASN 64 8.580 3.169 -10.823 502 HD21 ASN 64 HD21 ASN 64 5.801 1.762 -11.119 503 HD22 ASN 64 HD22 ASN 64 4.805 3.057 -11.627 504 H GLY 65 H GLY 65 10.714 4.151 -11.366 505 HA2 GLY 65 HA3 GLY 65 9.826 6.783 -11.297 506 HA3 GLY 65 HA2 GLY 65 11.431 6.252 -10.848 507 H ASP 66 H ASP 66 9.849 6.183 -14.015 508 HA ASP 66 HA ASP 66 12.066 7.336 -15.378 509 HB2 ASP 66 HB3 ASP 66 10.302 5.922 -16.451 510 HB3 ASP 66 HB2 ASP 66 9.179 7.259 -16.263 511 H GLY 67 H GLY 67 9.122 8.509 -13.970 512 HA2 GLY 67 HA3 GLY 67 10.022 11.308 -14.405 513 HA3 GLY 67 HA2 GLY 67 8.339 10.830 -14.399 514 H GLU 68 H GLU 68 7.642 9.623 -12.414 515 HA GLU 68 HA GLU 68 8.938 10.466 -9.909 516 HB2 GLU 68 HB3 GLU 68 6.043 10.991 -10.495 517 HB3 GLU 68 HB2 GLU 68 6.894 11.454 -9.033 518 HG2 GLU 68 HG3 GLU 68 7.295 13.427 -9.991 519 HG3 GLU 68 HG2 GLU 68 8.374 12.640 -11.126 520 H VAL 69 H VAL 69 7.641 9.482 -8.038 521 HA VAL 69 HA VAL 69 6.278 7.042 -8.890 522 HB VAL 69 HB VAL 69 7.702 5.847 -7.653 523 HG11 VAL 69 HG11 VAL 69 9.559 6.721 -6.487 524 HG12 VAL 69 HG12 VAL 69 8.781 8.270 -6.204 525 HG13 VAL 69 HG13 VAL 69 9.292 7.818 -7.832 526 HG21 VAL 69 HG21 VAL 69 7.472 5.847 -5.200 527 HG22 VAL 69 HG22 VAL 69 5.900 6.013 -5.950 528 HG23 VAL 69 HG23 VAL 69 6.689 7.422 -5.243 529 H ASP 70 H ASP 70 4.207 6.813 -8.208 530 HA ASP 70 HA ASP 70 3.142 9.108 -6.744 531 HB2 ASP 70 HB3 ASP 70 1.194 8.828 -7.852 532 HB3 ASP 70 HB2 ASP 70 2.136 7.818 -8.935 533 H PHE 71 H PHE 71 1.041 8.338 -5.406 534 HA PHE 71 HA PHE 71 2.091 7.205 -3.068 535 HB2 PHE 71 HB3 PHE 71 0.100 8.679 -3.079 536 HB3 PHE 71 HB2 PHE 71 -0.826 7.374 -3.823 537 HD1 PHE 71 HD1 PHE 71 1.305 8.122 -0.846 538 HD2 PHE 71 HD2 PHE 71 -1.884 5.692 -2.436 539 HE1 PHE 71 HE1 PHE 71 0.906 7.146 1.391 540 HE2 PHE 71 HE2 PHE 71 -2.270 4.753 -0.204 541 HZ PHE 71 HZ PHE 71 -0.882 5.466 1.715 542 H GLN 72 H GLN 72 0.073 5.860 -5.631 543 HA GLN 72 HA GLN 72 -0.358 3.304 -4.526 544 HB2 GLN 72 HB3 GLN 72 -1.366 4.477 -6.680 545 HB3 GLN 72 HB2 GLN 72 -0.004 3.707 -7.485 546 HG2 GLN 72 HG3 GLN 72 -0.752 1.514 -6.451 547 HG3 GLN 72 HG2 GLN 72 -2.182 2.360 -5.896 548 HE21 GLN 72 HE21 GLN 72 -1.301 3.765 -8.845 549 HE22 GLN 72 HE22 GLN 72 -2.318 2.874 -9.845 550 H GLU 73 H GLU 73 2.166 4.620 -6.582 551 HA GLU 73 HA GLU 73 3.721 2.230 -6.751 552 HB2 GLU 73 HB3 GLU 73 4.300 5.134 -7.318 553 HB3 GLU 73 HB2 GLU 73 5.480 3.842 -7.604 554 HG2 GLU 73 HG3 GLU 73 4.077 2.712 -9.093 555 HG3 GLU 73 HG2 GLU 73 2.666 3.685 -8.701 556 H TYR 74 H TYR 74 3.800 5.072 -4.688 557 HA TYR 74 HA TYR 74 6.141 4.431 -3.204 558 HB2 TYR 74 HB3 TYR 74 5.304 6.664 -3.126 559 HB3 TYR 74 HB2 TYR 74 3.729 6.119 -2.587 560 HD1 TYR 74 HD1 TYR 74 7.341 5.796 -1.480 561 HD2 TYR 74 HD2 TYR 74 3.232 6.396 -0.340 562 HE1 TYR 74 HE1 TYR 74 8.024 6.058 0.879 563 HE2 TYR 74 HE2 TYR 74 3.925 6.657 2.012 564 HH TYR 74 HH TYR 74 6.302 7.423 3.159 565 H VAL 75 H VAL 75 2.709 3.692 -2.489 566 HA VAL 75 HA VAL 75 3.284 2.487 -0.028 567 HB VAL 75 HB VAL 75 1.089 1.333 -0.252 568 HG11 VAL 75 HG11 VAL 75 1.415 3.683 0.634 569 HG12 VAL 75 HG12 VAL 75 -0.185 3.336 -0.031 570 HG13 VAL 75 HG13 VAL 75 0.972 4.268 -0.977 571 HG21 VAL 75 HG21 VAL 75 1.525 1.917 -3.002 572 HG22 VAL 75 HG22 VAL 75 0.167 2.868 -2.518 573 HG23 VAL 75 HG23 VAL 75 0.142 1.094 -2.299 574 H VAL 76 H VAL 76 3.134 1.004 -3.288 575 HA VAL 76 HA VAL 76 3.333 -1.608 -2.304 576 HB VAL 76 HB VAL 76 2.508 -1.127 -4.582 577 HG11 VAL 76 HG11 VAL 76 3.820 0.698 -5.315 578 HG12 VAL 76 HG12 VAL 76 4.275 -0.663 -6.338 579 HG13 VAL 76 HG13 VAL 76 5.347 -0.159 -5.060 580 HG21 VAL 76 HG21 VAL 76 5.065 -2.777 -4.616 581 HG22 VAL 76 HG22 VAL 76 3.745 -2.878 -5.763 582 HG23 VAL 76 HG23 VAL 76 3.484 -3.371 -4.092 583 H LEU 77 H LEU 77 5.724 0.814 -3.169 584 HA LEU 77 HA LEU 77 8.019 -0.814 -3.146 585 HB2 LEU 77 HB3 LEU 77 8.072 1.499 -3.938 586 HB3 LEU 77 HB2 LEU 77 7.664 2.083 -2.340 587 HG LEU 77 HG LEU 77 9.778 1.156 -1.426 588 HD11 LEU 77 HD11 LEU 77 10.449 -0.644 -2.548 589 HD12 LEU 77 HD12 LEU 77 11.439 0.517 -3.440 590 HD13 LEU 77 HD13 LEU 77 9.919 -0.069 -4.128 591 HD21 LEU 77 HD21 LEU 77 10.466 3.240 -1.937 592 HD22 LEU 77 HD22 LEU 77 9.644 3.244 -3.501 593 HD23 LEU 77 HD23 LEU 77 11.249 2.535 -3.344 594 H VAL 78 H VAL 78 6.541 1.117 -0.564 595 HA VAL 78 HA VAL 78 8.298 0.088 1.434 596 HB VAL 78 HB VAL 78 6.882 1.238 3.063 597 HG11 VAL 78 HG11 VAL 78 7.961 3.104 2.366 598 HG12 VAL 78 HG12 VAL 78 6.654 3.413 1.238 599 HG13 VAL 78 HG13 VAL 78 8.053 2.495 0.713 600 HG21 VAL 78 HG21 VAL 78 5.024 1.662 0.706 601 HG22 VAL 78 HG22 VAL 78 4.825 2.424 2.274 602 HG23 VAL 78 HG23 VAL 78 4.649 0.690 2.123 603 H ALA 79 H ALA 79 5.035 -0.731 0.403 604 HA ALA 79 HA ALA 79 4.516 -2.634 2.407 605 HB1 ALA 79 HB1 ALA 79 2.837 -1.646 0.745 606 HB2 ALA 79 HB2 ALA 79 2.709 -3.368 1.099 607 HB3 ALA 79 HB3 ALA 79 3.465 -2.834 -0.401 608 H ALA 80 H ALA 80 5.949 -2.993 -0.827 609 HA ALA 80 HA ALA 80 6.173 -5.787 -0.763 610 HB1 ALA 80 HB1 ALA 80 6.548 -4.681 -2.854 611 HB2 ALA 80 HB2 ALA 80 8.084 -5.408 -2.401 612 HB3 ALA 80 HB3 ALA 80 7.815 -3.685 -2.152 613 H LEU 81 H LEU 81 8.309 -3.234 0.359 614 HA LEU 81 HA LEU 81 10.379 -4.937 1.336 615 HB2 LEU 81 HB3 LEU 81 9.570 -2.121 2.076 616 HB3 LEU 81 HB2 LEU 81 10.994 -2.934 2.723 617 HG LEU 81 HG LEU 81 10.468 -2.529 -0.245 618 HD11 LEU 81 HD11 LEU 81 10.905 -0.367 0.532 619 HD12 LEU 81 HD12 LEU 81 12.502 -0.950 0.064 620 HD13 LEU 81 HD13 LEU 81 12.040 -0.925 1.761 621 HD21 LEU 81 HD21 LEU 81 11.926 -4.374 -0.069 622 HD22 LEU 81 HD22 LEU 81 12.714 -3.746 1.383 623 HD23 LEU 81 HD23 LEU 81 13.020 -3.008 -0.178 624 H THR 82 H THR 82 7.460 -3.563 2.758 625 HA THR 82 HA THR 82 7.933 -4.396 5.391 626 HB THR 82 HB THR 82 5.217 -4.209 4.063 627 HG1 THR 82 HG2 THR 82 6.691 -2.306 3.760 628 HG21 THR 82 HG21 THR 82 4.356 -3.877 6.207 629 HG22 THR 82 HG22 THR 82 5.911 -3.416 6.880 630 HG23 THR 82 HG23 THR 82 5.585 -5.101 6.490 631 H VAL 83 H VAL 83 6.048 -5.978 2.773 632 HA VAL 83 HA VAL 83 5.677 -8.383 4.268 633 HB VAL 83 HB VAL 83 4.080 -7.936 2.552 634 HG11 VAL 83 HG11 VAL 83 6.477 -7.627 0.809 635 HG12 VAL 83 HG12 VAL 83 4.937 -6.750 0.777 636 HG13 VAL 83 HG13 VAL 83 5.052 -8.349 0.081 637 HG21 VAL 83 HG21 VAL 83 5.669 -10.220 1.379 638 HG22 VAL 83 HG22 VAL 83 3.942 -10.053 1.501 639 HG23 VAL 83 HG23 VAL 83 4.899 -10.374 2.953 640 H ALA 84 H ALA 84 8.153 -7.306 2.032 641 HA ALA 84 HA ALA 84 9.435 -9.757 1.651 642 HB1 ALA 84 HB1 ALA 84 11.505 -8.434 1.298 643 HB2 ALA 84 HB2 ALA 84 10.687 -6.995 1.873 644 HB3 ALA 84 HB3 ALA 84 10.146 -7.792 0.394 645 H MET 85 H MET 85 9.970 -7.341 4.225 646 HA MET 85 HA MET 85 11.766 -9.109 5.626 647 HB2 MET 85 HB3 MET 85 11.705 -6.531 5.829 648 HB3 MET 85 HB2 MET 85 10.321 -6.813 6.889 649 HG2 MET 85 HG3 MET 85 11.740 -8.372 8.292 650 HG3 MET 85 HG2 MET 85 13.105 -7.949 7.278 651 HE1 MET 85 HE1 MET 85 10.793 -5.467 10.246 652 HE2 MET 85 HE2 MET 85 11.669 -6.880 10.799 653 HE3 MET 85 HE3 MET 85 10.451 -7.065 9.554 654 H ASN 86 H ASN 86 8.382 -8.096 6.083 655 HA ASN 86 HA ASN 86 7.967 -9.557 8.442 656 HB2 ASN 86 HB3 ASN 86 6.290 -7.951 6.791 657 HB3 ASN 86 HB2 ASN 86 5.503 -9.499 6.912 658 HD21 ASN 86 HD21 ASN 86 6.327 -6.618 8.648 659 HD22 ASN 86 HD22 ASN 86 5.617 -7.048 10.117 660 H ASN 87 H ASN 87 7.993 -10.527 5.133 661 HA ASN 87 HA ASN 87 6.849 -13.071 5.291 662 HB2 ASN 87 HB3 ASN 87 7.469 -12.190 3.162 663 HB3 ASN 87 HB2 ASN 87 9.145 -11.981 3.662 664 HD21 ASN 87 HD21 ASN 87 6.687 -14.512 3.051 665 HD22 ASN 87 HD22 ASN 87 7.820 -15.719 2.679 666 H PHE 88 H PHE 88 10.057 -11.888 6.206 667 HA PHE 88 HA PHE 88 11.177 -14.407 6.855 668 HB2 PHE 88 HB3 PHE 88 12.666 -12.488 6.662 669 HB3 PHE 88 HB2 PHE 88 11.828 -11.645 7.954 670 HD1 PHE 88 HD2 PHE 88 13.531 -14.957 7.328 671 HD2 PHE 88 HD1 PHE 88 12.699 -11.778 10.108 672 HE1 PHE 88 HE2 PHE 88 14.983 -16.040 9.027 673 HE2 PHE 88 HE1 PHE 88 14.139 -12.867 11.785 674 HZ PHE 88 HZ PHE 88 15.288 -14.997 11.247 675 H PHE 89 H PHE 89 9.325 -12.059 8.753 676 HA PHE 89 HA PHE 89 9.370 -13.571 11.166 677 HB2 PHE 89 HB3 PHE 89 7.392 -11.533 10.117 678 HB3 PHE 89 HB2 PHE 89 7.151 -12.362 11.639 679 HD1 PHE 89 HD1 PHE 89 9.704 -12.524 12.941 680 HD2 PHE 89 HD2 PHE 89 8.156 -9.334 10.499 681 HE1 PHE 89 HE1 PHE 89 11.175 -10.926 14.092 682 HE2 PHE 89 HE2 PHE 89 9.644 -7.745 11.658 683 HZ PHE 89 HZ PHE 89 11.155 -8.532 13.448 684 H TRP 90 H TRP 90 7.201 -13.530 8.387 685 HA TRP 90 HA TRP 90 5.312 -15.404 9.423 686 HB2 TRP 90 HB3 TRP 90 5.913 -14.991 6.493 687 HB3 TRP 90 HB2 TRP 90 4.414 -15.522 7.232 688 HD1 TRP 90 HD TRP 90 5.231 -13.021 9.550 689 HE1 TRP 90 HE1 TRP 90 4.334 -10.761 8.971 690 HE3 TRP 90 HE3 TRP 90 4.179 -13.781 4.624 691 HZ2 TRP 90 HZ2 TRP 90 3.236 -9.383 6.684 692 HZ3 TRP 90 HZ3 TRP 90 3.194 -11.959 3.255 693 HH2 TRP 90 HH TRP 90 2.720 -9.746 4.286 694 H GLU 91 H GLU 91 7.982 -15.702 7.218 695 HA GLU 91 HA GLU 91 7.743 -18.624 7.201 696 HB2 GLU 91 HB3 GLU 91 9.726 -16.813 5.780 697 HB3 GLU 91 HB2 GLU 91 9.715 -18.570 5.672 698 HG2 GLU 91 HG3 GLU 91 7.404 -18.525 4.805 699 HG3 GLU 91 HG2 GLU 91 7.400 -16.766 4.914 700 H ASN 92 H ASN 92 8.822 -16.688 9.469 701 HA ASN 92 HA ASN 92 11.414 -17.509 10.104 702 HB2 ASN 92 HB3 ASN 92 10.273 -15.718 11.334 703 HB3 ASN 92 HB2 ASN 92 9.159 -16.904 12.035 704 HD21 ASN 92 HD21 ASN 92 10.307 -15.823 14.067 705 HD22 ASN 92 HD22 ASN 92 11.689 -16.635 14.626 706 H SER 93 H SER 93 11.973 -19.574 10.002 707 HA SER 93 HA SER 93 10.944 -21.507 11.842 708 HB2 SER 93 HB3 SER 93 10.267 -21.685 8.911 709 HB3 SER 93 HB2 SER 93 10.237 -23.070 9.979 710 HG SER 93 HG SER 93 8.922 -20.717 10.789 711 H1 GLY 1 H GLY 1 11.402 0.612 11.815 712 HA2 GLY 1 HA3 GLY 1 12.974 3.007 11.494 713 HA3 GLY 1 HA2 GLY 1 11.751 2.374 10.403 714 H SER 2 H SER 2 10.433 4.020 10.122 715 HA SER 2 HA SER 2 9.533 5.664 12.353 716 HB2 SER 2 HB3 SER 2 9.111 5.730 9.379 717 HB3 SER 2 HB2 SER 2 8.235 6.798 10.470 718 HG SER 2 HG SER 2 10.154 7.562 9.518 719 H GLU 3 H GLU 3 7.182 6.161 12.515 720 HA GLU 3 HA GLU 3 5.627 4.015 13.274 721 HB2 GLU 3 HB3 GLU 3 4.343 6.453 12.085 722 HB3 GLU 3 HB2 GLU 3 3.827 5.483 13.457 723 HG2 GLU 3 HG3 GLU 3 4.727 7.263 14.564 724 HG3 GLU 3 HG2 GLU 3 6.141 6.237 14.487 725 H LEU 4 H LEU 4 6.305 5.154 10.134 726 HA LEU 4 HA LEU 4 4.042 4.199 8.696 727 HB2 LEU 4 HB3 LEU 4 6.948 4.429 7.815 728 HB3 LEU 4 HB2 LEU 4 5.605 4.061 6.764 729 HG LEU 4 HG LEU 4 5.747 6.343 6.419 730 HD11 LEU 4 HD11 LEU 4 4.016 6.359 8.899 731 HD12 LEU 4 HD12 LEU 4 3.447 5.869 7.276 732 HD13 LEU 4 HD13 LEU 4 4.012 7.515 7.576 733 HD21 LEU 4 HD21 LEU 4 7.535 6.494 8.302 734 HD22 LEU 4 HD22 LEU 4 6.186 7.065 9.313 735 HD23 LEU 4 HD23 LEU 4 6.640 7.935 7.878 736 H GLU 5 H GLU 5 7.039 2.698 9.805 737 HA GLU 5 HA GLU 5 6.571 0.203 8.585 738 HB2 GLU 5 HB3 GLU 5 8.081 0.968 11.081 739 HB3 GLU 5 HB2 GLU 5 8.115 -0.665 10.447 740 HG2 GLU 5 HG3 GLU 5 8.888 0.411 8.235 741 HG3 GLU 5 HG2 GLU 5 9.101 1.868 9.145 742 H THR 6 H THR 6 5.665 1.565 11.720 743 HA THR 6 HA THR 6 4.296 -0.711 12.690 744 HB THR 6 HB THR 6 3.577 2.164 13.314 745 HG1 THR 6 HG2 THR 6 5.215 2.212 14.711 746 HG21 THR 6 HG21 THR 6 2.375 -0.080 14.170 747 HG22 THR 6 HG22 THR 6 2.582 1.324 15.208 748 HG23 THR 6 HG23 THR 6 3.695 -0.029 15.332 749 H ALA 7 H ALA 7 3.271 2.135 10.808 750 HA ALA 7 HA ALA 7 0.563 1.456 10.593 751 HB1 ALA 7 HB1 ALA 7 0.428 3.105 8.891 752 HB2 ALA 7 HB2 ALA 7 2.128 2.926 8.471 753 HB3 ALA 7 HB3 ALA 7 1.670 3.676 10.006 754 H MET 8 H MET 8 3.359 0.707 8.546 755 HA MET 8 HA MET 8 1.884 -0.725 6.584 756 HB2 MET 8 HB3 MET 8 4.794 -1.010 7.365 757 HB3 MET 8 HB2 MET 8 4.076 -1.746 5.936 758 HG2 MET 8 HG3 MET 8 4.267 1.244 6.507 759 HG3 MET 8 HG2 MET 8 5.160 0.337 5.309 760 HE1 MET 8 HE1 MET 8 2.950 -0.546 2.601 761 HE2 MET 8 HE2 MET 8 2.612 -1.632 3.938 762 HE3 MET 8 HE3 MET 8 4.258 -1.054 3.686 763 H GLU 9 H GLU 9 3.517 -1.770 9.578 764 HA GLU 9 HA GLU 9 2.702 -4.416 9.106 765 HB2 GLU 9 HB3 GLU 9 3.737 -3.173 11.644 766 HB3 GLU 9 HB2 GLU 9 3.232 -4.856 11.542 767 HG2 GLU 9 HG3 GLU 9 4.778 -5.051 9.489 768 HG3 GLU 9 HG2 GLU 9 5.441 -3.501 9.994 769 H THR 10 H THR 10 1.143 -1.702 10.442 770 HA THR 10 HA THR 10 -0.969 -3.013 11.801 771 HB THR 10 HB THR 10 -1.324 -0.497 10.133 772 HG1 THR 10 HG2 THR 10 0.569 -0.719 11.843 773 HG21 THR 10 HG21 THR 10 -2.599 -1.506 12.684 774 HG22 THR 10 HG22 THR 10 -3.347 -1.409 11.093 775 HG23 THR 10 HG23 THR 10 -2.905 0.064 11.941 776 H LEU 11 H LEU 11 -0.407 -2.184 8.419 777 HA LEU 11 HA LEU 11 -2.817 -3.327 7.328 778 HB2 LEU 11 HB3 LEU 11 -0.054 -2.989 6.071 779 HB3 LEU 11 HB2 LEU 11 -1.535 -3.373 5.217 780 HG LEU 11 HG LEU 11 -1.115 -0.833 6.822 781 HD11 LEU 11 HD11 LEU 11 -1.220 -1.099 3.809 782 HD12 LEU 11 HD12 LEU 11 0.303 -1.054 4.719 783 HD13 LEU 11 HD13 LEU 11 -0.791 0.312 4.767 784 HD21 LEU 11 HD21 LEU 11 -3.433 -1.243 6.732 785 HD22 LEU 11 HD22 LEU 11 -3.355 -1.897 5.086 786 HD23 LEU 11 HD23 LEU 11 -3.144 -0.171 5.366 787 H ILE 12 H ILE 12 0.427 -4.542 8.057 788 HA ILE 12 HA ILE 12 0.136 -7.135 6.939 789 HB ILE 12 HB ILE 12 1.867 -6.224 9.298 790 HG12 ILE 12 HG13 ILE 12 2.259 -5.179 6.953 791 HG13 ILE 12 HG12 ILE 12 3.644 -5.990 7.690 792 HG21 ILE 12 HG21 ILE 12 1.595 -8.841 7.958 793 HG22 ILE 12 HG22 ILE 12 1.921 -8.427 9.646 794 HG23 ILE 12 HG23 ILE 12 3.197 -8.287 8.451 795 HD11 ILE 12 HD11 ILE 12 1.924 -7.751 6.009 796 HD12 ILE 12 HD12 ILE 12 3.679 -7.582 6.097 797 HD13 ILE 12 HD13 ILE 12 2.756 -6.442 5.175 798 H ASN 13 H ASN 13 -0.454 -5.855 10.168 799 HA ASN 13 HA ASN 13 -1.070 -8.247 11.483 800 HB2 ASN 13 HB3 ASN 13 -1.888 -5.398 11.991 801 HB3 ASN 13 HB2 ASN 13 -2.457 -6.711 13.005 802 HD21 ASN 13 HD21 ASN 13 0.320 -4.779 12.198 803 HD22 ASN 13 HD22 ASN 13 1.367 -5.452 13.336 804 H VAL 14 H VAL 14 -3.218 -5.936 9.849 805 HA VAL 14 HA VAL 14 -5.554 -7.490 10.312 806 HB VAL 14 HB VAL 14 -6.574 -6.061 8.529 807 HG11 VAL 14 HG11 VAL 14 -6.798 -4.237 9.910 808 HG12 VAL 14 HG12 VAL 14 -5.089 -4.213 10.363 809 HG13 VAL 14 HG13 VAL 14 -6.169 -5.420 11.046 810 HG21 VAL 14 HG21 VAL 14 -3.881 -4.650 8.448 811 HG22 VAL 14 HG22 VAL 14 -5.333 -4.270 7.542 812 HG23 VAL 14 HG23 VAL 14 -4.466 -5.737 7.178 813 H PHE 15 H PHE 15 -3.159 -7.329 7.779 814 HA PHE 15 HA PHE 15 -4.391 -9.008 5.896 815 HB2 PHE 15 HB3 PHE 15 -2.351 -7.658 5.455 816 HB3 PHE 15 HB2 PHE 15 -1.430 -8.721 6.505 817 HD1 PHE 15 HD1 PHE 15 -3.391 -8.584 3.362 818 HD2 PHE 15 HD2 PHE 15 -0.684 -10.887 5.793 819 HE1 PHE 15 HE1 PHE 15 -3.032 -10.156 1.488 820 HE2 PHE 15 HE2 PHE 15 -0.348 -12.447 3.917 821 HZ PHE 15 HZ PHE 15 -1.502 -12.094 1.782 822 H HIS 16 H HIS 16 -2.135 -9.776 8.558 823 HA HIS 16 HA HIS 16 -2.284 -12.598 8.208 824 HB2 HIS 16 HB3 HIS 16 -1.181 -10.825 10.308 825 HB3 HIS 16 HB2 HIS 16 -1.640 -12.444 10.812 826 HD1 HIS 16 HD1 HIS 16 -0.556 -14.466 9.458 827 HD2 HIS 16 HD2 HIS 16 1.184 -10.732 8.826 828 HE1 HIS 16 HE1 HIS 16 1.704 -14.902 8.395 829 HE2 HIS 16 HE2 HIS 16 2.785 -12.643 8.025 830 H ALA 17 H ALA 17 -4.093 -10.335 10.195 831 HA ALA 17 HA ALA 17 -5.504 -12.160 11.758 832 HB1 ALA 17 HB1 ALA 17 -5.619 -9.568 11.789 833 HB2 ALA 17 HB2 ALA 17 -7.094 -10.446 12.128 834 HB3 ALA 17 HB3 ALA 17 -6.842 -9.737 10.536 835 H HIS 18 H HIS 18 -6.250 -10.853 8.565 836 HA HIS 18 HA HIS 18 -8.483 -12.591 8.169 837 HB2 HIS 18 HB3 HIS 18 -6.974 -10.808 6.284 838 HB3 HIS 18 HB2 HIS 18 -8.396 -11.758 5.820 839 HD1 HIS 18 HD1 HIS 18 -10.670 -11.268 7.327 840 HD2 HIS 18 HD2 HIS 18 -7.617 -8.408 7.607 841 HE1 HIS 18 HE1 HIS 18 -11.663 -9.240 8.395 842 HE2 HIS 18 HE2 HIS 18 -9.832 -7.502 8.597 843 H SER 19 H SER 19 -5.043 -12.770 7.243 844 HA SER 19 HA SER 19 -5.173 -14.915 5.445 845 HB2 SER 19 HB3 SER 19 -3.075 -14.374 7.564 846 HB3 SER 19 HB2 SER 19 -2.857 -15.488 6.237 847 HG SER 19 HG SER 19 -3.624 -13.347 5.057 848 H GLY 20 H GLY 20 -5.323 -14.922 8.927 849 HA2 GLY 20 HA3 GLY 20 -5.128 -17.675 9.410 850 HA3 GLY 20 HA2 GLY 20 -6.000 -16.523 10.416 851 H LYS 21 H LYS 21 -7.736 -15.765 8.077 852 HA LYS 21 HA LYS 21 -9.893 -17.497 8.732 853 HB2 LYS 21 HB3 LYS 21 -9.614 -15.593 6.391 854 HB3 LYS 21 HB2 LYS 21 -11.115 -16.290 6.985 855 HG2 LYS 21 HG3 LYS 21 -9.281 -14.560 8.662 856 HG3 LYS 21 HG2 LYS 21 -10.694 -13.953 7.828 857 HD2 LYS 21 HD3 LYS 21 -12.108 -15.560 9.147 858 HD3 LYS 21 HD2 LYS 21 -10.671 -16.067 10.010 859 HE2 LYS 21 HE2 LYS 21 -11.624 -14.397 11.399 860 HE3 LYS 21 HE1 LYS 21 -10.274 -13.655 10.588 861 HZ1 LYS 21 HZ1 LYS 21 -12.097 -12.162 10.434 862 HZ2 LYS 21 HZ2 LYS 21 -13.131 -13.344 9.853 863 HZ3 LYS 21 HZ3 LYS 21 -11.911 -12.739 8.854 864 H GLU 22 H GLU 22 -7.887 -17.176 5.809 865 HA GLU 22 HA GLU 22 -9.103 -19.578 4.706 866 HB2 GLU 22 HB3 GLU 22 -7.943 -19.056 2.647 867 HB3 GLU 22 HB2 GLU 22 -8.663 -17.607 3.269 868 HG2 GLU 22 HG3 GLU 22 -6.264 -17.373 4.520 869 HG3 GLU 22 HG2 GLU 22 -5.779 -18.267 3.073 870 H GLY 23 H GLY 23 -6.029 -18.495 6.025 871 HA2 GLY 23 HA3 GLY 23 -4.452 -19.721 7.157 872 HA3 GLY 23 HA2 GLY 23 -5.406 -21.166 6.869 873 H ASP 24 H ASP 24 -4.421 -19.251 4.110 874 HA ASP 24 HA ASP 24 -3.015 -21.408 2.915 875 HB2 ASP 24 HB3 ASP 24 -3.849 -19.440 1.599 876 HB3 ASP 24 HB2 ASP 24 -2.624 -18.450 2.370 877 H LYS 25 H LYS 25 -1.971 -18.562 4.625 878 HA LYS 25 HA LYS 25 -0.303 -19.428 6.409 879 HB2 LYS 25 HB3 LYS 25 2.019 -19.202 5.509 880 HB3 LYS 25 HB2 LYS 25 1.203 -20.678 5.015 881 HG2 LYS 25 HG3 LYS 25 0.544 -19.017 2.900 882 HG3 LYS 25 HG2 LYS 25 2.108 -18.354 3.385 883 HD2 LYS 25 HD3 LYS 25 2.745 -20.975 3.417 884 HD3 LYS 25 HD2 LYS 25 1.440 -21.004 2.246 885 HE2 LYS 25 HE2 LYS 25 2.851 -20.253 0.651 886 HE3 LYS 25 HE1 LYS 25 3.036 -18.756 1.531 887 HZ1 LYS 25 HZ1 LYS 25 5.054 -19.299 2.171 888 HZ2 LYS 25 HZ2 LYS 25 5.026 -20.590 1.100 889 HZ3 LYS 25 HZ3 LYS 25 4.600 -20.816 2.741 890 H TYR 26 H TYR 26 0.494 -17.279 3.767 891 HA TYR 26 HA TYR 26 -0.314 -15.033 5.391 892 HB2 TYR 26 HB3 TYR 26 1.633 -13.782 4.079 893 HB3 TYR 26 HB2 TYR 26 1.889 -14.468 5.667 894 HD1 TYR 26 HD1 TYR 26 2.962 -16.644 5.923 895 HD2 TYR 26 HD2 TYR 26 2.677 -14.760 2.100 896 HE1 TYR 26 HE1 TYR 26 4.716 -18.186 5.038 897 HE2 TYR 26 HE2 TYR 26 4.405 -16.267 1.200 898 HH TYR 26 HH TYR 26 6.512 -17.769 2.630 899 H LYS 27 H LYS 27 -2.142 -14.906 4.293 900 HA LYS 27 HA LYS 27 -2.011 -13.997 1.548 901 HB2 LYS 27 HB3 LYS 27 -3.367 -16.530 2.412 902 HB3 LYS 27 HB2 LYS 27 -3.881 -15.640 1.012 903 HG2 LYS 27 HG3 LYS 27 -1.107 -16.813 1.447 904 HG3 LYS 27 HG2 LYS 27 -2.405 -17.323 0.351 905 HD2 LYS 27 HD3 LYS 27 -2.295 -14.840 -0.520 906 HD3 LYS 27 HD2 LYS 27 -0.704 -14.856 0.169 907 HE2 LYS 27 HE2 LYS 27 -1.395 -15.807 -2.336 908 HE3 LYS 27 HE1 LYS 27 0.152 -15.984 -1.521 909 HZ1 LYS 27 HZ1 LYS 27 -0.527 -18.214 -2.017 910 HZ2 LYS 27 HZ2 LYS 27 -2.123 -17.908 -1.666 911 HZ3 LYS 27 HZ3 LYS 27 -1.018 -18.090 -0.410 912 H LEU 28 H LEU 28 -4.001 -13.160 0.852 913 HA LEU 28 HA LEU 28 -5.996 -13.005 2.931 914 HB2 LEU 28 HB3 LEU 28 -4.989 -10.886 2.908 915 HB3 LEU 28 HB2 LEU 28 -5.075 -10.757 1.137 916 HG LEU 28 HG LEU 28 -7.603 -10.997 1.392 917 HD11 LEU 28 HD11 LEU 28 -7.624 -11.947 3.663 918 HD12 LEU 28 HD12 LEU 28 -8.524 -10.426 3.601 919 HD13 LEU 28 HD13 LEU 28 -6.881 -10.453 4.255 920 HD21 LEU 28 HD21 LEU 28 -6.138 -8.639 2.587 921 HD22 LEU 28 HD22 LEU 28 -7.872 -8.667 2.300 922 HD23 LEU 28 HD23 LEU 28 -6.760 -8.803 0.934 923 H SER 29 H SER 29 -7.608 -14.126 2.209 924 HA SER 29 HA SER 29 -7.826 -14.688 -0.576 925 HB2 SER 29 HB3 SER 29 -9.844 -16.047 0.176 926 HB3 SER 29 HB2 SER 29 -8.269 -16.524 0.757 927 HG SER 29 HG SER 29 -8.673 -15.486 2.680 928 H LYS 30 H LYS 30 -9.978 -14.561 -1.666 929 HA LYS 30 HA LYS 30 -10.795 -11.804 -1.595 930 HB2 LYS 30 HB3 LYS 30 -12.174 -14.016 -3.115 931 HB3 LYS 30 HB2 LYS 30 -12.166 -12.301 -3.485 932 HG2 LYS 30 HG3 LYS 30 -9.854 -14.260 -3.740 933 HG3 LYS 30 HG2 LYS 30 -10.599 -13.300 -5.001 934 HD2 LYS 30 HD3 LYS 30 -9.113 -12.032 -2.656 935 HD3 LYS 30 HD2 LYS 30 -8.353 -12.428 -4.176 936 HE2 LYS 30 HE2 LYS 30 -10.656 -10.503 -3.765 937 HE3 LYS 30 HE1 LYS 30 -9.033 -10.112 -4.304 938 HZ1 LYS 30 HZ1 LYS 30 -11.251 -10.895 -5.835 939 HZ2 LYS 30 HZ2 LYS 30 -10.039 -12.076 -6.067 940 HZ3 LYS 30 HZ3 LYS 30 -9.719 -10.446 -6.361 941 H LYS 31 H LYS 31 -11.540 -14.377 0.270 942 HA LYS 31 HA LYS 31 -14.335 -14.064 0.760 943 HB2 LYS 31 HB3 LYS 31 -12.357 -14.935 2.942 944 HB3 LYS 31 HB2 LYS 31 -14.004 -15.408 2.630 945 HG2 LYS 31 HG3 LYS 31 -13.332 -16.755 0.702 946 HG3 LYS 31 HG2 LYS 31 -11.742 -16.055 0.768 947 HD2 LYS 31 HD3 LYS 31 -11.394 -16.987 3.018 948 HD3 LYS 31 HD2 LYS 31 -12.935 -17.822 2.910 949 HE2 LYS 31 HE2 LYS 31 -10.840 -18.104 0.779 950 HE3 LYS 31 HE1 LYS 31 -10.783 -19.119 2.202 951 HZ1 LYS 31 HZ1 LYS 31 -12.423 -19.353 -0.092 952 HZ2 LYS 31 HZ2 LYS 31 -13.416 -19.240 1.292 953 HZ3 LYS 31 HZ3 LYS 31 -12.214 -20.422 1.176 954 H GLU 32 H GLU 32 -11.604 -13.259 2.864 955 HA GLU 32 HA GLU 32 -12.964 -11.355 4.443 956 HB2 GLU 32 HB3 GLU 32 -10.038 -12.028 4.132 957 HB3 GLU 32 HB2 GLU 32 -10.739 -11.029 5.405 958 HG2 GLU 32 HG3 GLU 32 -11.574 -13.895 4.858 959 HG3 GLU 32 HG2 GLU 32 -10.343 -13.459 6.009 960 H LEU 33 H LEU 33 -10.750 -11.163 1.709 961 HA LEU 33 HA LEU 33 -9.835 -8.613 2.038 962 HB2 LEU 33 HB3 LEU 33 -8.860 -10.090 0.369 963 HB3 LEU 33 HB2 LEU 33 -10.371 -10.132 -0.518 964 HG LEU 33 HG LEU 33 -8.384 -8.638 -1.348 965 HD11 LEU 33 HD11 LEU 33 -11.024 -7.195 -1.275 966 HD12 LEU 33 HD12 LEU 33 -10.873 -8.732 -2.120 967 HD13 LEU 33 HD13 LEU 33 -9.881 -7.373 -2.592 968 HD21 LEU 33 HD21 LEU 33 -8.624 -7.380 1.125 969 HD22 LEU 33 HD22 LEU 33 -9.629 -6.377 0.105 970 HD23 LEU 33 HD23 LEU 33 -7.960 -6.658 -0.332 971 H LYS 34 H LYS 34 -12.727 -9.587 0.250 972 HA LYS 34 HA LYS 34 -13.406 -6.982 -0.642 973 HB2 LYS 34 HB3 LYS 34 -15.187 -9.294 0.013 974 HB3 LYS 34 HB2 LYS 34 -15.656 -7.912 -0.965 975 HG2 LYS 34 HG3 LYS 34 -13.844 -8.471 -2.581 976 HG3 LYS 34 HG2 LYS 34 -13.458 -9.920 -1.679 977 HD2 LYS 34 HD3 LYS 34 -15.925 -9.287 -3.281 978 HD3 LYS 34 HD2 LYS 34 -14.892 -10.699 -3.380 979 HE2 LYS 34 HE2 LYS 34 -17.052 -10.074 -1.364 980 HE3 LYS 34 HE1 LYS 34 -16.799 -11.530 -2.301 981 HZ1 LYS 34 HZ1 LYS 34 -15.792 -10.924 0.333 982 HZ2 LYS 34 HZ2 LYS 34 -14.517 -11.429 -0.725 983 HZ3 LYS 34 HZ3 LYS 34 -15.852 -12.362 -0.505 984 H GLU 35 H GLU 35 -14.451 -8.919 2.164 985 HA GLU 35 HA GLU 35 -16.166 -6.910 3.178 986 HB2 GLU 35 HB3 GLU 35 -15.057 -9.417 4.464 987 HB3 GLU 35 HB2 GLU 35 -16.147 -8.314 5.288 988 HG2 GLU 35 HG3 GLU 35 -17.713 -9.715 4.396 989 HG3 GLU 35 HG2 GLU 35 -17.585 -8.599 3.037 990 H LEU 36 H LEU 36 -12.861 -7.856 4.028 991 HA LEU 36 HA LEU 36 -12.641 -6.002 6.155 992 HB2 LEU 36 HB3 LEU 36 -10.714 -7.028 6.512 993 HB3 LEU 36 HB2 LEU 36 -11.010 -8.051 5.135 994 HG LEU 36 HG LEU 36 -9.922 -6.098 3.743 995 HD11 LEU 36 HD11 LEU 36 -8.439 -5.485 6.258 996 HD12 LEU 36 HD12 LEU 36 -9.984 -4.697 6.021 997 HD13 LEU 36 HD13 LEU 36 -8.696 -4.489 4.832 998 HD21 LEU 36 HD21 LEU 36 -7.829 -7.121 3.936 999 HD22 LEU 36 HD22 LEU 36 -8.930 -8.404 4.449 1000 HD23 LEU 36 HD23 LEU 36 -8.033 -7.479 5.640 1001 H LEU 37 H LEU 37 -11.840 -5.767 2.727 1002 HA LEU 37 HA LEU 37 -10.591 -3.282 2.922 1003 HB2 LEU 37 HB3 LEU 37 -10.330 -4.650 0.926 1004 HB3 LEU 37 HB2 LEU 37 -12.039 -4.553 0.576 1005 HG LEU 37 HG LEU 37 -10.431 -3.035 -0.752 1006 HD11 LEU 37 HD11 LEU 37 -13.085 -2.774 -0.154 1007 HD12 LEU 37 HD12 LEU 37 -12.195 -1.787 -1.302 1008 HD13 LEU 37 HD13 LEU 37 -12.445 -1.203 0.341 1009 HD21 LEU 37 HD21 LEU 37 -10.695 -1.047 1.458 1010 HD22 LEU 37 HD22 LEU 37 -9.477 -1.193 0.200 1011 HD23 LEU 37 HD23 LEU 37 -9.402 -2.246 1.599 1012 H GLN 38 H GLN 38 -13.982 -4.083 2.192 1013 HA GLN 38 HA GLN 38 -14.786 -1.361 2.027 1014 HB2 GLN 38 HB3 GLN 38 -17.091 -2.187 2.204 1015 HB3 GLN 38 HB2 GLN 38 -16.181 -3.192 1.094 1016 HG2 GLN 38 HG3 GLN 38 -15.833 -4.862 2.839 1017 HG3 GLN 38 HG2 GLN 38 -16.723 -3.890 4.017 1018 HE21 GLN 38 HE21 GLN 38 -18.785 -4.725 4.260 1019 HE22 GLN 38 HE22 GLN 38 -19.731 -5.380 3.023 1020 H THR 39 H THR 39 -14.647 -3.706 4.637 1021 HA THR 39 HA THR 39 -15.928 -2.156 6.611 1022 HB THR 39 HB THR 39 -13.878 -4.349 6.862 1023 HG1 THR 39 HG2 THR 39 -15.596 -5.115 5.860 1024 HG21 THR 39 HG21 THR 39 -14.877 -4.654 9.137 1025 HG22 THR 39 HG22 THR 39 -15.723 -3.105 8.928 1026 HG23 THR 39 HG23 THR 39 -13.965 -3.175 8.919 1027 H GLU 40 H GLU 40 -12.399 -2.659 6.092 1028 HA GLU 40 HA GLU 40 -11.693 -0.841 8.158 1029 HB2 GLU 40 HB3 GLU 40 -10.073 -2.014 5.895 1030 HB3 GLU 40 HB2 GLU 40 -9.438 -0.972 7.164 1031 HG2 GLU 40 HG3 GLU 40 -10.912 -3.561 7.730 1032 HG3 GLU 40 HG2 GLU 40 -9.157 -3.447 7.636 1033 H LEU 41 H LEU 41 -12.043 -0.473 4.670 1034 HA LEU 41 HA LEU 41 -11.292 2.361 4.939 1035 HB2 LEU 41 HB3 LEU 41 -11.541 0.499 2.582 1036 HB3 LEU 41 HB2 LEU 41 -11.644 2.209 2.339 1037 HG LEU 41 HG LEU 41 -9.431 2.491 3.594 1038 HD11 LEU 41 HD11 LEU 41 -9.379 0.533 4.905 1039 HD12 LEU 41 HD12 LEU 41 -8.044 0.429 3.759 1040 HD13 LEU 41 HD13 LEU 41 -9.504 -0.515 3.489 1041 HD21 LEU 41 HD21 LEU 41 -9.226 0.627 1.203 1042 HD22 LEU 41 HD22 LEU 41 -8.075 1.862 1.709 1043 HD23 LEU 41 HD23 LEU 41 -9.631 2.336 1.052 1044 H SER 42 H SER 42 -13.684 1.494 6.145 1045 HA SER 42 HA SER 42 -15.960 1.771 4.605 1046 HB2 SER 42 HB3 SER 42 -15.496 2.452 7.516 1047 HB3 SER 42 HB2 SER 42 -17.071 2.501 6.774 1048 HG SER 42 HG SER 42 -15.411 0.307 7.379 1049 H GLY 43 H GLY 43 -14.084 4.329 6.230 1050 HA2 GLY 43 HA3 GLY 43 -15.799 6.457 5.468 1051 HA3 GLY 43 HA2 GLY 43 -14.133 6.613 6.009 1052 H PHE 44 H PHE 44 -12.816 5.121 4.134 1053 HA PHE 44 HA PHE 44 -12.673 6.910 1.887 1054 HB2 PHE 44 HB3 PHE 44 -11.446 4.224 2.459 1055 HB3 PHE 44 HB2 PHE 44 -11.307 4.930 0.861 1056 HD1 PHE 44 HD2 PHE 44 -11.181 7.935 2.472 1057 HD2 PHE 44 HD1 PHE 44 -8.933 4.230 2.467 1058 HE1 PHE 44 HE2 PHE 44 -9.224 9.108 3.208 1059 HE2 PHE 44 HE1 PHE 44 -6.958 5.464 3.217 1060 HZ PHE 44 HZ PHE 44 -7.088 7.920 3.598 1061 H LEU 45 H LEU 45 -14.061 3.745 2.337 1062 HA LEU 45 HA LEU 45 -14.913 3.344 -0.292 1063 HB2 LEU 45 HB3 LEU 45 -15.086 1.431 1.015 1064 HB3 LEU 45 HB2 LEU 45 -15.699 2.317 2.397 1065 HG LEU 45 HG LEU 45 -17.821 2.630 1.373 1066 HD11 LEU 45 HD11 LEU 45 -17.889 0.886 -0.863 1067 HD12 LEU 45 HD12 LEU 45 -16.425 1.858 -1.076 1068 HD13 LEU 45 HD13 LEU 45 -17.987 2.639 -0.836 1069 HD21 LEU 45 HD21 LEU 45 -18.578 0.576 1.970 1070 HD22 LEU 45 HD22 LEU 45 -16.897 0.277 2.387 1071 HD23 LEU 45 HD23 LEU 45 -17.536 -0.282 0.841 1072 H ASP 46 H ASP 46 -16.564 4.827 2.472 1073 HA ASP 46 HA ASP 46 -18.939 5.448 1.055 1074 HB2 ASP 46 HB3 ASP 46 -18.743 5.330 3.491 1075 HB3 ASP 46 HB2 ASP 46 -17.875 6.864 3.495 1076 H ALA 47 H ALA 47 -15.994 7.223 1.648 1077 HA ALA 47 HA ALA 47 -16.856 9.745 0.871 1078 HB1 ALA 47 HB1 ALA 47 -14.850 9.942 1.897 1079 HB2 ALA 47 HB2 ALA 47 -14.307 9.968 0.240 1080 HB3 ALA 47 HB3 ALA 47 -14.198 8.467 1.173 1081 H GLN 48 H GLN 48 -15.511 7.180 -1.129 1082 HA GLN 48 HA GLN 48 -16.078 8.862 -3.505 1083 HB2 GLN 48 HB3 GLN 48 -14.122 7.362 -4.521 1084 HB3 GLN 48 HB2 GLN 48 -13.758 8.849 -3.633 1085 HG2 GLN 48 HG3 GLN 48 -12.328 7.317 -2.646 1086 HG3 GLN 48 HG2 GLN 48 -13.684 7.204 -1.552 1087 HE21 GLN 48 HE21 GLN 48 -14.823 5.183 -1.481 1088 HE22 GLN 48 HE22 GLN 48 -14.382 3.853 -2.429 1089 H LYS 49 H LYS 49 -18.022 7.235 -2.556 1090 HA LYS 49 HA LYS 49 -18.132 4.674 -3.813 1091 HB2 LYS 49 HB3 LYS 49 -20.348 6.595 -3.065 1092 HB3 LYS 49 HB2 LYS 49 -20.610 4.942 -3.590 1093 HG2 LYS 49 HG3 LYS 49 -19.159 4.150 -1.682 1094 HG3 LYS 49 HG2 LYS 49 -19.086 5.814 -1.115 1095 HD2 LYS 49 HD3 LYS 49 -21.651 4.231 -1.478 1096 HD3 LYS 49 HD2 LYS 49 -20.857 4.465 0.068 1097 HE2 LYS 49 HE2 LYS 49 -21.952 6.718 -1.686 1098 HE3 LYS 49 HE1 LYS 49 -22.707 6.031 -0.266 1099 HZ1 LYS 49 HZ1 LYS 49 -21.463 8.075 0.128 1100 HZ2 LYS 49 HZ2 LYS 49 -19.998 7.321 -0.130 1101 HZ3 LYS 49 HZ3 LYS 49 -21.023 6.845 1.152 1102 H ASP 50 H ASP 50 -18.981 7.916 -4.711 1103 HA ASP 50 HA ASP 50 -20.259 7.436 -7.161 1104 HB2 ASP 50 HB3 ASP 50 -20.561 9.538 -6.111 1105 HB3 ASP 50 HB2 ASP 50 -18.840 9.862 -6.099 1106 H VAL 51 H VAL 51 -16.853 7.646 -6.410 1107 HA VAL 51 HA VAL 51 -15.985 8.398 -8.961 1108 HB VAL 51 HB VAL 51 -14.407 6.712 -6.994 1109 HG11 VAL 51 HG11 VAL 51 -13.579 8.769 -9.076 1110 HG12 VAL 51 HG12 VAL 51 -13.400 7.034 -9.283 1111 HG13 VAL 51 HG13 VAL 51 -12.485 7.878 -8.035 1112 HG21 VAL 51 HG21 VAL 51 -14.834 9.712 -7.152 1113 HG22 VAL 51 HG22 VAL 51 -13.609 8.943 -6.162 1114 HG23 VAL 51 HG23 VAL 51 -15.320 8.667 -5.816 1115 H ASP 52 H ASP 52 -17.111 5.396 -7.742 1116 HA ASP 52 HA ASP 52 -17.521 3.373 -8.779 1117 HB2 ASP 52 HB3 ASP 52 -17.704 5.159 -10.873 1118 HB3 ASP 52 HB2 ASP 52 -16.425 4.085 -11.410 1119 H ALA 53 H ALA 53 -14.509 4.987 -8.900 1120 HA ALA 53 HA ALA 53 -12.831 2.970 -9.900 1121 HB1 ALA 53 HB1 ALA 53 -11.066 4.108 -8.531 1122 HB2 ALA 53 HB2 ALA 53 -12.305 5.172 -7.881 1123 HB3 ALA 53 HB3 ALA 53 -11.937 5.185 -9.618 1124 H VAL 54 H VAL 54 -14.187 3.615 -6.735 1125 HA VAL 54 HA VAL 54 -12.731 1.695 -5.296 1126 HB VAL 54 HB VAL 54 -14.082 3.374 -4.178 1127 HG11 VAL 54 HG11 VAL 54 -16.018 3.311 -5.864 1128 HG12 VAL 54 HG12 VAL 54 -16.447 3.424 -4.174 1129 HG13 VAL 54 HG13 VAL 54 -16.570 1.879 -4.988 1130 HG21 VAL 54 HG21 VAL 54 -15.643 1.349 -2.981 1131 HG22 VAL 54 HG22 VAL 54 -14.072 1.903 -2.432 1132 HG23 VAL 54 HG23 VAL 54 -14.190 0.526 -3.530 1133 H ASP 55 H ASP 55 -15.738 1.487 -7.094 1134 HA ASP 55 HA ASP 55 -16.310 -1.261 -6.608 1135 HB2 ASP 55 HB3 ASP 55 -17.975 0.228 -7.634 1136 HB3 ASP 55 HB2 ASP 55 -16.940 0.434 -9.047 1137 H LYS 56 H LYS 56 -14.665 0.395 -9.192 1138 HA LYS 56 HA LYS 56 -13.848 -1.898 -10.594 1139 HB2 LYS 56 HB3 LYS 56 -12.932 0.955 -10.645 1140 HB3 LYS 56 HB2 LYS 56 -12.327 -0.268 -11.769 1141 HG2 LYS 56 HG3 LYS 56 -14.587 -0.794 -12.543 1142 HG3 LYS 56 HG2 LYS 56 -15.272 0.303 -11.349 1143 HD2 LYS 56 HD3 LYS 56 -14.379 2.198 -12.437 1144 HD3 LYS 56 HD2 LYS 56 -13.408 1.230 -13.560 1145 HE2 LYS 56 HE2 LYS 56 -15.711 2.197 -14.369 1146 HE3 LYS 56 HE1 LYS 56 -15.313 0.537 -14.773 1147 HZ1 LYS 56 HZ1 LYS 56 -16.603 -0.166 -12.778 1148 HZ2 LYS 56 HZ2 LYS 56 -17.524 0.661 -13.926 1149 HZ3 LYS 56 HZ3 LYS 56 -17.082 1.443 -12.514 1150 H VAL 57 H VAL 57 -12.205 0.050 -8.142 1151 HA VAL 57 HA VAL 57 -9.697 -1.234 -8.326 1152 HB VAL 57 HB VAL 57 -11.041 0.207 -6.029 1153 HG11 VAL 57 HG11 VAL 57 -8.410 0.378 -5.441 1154 HG12 VAL 57 HG12 VAL 57 -8.423 -1.219 -6.186 1155 HG13 VAL 57 HG13 VAL 57 -9.448 -0.879 -4.791 1156 HG21 VAL 57 HG21 VAL 57 -9.996 2.121 -6.789 1157 HG22 VAL 57 HG22 VAL 57 -10.166 1.314 -8.344 1158 HG23 VAL 57 HG23 VAL 57 -8.637 1.247 -7.470 1159 H MET 58 H MET 58 -12.520 -1.858 -6.217 1160 HA MET 58 HA MET 58 -11.336 -4.145 -5.002 1161 HB2 MET 58 HB3 MET 58 -13.538 -4.695 -4.150 1162 HB3 MET 58 HB2 MET 58 -13.319 -2.964 -4.005 1163 HG2 MET 58 HG3 MET 58 -14.624 -2.595 -6.017 1164 HG3 MET 58 HG2 MET 58 -14.841 -4.336 -6.252 1165 HE1 MET 58 HE1 MET 58 -18.108 -4.273 -5.519 1166 HE2 MET 58 HE2 MET 58 -17.004 -3.516 -6.649 1167 HE3 MET 58 HE3 MET 58 -17.963 -2.512 -5.569 1168 H LYS 59 H LYS 59 -13.254 -3.637 -7.854 1169 HA LYS 59 HA LYS 59 -13.445 -6.346 -8.690 1170 HB2 LYS 59 HB3 LYS 59 -14.742 -4.645 -9.889 1171 HB3 LYS 59 HB2 LYS 59 -13.231 -3.845 -10.363 1172 HG2 LYS 59 HG3 LYS 59 -12.566 -5.665 -11.601 1173 HG3 LYS 59 HG2 LYS 59 -13.827 -6.717 -11.002 1174 HD2 LYS 59 HD3 LYS 59 -15.515 -5.163 -12.085 1175 HD3 LYS 59 HD2 LYS 59 -14.159 -4.204 -12.657 1176 HE2 LYS 59 HE2 LYS 59 -14.763 -5.676 -14.438 1177 HE3 LYS 59 HE1 LYS 59 -13.222 -6.133 -13.674 1178 HZ1 LYS 59 HZ1 LYS 59 -15.490 -7.782 -13.966 1179 HZ2 LYS 59 HZ2 LYS 59 -15.251 -7.564 -12.317 1180 HZ3 LYS 59 HZ3 LYS 59 -13.996 -8.148 -13.315 1181 H GLU 60 H GLU 60 -10.981 -3.867 -9.274 1182 HA GLU 60 HA GLU 60 -9.371 -5.335 -10.957 1183 HB2 GLU 60 HB3 GLU 60 -9.047 -3.099 -9.149 1184 HB3 GLU 60 HB2 GLU 60 -7.504 -3.919 -9.437 1185 HG2 GLU 60 HG3 GLU 60 -9.313 -3.231 -11.757 1186 HG3 GLU 60 HG2 GLU 60 -8.335 -1.964 -11.035 1187 H LEU 61 H LEU 61 -9.534 -5.338 -7.438 1188 HA LEU 61 HA LEU 61 -7.524 -7.329 -7.088 1189 HB2 LEU 61 HB3 LEU 61 -9.644 -6.201 -5.295 1190 HB3 LEU 61 HB2 LEU 61 -8.842 -7.696 -4.830 1191 HG LEU 61 HG LEU 61 -7.771 -5.560 -3.969 1192 HD11 LEU 61 HD11 LEU 61 -6.578 -7.790 -4.124 1193 HD12 LEU 61 HD12 LEU 61 -5.535 -6.387 -4.219 1194 HD13 LEU 61 HD13 LEU 61 -5.926 -7.261 -5.675 1195 HD21 LEU 61 HD21 LEU 61 -6.419 -4.233 -5.464 1196 HD22 LEU 61 HD22 LEU 61 -8.020 -4.323 -6.185 1197 HD23 LEU 61 HD23 LEU 61 -6.709 -5.326 -6.810 1198 H ASP 62 H ASP 62 -10.980 -7.446 -7.650 1199 HA ASP 62 HA ASP 62 -11.038 -10.338 -7.479 1200 HB2 ASP 62 HB3 ASP 62 -13.057 -8.328 -8.417 1201 HB3 ASP 62 HB2 ASP 62 -13.214 -10.032 -8.828 1202 H GLU 63 H GLU 63 -10.400 -8.113 -9.991 1203 HA GLU 63 HA GLU 63 -10.319 -10.016 -12.104 1204 HB2 GLU 63 HB3 GLU 63 -8.763 -7.448 -11.712 1205 HB3 GLU 63 HB2 GLU 63 -8.773 -8.381 -13.192 1206 HG2 GLU 63 HG3 GLU 63 -11.277 -7.281 -11.883 1207 HG3 GLU 63 HG2 GLU 63 -10.386 -6.470 -13.161 1208 H ASN 64 H ASN 64 -7.661 -8.628 -10.199 1209 HA ASN 64 HA ASN 64 -5.738 -10.585 -11.096 1210 HB2 ASN 64 HB3 ASN 64 -5.388 -8.149 -10.091 1211 HB3 ASN 64 HB2 ASN 64 -5.346 -9.100 -8.592 1212 HD21 ASN 64 HD21 ASN 64 -3.250 -7.865 -10.826 1213 HD22 ASN 64 HD22 ASN 64 -2.010 -8.998 -10.721 1214 H GLY 65 H GLY 65 -7.440 -9.998 -8.035 1215 HA2 GLY 65 HA3 GLY 65 -6.341 -12.262 -6.699 1216 HA3 GLY 65 HA2 GLY 65 -7.664 -11.273 -6.128 1217 H ASP 66 H ASP 66 -7.341 -13.094 -9.146 1218 HA ASP 66 HA ASP 66 -9.998 -14.087 -9.028 1219 HB2 ASP 66 HB3 ASP 66 -8.275 -13.976 -11.018 1220 HB3 ASP 66 HB2 ASP 66 -7.787 -15.549 -10.435 1221 H GLY 67 H GLY 67 -6.896 -15.172 -7.970 1222 HA2 GLY 67 HA3 GLY 67 -8.045 -17.643 -6.814 1223 HA3 GLY 67 HA2 GLY 67 -6.341 -17.370 -7.124 1224 H GLU 68 H GLU 68 -5.336 -15.563 -5.922 1225 HA GLU 68 HA GLU 68 -6.457 -15.058 -3.252 1226 HB2 GLU 68 HB3 GLU 68 -3.884 -16.512 -3.809 1227 HB3 GLU 68 HB2 GLU 68 -4.162 -15.675 -2.292 1228 HG2 GLU 68 HG3 GLU 68 -6.016 -16.988 -1.750 1229 HG3 GLU 68 HG2 GLU 68 -6.148 -17.769 -3.309 1230 H VAL 69 H VAL 69 -5.368 -13.359 -2.074 1231 HA VAL 69 HA VAL 69 -3.646 -11.667 -3.741 1232 HB VAL 69 HB VAL 69 -5.597 -10.429 -3.891 1233 HG11 VAL 69 HG11 VAL 69 -7.306 -10.211 -2.266 1234 HG12 VAL 69 HG12 VAL 69 -6.281 -10.816 -0.973 1235 HG13 VAL 69 HG13 VAL 69 -6.881 -11.923 -2.214 1236 HG21 VAL 69 HG21 VAL 69 -5.334 -8.893 -1.536 1237 HG22 VAL 69 HG22 VAL 69 -4.657 -8.538 -3.088 1238 HG23 VAL 69 HG23 VAL 69 -3.699 -9.416 -1.900 1239 H ASP 70 H ASP 70 -1.785 -11.094 -2.820 1240 HA ASP 70 HA ASP 70 -1.379 -11.935 -0.068 1241 HB2 ASP 70 HB3 ASP 70 0.907 -11.954 -0.440 1242 HB3 ASP 70 HB2 ASP 70 0.276 -12.483 -1.986 1243 H PHE 71 H PHE 71 0.589 -10.301 0.718 1244 HA PHE 71 HA PHE 71 -0.798 -8.056 1.712 1245 HB2 PHE 71 HB3 PHE 71 1.159 -9.075 2.830 1246 HB3 PHE 71 HB2 PHE 71 2.196 -8.401 1.568 1247 HD1 PHE 71 HD1 PHE 71 -0.414 -7.389 4.047 1248 HD2 PHE 71 HD2 PHE 71 3.094 -6.208 1.842 1249 HE1 PHE 71 HE1 PHE 71 -0.349 -5.257 5.281 1250 HE2 PHE 71 HE2 PHE 71 3.144 -4.082 3.101 1251 HZ PHE 71 HZ PHE 71 1.437 -3.596 4.809 1252 H GLN 72 H GLN 72 1.613 -8.388 -0.876 1253 HA GLN 72 HA GLN 72 1.730 -5.640 -1.541 1254 HB2 GLN 72 HB3 GLN 72 2.510 -8.169 -2.941 1255 HB3 GLN 72 HB2 GLN 72 2.599 -6.617 -3.809 1256 HG2 GLN 72 HG3 GLN 72 4.086 -5.758 -2.084 1257 HG3 GLN 72 HG2 GLN 72 3.888 -7.242 -1.147 1258 HE21 GLN 72 HE21 GLN 72 4.601 -6.599 -4.640 1259 HE22 GLN 72 HE22 GLN 72 5.959 -7.599 -4.684 1260 H GLU 73 H GLU 73 -0.365 -8.222 -2.713 1261 HA GLU 73 HA GLU 73 -1.734 -6.488 -4.557 1262 HB2 GLU 73 HB3 GLU 73 -2.455 -9.192 -3.394 1263 HB3 GLU 73 HB2 GLU 73 -3.456 -8.310 -4.567 1264 HG2 GLU 73 HG3 GLU 73 -0.563 -9.059 -5.007 1265 HG3 GLU 73 HG2 GLU 73 -1.943 -9.949 -5.617 1266 H TYR 74 H TYR 74 -2.217 -7.526 -1.237 1267 HA TYR 74 HA TYR 74 -4.731 -6.332 -0.778 1268 HB2 TYR 74 HB3 TYR 74 -3.920 -7.983 0.743 1269 HB3 TYR 74 HB2 TYR 74 -2.465 -7.052 1.061 1270 HD1 TYR 74 HD1 TYR 74 -6.158 -6.264 1.051 1271 HD2 TYR 74 HD2 TYR 74 -2.439 -6.168 3.211 1272 HE1 TYR 74 HE1 TYR 74 -7.284 -5.154 2.939 1273 HE2 TYR 74 HE2 TYR 74 -3.576 -5.075 5.111 1274 HH TYR 74 HH TYR 74 -6.723 -5.068 5.602 1275 H VAL 75 H VAL 75 -1.478 -4.997 -0.165 1276 HA VAL 75 HA VAL 75 -2.449 -2.619 0.958 1277 HB VAL 75 HB VAL 75 -0.176 -1.657 0.476 1278 HG11 VAL 75 HG11 VAL 75 -0.966 -3.139 2.487 1279 HG12 VAL 75 HG12 VAL 75 0.749 -2.839 2.260 1280 HG13 VAL 75 HG13 VAL 75 0.054 -4.376 1.753 1281 HG21 VAL 75 HG21 VAL 75 1.119 -4.139 -0.073 1282 HG22 VAL 75 HG22 VAL 75 1.140 -2.685 -1.058 1283 HG23 VAL 75 HG23 VAL 75 -0.081 -3.913 -1.334 1284 H VAL 76 H VAL 76 -1.661 -3.309 -2.446 1285 HA VAL 76 HA VAL 76 -1.919 -0.635 -3.280 1286 HB VAL 76 HB VAL 76 -0.795 -2.347 -4.655 1287 HG11 VAL 76 HG11 VAL 76 -3.584 -3.498 -4.932 1288 HG12 VAL 76 HG12 VAL 76 -2.146 -4.272 -4.285 1289 HG13 VAL 76 HG13 VAL 76 -2.246 -3.904 -6.002 1290 HG21 VAL 76 HG21 VAL 76 -3.196 -1.325 -6.206 1291 HG22 VAL 76 HG22 VAL 76 -1.550 -1.557 -6.778 1292 HG23 VAL 76 HG23 VAL 76 -1.911 -0.248 -5.667 1293 H LEU 77 H LEU 77 -4.275 -3.154 -2.766 1294 HA LEU 77 HA LEU 77 -6.476 -1.954 -4.056 1295 HB2 LEU 77 HB3 LEU 77 -6.521 -4.269 -3.285 1296 HB3 LEU 77 HB2 LEU 77 -6.380 -3.759 -1.627 1297 HG LEU 77 HG LEU 77 -8.578 -2.489 -1.884 1298 HD11 LEU 77 HD11 LEU 77 -9.827 -2.544 -3.756 1299 HD12 LEU 77 HD12 LEU 77 -9.270 -4.125 -4.252 1300 HD13 LEU 77 HD13 LEU 77 -8.278 -2.714 -4.569 1301 HD21 LEU 77 HD21 LEU 77 -8.836 -4.509 -0.753 1302 HD22 LEU 77 HD22 LEU 77 -8.372 -5.493 -2.146 1303 HD23 LEU 77 HD23 LEU 77 -9.946 -4.720 -2.100 1304 H VAL 78 H VAL 78 -5.376 -1.797 -0.686 1305 HA VAL 78 HA VAL 78 -7.340 0.154 -0.008 1306 HB VAL 78 HB VAL 78 -6.153 0.396 2.127 1307 HG11 VAL 78 HG11 VAL 78 -7.159 -2.108 0.986 1308 HG12 VAL 78 HG12 VAL 78 -7.425 -1.428 2.587 1309 HG13 VAL 78 HG13 VAL 78 -6.009 -2.408 2.281 1310 HG21 VAL 78 HG21 VAL 78 -4.129 -0.857 2.586 1311 HG22 VAL 78 HG22 VAL 78 -3.811 0.103 1.149 1312 HG23 VAL 78 HG23 VAL 78 -4.213 -1.628 1.013 1313 H ALA 79 H ALA 79 -3.971 0.277 -0.990 1314 HA ALA 79 HA ALA 79 -3.589 3.060 -0.594 1315 HB1 ALA 79 HB1 ALA 79 -1.656 2.883 -1.768 1316 HB2 ALA 79 HB2 ALA 79 -2.237 1.571 -2.806 1317 HB3 ALA 79 HB3 ALA 79 -1.798 1.248 -1.113 1318 H ALA 80 H ALA 80 -4.676 1.250 -3.437 1319 HA ALA 80 HA ALA 80 -4.821 3.467 -5.124 1320 HB1 ALA 80 HB1 ALA 80 -6.850 1.965 -6.102 1321 HB2 ALA 80 HB2 ALA 80 -6.029 0.744 -5.129 1322 HB3 ALA 80 HB3 ALA 80 -5.159 1.602 -6.390 1323 H LEU 81 H LEU 81 -7.181 2.059 -2.913 1324 HA LEU 81 HA LEU 81 -9.240 3.964 -3.398 1325 HB2 LEU 81 HB3 LEU 81 -8.652 2.219 -1.010 1326 HB3 LEU 81 HB2 LEU 81 -10.085 3.234 -1.158 1327 HG LEU 81 HG LEU 81 -9.311 1.135 -3.209 1328 HD11 LEU 81 HD11 LEU 81 -10.021 -0.340 -1.668 1329 HD12 LEU 81 HD12 LEU 81 -11.627 0.266 -2.027 1330 HD13 LEU 81 HD13 LEU 81 -10.746 0.892 -0.635 1331 HD21 LEU 81 HD21 LEU 81 -10.796 2.369 -4.419 1332 HD22 LEU 81 HD22 LEU 81 -11.437 3.202 -2.996 1333 HD23 LEU 81 HD23 LEU 81 -11.994 1.583 -3.406 1334 H THR 82 H THR 82 -6.556 3.811 -1.086 1335 HA THR 82 HA THR 82 -7.260 6.108 0.385 1336 HB THR 82 HB THR 82 -4.435 5.148 -0.111 1337 HG1 THR 82 HG2 THR 82 -5.894 3.451 0.614 1338 HG21 THR 82 HG21 THR 82 -5.294 7.380 1.246 1339 HG22 THR 82 HG22 THR 82 -3.819 6.510 1.611 1340 HG23 THR 82 HG23 THR 82 -5.271 6.191 2.536 1341 H VAL 83 H VAL 83 -5.015 5.764 -2.372 1342 HA VAL 83 HA VAL 83 -4.465 8.539 -2.474 1343 HB VAL 83 HB VAL 83 -2.955 6.996 -3.574 1344 HG11 VAL 83 HG11 VAL 83 -4.961 5.503 -4.373 1345 HG12 VAL 83 HG12 VAL 83 -3.474 5.551 -5.318 1346 HG13 VAL 83 HG13 VAL 83 -4.866 6.506 -5.816 1347 HG21 VAL 83 HG21 VAL 83 -4.162 8.537 -5.853 1348 HG22 VAL 83 HG22 VAL 83 -2.472 8.273 -5.480 1349 HG23 VAL 83 HG23 VAL 83 -3.413 9.405 -4.513 1350 H ALA 84 H ALA 84 -6.857 6.561 -4.185 1351 HA ALA 84 HA ALA 84 -7.948 8.625 -5.730 1352 HB1 ALA 84 HB1 ALA 84 -8.581 6.341 -6.184 1353 HB2 ALA 84 HB2 ALA 84 -10.027 7.250 -5.738 1354 HB3 ALA 84 HB3 ALA 84 -9.280 6.161 -4.569 1355 H MET 85 H MET 85 -8.973 7.439 -2.508 1356 HA MET 85 HA MET 85 -10.901 9.509 -2.219 1357 HB2 MET 85 HB3 MET 85 -10.427 7.196 -0.806 1358 HB3 MET 85 HB2 MET 85 -9.840 8.421 0.303 1359 HG2 MET 85 HG3 MET 85 -12.485 9.018 -0.981 1360 HG3 MET 85 HG2 MET 85 -12.410 7.687 0.134 1361 HE1 MET 85 HE1 MET 85 -13.107 11.751 0.799 1362 HE2 MET 85 HE2 MET 85 -12.428 11.101 -0.687 1363 HE3 MET 85 HE3 MET 85 -11.389 11.931 0.450 1364 H ASN 86 H ASN 86 -7.614 9.154 -0.915 1365 HA ASN 86 HA ASN 86 -7.770 11.542 0.567 1366 HB2 ASN 86 HB3 ASN 86 -5.953 9.551 0.582 1367 HB3 ASN 86 HB2 ASN 86 -5.074 10.741 -0.375 1368 HD21 ASN 86 HD21 ASN 86 -6.532 10.143 2.819 1369 HD22 ASN 86 HD22 ASN 86 -5.775 11.435 3.573 1370 H ASN 87 H ASN 87 -6.873 10.911 -2.748 1371 HA ASN 87 HA ASN 87 -5.799 13.434 -3.397 1372 HB2 ASN 87 HB3 ASN 87 -5.750 11.498 -4.960 1373 HB3 ASN 87 HB2 ASN 87 -7.493 11.619 -5.136 1374 HD21 ASN 87 HD21 ASN 87 -6.865 14.828 -4.972 1375 HD22 ASN 87 HD22 ASN 87 -6.468 15.138 -6.570 1376 H PHE 88 H PHE 88 -9.081 12.302 -3.064 1377 HA PHE 88 HA PHE 88 -10.392 14.592 -4.049 1378 HB2 PHE 88 HB3 PHE 88 -11.631 12.543 -3.626 1379 HB3 PHE 88 HB2 PHE 88 -11.297 12.632 -1.908 1380 HD1 PHE 88 HD2 PHE 88 -12.886 14.510 -4.713 1381 HD2 PHE 88 HD1 PHE 88 -12.707 13.877 -0.464 1382 HE1 PHE 88 HE2 PHE 88 -14.861 15.948 -4.411 1383 HE2 PHE 88 HE1 PHE 88 -14.694 15.328 -0.167 1384 HZ PHE 88 HZ PHE 88 -15.768 16.362 -2.142 1385 H PHE 89 H PHE 89 -9.208 13.773 -0.813 1386 HA PHE 89 HA PHE 89 -10.129 16.147 0.420 1387 HB2 PHE 89 HB3 PHE 89 -7.864 14.270 1.114 1388 HB3 PHE 89 HB2 PHE 89 -8.126 15.747 2.007 1389 HD1 PHE 89 HD1 PHE 89 -10.561 16.212 2.827 1390 HD2 PHE 89 HD2 PHE 89 -9.107 12.321 1.738 1391 HE1 PHE 89 HE1 PHE 89 -12.372 15.162 4.151 1392 HE2 PHE 89 HE2 PHE 89 -10.912 11.278 3.065 1393 HZ PHE 89 HZ PHE 89 -12.544 12.684 4.270 1394 H TRP 90 H TRP 90 -7.142 15.444 -1.320 1395 HA TRP 90 HA TRP 90 -5.878 17.948 -0.774 1396 HB2 TRP 90 HB3 TRP 90 -5.417 16.457 -3.340 1397 HB3 TRP 90 HB2 TRP 90 -4.274 17.374 -2.366 1398 HD1 TRP 90 HD TRP 90 -5.389 15.791 0.376 1399 HE1 TRP 90 HE1 TRP 90 -4.452 13.467 0.788 1400 HE3 TRP 90 HE3 TRP 90 -3.656 14.689 -4.285 1401 HZ2 TRP 90 HZ2 TRP 90 -3.118 11.389 -0.628 1402 HZ3 TRP 90 HZ3 TRP 90 -2.546 12.511 -4.726 1403 HH2 TRP 90 HH TRP 90 -2.280 10.859 -2.899 1404 H GLU 91 H GLU 91 -7.769 16.745 -3.441 1405 HA GLU 91 HA GLU 91 -7.835 19.465 -4.585 1406 HB2 GLU 91 HB3 GLU 91 -8.182 16.807 -5.964 1407 HB3 GLU 91 HB2 GLU 91 -8.413 18.339 -6.757 1408 HG2 GLU 91 HG3 GLU 91 -6.134 19.080 -6.192 1409 HG3 GLU 91 HG2 GLU 91 -5.831 17.584 -5.325 1410 H ASN 92 H ASN 92 -9.895 17.986 -2.661 1411 HA ASN 92 HA ASN 92 -12.368 18.247 -4.020 1412 HB2 ASN 92 HB3 ASN 92 -12.311 17.078 -1.879 1413 HB3 ASN 92 HB2 ASN 92 -11.823 18.569 -1.053 1414 HD21 ASN 92 HD21 ASN 92 -13.924 18.217 0.223 1415 HD22 ASN 92 HD22 ASN 92 -15.360 18.746 -0.486 1416 H SER 93 H SER 93 -13.150 19.995 -4.877 1417 HA SER 93 HA SER 93 -13.303 22.491 -3.512 1418 HB2 SER 93 HB3 SER 93 -11.352 22.083 -5.757 1419 HB3 SER 93 HB2 SER 93 -11.962 23.689 -5.314 1420 HG SER 93 HG SER 93 -11.058 22.072 -3.233 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -11.055 7.996 10.643 2 HA2 GLY 1 HA3 GLY 1 -12.240 6.031 8.906 3 HA3 GLY 1 HA2 GLY 1 -10.639 6.496 8.368 4 H SER 2 H SER 2 -11.163 3.906 9.156 5 HA SER 2 HA SER 2 -10.576 3.314 11.866 6 HB2 SER 2 HB3 SER 2 -9.745 1.400 9.729 7 HB3 SER 2 HB2 SER 2 -10.648 1.149 11.226 8 HG SER 2 HG SER 2 -11.509 2.119 8.696 9 H GLU 3 H GLU 3 -8.486 1.823 12.337 10 HA GLU 3 HA GLU 3 -6.224 3.480 12.299 11 HB2 GLU 3 HB3 GLU 3 -6.564 0.514 12.738 12 HB3 GLU 3 HB2 GLU 3 -4.981 1.253 12.716 13 HG2 GLU 3 HG3 GLU 3 -5.482 1.313 14.899 14 HG3 GLU 3 HG2 GLU 3 -5.947 2.944 14.411 15 H LEU 4 H LEU 4 -7.236 0.863 10.190 16 HA LEU 4 HA LEU 4 -4.889 0.719 8.621 17 HB2 LEU 4 HB3 LEU 4 -7.772 0.023 8.131 18 HB3 LEU 4 HB2 LEU 4 -6.597 -0.105 6.830 19 HG LEU 4 HG LEU 4 -7.079 -2.196 8.382 20 HD11 LEU 4 HD11 LEU 4 -5.110 -3.136 7.741 21 HD12 LEU 4 HD12 LEU 4 -4.182 -1.644 7.933 22 HD13 LEU 4 HD13 LEU 4 -5.326 -1.835 6.584 23 HD21 LEU 4 HD21 LEU 4 -5.073 -0.613 10.090 24 HD22 LEU 4 HD22 LEU 4 -5.376 -2.322 10.243 25 HD23 LEU 4 HD23 LEU 4 -6.672 -1.196 10.543 26 H GLU 5 H GLU 5 -7.807 2.658 8.343 27 HA GLU 5 HA GLU 5 -7.080 4.066 5.974 28 HB2 GLU 5 HB3 GLU 5 -8.881 4.837 8.310 29 HB3 GLU 5 HB2 GLU 5 -8.792 5.703 6.794 30 HG2 GLU 5 HG3 GLU 5 -9.452 3.696 5.565 31 HG3 GLU 5 HG2 GLU 5 -9.522 2.782 7.057 32 H THR 6 H THR 6 -6.650 4.580 9.406 33 HA THR 6 HA THR 6 -5.335 7.083 9.303 34 HB THR 6 HB THR 6 -4.801 4.937 11.375 35 HG1 THR 6 HG2 THR 6 -7.111 5.187 10.952 36 HG21 THR 6 HG21 THR 6 -4.926 7.970 11.441 37 HG22 THR 6 HG22 THR 6 -3.490 6.976 11.595 38 HG23 THR 6 HG23 THR 6 -4.710 6.949 12.855 39 H ALA 7 H ALA 7 -4.136 3.729 9.308 40 HA ALA 7 HA ALA 7 -1.390 4.261 9.244 41 HB1 ALA 7 HB1 ALA 7 -1.370 1.977 7.953 42 HB2 ALA 7 HB2 ALA 7 -3.088 1.967 8.288 43 HB3 ALA 7 HB3 ALA 7 -1.939 2.012 9.624 44 H MET 8 H MET 8 -3.728 3.817 6.608 45 HA MET 8 HA MET 8 -1.854 4.239 4.524 46 HB2 MET 8 HB3 MET 8 -4.860 4.639 4.515 47 HB3 MET 8 HB2 MET 8 -3.855 4.622 3.087 48 HG2 MET 8 HG3 MET 8 -4.282 2.297 5.004 49 HG3 MET 8 HG2 MET 8 -4.786 2.421 3.331 50 HE1 MET 8 HE1 MET 8 -1.738 2.220 1.232 51 HE2 MET 8 HE2 MET 8 -2.093 3.796 1.908 52 HE3 MET 8 HE3 MET 8 -3.431 2.720 1.450 53 H GLU 9 H GLU 9 -4.027 6.427 6.272 54 HA GLU 9 HA GLU 9 -3.402 8.723 4.782 55 HB2 GLU 9 HB3 GLU 9 -4.414 8.367 7.607 56 HB3 GLU 9 HB2 GLU 9 -4.170 9.961 6.897 57 HG2 GLU 9 HG3 GLU 9 -5.870 7.798 5.621 58 HG3 GLU 9 HG2 GLU 9 -6.528 9.105 6.588 59 H THR 10 H THR 10 -1.827 7.186 7.467 60 HA THR 10 HA THR 10 0.023 9.243 8.071 61 HB THR 10 HB THR 10 0.565 6.258 8.304 62 HG1 THR 10 HG2 THR 10 -1.517 6.979 9.243 63 HG21 THR 10 HG21 THR 10 2.334 8.190 8.802 64 HG22 THR 10 HG22 THR 10 2.180 6.803 9.870 65 HG23 THR 10 HG23 THR 10 1.428 8.316 10.305 66 H LEU 11 H LEU 11 0.112 6.577 5.753 67 HA LEU 11 HA LEU 11 2.679 7.186 4.688 68 HB2 LEU 11 HB3 LEU 11 0.300 5.719 3.530 69 HB3 LEU 11 HB2 LEU 11 1.834 5.826 2.681 70 HG LEU 11 HG LEU 11 1.524 4.674 5.485 71 HD11 LEU 11 HD11 LEU 11 1.431 2.545 4.613 72 HD12 LEU 11 HD12 LEU 11 2.033 3.011 3.037 73 HD13 LEU 11 HD13 LEU 11 0.371 3.413 3.510 74 HD21 LEU 11 HD21 LEU 11 3.864 5.535 4.758 75 HD22 LEU 11 HD22 LEU 11 3.801 4.320 3.490 76 HD23 LEU 11 HD23 LEU 11 3.752 3.835 5.173 77 H ILE 12 H ILE 12 -0.579 8.279 3.892 78 HA ILE 12 HA ILE 12 0.051 9.689 1.520 79 HB ILE 12 HB ILE 12 -2.090 10.230 3.607 80 HG12 ILE 12 HG13 ILE 12 -2.199 8.012 2.334 81 HG13 ILE 12 HG12 ILE 12 -3.591 9.062 2.146 82 HG21 ILE 12 HG21 ILE 12 -2.077 12.244 2.549 83 HG22 ILE 12 HG22 ILE 12 -3.151 11.350 1.496 84 HG23 ILE 12 HG23 ILE 12 -1.471 11.602 1.022 85 HD11 ILE 12 HD11 ILE 12 -1.316 9.112 0.116 86 HD12 ILE 12 HD12 ILE 12 -2.958 9.734 -0.039 87 HD13 ILE 12 HD13 ILE 12 -2.686 8.012 0.015 88 H ASN 13 H ASN 13 0.037 10.686 4.895 89 HA ASN 13 HA ASN 13 0.620 13.426 4.527 90 HB2 ASN 13 HB3 ASN 13 1.267 11.524 6.775 91 HB3 ASN 13 HB2 ASN 13 1.671 13.227 6.832 92 HD21 ASN 13 HD21 ASN 13 -0.612 11.238 7.955 93 HD22 ASN 13 HD22 ASN 13 -1.972 12.253 7.911 94 H VAL 14 H VAL 14 2.699 10.593 4.884 95 HA VAL 14 HA VAL 14 5.184 11.951 4.766 96 HB VAL 14 HB VAL 14 4.452 9.121 3.954 97 HG11 VAL 14 HG11 VAL 14 6.933 8.778 4.489 98 HG12 VAL 14 HG12 VAL 14 7.092 10.520 4.334 99 HG13 VAL 14 HG13 VAL 14 6.543 9.558 2.954 100 HG21 VAL 14 HG21 VAL 14 5.869 9.909 6.493 101 HG22 VAL 14 HG22 VAL 14 4.892 8.477 6.151 102 HG23 VAL 14 HG23 VAL 14 4.110 10.017 6.417 103 H PHE 15 H PHE 15 3.147 10.431 2.330 104 HA PHE 15 HA PHE 15 4.785 10.829 0.096 105 HB2 PHE 15 HB3 PHE 15 2.747 9.414 0.181 106 HB3 PHE 15 HB2 PHE 15 1.754 10.862 0.163 107 HD1 PHE 15 HD1 PHE 15 4.171 8.840 -1.787 108 HD2 PHE 15 HD2 PHE 15 1.463 12.185 -1.890 109 HE1 PHE 15 HE1 PHE 15 4.350 8.918 -4.244 110 HE2 PHE 15 HE2 PHE 15 1.646 12.246 -4.341 111 HZ PHE 15 HZ PHE 15 3.090 10.610 -5.527 112 H HIS 16 H HIS 16 2.249 12.845 1.494 113 HA HIS 16 HA HIS 16 2.304 15.003 -0.327 114 HB2 HIS 16 HB3 HIS 16 1.515 14.706 2.530 115 HB3 HIS 16 HB2 HIS 16 1.822 16.330 1.943 116 HD1 HIS 16 HD1 HIS 16 0.628 16.513 -0.744 117 HD2 HIS 16 HD2 HIS 16 -1.161 14.240 2.266 118 HE1 HIS 16 HE1 HIS 16 -1.807 16.300 -1.354 119 HE2 HIS 16 HE2 HIS 16 -2.914 14.927 0.492 120 H ALA 17 H ALA 17 4.133 14.439 2.654 121 HA ALA 17 HA ALA 17 5.431 16.866 2.766 122 HB1 ALA 17 HB1 ALA 17 6.917 14.420 3.644 123 HB2 ALA 17 HB2 ALA 17 5.400 14.824 4.440 124 HB3 ALA 17 HB3 ALA 17 6.727 15.980 4.433 125 H HIS 18 H HIS 18 6.630 13.862 1.335 126 HA HIS 18 HA HIS 18 9.009 15.063 0.330 127 HB2 HIS 18 HB3 HIS 18 7.652 12.463 -0.322 128 HB3 HIS 18 HB2 HIS 18 9.173 12.964 -1.060 129 HD1 HIS 18 HD1 HIS 18 11.277 13.385 0.610 130 HD2 HIS 18 HD2 HIS 18 7.895 11.587 2.339 131 HE1 HIS 18 HE1 HIS 18 11.996 12.455 2.836 132 HE2 HIS 18 HE2 HIS 18 9.974 11.376 3.910 133 H SER 19 H SER 19 5.832 14.523 -1.096 134 HA SER 19 HA SER 19 6.396 15.135 -3.772 135 HB2 SER 19 HB3 SER 19 3.968 15.978 -2.163 136 HB3 SER 19 HB2 SER 19 4.053 15.902 -3.908 137 HG SER 19 HG SER 19 4.425 13.694 -2.090 138 H GLY 20 H GLY 20 5.807 17.202 -0.990 139 HA2 GLY 20 HA3 GLY 20 5.995 19.694 -2.333 140 HA3 GLY 20 HA2 GLY 20 6.209 19.413 -0.600 141 H LYS 21 H LYS 21 8.365 17.577 -0.745 142 HA LYS 21 HA LYS 21 10.500 19.430 -0.775 143 HB2 LYS 21 HB3 LYS 21 10.700 16.400 -0.883 144 HB3 LYS 21 HB2 LYS 21 11.985 17.508 -0.424 145 HG2 LYS 21 HG3 LYS 21 9.357 17.166 1.011 146 HG3 LYS 21 HG2 LYS 21 10.898 16.537 1.551 147 HD2 LYS 21 HD3 LYS 21 11.765 18.685 1.995 148 HD3 LYS 21 HD2 LYS 21 10.512 19.541 1.121 149 HE2 LYS 21 HE2 LYS 21 10.241 18.023 3.717 150 HE3 LYS 21 HE1 LYS 21 9.958 19.739 3.432 151 HZ1 LYS 21 HZ1 LYS 21 7.843 18.777 3.447 152 HZ2 LYS 21 HZ2 LYS 21 8.329 17.441 2.536 153 HZ3 LYS 21 HZ3 LYS 21 8.176 18.955 1.803 154 H GLU 22 H GLU 22 9.581 16.908 -3.088 155 HA GLU 22 HA GLU 22 11.785 17.563 -4.778 156 HB2 GLU 22 HB3 GLU 22 10.858 16.012 -6.400 157 HB3 GLU 22 HB2 GLU 22 10.863 15.337 -4.777 158 HG2 GLU 22 HG3 GLU 22 8.631 14.980 -4.884 159 HG3 GLU 22 HG2 GLU 22 8.330 16.675 -5.155 160 H GLY 23 H GLY 23 8.372 18.475 -4.787 161 HA2 GLY 23 HA3 GLY 23 8.289 20.928 -5.460 162 HA3 GLY 23 HA2 GLY 23 8.990 20.377 -6.977 163 H ASP 24 H ASP 24 7.052 17.877 -6.259 164 HA ASP 24 HA ASP 24 5.047 18.840 -8.093 165 HB2 ASP 24 HB3 ASP 24 5.983 16.398 -7.895 166 HB3 ASP 24 HB2 ASP 24 4.773 16.239 -6.657 167 H LYS 25 H LYS 25 2.836 18.961 -7.696 168 HA LYS 25 HA LYS 25 2.045 19.864 -5.097 169 HB2 LYS 25 HB3 LYS 25 -0.267 19.674 -6.006 170 HB3 LYS 25 HB2 LYS 25 0.780 20.744 -6.960 171 HG2 LYS 25 HG3 LYS 25 1.177 18.887 -8.570 172 HG3 LYS 25 HG2 LYS 25 0.154 17.826 -7.609 173 HD2 LYS 25 HD3 LYS 25 -1.754 19.414 -7.988 174 HD3 LYS 25 HD2 LYS 25 -0.696 20.349 -9.024 175 HE2 LYS 25 HE2 LYS 25 -0.420 18.617 -10.587 176 HE3 LYS 25 HE1 LYS 25 -1.103 17.402 -9.523 177 HZ1 LYS 25 HZ1 LYS 25 -2.567 18.412 -11.395 178 HZ2 LYS 25 HZ2 LYS 25 -2.794 19.704 -10.323 179 HZ3 LYS 25 HZ3 LYS 25 -3.200 18.116 -9.865 180 H TYR 26 H TYR 26 1.851 16.870 -6.930 181 HA TYR 26 HA TYR 26 2.004 15.355 -4.590 182 HB2 TYR 26 HB3 TYR 26 -0.150 13.977 -5.106 183 HB3 TYR 26 HB2 TYR 26 -0.279 15.435 -4.142 184 HD1 TYR 26 HD2 TYR 26 -0.905 13.964 -7.519 185 HD2 TYR 26 HD1 TYR 26 -1.395 17.423 -5.002 186 HE1 TYR 26 HE2 TYR 26 -2.487 14.916 -9.138 187 HE2 TYR 26 HE1 TYR 26 -2.993 18.371 -6.624 188 HH TYR 26 HH TYR 26 -4.534 16.702 -8.887 189 H LYS 27 H LYS 27 3.735 14.541 -5.554 190 HA LYS 27 HA LYS 27 3.426 12.124 -6.922 191 HB2 LYS 27 HB3 LYS 27 4.976 14.298 -8.416 192 HB3 LYS 27 HB2 LYS 27 5.048 12.577 -8.757 193 HG2 LYS 27 HG3 LYS 27 2.528 14.252 -8.962 194 HG3 LYS 27 HG2 LYS 27 3.547 13.849 -10.309 195 HD2 LYS 27 HD3 LYS 27 2.441 11.595 -8.580 196 HD3 LYS 27 HD2 LYS 27 1.467 12.310 -9.838 197 HE2 LYS 27 HE2 LYS 27 4.199 11.071 -10.244 198 HE3 LYS 27 HE1 LYS 27 2.657 10.355 -10.691 199 HZ1 LYS 27 HZ1 LYS 27 3.171 11.295 -12.616 200 HZ2 LYS 27 HZ2 LYS 27 4.165 12.484 -11.999 201 HZ3 LYS 27 HZ3 LYS 27 2.468 12.694 -12.008 202 H LEU 28 H LEU 28 5.617 11.043 -6.971 203 HA LEU 28 HA LEU 28 7.384 12.384 -5.056 204 HB2 LEU 28 HB3 LEU 28 6.191 10.656 -3.905 205 HB3 LEU 28 HB2 LEU 28 6.610 9.451 -5.110 206 HG LEU 28 HG LEU 28 9.063 9.956 -4.563 207 HD11 LEU 28 HD11 LEU 28 7.671 11.469 -2.362 208 HD12 LEU 28 HD12 LEU 28 8.881 12.079 -3.489 209 HD13 LEU 28 HD13 LEU 28 9.339 10.914 -2.238 210 HD21 LEU 28 HD21 LEU 28 8.105 7.926 -3.725 211 HD22 LEU 28 HD22 LEU 28 7.149 8.805 -2.521 212 HD23 LEU 28 HD23 LEU 28 8.902 8.715 -2.363 213 H SER 29 H SER 29 9.391 12.582 -5.706 214 HA SER 29 HA SER 29 10.186 11.569 -8.287 215 HB2 SER 29 HB3 SER 29 12.308 12.831 -7.764 216 HB3 SER 29 HB2 SER 29 10.827 13.760 -7.819 217 HG SER 29 HG SER 29 10.792 13.900 -5.678 218 H LYS 30 H LYS 30 12.315 10.490 -8.541 219 HA LYS 30 HA LYS 30 12.504 8.274 -6.680 220 HB2 LYS 30 HB3 LYS 30 14.456 8.853 -8.908 221 HB3 LYS 30 HB2 LYS 30 14.082 7.328 -8.131 222 HG2 LYS 30 HG3 LYS 30 12.370 8.881 -10.084 223 HG3 LYS 30 HG2 LYS 30 12.934 7.226 -10.231 224 HD2 LYS 30 HD3 LYS 30 11.052 8.026 -7.972 225 HD3 LYS 30 HD2 LYS 30 10.424 7.635 -9.550 226 HE2 LYS 30 HE2 LYS 30 12.074 5.813 -7.777 227 HE3 LYS 30 HE1 LYS 30 10.370 5.632 -8.188 228 HZ1 LYS 30 HZ1 LYS 30 11.452 4.205 -9.616 229 HZ2 LYS 30 HZ2 LYS 30 12.756 5.244 -9.829 230 HZ3 LYS 30 HZ3 LYS 30 11.233 5.555 -10.613 231 H LYS 31 H LYS 31 13.507 11.361 -6.612 232 HA LYS 31 HA LYS 31 16.141 11.121 -5.433 233 HB2 LYS 31 HB3 LYS 31 14.229 13.460 -4.972 234 HB3 LYS 31 HB2 LYS 31 15.970 13.422 -5.024 235 HG2 LYS 31 HG3 LYS 31 15.980 13.138 -7.435 236 HG3 LYS 31 HG2 LYS 31 14.255 12.858 -7.413 237 HD2 LYS 31 HD3 LYS 31 13.816 15.089 -6.563 238 HD3 LYS 31 HD2 LYS 31 15.539 15.484 -6.588 239 HE2 LYS 31 HE2 LYS 31 14.048 14.515 -9.029 240 HE3 LYS 31 HE1 LYS 31 14.100 16.218 -8.616 241 HZ1 LYS 31 HZ1 LYS 31 16.717 14.875 -8.633 242 HZ2 LYS 31 HZ2 LYS 31 16.217 16.387 -9.237 243 HZ3 LYS 31 HZ3 LYS 31 15.934 15.027 -10.129 244 H GLU 32 H GLU 32 12.992 12.192 -4.224 245 HA GLU 32 HA GLU 32 13.604 12.004 -1.487 246 HB2 GLU 32 HB3 GLU 32 11.021 12.243 -3.004 247 HB3 GLU 32 HB2 GLU 32 11.154 12.339 -1.239 248 HG2 GLU 32 HG3 GLU 32 12.649 14.119 -3.192 249 HG3 GLU 32 HG2 GLU 32 11.177 14.594 -2.384 250 H LEU 33 H LEU 33 11.974 9.833 -3.732 251 HA LEU 33 HA LEU 33 10.796 8.162 -1.860 252 HB2 LEU 33 HB3 LEU 33 10.323 8.026 -4.302 253 HB3 LEU 33 HB2 LEU 33 11.962 7.422 -4.509 254 HG LEU 33 HG LEU 33 10.009 5.695 -4.461 255 HD11 LEU 33 HD11 LEU 33 12.018 4.686 -2.584 256 HD12 LEU 33 HD12 LEU 33 12.720 5.491 -3.979 257 HD13 LEU 33 HD13 LEU 33 11.602 4.153 -4.198 258 HD21 LEU 33 HD21 LEU 33 10.481 5.687 -1.473 259 HD22 LEU 33 HD22 LEU 33 9.162 5.009 -2.400 260 HD23 LEU 33 HD23 LEU 33 9.230 6.737 -2.140 261 H LYS 34 H LYS 34 14.064 7.998 -3.253 262 HA LYS 34 HA LYS 34 14.839 5.588 -1.984 263 HB2 LYS 34 HB3 LYS 34 16.473 7.995 -2.800 264 HB3 LYS 34 HB2 LYS 34 17.176 6.488 -2.256 265 HG2 LYS 34 HG3 LYS 34 16.103 5.279 -4.113 266 HG3 LYS 34 HG2 LYS 34 15.360 6.779 -4.668 267 HD2 LYS 34 HD3 LYS 34 17.609 7.767 -5.020 268 HD3 LYS 34 HD2 LYS 34 18.359 6.296 -4.444 269 HE2 LYS 34 HE2 LYS 34 18.326 6.318 -6.889 270 HE3 LYS 34 HE1 LYS 34 17.293 5.031 -6.288 271 HZ1 LYS 34 HZ1 LYS 34 15.781 7.425 -6.483 272 HZ2 LYS 34 HZ2 LYS 34 15.631 5.880 -7.268 273 HZ3 LYS 34 HZ3 LYS 34 16.599 7.091 -7.956 274 H GLU 35 H GLU 35 15.205 8.971 -1.116 275 HA GLU 35 HA GLU 35 16.488 8.622 1.373 276 HB2 GLU 35 HB3 GLU 35 16.419 10.719 0.020 277 HB3 GLU 35 HB2 GLU 35 14.729 10.866 0.401 278 HG2 GLU 35 HG3 GLU 35 15.139 11.084 2.745 279 HG3 GLU 35 HG2 GLU 35 16.856 10.721 2.558 280 H LEU 36 H LEU 36 13.184 9.086 0.385 281 HA LEU 36 HA LEU 36 11.903 9.122 2.856 282 HB2 LEU 36 HB3 LEU 36 10.758 9.859 0.931 283 HB3 LEU 36 HB2 LEU 36 11.130 8.369 0.077 284 HG LEU 36 HG LEU 36 9.667 7.107 1.405 285 HD11 LEU 36 HD11 LEU 36 8.699 9.607 2.842 286 HD12 LEU 36 HD12 LEU 36 10.026 8.671 3.527 287 HD13 LEU 36 HD13 LEU 36 8.454 7.920 3.272 288 HD21 LEU 36 HD21 LEU 36 7.493 8.655 0.993 289 HD22 LEU 36 HD22 LEU 36 8.409 7.842 -0.279 290 HD23 LEU 36 HD23 LEU 36 8.705 9.550 0.055 291 H LEU 37 H LEU 37 12.482 6.445 0.608 292 HA LEU 37 HA LEU 37 11.151 4.593 2.175 293 HB2 LEU 37 HB3 LEU 37 11.581 4.214 -0.206 294 HB3 LEU 37 HB2 LEU 37 13.312 4.107 0.083 295 HG LEU 37 HG LEU 37 11.890 1.942 -0.194 296 HD11 LEU 37 HD11 LEU 37 14.323 2.364 0.846 297 HD12 LEU 37 HD12 LEU 37 13.572 0.770 0.845 298 HD13 LEU 37 HD13 LEU 37 13.531 1.755 2.297 299 HD21 LEU 37 HD21 LEU 37 10.999 1.051 1.941 300 HD22 LEU 37 HD22 LEU 37 10.135 2.470 1.410 301 HD23 LEU 37 HD23 LEU 37 11.313 2.594 2.718 302 H GLN 38 H GLN 38 14.602 5.386 2.008 303 HA GLN 38 HA GLN 38 15.318 3.503 4.040 304 HB2 GLN 38 HB3 GLN 38 17.479 4.571 4.112 305 HB3 GLN 38 HB2 GLN 38 17.010 4.393 2.421 306 HG2 GLN 38 HG3 GLN 38 16.233 6.738 2.398 307 HG3 GLN 38 HG2 GLN 38 16.743 6.938 4.074 308 HE21 GLN 38 HE21 GLN 38 19.224 6.068 4.322 309 HE22 GLN 38 HE22 GLN 38 20.261 6.696 3.140 310 H THR 39 H THR 39 14.494 6.915 4.037 311 HA THR 39 HA THR 39 15.106 7.435 6.704 312 HB THR 39 HB THR 39 13.083 8.700 4.863 313 HG1 THR 39 HG2 THR 39 15.019 8.988 4.073 314 HG21 THR 39 HG21 THR 39 12.439 9.274 7.057 315 HG22 THR 39 HG22 THR 39 13.277 10.654 6.379 316 HG23 THR 39 HG23 THR 39 14.100 9.616 7.566 317 H GLU 40 H GLU 40 11.939 6.544 5.270 318 HA GLU 40 HA GLU 40 10.831 6.471 7.915 319 HB2 GLU 40 HB3 GLU 40 9.526 5.879 5.251 320 HB3 GLU 40 HB2 GLU 40 8.687 5.966 6.798 321 HG2 GLU 40 HG3 GLU 40 10.297 8.254 5.593 322 HG3 GLU 40 HG2 GLU 40 8.538 8.113 5.576 323 H LEU 41 H LEU 41 11.813 4.025 5.588 324 HA LEU 41 HA LEU 41 10.901 1.929 7.469 325 HB2 LEU 41 HB3 LEU 41 11.483 1.914 4.540 326 HB3 LEU 41 HB2 LEU 41 11.562 0.438 5.432 327 HG LEU 41 HG LEU 41 9.250 0.871 6.356 328 HD11 LEU 41 HD11 LEU 41 9.489 3.208 4.491 329 HD12 LEU 41 HD12 LEU 41 8.797 3.121 6.112 330 HD13 LEU 41 HD13 LEU 41 7.920 2.450 4.743 331 HD21 LEU 41 HD21 LEU 41 9.886 -0.536 4.233 332 HD22 LEU 41 HD22 LEU 41 9.147 0.796 3.346 333 HD23 LEU 41 HD23 LEU 41 8.197 -0.118 4.511 334 H SER 42 H SER 42 13.223 3.428 8.098 335 HA SER 42 HA SER 42 15.627 2.278 7.277 336 HB2 SER 42 HB3 SER 42 15.018 3.275 10.064 337 HB3 SER 42 HB2 SER 42 16.584 3.176 9.284 338 HG SER 42 HG SER 42 15.198 4.573 7.593 339 H GLY 43 H GLY 43 13.323 1.304 9.765 340 HA2 GLY 43 HA3 GLY 43 14.808 -0.804 10.921 341 HA3 GLY 43 HA2 GLY 43 13.055 -0.620 10.941 342 H PHE 44 H PHE 44 12.378 -0.810 8.324 343 HA PHE 44 HA PHE 44 12.673 -3.642 7.858 344 HB2 PHE 44 HB3 PHE 44 11.324 -1.462 6.279 345 HB3 PHE 44 HB2 PHE 44 11.555 -3.057 5.575 346 HD1 PHE 44 HD2 PHE 44 10.914 -5.040 7.323 347 HD2 PHE 44 HD1 PHE 44 9.288 -1.094 7.317 348 HE1 PHE 44 HE2 PHE 44 8.917 -5.879 8.548 349 HE2 PHE 44 HE1 PHE 44 7.279 -1.918 8.545 350 HZ PHE 44 HZ PHE 44 7.099 -4.305 9.155 351 H LEU 45 H LEU 45 13.920 -0.720 6.442 352 HA LEU 45 HA LEU 45 15.319 -1.920 4.330 353 HB2 LEU 45 HB3 LEU 45 14.860 0.422 4.300 354 HB3 LEU 45 HB2 LEU 45 15.733 0.686 5.795 355 HG LEU 45 HG LEU 45 17.756 -0.057 4.818 356 HD11 LEU 45 HD11 LEU 45 15.989 -0.565 2.406 357 HD12 LEU 45 HD12 LEU 45 17.270 -1.590 3.066 358 HD13 LEU 45 HD13 LEU 45 17.684 -0.158 2.132 359 HD21 LEU 45 HD21 LEU 45 16.976 2.338 4.629 360 HD22 LEU 45 HD22 LEU 45 16.603 2.004 2.921 361 HD23 LEU 45 HD23 LEU 45 18.255 1.879 3.516 362 H ASP 46 H ASP 46 16.415 -0.974 7.606 363 HA ASP 46 HA ASP 46 19.047 -1.926 7.116 364 HB2 ASP 46 HB3 ASP 46 18.671 -0.217 8.766 365 HB3 ASP 46 HB2 ASP 46 17.718 -1.309 9.754 366 H ALA 47 H ALA 47 16.265 -3.373 8.709 367 HA ALA 47 HA ALA 47 17.547 -5.531 9.876 368 HB1 ALA 47 HB1 ALA 47 15.389 -5.597 10.556 369 HB2 ALA 47 HB2 ALA 47 15.192 -6.687 9.198 370 HB3 ALA 47 HB3 ALA 47 14.771 -4.984 9.020 371 H GLN 48 H GLN 48 16.263 -5.237 6.604 372 HA GLN 48 HA GLN 48 17.917 -7.553 5.896 373 HB2 GLN 48 HB3 GLN 48 16.218 -7.820 3.931 374 HB3 GLN 48 HB2 GLN 48 15.773 -8.447 5.518 375 HG2 GLN 48 HG3 GLN 48 13.874 -7.288 5.004 376 HG3 GLN 48 HG2 GLN 48 14.742 -5.981 5.789 377 HE21 GLN 48 HE21 GLN 48 15.132 -4.159 4.527 378 HE22 GLN 48 HE22 GLN 48 14.896 -4.082 2.837 379 H LYS 49 H LYS 49 19.132 -5.288 5.930 380 HA LYS 49 HA LYS 49 18.911 -3.502 3.790 381 HB2 LYS 49 HB3 LYS 49 20.347 -3.395 5.959 382 HB3 LYS 49 HB2 LYS 49 21.572 -4.211 4.999 383 HG2 LYS 49 HG3 LYS 49 21.224 -2.391 3.230 384 HG3 LYS 49 HG2 LYS 49 20.317 -1.502 4.447 385 HD2 LYS 49 HD3 LYS 49 23.231 -2.363 4.599 386 HD3 LYS 49 HD2 LYS 49 22.633 -0.722 4.471 387 HE2 LYS 49 HE2 LYS 49 22.268 -2.593 6.852 388 HE3 LYS 49 HE1 LYS 49 23.283 -1.169 6.761 389 HZ1 LYS 49 HZ1 LYS 49 20.429 -0.734 6.172 390 HZ2 LYS 49 HZ2 LYS 49 21.557 0.217 6.961 391 HZ3 LYS 49 HZ3 LYS 49 20.888 -1.087 7.775 392 H ASP 50 H ASP 50 20.770 -6.452 4.057 393 HA ASP 50 HA ASP 50 21.606 -6.134 1.237 394 HB2 ASP 50 HB3 ASP 50 23.420 -6.172 2.867 395 HB3 ASP 50 HB2 ASP 50 22.950 -7.808 3.363 396 H VAL 51 H VAL 51 19.131 -7.492 2.438 397 HA VAL 51 HA VAL 51 19.448 -10.257 1.710 398 HB VAL 51 HB VAL 51 16.909 -8.690 2.225 399 HG11 VAL 51 HG11 VAL 51 16.098 -10.705 1.320 400 HG12 VAL 51 HG12 VAL 51 16.309 -11.182 3.000 401 HG13 VAL 51 HG13 VAL 51 17.515 -11.621 1.824 402 HG21 VAL 51 HG21 VAL 51 18.344 -8.554 4.145 403 HG22 VAL 51 HG22 VAL 51 18.796 -10.242 3.974 404 HG23 VAL 51 HG23 VAL 51 17.176 -9.837 4.514 405 H ASP 52 H ASP 52 19.978 -8.110 -0.329 406 HA ASP 52 HA ASP 52 19.831 -7.857 -2.582 407 HB2 ASP 52 HB3 ASP 52 20.385 -10.302 -2.307 408 HB3 ASP 52 HB2 ASP 52 18.695 -10.649 -2.612 409 H ALA 53 H ALA 53 16.884 -9.442 -1.422 410 HA ALA 53 HA ALA 53 15.232 -8.702 -3.544 411 HB1 ALA 53 HB1 ALA 53 14.237 -8.899 -0.687 412 HB2 ALA 53 HB2 ALA 53 14.678 -10.314 -1.630 413 HB3 ALA 53 HB3 ALA 53 13.380 -9.265 -2.179 414 H VAL 54 H VAL 54 16.164 -6.941 -0.666 415 HA VAL 54 HA VAL 54 14.361 -4.795 -0.855 416 HB VAL 54 HB VAL 54 15.727 -5.149 1.149 417 HG11 VAL 54 HG11 VAL 54 18.160 -4.138 -0.331 418 HG12 VAL 54 HG12 VAL 54 17.842 -5.869 -0.139 419 HG13 VAL 54 HG13 VAL 54 18.040 -4.839 1.260 420 HG21 VAL 54 HG21 VAL 54 15.193 -2.927 1.378 421 HG22 VAL 54 HG22 VAL 54 15.675 -2.520 -0.258 422 HG23 VAL 54 HG23 VAL 54 16.884 -2.657 1.005 423 H ASP 55 H ASP 55 17.607 -5.174 -2.233 424 HA ASP 55 HA ASP 55 17.766 -2.693 -3.599 425 HB2 ASP 55 HB3 ASP 55 19.718 -4.136 -3.352 426 HB3 ASP 55 HB2 ASP 55 18.906 -5.403 -4.288 427 H LYS 56 H LYS 56 16.718 -5.896 -4.572 428 HA LYS 56 HA LYS 56 16.045 -5.232 -7.207 429 HB2 LYS 56 HB3 LYS 56 15.153 -7.466 -5.407 430 HB3 LYS 56 HB2 LYS 56 14.724 -7.372 -7.120 431 HG2 LYS 56 HG3 LYS 56 17.081 -7.292 -7.781 432 HG3 LYS 56 HG2 LYS 56 17.579 -7.266 -6.089 433 HD2 LYS 56 HD3 LYS 56 16.897 -9.420 -5.709 434 HD3 LYS 56 HD2 LYS 56 15.955 -9.568 -7.219 435 HE2 LYS 56 HE2 LYS 56 18.300 -10.695 -7.118 436 HE3 LYS 56 HE1 LYS 56 17.962 -9.688 -8.517 437 HZ1 LYS 56 HZ1 LYS 56 19.188 -7.861 -7.449 438 HZ2 LYS 56 HZ2 LYS 56 20.119 -9.243 -7.533 439 HZ3 LYS 56 HZ3 LYS 56 19.451 -8.801 -6.067 440 H VAL 57 H VAL 57 14.040 -5.261 -4.292 441 HA VAL 57 HA VAL 57 11.624 -4.531 -5.623 442 HB VAL 57 HB VAL 57 12.540 -3.986 -2.779 443 HG11 VAL 57 HG11 VAL 57 10.702 -2.481 -3.676 444 HG12 VAL 57 HG12 VAL 57 10.251 -3.447 -2.267 445 HG13 VAL 57 HG13 VAL 57 9.731 -3.935 -3.881 446 HG21 VAL 57 HG21 VAL 57 10.488 -6.013 -3.666 447 HG22 VAL 57 HG22 VAL 57 11.402 -5.961 -2.154 448 HG23 VAL 57 HG23 VAL 57 12.199 -6.438 -3.647 449 H MET 58 H MET 58 14.244 -2.701 -4.115 450 HA MET 58 HA MET 58 13.294 -0.069 -4.664 451 HB2 MET 58 HB3 MET 58 16.128 -1.138 -4.447 452 HB3 MET 58 HB2 MET 58 15.672 0.553 -4.404 453 HG2 MET 58 HG3 MET 58 14.201 -1.172 -2.525 454 HG3 MET 58 HG2 MET 58 15.903 -1.013 -2.175 455 HE1 MET 58 HE1 MET 58 17.154 0.815 -2.295 456 HE2 MET 58 HE2 MET 58 16.814 2.082 -1.134 457 HE3 MET 58 HE3 MET 58 16.612 2.404 -2.858 458 H LYS 59 H LYS 59 15.239 -2.412 -6.390 459 HA LYS 59 HA LYS 59 16.124 -0.840 -8.483 460 HB2 LYS 59 HB3 LYS 59 16.724 -3.264 -7.751 461 HB3 LYS 59 HB2 LYS 59 15.420 -3.744 -8.816 462 HG2 LYS 59 HG3 LYS 59 17.262 -3.755 -10.328 463 HG3 LYS 59 HG2 LYS 59 16.548 -2.173 -10.529 464 HD2 LYS 59 HD3 LYS 59 18.605 -1.334 -10.103 465 HD3 LYS 59 HD2 LYS 59 18.267 -1.663 -8.414 466 HE2 LYS 59 HE2 LYS 59 19.917 -3.296 -10.348 467 HE3 LYS 59 HE1 LYS 59 20.320 -2.715 -8.741 468 HZ1 LYS 59 HZ1 LYS 59 19.278 -4.395 -7.712 469 HZ2 LYS 59 HZ2 LYS 59 19.596 -5.214 -9.146 470 HZ3 LYS 59 HZ3 LYS 59 18.057 -4.582 -8.871 471 H GLU 60 H GLU 60 13.291 -2.936 -8.172 472 HA GLU 60 HA GLU 60 12.246 -2.473 -10.756 473 HB2 GLU 60 HB3 GLU 60 10.950 -3.240 -8.170 474 HB3 GLU 60 HB2 GLU 60 10.066 -3.193 -9.693 475 HG2 GLU 60 HG3 GLU 60 11.696 -4.858 -10.637 476 HG3 GLU 60 HG2 GLU 60 12.498 -4.893 -9.051 477 H LEU 61 H LEU 61 11.791 -0.801 -7.683 478 HA LEU 61 HA LEU 61 9.848 1.024 -8.657 479 HB2 LEU 61 HB3 LEU 61 11.670 0.996 -6.277 480 HB3 LEU 61 HB2 LEU 61 10.953 2.522 -6.732 481 HG LEU 61 HG LEU 61 9.646 1.150 -5.065 482 HD11 LEU 61 HD11 LEU 61 7.511 1.782 -5.979 483 HD12 LEU 61 HD12 LEU 61 8.140 1.778 -7.613 484 HD13 LEU 61 HD13 LEU 61 8.689 2.999 -6.458 485 HD21 LEU 61 HD21 LEU 61 9.915 -1.087 -6.095 486 HD22 LEU 61 HD22 LEU 61 9.027 -0.562 -7.530 487 HD23 LEU 61 HD23 LEU 61 8.222 -0.666 -5.986 488 H ASP 62 H ASP 62 13.365 1.073 -8.661 489 HA ASP 62 HA ASP 62 13.155 3.516 -10.183 490 HB2 ASP 62 HB3 ASP 62 15.412 2.415 -8.683 491 HB3 ASP 62 HB2 ASP 62 15.817 3.301 -10.153 492 H GLU 63 H GLU 63 13.069 0.442 -11.050 493 HA GLU 63 HA GLU 63 14.030 0.900 -13.793 494 HB2 GLU 63 HB3 GLU 63 11.927 -0.990 -12.648 495 HB3 GLU 63 HB2 GLU 63 12.407 -0.966 -14.324 496 HG2 GLU 63 HG3 GLU 63 14.776 -1.520 -13.651 497 HG3 GLU 63 HG2 GLU 63 14.221 -1.518 -11.992 498 H ASN 64 H ASN 64 11.293 1.381 -11.810 499 HA ASN 64 HA ASN 64 9.858 2.899 -13.833 500 HB2 ASN 64 HB3 ASN 64 8.884 1.512 -11.807 501 HB3 ASN 64 HB2 ASN 64 9.182 2.990 -10.907 502 HD21 ASN 64 HD21 ASN 64 6.571 1.756 -11.887 503 HD22 ASN 64 HD22 ASN 64 5.796 3.011 -12.724 504 H GLY 65 H GLY 65 12.543 3.636 -13.354 505 HA2 GLY 65 HA3 GLY 65 12.510 6.104 -11.773 506 HA3 GLY 65 HA2 GLY 65 13.911 5.349 -12.553 507 H ASP 66 H ASP 66 11.076 5.409 -14.330 508 HA ASP 66 HA ASP 66 12.127 6.738 -16.520 509 HB2 ASP 66 HB3 ASP 66 10.254 5.130 -16.442 510 HB3 ASP 66 HB2 ASP 66 9.234 6.394 -15.774 511 H GLY 67 H GLY 67 9.984 7.872 -13.945 512 HA2 GLY 67 HA3 GLY 67 10.891 10.595 -14.360 513 HA3 GLY 67 HA2 GLY 67 9.185 10.336 -14.707 514 H GLU 68 H GLU 68 7.843 9.535 -12.986 515 HA GLU 68 HA GLU 68 8.828 10.332 -10.295 516 HB2 GLU 68 HB3 GLU 68 6.075 10.653 -11.494 517 HB3 GLU 68 HB2 GLU 68 6.509 11.034 -9.835 518 HG2 GLU 68 HG3 GLU 68 7.193 13.043 -10.454 519 HG3 GLU 68 HG2 GLU 68 8.411 12.385 -11.526 520 H VAL 69 H VAL 69 7.597 9.393 -8.517 521 HA VAL 69 HA VAL 69 6.343 6.815 -9.139 522 HB VAL 69 HB VAL 69 8.373 6.164 -8.112 523 HG11 VAL 69 HG11 VAL 69 9.266 7.215 -6.042 524 HG12 VAL 69 HG12 VAL 69 7.929 8.365 -6.086 525 HG13 VAL 69 HG13 VAL 69 9.128 8.385 -7.358 526 HG21 VAL 69 HG21 VAL 69 5.963 6.117 -6.346 527 HG22 VAL 69 HG22 VAL 69 7.481 5.873 -5.520 528 HG23 VAL 69 HG23 VAL 69 7.039 4.817 -6.852 529 H ASP 70 H ASP 70 4.300 6.727 -8.416 530 HA ASP 70 HA ASP 70 3.376 9.054 -6.935 531 HB2 ASP 70 HB3 ASP 70 2.058 8.868 -8.770 532 HB3 ASP 70 HB2 ASP 70 2.099 7.133 -8.838 533 H PHE 71 H PHE 71 1.284 8.389 -5.576 534 HA PHE 71 HA PHE 71 2.311 7.333 -3.227 535 HB2 PHE 71 HB3 PHE 71 0.284 8.801 -3.351 536 HB3 PHE 71 HB2 PHE 71 -0.602 7.421 -4.002 537 HD1 PHE 71 HD1 PHE 71 1.608 8.292 -1.125 538 HD2 PHE 71 HD2 PHE 71 -1.795 6.059 -2.478 539 HE1 PHE 71 HE1 PHE 71 1.180 7.541 1.192 540 HE2 PHE 71 HE2 PHE 71 -2.222 5.307 -0.133 541 HZ PHE 71 HZ PHE 71 -0.740 6.046 1.687 542 H GLN 72 H GLN 72 0.356 5.844 -5.740 543 HA GLN 72 HA GLN 72 -0.138 3.367 -4.510 544 HB2 GLN 72 HB3 GLN 72 0.128 4.141 -7.402 545 HB3 GLN 72 HB2 GLN 72 -0.432 2.542 -6.875 546 HG2 GLN 72 HG3 GLN 72 -2.287 3.606 -5.636 547 HG3 GLN 72 HG2 GLN 72 -1.702 5.194 -6.110 548 HE21 GLN 72 HE21 GLN 72 -1.108 3.321 -8.788 549 HE22 GLN 72 HE22 GLN 72 -2.562 3.583 -9.617 550 H GLU 73 H GLU 73 2.533 4.422 -6.628 551 HA GLU 73 HA GLU 73 3.925 1.936 -6.508 552 HB2 GLU 73 HB3 GLU 73 4.811 4.728 -7.230 553 HB3 GLU 73 HB2 GLU 73 5.845 3.300 -7.360 554 HG2 GLU 73 HG3 GLU 73 4.948 3.502 -9.526 555 HG3 GLU 73 HG2 GLU 73 3.901 2.289 -8.778 556 H TYR 74 H TYR 74 4.021 4.930 -4.689 557 HA TYR 74 HA TYR 74 6.263 4.372 -3.075 558 HB2 TYR 74 HB3 TYR 74 5.483 6.614 -3.091 559 HB3 TYR 74 HB2 TYR 74 3.848 6.106 -2.698 560 HD1 TYR 74 HD1 TYR 74 7.301 5.609 -1.162 561 HD2 TYR 74 HD2 TYR 74 3.151 6.630 -0.553 562 HE1 TYR 74 HE1 TYR 74 7.714 5.925 1.233 563 HE2 TYR 74 HE2 TYR 74 3.595 6.952 1.850 564 HH TYR 74 HH TYR 74 6.365 7.489 3.153 565 H VAL 75 H VAL 75 2.811 3.795 -2.420 566 HA VAL 75 HA VAL 75 3.290 2.623 0.095 567 HB VAL 75 HB VAL 75 1.001 1.656 -0.075 568 HG11 VAL 75 HG11 VAL 75 -0.065 3.734 0.186 569 HG12 VAL 75 HG12 VAL 75 1.000 4.547 -0.937 570 HG13 VAL 75 HG13 VAL 75 1.599 4.058 0.658 571 HG21 VAL 75 HG21 VAL 75 0.167 1.330 -2.177 572 HG22 VAL 75 HG22 VAL 75 1.459 2.311 -2.874 573 HG23 VAL 75 HG23 VAL 75 0.019 3.086 -2.311 574 H VAL 76 H VAL 76 2.978 1.089 -3.113 575 HA VAL 76 HA VAL 76 3.105 -1.524 -2.080 576 HB VAL 76 HB VAL 76 2.240 -1.034 -4.349 577 HG11 VAL 76 HG11 VAL 76 3.779 -0.582 -6.187 578 HG12 VAL 76 HG12 VAL 76 5.140 -0.519 -5.068 579 HG13 VAL 76 HG13 VAL 76 3.849 0.677 -4.969 580 HG21 VAL 76 HG21 VAL 76 3.217 -2.965 -5.462 581 HG22 VAL 76 HG22 VAL 76 3.117 -3.331 -3.740 582 HG23 VAL 76 HG23 VAL 76 4.660 -2.877 -4.455 583 H LEU 77 H LEU 77 5.603 0.736 -3.095 584 HA LEU 77 HA LEU 77 7.784 -1.027 -3.048 585 HB2 LEU 77 HB3 LEU 77 8.012 1.184 -3.952 586 HB3 LEU 77 HB2 LEU 77 7.635 1.924 -2.407 587 HG LEU 77 HG LEU 77 9.679 0.911 -1.394 588 HD11 LEU 77 HD11 LEU 77 10.471 -0.917 -2.336 589 HD12 LEU 77 HD12 LEU 77 11.274 0.133 -3.489 590 HD13 LEU 77 HD13 LEU 77 9.735 -0.601 -3.904 591 HD21 LEU 77 HD21 LEU 77 10.353 2.970 -2.013 592 HD22 LEU 77 HD22 LEU 77 9.730 2.831 -3.651 593 HD23 LEU 77 HD23 LEU 77 11.299 2.122 -3.230 594 H VAL 78 H VAL 78 6.484 1.074 -0.491 595 HA VAL 78 HA VAL 78 8.281 0.046 1.460 596 HB VAL 78 HB VAL 78 6.895 1.191 3.129 597 HG11 VAL 78 HG11 VAL 78 8.010 3.024 2.443 598 HG12 VAL 78 HG12 VAL 78 6.696 3.387 1.334 599 HG13 VAL 78 HG13 VAL 78 8.069 2.438 0.780 600 HG21 VAL 78 HG21 VAL 78 5.016 1.759 0.811 601 HG22 VAL 78 HG22 VAL 78 4.844 2.374 2.447 602 HG23 VAL 78 HG23 VAL 78 4.647 0.659 2.139 603 H ALA 79 H ALA 79 4.983 -0.773 0.522 604 HA ALA 79 HA ALA 79 4.553 -2.705 2.533 605 HB1 ALA 79 HB1 ALA 79 3.374 -2.914 -0.222 606 HB2 ALA 79 HB2 ALA 79 2.814 -1.688 0.919 607 HB3 ALA 79 HB3 ALA 79 2.700 -3.400 1.327 608 H ALA 80 H ALA 80 5.905 -2.955 -0.728 609 HA ALA 80 HA ALA 80 6.138 -5.720 -0.879 610 HB1 ALA 80 HB1 ALA 80 8.109 -5.206 -2.400 611 HB2 ALA 80 HB2 ALA 80 7.823 -3.504 -2.033 612 HB3 ALA 80 HB3 ALA 80 6.572 -4.459 -2.830 613 H LEU 81 H LEU 81 8.419 -3.312 0.316 614 HA LEU 81 HA LEU 81 10.416 -5.126 1.224 615 HB2 LEU 81 HB3 LEU 81 9.701 -2.318 2.085 616 HB3 LEU 81 HB2 LEU 81 11.113 -3.187 2.667 617 HG LEU 81 HG LEU 81 10.562 -2.739 -0.290 618 HD11 LEU 81 HD11 LEU 81 12.206 -1.098 1.662 619 HD12 LEU 81 HD12 LEU 81 10.910 -0.560 0.576 620 HD13 LEU 81 HD13 LEU 81 12.449 -1.065 -0.084 621 HD21 LEU 81 HD21 LEU 81 12.843 -3.883 1.330 622 HD22 LEU 81 HD22 LEU 81 13.149 -3.112 -0.223 623 HD23 LEU 81 HD23 LEU 81 12.086 -4.512 -0.141 624 H THR 82 H THR 82 7.570 -3.664 2.705 625 HA THR 82 HA THR 82 7.978 -4.655 5.310 626 HB THR 82 HB THR 82 5.287 -4.223 4.015 627 HG1 THR 82 HG2 THR 82 6.769 -2.397 3.724 628 HG21 THR 82 HG21 THR 82 5.726 -5.197 6.467 629 HG22 THR 82 HG22 THR 82 4.442 -4.041 6.145 630 HG23 THR 82 HG23 THR 82 5.968 -3.484 6.822 631 H VAL 83 H VAL 83 6.003 -5.985 2.600 632 HA VAL 83 HA VAL 83 5.366 -8.312 4.065 633 HB VAL 83 HB VAL 83 3.919 -7.783 2.252 634 HG11 VAL 83 HG11 VAL 83 6.404 -7.824 0.539 635 HG12 VAL 83 HG12 VAL 83 5.062 -6.651 0.600 636 HG13 VAL 83 HG13 VAL 83 4.832 -8.208 -0.146 637 HG21 VAL 83 HG21 VAL 83 3.667 -9.892 1.218 638 HG22 VAL 83 HG22 VAL 83 4.495 -10.259 2.740 639 HG23 VAL 83 HG23 VAL 83 5.396 -10.204 1.231 640 H ALA 84 H ALA 84 7.975 -7.627 1.781 641 HA ALA 84 HA ALA 84 9.003 -10.212 1.668 642 HB1 ALA 84 HB1 ALA 84 10.797 -7.791 1.710 643 HB2 ALA 84 HB2 ALA 84 9.739 -8.110 0.339 644 HB3 ALA 84 HB3 ALA 84 10.970 -9.284 0.797 645 H MET 85 H MET 85 9.876 -7.558 3.901 646 HA MET 85 HA MET 85 11.561 -9.323 5.407 647 HB2 MET 85 HB3 MET 85 11.805 -6.751 5.242 648 HB3 MET 85 HB2 MET 85 10.528 -6.736 6.468 649 HG2 MET 85 HG3 MET 85 11.887 -8.213 7.936 650 HG3 MET 85 HG2 MET 85 13.159 -8.220 6.743 651 HE1 MET 85 HE1 MET 85 12.615 -6.334 10.176 652 HE2 MET 85 HE2 MET 85 11.162 -6.713 9.270 653 HE3 MET 85 HE3 MET 85 11.635 -5.032 9.502 654 H ASN 86 H ASN 86 8.302 -8.003 5.890 655 HA ASN 86 HA ASN 86 8.024 -9.071 8.492 656 HB2 ASN 86 HB3 ASN 86 6.441 -7.358 7.126 657 HB3 ASN 86 HB2 ASN 86 5.564 -8.854 6.814 658 HD21 ASN 86 HD21 ASN 86 6.456 -6.499 9.303 659 HD22 ASN 86 HD22 ASN 86 5.493 -7.184 10.506 660 H ASN 87 H ASN 87 7.564 -10.413 5.295 661 HA ASN 87 HA ASN 87 6.315 -12.837 6.067 662 HB2 ASN 87 HB3 ASN 87 6.486 -12.241 3.712 663 HB3 ASN 87 HB2 ASN 87 8.247 -12.332 3.791 664 HD21 ASN 87 HD21 ASN 87 5.406 -14.192 3.211 665 HD22 ASN 87 HD22 ASN 87 6.155 -15.710 3.280 666 H PHE 88 H PHE 88 9.637 -11.781 6.117 667 HA PHE 88 HA PHE 88 10.707 -14.265 6.971 668 HB2 PHE 88 HB3 PHE 88 12.229 -12.488 6.235 669 HB3 PHE 88 HB2 PHE 88 11.725 -11.455 7.565 670 HD1 PHE 88 HD1 PHE 88 13.245 -14.793 6.842 671 HD2 PHE 88 HD2 PHE 88 12.740 -11.605 9.684 672 HE1 PHE 88 HE1 PHE 88 14.888 -15.869 8.338 673 HE2 PHE 88 HE2 PHE 88 14.388 -12.693 11.177 674 HZ PHE 88 HZ PHE 88 15.461 -14.824 10.505 675 H PHE 89 H PHE 89 9.255 -11.527 8.669 676 HA PHE 89 HA PHE 89 9.523 -12.585 11.316 677 HB2 PHE 89 HB3 PHE 89 7.314 -10.788 10.208 678 HB3 PHE 89 HB2 PHE 89 7.534 -11.241 11.861 679 HD1 PHE 89 HD1 PHE 89 10.856 -11.088 11.283 680 HD2 PHE 89 HD2 PHE 89 7.448 -8.436 11.095 681 HE1 PHE 89 HE1 PHE 89 12.318 -9.166 11.653 682 HE2 PHE 89 HE2 PHE 89 8.945 -6.518 11.465 683 HZ PHE 89 HZ PHE 89 11.377 -6.871 11.750 684 H TRP 90 H TRP 90 7.069 -13.005 8.805 685 HA TRP 90 HA TRP 90 5.297 -14.650 10.323 686 HB2 TRP 90 HB3 TRP 90 5.789 -14.910 7.355 687 HB3 TRP 90 HB2 TRP 90 4.311 -15.295 8.245 688 HD1 TRP 90 HD TRP 90 4.903 -12.399 9.949 689 HE1 TRP 90 HE1 TRP 90 4.020 -10.337 8.892 690 HE3 TRP 90 HE3 TRP 90 4.275 -14.096 5.193 691 HZ2 TRP 90 HZ2 TRP 90 3.090 -9.424 6.290 692 HZ3 TRP 90 HZ3 TRP 90 3.377 -12.595 3.433 693 HH2 TRP 90 HH TRP 90 2.786 -10.255 3.981 694 H GLU 91 H GLU 91 7.795 -15.393 8.073 695 HA GLU 91 HA GLU 91 7.696 -18.214 8.565 696 HB2 GLU 91 HB3 GLU 91 9.766 -16.577 7.117 697 HB3 GLU 91 HB2 GLU 91 9.824 -18.331 7.225 698 HG2 GLU 91 HG3 GLU 91 7.552 -18.496 6.248 699 HG3 GLU 91 HG2 GLU 91 7.482 -16.748 6.121 700 H ASN 92 H ASN 92 9.497 -15.637 9.971 701 HA ASN 92 HA ASN 92 11.731 -16.587 10.985 702 HB2 ASN 92 HB3 ASN 92 10.813 -14.390 11.598 703 HB3 ASN 92 HB2 ASN 92 9.708 -15.202 12.738 704 HD21 ASN 92 HD21 ASN 92 11.246 -13.472 14.072 705 HD22 ASN 92 HD22 ASN 92 12.582 -14.201 14.801 706 H SER 93 H SER 93 12.370 -18.340 11.949 707 HA SER 93 HA SER 93 10.712 -19.751 13.890 708 HB2 SER 93 HB3 SER 93 11.667 -20.708 11.219 709 HB3 SER 93 HB2 SER 93 11.202 -21.861 12.483 710 HG SER 93 HG SER 93 9.763 -19.845 11.104 711 H1 GLY 1 H GLY 1 11.575 2.083 9.840 712 HA2 GLY 1 HA3 GLY 1 11.444 1.590 12.103 713 HA3 GLY 1 HA2 GLY 1 12.737 2.728 12.423 714 H SER 2 H SER 2 10.135 3.831 10.476 715 HA SER 2 HA SER 2 9.317 5.684 12.596 716 HB2 SER 2 HB3 SER 2 8.526 5.610 9.685 717 HB3 SER 2 HB2 SER 2 8.214 6.914 10.799 718 HG SER 2 HG SER 2 9.982 7.131 9.427 719 H GLU 3 H GLU 3 6.875 6.294 12.490 720 HA GLU 3 HA GLU 3 5.267 4.192 13.416 721 HB2 GLU 3 HB3 GLU 3 4.411 6.752 12.041 722 HB3 GLU 3 HB2 GLU 3 3.419 5.742 13.069 723 HG2 GLU 3 HG3 GLU 3 4.067 7.324 14.598 724 HG3 GLU 3 HG2 GLU 3 5.324 6.138 14.853 725 H LEU 4 H LEU 4 6.173 5.256 10.305 726 HA LEU 4 HA LEU 4 4.012 4.277 8.778 727 HB2 LEU 4 HB3 LEU 4 6.933 4.765 8.101 728 HB3 LEU 4 HB2 LEU 4 5.816 4.103 6.935 729 HG LEU 4 HG LEU 4 5.806 6.446 6.539 730 HD11 LEU 4 HD11 LEU 4 3.491 5.249 6.844 731 HD12 LEU 4 HD12 LEU 4 3.549 6.999 6.736 732 HD13 LEU 4 HD13 LEU 4 3.385 6.240 8.306 733 HD21 LEU 4 HD21 LEU 4 5.748 8.131 8.173 734 HD22 LEU 4 HD22 LEU 4 6.782 6.928 8.912 735 HD23 LEU 4 HD23 LEU 4 5.094 7.071 9.409 736 H GLU 5 H GLU 5 6.947 2.744 10.003 737 HA GLU 5 HA GLU 5 6.482 0.260 8.725 738 HB2 GLU 5 HB3 GLU 5 7.968 0.950 11.275 739 HB3 GLU 5 HB2 GLU 5 7.950 -0.670 10.621 740 HG2 GLU 5 HG3 GLU 5 8.858 0.313 8.443 741 HG3 GLU 5 HG2 GLU 5 9.028 1.819 9.300 742 H THR 6 H THR 6 5.441 1.683 11.760 743 HA THR 6 HA THR 6 4.014 -0.571 12.740 744 HB THR 6 HB THR 6 3.320 2.327 13.232 745 HG1 THR 6 HG2 THR 6 5.589 0.912 13.756 746 HG21 THR 6 HG21 THR 6 2.348 -0.162 14.247 747 HG22 THR 6 HG22 THR 6 1.929 1.465 14.756 748 HG23 THR 6 HG23 THR 6 3.257 0.624 15.535 749 H ALA 7 H ALA 7 3.092 2.247 10.774 750 HA ALA 7 HA ALA 7 0.380 1.625 10.456 751 HB1 ALA 7 HB1 ALA 7 2.282 3.002 8.544 752 HB2 ALA 7 HB2 ALA 7 1.321 3.776 9.793 753 HB3 ALA 7 HB3 ALA 7 0.525 3.037 8.405 754 H MET 8 H MET 8 3.224 0.749 8.508 755 HA MET 8 HA MET 8 1.791 -0.833 6.636 756 HB2 MET 8 HB3 MET 8 4.697 -1.012 7.473 757 HB3 MET 8 HB2 MET 8 4.005 -1.826 6.081 758 HG2 MET 8 HG3 MET 8 4.136 1.195 6.498 759 HG3 MET 8 HG2 MET 8 5.034 0.236 5.323 760 HE1 MET 8 HE1 MET 8 4.174 -1.249 3.870 761 HE2 MET 8 HE2 MET 8 3.052 -0.668 2.635 762 HE3 MET 8 HE3 MET 8 2.470 -1.761 3.877 763 H GLU 9 H GLU 9 3.411 -1.620 9.693 764 HA GLU 9 HA GLU 9 2.822 -4.374 9.485 765 HB2 GLU 9 HB3 GLU 9 3.609 -2.690 11.842 766 HB3 GLU 9 HB2 GLU 9 3.311 -4.427 11.984 767 HG2 GLU 9 HG3 GLU 9 4.980 -4.852 10.200 768 HG3 GLU 9 HG2 GLU 9 5.305 -3.128 10.100 769 H THR 10 H THR 10 1.031 -1.662 10.752 770 HA THR 10 HA THR 10 -0.998 -3.136 12.049 771 HB THR 10 HB THR 10 -1.500 -0.544 10.501 772 HG1 THR 10 HG2 THR 10 0.417 -0.480 11.924 773 HG21 THR 10 HG21 THR 10 -3.289 -0.238 11.952 774 HG22 THR 10 HG22 THR 10 -2.649 -1.326 13.170 775 HG23 THR 10 HG23 THR 10 -3.353 -1.975 11.697 776 H LEU 11 H LEU 11 -0.489 -2.142 8.702 777 HA LEU 11 HA LEU 11 -2.822 -3.295 7.566 778 HB2 LEU 11 HB3 LEU 11 -0.067 -2.762 6.373 779 HB3 LEU 11 HB2 LEU 11 -1.452 -3.311 5.455 780 HG LEU 11 HG LEU 11 -1.593 -0.784 7.130 781 HD11 LEU 11 HD11 LEU 11 -1.249 -0.522 4.204 782 HD12 LEU 11 HD12 LEU 11 0.202 -1.040 5.046 783 HD13 LEU 11 HD13 LEU 11 -0.604 0.458 5.504 784 HD21 LEU 11 HD21 LEU 11 -3.531 -2.263 5.767 785 HD22 LEU 11 HD22 LEU 11 -3.058 -1.039 4.597 786 HD23 LEU 11 HD23 LEU 11 -3.649 -0.545 6.174 787 H ILE 12 H ILE 12 0.449 -4.543 8.195 788 HA ILE 12 HA ILE 12 0.152 -7.066 6.936 789 HB ILE 12 HB ILE 12 1.867 -6.263 9.308 790 HG12 ILE 12 HG13 ILE 12 2.311 -5.133 7.023 791 HG13 ILE 12 HG12 ILE 12 3.669 -6.019 7.716 792 HG21 ILE 12 HG21 ILE 12 1.469 -8.882 7.990 793 HG22 ILE 12 HG22 ILE 12 2.086 -8.473 9.585 794 HG23 ILE 12 HG23 ILE 12 3.147 -8.394 8.206 795 HD11 ILE 12 HD11 ILE 12 2.830 -6.332 5.178 796 HD12 ILE 12 HD12 ILE 12 1.901 -7.633 5.930 797 HD13 ILE 12 HD13 ILE 12 3.655 -7.567 6.087 798 H ASN 13 H ASN 13 -0.393 -6.019 10.250 799 HA ASN 13 HA ASN 13 -0.974 -8.529 11.350 800 HB2 ASN 13 HB3 ASN 13 -1.753 -5.743 12.201 801 HB3 ASN 13 HB2 ASN 13 -2.248 -7.176 13.083 802 HD21 ASN 13 HD21 ASN 13 0.530 -5.173 12.302 803 HD22 ASN 13 HD22 ASN 13 1.615 -5.978 13.335 804 H VAL 14 H VAL 14 -3.083 -6.115 9.907 805 HA VAL 14 HA VAL 14 -5.543 -7.458 10.367 806 HB VAL 14 HB VAL 14 -4.738 -5.552 8.148 807 HG11 VAL 14 HG11 VAL 14 -6.809 -6.897 7.678 808 HG12 VAL 14 HG12 VAL 14 -7.061 -5.165 7.821 809 HG13 VAL 14 HG13 VAL 14 -7.513 -6.222 9.156 810 HG21 VAL 14 HG21 VAL 14 -5.529 -5.216 11.003 811 HG22 VAL 14 HG22 VAL 14 -6.300 -4.137 9.841 812 HG23 VAL 14 HG23 VAL 14 -4.544 -4.192 9.957 813 H PHE 15 H PHE 15 -3.213 -7.465 7.725 814 HA PHE 15 HA PHE 15 -4.537 -9.187 5.945 815 HB2 PHE 15 HB3 PHE 15 -2.475 -7.862 5.455 816 HB3 PHE 15 HB2 PHE 15 -1.554 -8.956 6.476 817 HD1 PHE 15 HD1 PHE 15 -3.522 -8.690 3.329 818 HD2 PHE 15 HD2 PHE 15 -0.891 -11.157 5.694 819 HE1 PHE 15 HE1 PHE 15 -3.182 -10.209 1.402 820 HE2 PHE 15 HE2 PHE 15 -0.571 -12.656 3.762 821 HZ PHE 15 HZ PHE 15 -1.714 -12.180 1.617 822 H HIS 16 H HIS 16 -2.264 -9.822 8.572 823 HA HIS 16 HA HIS 16 -2.277 -12.678 8.442 824 HB2 HIS 16 HB3 HIS 16 -1.483 -10.669 10.496 825 HB3 HIS 16 HB2 HIS 16 -1.841 -12.289 11.063 826 HD1 HIS 16 HD1 HIS 16 0.119 -13.801 11.060 827 HD2 HIS 16 HD2 HIS 16 0.357 -10.943 8.023 828 HE1 HIS 16 HE1 HIS 16 2.303 -14.216 9.851 829 HE2 HIS 16 HE2 HIS 16 2.466 -12.486 8.003 830 H ALA 17 H ALA 17 -4.230 -10.396 10.313 831 HA ALA 17 HA ALA 17 -5.689 -12.208 11.817 832 HB1 ALA 17 HB1 ALA 17 -6.988 -9.760 10.619 833 HB2 ALA 17 HB2 ALA 17 -5.757 -9.629 11.867 834 HB3 ALA 17 HB3 ALA 17 -7.262 -10.489 12.202 835 H HIS 18 H HIS 18 -6.061 -11.271 8.471 836 HA HIS 18 HA HIS 18 -8.459 -12.909 8.172 837 HB2 HIS 18 HB3 HIS 18 -6.999 -11.079 6.274 838 HB3 HIS 18 HB2 HIS 18 -8.304 -12.151 5.762 839 HD1 HIS 18 HD1 HIS 18 -10.636 -11.839 6.856 840 HD2 HIS 18 HD2 HIS 18 -7.889 -8.846 7.796 841 HE1 HIS 18 HE1 HIS 18 -11.969 -9.904 7.917 842 HE2 HIS 18 HE2 HIS 18 -10.298 -8.104 8.512 843 H SER 19 H SER 19 -5.043 -13.056 7.231 844 HA SER 19 HA SER 19 -5.236 -15.244 5.461 845 HB2 SER 19 HB3 SER 19 -3.013 -14.536 7.392 846 HB3 SER 19 HB2 SER 19 -2.897 -15.743 6.127 847 HG SER 19 HG SER 19 -3.727 -13.840 4.783 848 H GLY 20 H GLY 20 -4.934 -15.137 8.964 849 HA2 GLY 20 HA3 GLY 20 -4.741 -17.883 9.459 850 HA3 GLY 20 HA2 GLY 20 -5.449 -16.703 10.559 851 H LYS 21 H LYS 21 -7.498 -15.767 8.922 852 HA LYS 21 HA LYS 21 -9.560 -17.714 9.382 853 HB2 LYS 21 HB3 LYS 21 -9.718 -15.201 7.697 854 HB3 LYS 21 HB2 LYS 21 -11.026 -16.090 8.471 855 HG2 LYS 21 HG3 LYS 21 -8.756 -14.831 9.980 856 HG3 LYS 21 HG2 LYS 21 -10.313 -14.034 9.732 857 HD2 LYS 21 HD3 LYS 21 -11.446 -15.688 11.052 858 HD3 LYS 21 HD2 LYS 21 -10.063 -16.769 11.028 859 HE2 LYS 21 HE2 LYS 21 -10.550 -15.200 13.110 860 HE3 LYS 21 HE1 LYS 21 -8.912 -15.595 12.615 861 HZ1 LYS 21 HZ1 LYS 21 -8.786 -13.478 11.388 862 HZ2 LYS 21 HZ2 LYS 21 -9.183 -13.238 12.990 863 HZ3 LYS 21 HZ3 LYS 21 -10.384 -13.105 11.823 864 H GLU 22 H GLU 22 -8.071 -16.238 6.518 865 HA GLU 22 HA GLU 22 -9.684 -17.564 4.689 866 HB2 GLU 22 HB3 GLU 22 -8.751 -16.312 3.115 867 HB3 GLU 22 HB2 GLU 22 -8.149 -15.405 4.458 868 HG2 GLU 22 HG3 GLU 22 -6.217 -15.725 3.126 869 HG3 GLU 22 HG2 GLU 22 -6.029 -16.966 4.347 870 H GLY 23 H GLY 23 -6.368 -18.447 5.642 871 HA2 GLY 23 HA3 GLY 23 -6.730 -21.179 5.415 872 HA3 GLY 23 HA2 GLY 23 -6.404 -20.636 3.783 873 H ASP 24 H ASP 24 -4.401 -19.240 3.559 874 HA ASP 24 HA ASP 24 -2.267 -20.843 4.536 875 HB2 ASP 24 HB3 ASP 24 -2.126 -19.756 2.289 876 HB3 ASP 24 HB2 ASP 24 -1.991 -18.207 3.124 877 H LYS 25 H LYS 25 -0.374 -20.061 5.498 878 HA LYS 25 HA LYS 25 -0.703 -18.922 8.069 879 HB2 LYS 25 HB3 LYS 25 1.972 -18.540 7.667 880 HB3 LYS 25 HB2 LYS 25 1.281 -20.137 7.964 881 HG2 LYS 25 HG3 LYS 25 1.143 -20.552 5.584 882 HG3 LYS 25 HG2 LYS 25 1.769 -18.921 5.229 883 HD2 LYS 25 HD3 LYS 25 3.843 -19.618 6.432 884 HD3 LYS 25 HD2 LYS 25 3.176 -21.233 6.571 885 HE2 LYS 25 HE2 LYS 25 3.760 -19.722 4.029 886 HE3 LYS 25 HE1 LYS 25 4.475 -21.210 4.648 887 HZ1 LYS 25 HZ1 LYS 25 2.832 -21.776 2.971 888 HZ2 LYS 25 HZ2 LYS 25 1.621 -20.909 3.743 889 HZ3 LYS 25 HZ3 LYS 25 2.282 -22.292 4.461 890 H TYR 26 H TYR 26 0.260 -17.547 4.945 891 HA TYR 26 HA TYR 26 -0.707 -15.030 5.890 892 HB2 TYR 26 HB3 TYR 26 1.414 -13.898 4.791 893 HB3 TYR 26 HB2 TYR 26 1.360 -14.386 6.478 894 HD1 TYR 26 HD2 TYR 26 2.613 -15.398 3.098 895 HD2 TYR 26 HD1 TYR 26 2.616 -16.137 7.305 896 HE1 TYR 26 HE2 TYR 26 4.516 -16.913 2.789 897 HE2 TYR 26 HE1 TYR 26 4.585 -17.692 7.024 898 HH TYR 26 HH TYR 26 6.556 -17.751 4.549 899 H LYS 27 H LYS 27 -2.282 -15.187 4.373 900 HA LYS 27 HA LYS 27 -1.690 -14.169 1.818 901 HB2 LYS 27 HB3 LYS 27 -2.936 -16.931 1.919 902 HB3 LYS 27 HB2 LYS 27 -3.064 -15.881 0.542 903 HG2 LYS 27 HG3 LYS 27 -0.381 -16.818 1.666 904 HG3 LYS 27 HG2 LYS 27 -1.221 -17.545 0.322 905 HD2 LYS 27 HD3 LYS 27 -0.770 -14.564 0.126 906 HD3 LYS 27 HD2 LYS 27 0.592 -15.634 -0.119 907 HE2 LYS 27 HE2 LYS 27 -2.050 -15.928 -1.558 908 HE3 LYS 27 HE1 LYS 27 -0.676 -15.036 -2.202 909 HZ1 LYS 27 HZ1 LYS 27 -1.096 -17.580 -2.699 910 HZ2 LYS 27 HZ2 LYS 27 -0.138 -17.764 -1.295 911 HZ3 LYS 27 HZ3 LYS 27 0.446 -16.923 -2.625 912 H LEU 28 H LEU 28 -3.676 -13.490 0.745 913 HA LEU 28 HA LEU 28 -5.991 -13.652 2.526 914 HB2 LEU 28 HB3 LEU 28 -5.069 -11.414 2.747 915 HB3 LEU 28 HB2 LEU 28 -5.072 -11.211 0.995 916 HG LEU 28 HG LEU 28 -7.571 -11.612 1.031 917 HD11 LEU 28 HD11 LEU 28 -8.474 -11.014 3.447 918 HD12 LEU 28 HD12 LEU 28 -6.962 -11.760 3.952 919 HD13 LEU 28 HD13 LEU 28 -8.127 -12.684 3.010 920 HD21 LEU 28 HD21 LEU 28 -8.108 -9.401 1.916 921 HD22 LEU 28 HD22 LEU 28 -6.639 -9.329 0.918 922 HD23 LEU 28 HD23 LEU 28 -6.523 -9.304 2.683 923 H SER 29 H SER 29 -7.697 -14.489 1.539 924 HA SER 29 HA SER 29 -7.662 -14.649 -1.374 925 HB2 SER 29 HB3 SER 29 -9.770 -16.035 -0.966 926 HB3 SER 29 HB2 SER 29 -8.222 -16.734 -0.533 927 HG SER 29 HG SER 29 -8.725 -16.673 1.439 928 H LYS 30 H LYS 30 -9.643 -14.118 -2.475 929 HA LYS 30 HA LYS 30 -10.305 -11.410 -1.806 930 HB2 LYS 30 HB3 LYS 30 -11.655 -13.157 -3.857 931 HB3 LYS 30 HB2 LYS 30 -11.644 -11.400 -3.840 932 HG2 LYS 30 HG3 LYS 30 -9.199 -13.175 -4.103 933 HG3 LYS 30 HG2 LYS 30 -9.923 -12.395 -5.460 934 HD2 LYS 30 HD3 LYS 30 -8.777 -10.944 -3.032 935 HD3 LYS 30 HD2 LYS 30 -7.945 -11.148 -4.566 936 HE2 LYS 30 HE2 LYS 30 -10.420 -9.498 -3.994 937 HE3 LYS 30 HE1 LYS 30 -8.876 -8.975 -4.653 938 HZ1 LYS 30 HZ1 LYS 30 -9.417 -9.689 -6.725 939 HZ2 LYS 30 HZ2 LYS 30 -11.023 -9.534 -6.121 940 HZ3 LYS 30 HZ3 LYS 30 -10.324 -11.015 -6.187 941 H LYS 31 H LYS 31 -11.321 -14.225 -0.582 942 HA LYS 31 HA LYS 31 -14.111 -14.133 -0.283 943 HB2 LYS 31 HB3 LYS 31 -12.000 -15.038 1.687 944 HB3 LYS 31 HB2 LYS 31 -13.688 -15.520 1.664 945 HG2 LYS 31 HG3 LYS 31 -13.390 -16.568 -0.540 946 HG3 LYS 31 HG2 LYS 31 -11.742 -16.039 -0.587 947 HD2 LYS 31 HD3 LYS 31 -11.421 -17.272 1.666 948 HD3 LYS 31 HD2 LYS 31 -12.932 -18.097 1.268 949 HE2 LYS 31 HE2 LYS 31 -10.478 -17.922 -0.417 950 HE3 LYS 31 HE1 LYS 31 -10.969 -19.384 0.422 951 HZ1 LYS 31 HZ1 LYS 31 -12.753 -19.704 -1.051 952 HZ2 LYS 31 HZ2 LYS 31 -11.587 -19.057 -2.058 953 HZ3 LYS 31 HZ3 LYS 31 -12.840 -18.090 -1.528 954 H GLU 32 H GLU 32 -11.463 -12.968 1.748 955 HA GLU 32 HA GLU 32 -13.341 -11.507 3.456 956 HB2 GLU 32 HB3 GLU 32 -10.412 -11.806 4.027 957 HB3 GLU 32 HB2 GLU 32 -11.789 -11.611 5.119 958 HG2 GLU 32 HG3 GLU 32 -12.470 -13.994 3.909 959 HG3 GLU 32 HG2 GLU 32 -10.741 -14.045 3.789 960 H LEU 33 H LEU 33 -10.918 -11.025 1.090 961 HA LEU 33 HA LEU 33 -9.948 -8.505 1.761 962 HB2 LEU 33 HB3 LEU 33 -9.079 -9.920 -0.135 963 HB3 LEU 33 HB2 LEU 33 -10.599 -9.556 -0.948 964 HG LEU 33 HG LEU 33 -8.475 -8.150 -1.576 965 HD11 LEU 33 HD11 LEU 33 -11.166 -7.741 -1.919 966 HD12 LEU 33 HD12 LEU 33 -9.885 -6.739 -2.583 967 HD13 LEU 33 HD13 LEU 33 -10.668 -6.267 -1.094 968 HD21 LEU 33 HD21 LEU 33 -8.083 -7.524 0.920 969 HD22 LEU 33 HD22 LEU 33 -9.456 -6.431 0.732 970 HD23 LEU 33 HD23 LEU 33 -8.037 -6.237 -0.270 971 H LYS 34 H LYS 34 -12.876 -9.428 -0.041 972 HA LYS 34 HA LYS 34 -13.679 -6.789 -0.649 973 HB2 LYS 34 HB3 LYS 34 -15.356 -9.306 -0.262 974 HB3 LYS 34 HB2 LYS 34 -15.972 -7.776 -0.835 975 HG2 LYS 34 HG3 LYS 34 -14.458 -7.833 -2.790 976 HG3 LYS 34 HG2 LYS 34 -13.788 -9.363 -2.201 977 HD2 LYS 34 HD3 LYS 34 -15.908 -10.500 -2.442 978 HD3 LYS 34 HD2 LYS 34 -16.741 -8.994 -2.784 979 HE2 LYS 34 HE2 LYS 34 -16.396 -10.247 -4.838 980 HE3 LYS 34 HE1 LYS 34 -15.467 -8.759 -4.884 981 HZ1 LYS 34 HZ1 LYS 34 -14.578 -11.336 -5.243 982 HZ2 LYS 34 HZ2 LYS 34 -13.929 -10.957 -3.779 983 HZ3 LYS 34 HZ3 LYS 34 -13.605 -9.981 -5.185 984 H GLU 35 H GLU 35 -14.436 -8.937 2.063 985 HA GLU 35 HA GLU 35 -16.119 -7.131 3.492 986 HB2 GLU 35 HB3 GLU 35 -14.500 -9.538 4.342 987 HB3 GLU 35 HB2 GLU 35 -15.623 -8.689 5.395 988 HG2 GLU 35 HG3 GLU 35 -17.491 -9.156 3.910 989 HG3 GLU 35 HG2 GLU 35 -16.422 -9.869 2.715 990 H LEU 36 H LEU 36 -12.754 -8.015 3.634 991 HA LEU 36 HA LEU 36 -11.883 -6.498 5.807 992 HB2 LEU 36 HB3 LEU 36 -10.539 -8.249 4.992 993 HB3 LEU 36 HB2 LEU 36 -10.588 -7.623 3.353 994 HG LEU 36 HG LEU 36 -9.270 -5.746 3.951 995 HD11 LEU 36 HD11 LEU 36 -8.685 -6.938 6.678 996 HD12 LEU 36 HD12 LEU 36 -10.086 -5.865 6.503 997 HD13 LEU 36 HD13 LEU 36 -8.462 -5.296 6.111 998 HD21 LEU 36 HD21 LEU 36 -7.147 -6.983 4.571 999 HD22 LEU 36 HD22 LEU 36 -8.078 -7.566 3.203 1000 HD23 LEU 36 HD23 LEU 36 -8.158 -8.430 4.752 1001 H LEU 37 H LEU 37 -11.834 -5.770 2.319 1002 HA LEU 37 HA LEU 37 -10.537 -3.316 2.626 1003 HB2 LEU 37 HB3 LEU 37 -10.881 -4.676 0.499 1004 HB3 LEU 37 HB2 LEU 37 -12.463 -3.911 0.339 1005 HG LEU 37 HG LEU 37 -9.696 -2.788 0.036 1006 HD11 LEU 37 HD11 LEU 37 -12.095 -1.779 -1.410 1007 HD12 LEU 37 HD12 LEU 37 -11.561 -3.417 -1.773 1008 HD13 LEU 37 HD13 LEU 37 -10.469 -2.069 -2.001 1009 HD21 LEU 37 HD21 LEU 37 -10.617 -0.478 0.252 1010 HD22 LEU 37 HD22 LEU 37 -10.559 -1.319 1.784 1011 HD23 LEU 37 HD23 LEU 37 -12.105 -1.146 0.913 1012 H GLN 38 H GLN 38 -14.015 -4.022 2.375 1013 HA GLN 38 HA GLN 38 -14.817 -1.310 2.723 1014 HB2 GLN 38 HB3 GLN 38 -17.059 -2.212 3.269 1015 HB3 GLN 38 HB2 GLN 38 -16.429 -2.930 1.790 1016 HG2 GLN 38 HG3 GLN 38 -15.746 -4.925 3.103 1017 HG3 GLN 38 HG2 GLN 38 -16.398 -4.194 4.566 1018 HE21 GLN 38 HE21 GLN 38 -17.869 -6.211 4.563 1019 HE22 GLN 38 HE22 GLN 38 -19.246 -6.142 3.600 1020 H THR 39 H THR 39 -14.355 -3.976 4.963 1021 HA THR 39 HA THR 39 -15.325 -2.703 7.246 1022 HB THR 39 HB THR 39 -13.249 -4.858 6.901 1023 HG1 THR 39 HG2 THR 39 -15.068 -5.616 6.162 1024 HG21 THR 39 HG21 THR 39 -14.619 -3.813 9.379 1025 HG22 THR 39 HG22 THR 39 -12.903 -4.091 9.045 1026 HG23 THR 39 HG23 THR 39 -13.978 -5.464 9.259 1027 H GLU 40 H GLU 40 -11.906 -3.027 6.154 1028 HA GLU 40 HA GLU 40 -11.067 -1.351 8.305 1029 HB2 GLU 40 HB3 GLU 40 -9.518 -2.480 5.984 1030 HB3 GLU 40 HB2 GLU 40 -8.814 -1.515 7.297 1031 HG2 GLU 40 HG3 GLU 40 -10.379 -4.088 7.694 1032 HG3 GLU 40 HG2 GLU 40 -8.628 -3.911 7.812 1033 H LEU 41 H LEU 41 -11.627 -0.709 4.915 1034 HA LEU 41 HA LEU 41 -10.830 2.069 5.390 1035 HB2 LEU 41 HB3 LEU 41 -11.365 0.476 2.902 1036 HB3 LEU 41 HB2 LEU 41 -11.566 2.208 2.855 1037 HG LEU 41 HG LEU 41 -9.262 2.501 3.826 1038 HD11 LEU 41 HD11 LEU 41 -9.281 -0.507 3.596 1039 HD12 LEU 41 HD12 LEU 41 -8.813 0.508 4.968 1040 HD13 LEU 41 HD13 LEU 41 -7.778 0.420 3.567 1041 HD21 LEU 41 HD21 LEU 41 -8.079 2.062 1.782 1042 HD22 LEU 41 HD22 LEU 41 -9.705 2.555 1.351 1043 HD23 LEU 41 HD23 LEU 41 -9.246 0.834 1.288 1044 H SER 42 H SER 42 -12.898 1.348 6.890 1045 HA SER 42 HA SER 42 -15.451 1.478 5.876 1046 HB2 SER 42 HB3 SER 42 -14.360 2.397 8.535 1047 HB3 SER 42 HB2 SER 42 -16.071 2.405 8.173 1048 HG SER 42 HG SER 42 -14.318 0.095 8.038 1049 H GLY 43 H GLY 43 -13.395 4.230 6.860 1050 HA2 GLY 43 HA3 GLY 43 -15.396 6.193 6.399 1051 HA3 GLY 43 HA2 GLY 43 -13.658 6.503 6.519 1052 H PHE 44 H PHE 44 -12.666 5.101 4.474 1053 HA PHE 44 HA PHE 44 -13.206 6.773 2.222 1054 HB2 PHE 44 HB3 PHE 44 -11.579 4.236 2.486 1055 HB3 PHE 44 HB2 PHE 44 -11.680 5.148 0.999 1056 HD1 PHE 44 HD2 PHE 44 -10.942 7.615 1.005 1057 HD2 PHE 44 HD1 PHE 44 -10.110 4.911 4.232 1058 HE1 PHE 44 HE2 PHE 44 -9.172 9.135 1.823 1059 HE2 PHE 44 HE1 PHE 44 -8.323 6.455 5.038 1060 HZ PHE 44 HZ PHE 44 -7.876 8.543 3.842 1061 H LEU 45 H LEU 45 -14.027 3.450 3.060 1062 HA LEU 45 HA LEU 45 -15.141 2.457 0.751 1063 HB2 LEU 45 HB3 LEU 45 -15.153 0.902 2.408 1064 HB3 LEU 45 HB2 LEU 45 -15.613 2.038 3.661 1065 HG LEU 45 HG LEU 45 -17.881 2.152 2.701 1066 HD11 LEU 45 HD11 LEU 45 -16.618 0.512 0.613 1067 HD12 LEU 45 HD12 LEU 45 -18.113 1.435 0.587 1068 HD13 LEU 45 HD13 LEU 45 -18.110 -0.209 1.228 1069 HD21 LEU 45 HD21 LEU 45 -18.086 0.713 4.419 1070 HD22 LEU 45 HD22 LEU 45 -16.684 -0.237 3.952 1071 HD23 LEU 45 HD23 LEU 45 -18.248 -0.520 3.182 1072 H ASP 46 H ASP 46 -16.776 4.322 3.222 1073 HA ASP 46 HA ASP 46 -19.289 4.406 1.982 1074 HB2 ASP 46 HB3 ASP 46 -18.939 4.841 4.307 1075 HB3 ASP 46 HB2 ASP 46 -18.004 6.274 3.956 1076 H ALA 47 H ALA 47 -16.575 6.638 1.823 1077 HA ALA 47 HA ALA 47 -17.961 8.662 0.386 1078 HB1 ALA 47 HB1 ALA 47 -15.979 9.108 1.785 1079 HB2 ALA 47 HB2 ALA 47 -15.766 9.693 0.138 1080 HB3 ALA 47 HB3 ALA 47 -15.005 8.193 0.646 1081 H GLN 48 H GLN 48 -15.804 6.083 -0.601 1082 HA GLN 48 HA GLN 48 -15.441 7.014 -3.238 1083 HB2 GLN 48 HB3 GLN 48 -15.140 4.168 -2.353 1084 HB3 GLN 48 HB2 GLN 48 -14.388 4.997 -3.710 1085 HG2 GLN 48 HG3 GLN 48 -12.830 6.044 -2.443 1086 HG3 GLN 48 HG2 GLN 48 -13.908 6.295 -1.084 1087 HE21 GLN 48 HE21 GLN 48 -14.772 3.694 -0.670 1088 HE22 GLN 48 HE22 GLN 48 -13.456 2.735 -0.141 1089 H LYS 49 H LYS 49 -18.089 5.311 -1.884 1090 HA LYS 49 HA LYS 49 -18.901 3.687 -4.022 1091 HB2 LYS 49 HB3 LYS 49 -20.578 5.246 -2.037 1092 HB3 LYS 49 HB2 LYS 49 -21.241 4.050 -3.133 1093 HG2 LYS 49 HG3 LYS 49 -19.751 2.339 -2.188 1094 HG3 LYS 49 HG2 LYS 49 -19.112 3.530 -1.051 1095 HD2 LYS 49 HD3 LYS 49 -21.347 3.891 -0.119 1096 HD3 LYS 49 HD2 LYS 49 -22.048 2.722 -1.230 1097 HE2 LYS 49 HE2 LYS 49 -20.063 2.201 1.002 1098 HE3 LYS 49 HE1 LYS 49 -21.714 1.608 0.803 1099 HZ1 LYS 49 HZ1 LYS 49 -20.777 0.636 -1.411 1100 HZ2 LYS 49 HZ2 LYS 49 -20.533 -0.190 0.022 1101 HZ3 LYS 49 HZ3 LYS 49 -19.296 0.743 -0.643 1102 H ASP 50 H ASP 50 -19.402 7.028 -3.344 1103 HA ASP 50 HA ASP 50 -21.103 7.654 -5.581 1104 HB2 ASP 50 HB3 ASP 50 -20.727 9.040 -3.475 1105 HB3 ASP 50 HB2 ASP 50 -19.220 9.555 -4.213 1106 H VAL 51 H VAL 51 -17.656 7.391 -5.103 1107 HA VAL 51 HA VAL 51 -16.859 8.816 -7.425 1108 HB VAL 51 HB VAL 51 -15.338 6.770 -5.774 1109 HG11 VAL 51 HG11 VAL 51 -14.461 7.353 -8.139 1110 HG12 VAL 51 HG12 VAL 51 -13.354 7.622 -6.781 1111 HG13 VAL 51 HG13 VAL 51 -14.204 8.965 -7.495 1112 HG21 VAL 51 HG21 VAL 51 -15.210 9.798 -5.630 1113 HG22 VAL 51 HG22 VAL 51 -14.463 8.650 -4.535 1114 HG23 VAL 51 HG23 VAL 51 -16.211 8.839 -4.543 1115 H ASP 52 H ASP 52 -17.442 5.473 -6.621 1116 HA ASP 52 HA ASP 52 -17.902 3.622 -7.884 1117 HB2 ASP 52 HB3 ASP 52 -18.838 5.607 -9.531 1118 HB3 ASP 52 HB2 ASP 52 -17.634 4.824 -10.540 1119 H ALA 53 H ALA 53 -15.195 5.435 -8.062 1120 HA ALA 53 HA ALA 53 -13.627 3.813 -9.832 1121 HB1 ALA 53 HB1 ALA 53 -12.977 6.131 -9.136 1122 HB2 ALA 53 HB2 ALA 53 -11.709 4.940 -8.980 1123 HB3 ALA 53 HB3 ALA 53 -12.565 5.495 -7.537 1124 H VAL 54 H VAL 54 -14.384 3.825 -6.403 1125 HA VAL 54 HA VAL 54 -12.597 1.850 -5.545 1126 HB VAL 54 HB VAL 54 -13.843 3.158 -3.936 1127 HG11 VAL 54 HG11 VAL 54 -16.242 2.901 -3.567 1128 HG12 VAL 54 HG12 VAL 54 -16.346 1.635 -4.758 1129 HG13 VAL 54 HG13 VAL 54 -16.031 3.293 -5.266 1130 HG21 VAL 54 HG21 VAL 54 -13.554 0.318 -3.761 1131 HG22 VAL 54 HG22 VAL 54 -15.110 0.712 -3.058 1132 HG23 VAL 54 HG23 VAL 54 -13.665 1.477 -2.444 1133 H ASP 55 H ASP 55 -15.798 1.604 -6.908 1134 HA ASP 55 HA ASP 55 -16.245 -1.168 -6.812 1135 HB2 ASP 55 HB3 ASP 55 -18.021 0.202 -7.681 1136 HB3 ASP 55 HB2 ASP 55 -16.914 0.989 -8.777 1137 H LYS 56 H LYS 56 -14.744 0.759 -9.291 1138 HA LYS 56 HA LYS 56 -13.882 -1.354 -10.957 1139 HB2 LYS 56 HB3 LYS 56 -12.977 1.526 -10.753 1140 HB3 LYS 56 HB2 LYS 56 -12.635 0.413 -12.085 1141 HG2 LYS 56 HG3 LYS 56 -14.915 0.085 -12.616 1142 HG3 LYS 56 HG2 LYS 56 -15.451 0.845 -11.131 1143 HD2 LYS 56 HD3 LYS 56 -14.312 2.974 -12.027 1144 HD3 LYS 56 HD2 LYS 56 -14.313 2.173 -13.608 1145 HE2 LYS 56 HE2 LYS 56 -16.359 3.684 -12.930 1146 HE3 LYS 56 HE1 LYS 56 -16.668 2.149 -13.724 1147 HZ1 LYS 56 HZ1 LYS 56 -16.560 2.370 -10.750 1148 HZ2 LYS 56 HZ2 LYS 56 -17.272 1.126 -11.654 1149 HZ3 LYS 56 HZ3 LYS 56 -17.996 2.635 -11.570 1150 H VAL 57 H VAL 57 -12.258 0.475 -8.398 1151 HA VAL 57 HA VAL 57 -9.681 -0.674 -8.765 1152 HB VAL 57 HB VAL 57 -10.933 0.393 -6.216 1153 HG11 VAL 57 HG11 VAL 57 -8.008 0.529 -6.682 1154 HG12 VAL 57 HG12 VAL 57 -8.626 -1.082 -6.387 1155 HG13 VAL 57 HG13 VAL 57 -8.896 0.204 -5.206 1156 HG21 VAL 57 HG21 VAL 57 -10.322 2.506 -6.856 1157 HG22 VAL 57 HG22 VAL 57 -10.512 1.861 -8.490 1158 HG23 VAL 57 HG23 VAL 57 -8.916 1.955 -7.748 1159 H MET 58 H MET 58 -12.459 -1.533 -6.722 1160 HA MET 58 HA MET 58 -11.318 -3.828 -5.514 1161 HB2 MET 58 HB3 MET 58 -14.211 -3.290 -6.232 1162 HB3 MET 58 HB2 MET 58 -13.633 -4.541 -5.151 1163 HG2 MET 58 HG3 MET 58 -12.422 -2.206 -4.234 1164 HG3 MET 58 HG2 MET 58 -14.056 -1.727 -4.640 1165 HE1 MET 58 HE1 MET 58 -15.836 -4.026 -4.412 1166 HE2 MET 58 HE2 MET 58 -16.243 -2.555 -3.529 1167 HE3 MET 58 HE3 MET 58 -16.349 -4.107 -2.713 1168 H LYS 59 H LYS 59 -13.151 -3.261 -8.410 1169 HA LYS 59 HA LYS 59 -13.461 -5.907 -9.229 1170 HB2 LYS 59 HB3 LYS 59 -14.491 -3.673 -10.020 1171 HB3 LYS 59 HB2 LYS 59 -13.163 -3.656 -11.165 1172 HG2 LYS 59 HG3 LYS 59 -14.938 -4.829 -12.350 1173 HG3 LYS 59 HG2 LYS 59 -13.788 -6.043 -11.839 1174 HD2 LYS 59 HD3 LYS 59 -16.226 -6.634 -11.412 1175 HD3 LYS 59 HD2 LYS 59 -15.181 -6.773 -10.029 1176 HE2 LYS 59 HE2 LYS 59 -17.476 -5.547 -9.735 1177 HE3 LYS 59 HE1 LYS 59 -16.064 -4.834 -8.984 1178 HZ1 LYS 59 HZ1 LYS 59 -17.144 -3.091 -10.098 1179 HZ2 LYS 59 HZ2 LYS 59 -17.419 -3.990 -11.488 1180 HZ3 LYS 59 HZ3 LYS 59 -15.856 -3.474 -11.112 1181 H GLU 60 H GLU 60 -10.936 -3.514 -9.926 1182 HA GLU 60 HA GLU 60 -9.432 -5.103 -11.706 1183 HB2 GLU 60 HB3 GLU 60 -8.997 -2.668 -11.348 1184 HB3 GLU 60 HB2 GLU 60 -8.407 -3.026 -9.740 1185 HG2 GLU 60 HG3 GLU 60 -6.601 -4.385 -10.611 1186 HG3 GLU 60 HG2 GLU 60 -7.166 -4.231 -12.259 1187 H LEU 61 H LEU 61 -9.420 -4.814 -8.204 1188 HA LEU 61 HA LEU 61 -7.391 -6.765 -7.761 1189 HB2 LEU 61 HB3 LEU 61 -9.517 -5.566 -6.031 1190 HB3 LEU 61 HB2 LEU 61 -8.706 -7.028 -5.486 1191 HG LEU 61 HG LEU 61 -7.696 -4.763 -4.781 1192 HD11 LEU 61 HD11 LEU 61 -5.858 -6.741 -6.142 1193 HD12 LEU 61 HD12 LEU 61 -6.557 -6.982 -4.537 1194 HD13 LEU 61 HD13 LEU 61 -5.449 -5.649 -4.834 1195 HD21 LEU 61 HD21 LEU 61 -6.323 -3.595 -6.310 1196 HD22 LEU 61 HD22 LEU 61 -7.769 -3.887 -7.250 1197 HD23 LEU 61 HD23 LEU 61 -6.334 -4.897 -7.481 1198 H ASP 62 H ASP 62 -10.856 -6.921 -8.187 1199 HA ASP 62 HA ASP 62 -10.986 -9.813 -7.810 1200 HB2 ASP 62 HB3 ASP 62 -12.907 -7.766 -8.885 1201 HB3 ASP 62 HB2 ASP 62 -13.191 -9.482 -9.115 1202 H GLU 63 H GLU 63 -10.502 -7.806 -10.590 1203 HA GLU 63 HA GLU 63 -10.315 -10.022 -12.438 1204 HB2 GLU 63 HB3 GLU 63 -9.101 -7.233 -12.483 1205 HB3 GLU 63 HB2 GLU 63 -9.035 -8.373 -13.822 1206 HG2 GLU 63 HG3 GLU 63 -11.493 -8.432 -13.944 1207 HG3 GLU 63 HG2 GLU 63 -11.561 -7.366 -12.541 1208 H ASN 64 H ASN 64 -8.102 -8.231 -10.429 1209 HA ASN 64 HA ASN 64 -5.807 -9.850 -11.101 1210 HB2 ASN 64 HB3 ASN 64 -6.353 -7.530 -9.363 1211 HB3 ASN 64 HB2 ASN 64 -5.119 -8.645 -8.767 1212 HD21 ASN 64 HD21 ASN 64 -5.997 -6.678 -11.674 1213 HD22 ASN 64 HD22 ASN 64 -4.398 -6.549 -12.209 1214 H GLY 65 H GLY 65 -8.558 -10.483 -9.472 1215 HA2 GLY 65 HA3 GLY 65 -7.527 -12.014 -7.246 1216 HA3 GLY 65 HA2 GLY 65 -9.178 -12.028 -7.869 1217 H ASP 66 H ASP 66 -6.136 -12.577 -9.523 1218 HA ASP 66 HA ASP 66 -7.141 -14.661 -11.109 1219 HB2 ASP 66 HB3 ASP 66 -5.161 -13.164 -11.550 1220 HB3 ASP 66 HB2 ASP 66 -4.228 -14.201 -10.473 1221 H GLY 67 H GLY 67 -5.301 -14.607 -8.134 1222 HA2 GLY 67 HA3 GLY 67 -5.954 -17.454 -7.665 1223 HA3 GLY 67 HA2 GLY 67 -4.302 -16.872 -7.468 1224 H GLU 68 H GLU 68 -3.924 -15.150 -5.957 1225 HA GLU 68 HA GLU 68 -5.925 -14.908 -3.788 1226 HB2 GLU 68 HB3 GLU 68 -2.968 -15.282 -3.349 1227 HB3 GLU 68 HB2 GLU 68 -4.233 -15.254 -2.124 1228 HG2 GLU 68 HG3 GLU 68 -4.156 -17.512 -2.291 1229 HG3 GLU 68 HG2 GLU 68 -5.123 -17.287 -3.734 1230 H VAL 69 H VAL 69 -5.312 -13.046 -2.316 1231 HA VAL 69 HA VAL 69 -3.866 -10.985 -3.834 1232 HB VAL 69 HB VAL 69 -6.074 -10.174 -3.647 1233 HG11 VAL 69 HG11 VAL 69 -7.359 -10.129 -1.524 1234 HG12 VAL 69 HG12 VAL 69 -6.063 -11.003 -0.743 1235 HG13 VAL 69 HG13 VAL 69 -6.995 -11.780 -2.031 1236 HG21 VAL 69 HG21 VAL 69 -5.132 -8.208 -3.016 1237 HG22 VAL 69 HG22 VAL 69 -4.064 -8.971 -1.838 1238 HG23 VAL 69 HG23 VAL 69 -5.705 -8.563 -1.401 1239 H ASP 70 H ASP 70 -2.015 -10.404 -2.957 1240 HA ASP 70 HA ASP 70 -1.414 -11.428 -0.284 1241 HB2 ASP 70 HB3 ASP 70 0.766 -11.537 -0.834 1242 HB3 ASP 70 HB2 ASP 70 0.101 -11.749 -2.439 1243 H PHE 71 H PHE 71 0.480 -9.891 0.596 1244 HA PHE 71 HA PHE 71 -0.896 -7.728 1.748 1245 HB2 PHE 71 HB3 PHE 71 1.095 -8.849 2.736 1246 HB3 PHE 71 HB2 PHE 71 2.085 -8.046 1.504 1247 HD1 PHE 71 HD1 PHE 71 -0.518 -7.257 4.063 1248 HD2 PHE 71 HD2 PHE 71 2.993 -5.899 1.986 1249 HE1 PHE 71 HE1 PHE 71 -0.482 -5.229 5.445 1250 HE2 PHE 71 HE2 PHE 71 3.027 -3.863 3.403 1251 HZ PHE 71 HZ PHE 71 1.303 -3.520 5.118 1252 H GLN 72 H GLN 72 1.462 -7.926 -0.879 1253 HA GLN 72 HA GLN 72 1.641 -5.172 -1.420 1254 HB2 GLN 72 HB3 GLN 72 2.163 -7.642 -3.015 1255 HB3 GLN 72 HB2 GLN 72 2.346 -6.025 -3.775 1256 HG2 GLN 72 HG3 GLN 72 3.961 -5.521 -1.930 1257 HG3 GLN 72 HG2 GLN 72 3.680 -7.148 -1.312 1258 HE21 GLN 72 HE21 GLN 72 3.443 -7.921 -4.391 1259 HE22 GLN 72 HE22 GLN 72 5.072 -8.130 -4.803 1260 H GLU 73 H GLU 73 -0.580 -7.665 -2.640 1261 HA GLU 73 HA GLU 73 -1.969 -5.814 -4.325 1262 HB2 GLU 73 HB3 GLU 73 -2.782 -8.541 -3.295 1263 HB3 GLU 73 HB2 GLU 73 -3.771 -7.571 -4.390 1264 HG2 GLU 73 HG3 GLU 73 -1.851 -7.490 -5.969 1265 HG3 GLU 73 HG2 GLU 73 -0.969 -8.556 -4.888 1266 H TYR 74 H TYR 74 -2.452 -7.020 -1.057 1267 HA TYR 74 HA TYR 74 -4.911 -5.744 -0.496 1268 HB2 TYR 74 HB3 TYR 74 -4.103 -7.504 0.953 1269 HB3 TYR 74 HB2 TYR 74 -2.637 -6.594 1.278 1270 HD1 TYR 74 HD1 TYR 74 -6.360 -5.741 1.422 1271 HD2 TYR 74 HD2 TYR 74 -2.535 -5.783 3.438 1272 HE1 TYR 74 HE1 TYR 74 -7.375 -4.690 3.368 1273 HE2 TYR 74 HE2 TYR 74 -3.577 -4.740 5.408 1274 HH TYR 74 HH TYR 74 -6.629 -3.298 5.347 1275 H VAL 75 H VAL 75 -1.565 -4.616 0.108 1276 HA VAL 75 HA VAL 75 -2.422 -2.183 1.224 1277 HB VAL 75 HB VAL 75 -0.111 -1.362 0.873 1278 HG11 VAL 75 HG11 VAL 75 0.756 -2.659 2.572 1279 HG12 VAL 75 HG12 VAL 75 0.083 -4.159 1.940 1280 HG13 VAL 75 HG13 VAL 75 -0.962 -3.003 2.752 1281 HG21 VAL 75 HG21 VAL 75 1.162 -3.775 0.158 1282 HG22 VAL 75 HG22 VAL 75 1.117 -2.290 -0.808 1283 HG23 VAL 75 HG23 VAL 75 -0.092 -3.543 -1.035 1284 H VAL 76 H VAL 76 -1.564 -2.979 -2.160 1285 HA VAL 76 HA VAL 76 -1.720 -0.303 -3.024 1286 HB VAL 76 HB VAL 76 -0.570 -2.082 -4.329 1287 HG11 VAL 76 HG11 VAL 76 -2.213 -3.863 -3.978 1288 HG12 VAL 76 HG12 VAL 76 -1.861 -3.641 -5.688 1289 HG13 VAL 76 HG13 VAL 76 -3.369 -3.040 -5.024 1290 HG21 VAL 76 HG21 VAL 76 -1.268 -1.300 -6.521 1291 HG22 VAL 76 HG22 VAL 76 -1.388 0.063 -5.413 1292 HG23 VAL 76 HG23 VAL 76 -2.834 -0.804 -5.911 1293 H LEU 77 H LEU 77 -4.091 -2.871 -2.762 1294 HA LEU 77 HA LEU 77 -6.168 -1.603 -4.138 1295 HB2 LEU 77 HB3 LEU 77 -6.288 -3.940 -3.533 1296 HB3 LEU 77 HB2 LEU 77 -6.269 -3.547 -1.827 1297 HG LEU 77 HG LEU 77 -8.406 -2.334 -2.028 1298 HD11 LEU 77 HD11 LEU 77 -9.526 -3.052 -4.436 1299 HD12 LEU 77 HD12 LEU 77 -7.888 -2.640 -4.912 1300 HD13 LEU 77 HD13 LEU 77 -8.879 -1.482 -4.020 1301 HD21 LEU 77 HD21 LEU 77 -8.085 -5.206 -2.573 1302 HD22 LEU 77 HD22 LEU 77 -9.632 -4.560 -3.143 1303 HD23 LEU 77 HD23 LEU 77 -9.171 -4.374 -1.463 1304 H VAL 78 H VAL 78 -5.350 -1.567 -0.666 1305 HA VAL 78 HA VAL 78 -7.408 0.305 -0.069 1306 HB VAL 78 HB VAL 78 -6.353 0.588 2.105 1307 HG11 VAL 78 HG11 VAL 78 -6.409 -1.822 2.818 1308 HG12 VAL 78 HG12 VAL 78 -6.407 -2.282 1.121 1309 HG13 VAL 78 HG13 VAL 78 -7.774 -1.393 1.783 1310 HG21 VAL 78 HG21 VAL 78 -3.950 0.514 1.401 1311 HG22 VAL 78 HG22 VAL 78 -4.178 -1.198 1.001 1312 HG23 VAL 78 HG23 VAL 78 -4.301 -0.667 2.669 1313 H ALA 79 H ALA 79 -3.979 0.577 -0.815 1314 HA ALA 79 HA ALA 79 -3.749 3.363 -0.376 1315 HB1 ALA 79 HB1 ALA 79 -1.688 3.253 -1.339 1316 HB2 ALA 79 HB2 ALA 79 -2.130 1.928 -2.438 1317 HB3 ALA 79 HB3 ALA 79 -1.880 1.615 -0.715 1318 H ALA 80 H ALA 80 -4.594 1.523 -3.295 1319 HA ALA 80 HA ALA 80 -4.634 3.733 -5.037 1320 HB1 ALA 80 HB1 ALA 80 -4.776 1.487 -5.961 1321 HB2 ALA 80 HB2 ALA 80 -6.262 2.340 -6.382 1322 HB3 ALA 80 HB3 ALA 80 -6.262 1.176 -5.064 1323 H LEU 81 H LEU 81 -7.049 2.253 -2.984 1324 HA LEU 81 HA LEU 81 -9.161 4.082 -3.520 1325 HB2 LEU 81 HB3 LEU 81 -8.537 2.305 -1.176 1326 HB3 LEU 81 HB2 LEU 81 -10.037 3.197 -1.307 1327 HG LEU 81 HG LEU 81 -9.027 1.235 -3.388 1328 HD11 LEU 81 HD11 LEU 81 -9.618 -0.096 -1.543 1329 HD12 LEU 81 HD12 LEU 81 -11.067 -0.070 -2.555 1330 HD13 LEU 81 HD13 LEU 81 -10.985 0.953 -1.121 1331 HD21 LEU 81 HD21 LEU 81 -11.576 2.843 -3.104 1332 HD22 LEU 81 HD22 LEU 81 -11.459 1.367 -4.071 1333 HD23 LEU 81 HD23 LEU 81 -10.482 2.757 -4.504 1334 H THR 82 H THR 82 -6.575 3.981 -1.151 1335 HA THR 82 HA THR 82 -7.321 6.287 0.294 1336 HB THR 82 HB THR 82 -4.479 5.362 -0.201 1337 HG1 THR 82 HG2 THR 82 -6.071 3.681 0.552 1338 HG21 THR 82 HG21 THR 82 -4.080 6.333 2.014 1339 HG22 THR 82 HG22 THR 82 -5.775 6.762 2.162 1340 HG23 THR 82 HG23 THR 82 -4.768 7.525 0.932 1341 H VAL 83 H VAL 83 -5.091 5.836 -2.476 1342 HA VAL 83 HA VAL 83 -4.490 8.584 -2.741 1343 HB VAL 83 HB VAL 83 -3.335 6.398 -3.820 1344 HG11 VAL 83 HG11 VAL 83 -5.117 5.804 -5.315 1345 HG12 VAL 83 HG12 VAL 83 -3.691 6.305 -6.187 1346 HG13 VAL 83 HG13 VAL 83 -5.061 7.402 -6.078 1347 HG21 VAL 83 HG21 VAL 83 -2.113 7.882 -5.329 1348 HG22 VAL 83 HG22 VAL 83 -2.395 8.716 -3.799 1349 HG23 VAL 83 HG23 VAL 83 -3.378 9.094 -5.214 1350 H ALA 84 H ALA 84 -6.952 6.543 -4.245 1351 HA ALA 84 HA ALA 84 -7.920 8.296 -6.134 1352 HB1 ALA 84 HB1 ALA 84 -10.110 7.199 -5.865 1353 HB2 ALA 84 HB2 ALA 84 -9.544 6.428 -4.383 1354 HB3 ALA 84 HB3 ALA 84 -8.793 6.030 -5.925 1355 H MET 85 H MET 85 -9.213 7.968 -2.826 1356 HA MET 85 HA MET 85 -10.674 10.409 -3.003 1357 HB2 MET 85 HB3 MET 85 -9.963 8.649 -0.678 1358 HB3 MET 85 HB2 MET 85 -10.777 10.204 -0.472 1359 HG2 MET 85 HG3 MET 85 -12.597 9.463 -2.018 1360 HG3 MET 85 HG2 MET 85 -11.763 7.922 -2.212 1361 HE1 MET 85 HE1 MET 85 -13.440 10.407 0.157 1362 HE2 MET 85 HE2 MET 85 -11.989 10.070 1.098 1363 HE3 MET 85 HE3 MET 85 -13.538 9.553 1.706 1364 H ASN 86 H ASN 86 -7.501 9.595 -1.642 1365 HA ASN 86 HA ASN 86 -7.122 12.122 -0.508 1366 HB2 ASN 86 HB3 ASN 86 -5.203 9.943 -1.238 1367 HB3 ASN 86 HB2 ASN 86 -4.598 11.525 -0.832 1368 HD21 ASN 86 HD21 ASN 86 -6.225 8.731 0.530 1369 HD22 ASN 86 HD22 ASN 86 -6.140 9.301 2.144 1370 H ASN 87 H ASN 87 -6.413 10.937 -3.736 1371 HA ASN 87 HA ASN 87 -5.084 13.258 -4.629 1372 HB2 ASN 87 HB3 ASN 87 -5.286 11.075 -5.895 1373 HB3 ASN 87 HB2 ASN 87 -6.936 11.539 -6.309 1374 HD21 ASN 87 HD21 ASN 87 -7.178 13.566 -7.619 1375 HD22 ASN 87 HD22 ASN 87 -5.880 14.122 -8.552 1376 H PHE 88 H PHE 88 -8.472 12.366 -4.331 1377 HA PHE 88 HA PHE 88 -9.473 14.850 -5.309 1378 HB2 PHE 88 HB3 PHE 88 -11.098 13.060 -5.168 1379 HB3 PHE 88 HB2 PHE 88 -10.795 12.829 -3.452 1380 HD1 PHE 88 HD1 PHE 88 -11.707 15.595 -5.838 1381 HD2 PHE 88 HD2 PHE 88 -12.199 13.892 -1.912 1382 HE1 PHE 88 HE1 PHE 88 -13.336 17.358 -5.276 1383 HE2 PHE 88 HE2 PHE 88 -13.834 15.663 -1.353 1384 HZ PHE 88 HZ PHE 88 -14.406 17.403 -3.034 1385 H PHE 89 H PHE 89 -8.587 13.693 -2.078 1386 HA PHE 89 HA PHE 89 -9.305 16.056 -0.668 1387 HB2 PHE 89 HB3 PHE 89 -7.002 14.155 -0.127 1388 HB3 PHE 89 HB2 PHE 89 -7.505 15.444 0.928 1389 HD1 PHE 89 HD1 PHE 89 -10.667 14.771 -0.042 1390 HD2 PHE 89 HD2 PHE 89 -7.420 12.652 1.891 1391 HE1 PHE 89 HE1 PHE 89 -12.264 13.294 1.054 1392 HE2 PHE 89 HE2 PHE 89 -9.054 11.187 2.967 1393 HZ PHE 89 HZ PHE 89 -11.482 11.495 2.563 1394 H TRP 90 H TRP 90 -6.319 15.210 -2.372 1395 HA TRP 90 HA TRP 90 -4.901 17.610 -1.744 1396 HB2 TRP 90 HB3 TRP 90 -4.600 16.088 -4.336 1397 HB3 TRP 90 HB2 TRP 90 -3.380 17.001 -3.464 1398 HD1 TRP 90 HD TRP 90 -4.567 15.537 -0.644 1399 HE1 TRP 90 HE1 TRP 90 -3.618 13.218 -0.133 1400 HE3 TRP 90 HE3 TRP 90 -2.814 14.318 -5.250 1401 HZ2 TRP 90 HZ2 TRP 90 -2.243 11.082 -1.533 1402 HZ3 TRP 90 HZ3 TRP 90 -1.693 12.142 -5.658 1403 HH2 TRP 90 HH TRP 90 -1.408 10.525 -3.801 1404 H GLU 91 H GLU 91 -6.740 16.599 -4.509 1405 HA GLU 91 HA GLU 91 -6.587 19.128 -5.813 1406 HB2 GLU 91 HB3 GLU 91 -8.345 16.767 -6.393 1407 HB3 GLU 91 HB2 GLU 91 -8.287 18.205 -7.396 1408 HG2 GLU 91 HG3 GLU 91 -5.837 17.951 -7.706 1409 HG3 GLU 91 HG2 GLU 91 -5.861 16.511 -6.711 1410 H ASN 92 H ASN 92 -8.913 17.733 -3.648 1411 HA ASN 92 HA ASN 92 -11.193 19.116 -4.113 1412 HB2 ASN 92 HB3 ASN 92 -11.037 17.463 -2.331 1413 HB3 ASN 92 HB2 ASN 92 -10.023 18.543 -1.372 1414 HD21 ASN 92 HD21 ASN 92 -12.217 17.873 0.005 1415 HD22 ASN 92 HD22 ASN 92 -13.413 19.079 -0.065 1416 H SER 93 H SER 93 -11.350 21.151 -4.621 1417 HA SER 93 HA SER 93 -10.953 23.271 -2.823 1418 HB2 SER 93 HB3 SER 93 -8.844 22.702 -4.870 1419 HB3 SER 93 HB2 SER 93 -9.165 24.379 -4.410 1420 HG SER 93 HG SER 93 -8.719 22.233 -2.595 Start of MODEL 11 1 H1 GLY 1 H GLY 1 -11.806 5.967 9.117 2 HA2 GLY 1 HA3 GLY 1 -10.043 7.290 10.283 3 HA3 GLY 1 HA2 GLY 1 -11.168 7.377 11.628 4 H SER 2 H SER 2 -10.582 4.578 9.520 5 HA SER 2 HA SER 2 -10.247 2.848 11.785 6 HB2 SER 2 HB3 SER 2 -9.555 2.167 8.910 7 HB3 SER 2 HB2 SER 2 -10.064 1.087 10.195 8 HG SER 2 HG SER 2 -11.560 2.002 8.442 9 H GLU 3 H GLU 3 -8.278 1.573 12.216 10 HA GLU 3 HA GLU 3 -5.878 3.099 12.292 11 HB2 GLU 3 HB3 GLU 3 -6.461 0.156 12.670 12 HB3 GLU 3 HB2 GLU 3 -4.809 0.739 12.604 13 HG2 GLU 3 HG3 GLU 3 -5.266 0.797 14.844 14 HG3 GLU 3 HG2 GLU 3 -5.528 2.468 14.389 15 H LEU 4 H LEU 4 -7.159 0.738 10.093 16 HA LEU 4 HA LEU 4 -4.899 0.431 8.401 17 HB2 LEU 4 HB3 LEU 4 -7.877 0.124 8.002 18 HB3 LEU 4 HB2 LEU 4 -6.764 -0.088 6.662 19 HG LEU 4 HG LEU 4 -7.266 -2.253 7.700 20 HD11 LEU 4 HD11 LEU 4 -4.950 -1.625 6.814 21 HD12 LEU 4 HD12 LEU 4 -5.119 -3.079 7.780 22 HD13 LEU 4 HD13 LEU 4 -4.431 -1.634 8.507 23 HD21 LEU 4 HD21 LEU 4 -5.882 -1.340 10.245 24 HD22 LEU 4 HD22 LEU 4 -6.904 -2.745 9.947 25 HD23 LEU 4 HD23 LEU 4 -7.636 -1.188 10.049 26 H GLU 5 H GLU 5 -7.656 2.588 8.405 27 HA GLU 5 HA GLU 5 -6.951 4.132 6.130 28 HB2 GLU 5 HB3 GLU 5 -8.681 4.695 8.546 29 HB3 GLU 5 HB2 GLU 5 -8.536 5.789 7.203 30 HG2 GLU 5 HG3 GLU 5 -9.358 4.042 5.648 31 HG3 GLU 5 HG2 GLU 5 -9.446 2.898 6.956 32 H THR 6 H THR 6 -6.384 4.393 9.569 33 HA THR 6 HA THR 6 -5.036 6.874 9.579 34 HB THR 6 HB THR 6 -4.442 4.584 11.470 35 HG1 THR 6 HG2 THR 6 -6.797 5.046 11.037 36 HG21 THR 6 HG21 THR 6 -4.742 7.018 12.815 37 HG22 THR 6 HG22 THR 6 -3.872 7.442 11.348 38 HG23 THR 6 HG23 THR 6 -3.226 6.219 12.425 39 H ALA 7 H ALA 7 -3.868 3.519 9.314 40 HA ALA 7 HA ALA 7 -1.122 4.129 9.094 41 HB1 ALA 7 HB1 ALA 7 -1.240 1.851 7.687 42 HB2 ALA 7 HB2 ALA 7 -2.831 1.767 8.431 43 HB3 ALA 7 HB3 ALA 7 -1.390 1.869 9.439 44 H MET 8 H MET 8 -3.697 3.819 6.678 45 HA MET 8 HA MET 8 -2.009 4.230 4.430 46 HB2 MET 8 HB3 MET 8 -4.972 4.746 4.732 47 HB3 MET 8 HB2 MET 8 -4.118 4.802 3.203 48 HG2 MET 8 HG3 MET 8 -4.406 2.362 5.010 49 HG3 MET 8 HG2 MET 8 -5.125 2.596 3.423 50 HE1 MET 8 HE1 MET 8 -2.318 2.501 0.980 51 HE2 MET 8 HE2 MET 8 -2.494 4.019 1.853 52 HE3 MET 8 HE3 MET 8 -3.933 3.100 1.420 53 H GLU 9 H GLU 9 -3.836 6.478 6.480 54 HA GLU 9 HA GLU 9 -3.187 8.769 4.966 55 HB2 GLU 9 HB3 GLU 9 -3.848 8.488 7.906 56 HB3 GLU 9 HB2 GLU 9 -3.560 10.040 7.131 57 HG2 GLU 9 HG3 GLU 9 -5.421 9.589 5.537 58 HG3 GLU 9 HG2 GLU 9 -5.693 8.041 6.324 59 H THR 10 H THR 10 -1.586 7.050 7.554 60 HA THR 10 HA THR 10 0.467 8.866 8.151 61 HB THR 10 HB THR 10 0.743 5.835 8.136 62 HG1 THR 10 HG2 THR 10 -1.221 6.577 9.219 63 HG21 THR 10 HG21 THR 10 2.806 6.644 8.744 64 HG22 THR 10 HG22 THR 10 2.031 6.582 10.310 65 HG23 THR 10 HG23 THR 10 2.180 8.122 9.463 66 H LEU 11 H LEU 11 0.303 6.289 5.711 67 HA LEU 11 HA LEU 11 2.857 6.825 4.601 68 HB2 LEU 11 HB3 LEU 11 0.396 5.537 3.417 69 HB3 LEU 11 HB2 LEU 11 1.957 5.574 2.599 70 HG LEU 11 HG LEU 11 1.417 4.327 5.318 71 HD11 LEU 11 HD11 LEU 11 2.114 2.922 2.753 72 HD12 LEU 11 HD12 LEU 11 0.448 3.134 3.318 73 HD13 LEU 11 HD13 LEU 11 1.610 2.223 4.287 74 HD21 LEU 11 HD21 LEU 11 3.925 5.028 3.900 75 HD22 LEU 11 HD22 LEU 11 3.810 3.329 4.337 76 HD23 LEU 11 HD23 LEU 11 3.653 4.550 5.577 77 H ILE 12 H ILE 12 -0.399 8.014 3.907 78 HA ILE 12 HA ILE 12 0.272 9.569 1.639 79 HB ILE 12 HB ILE 12 -1.969 9.873 3.660 80 HG12 ILE 12 HG13 ILE 12 -1.982 7.814 2.167 81 HG13 ILE 12 HG12 ILE 12 -3.374 8.873 1.964 82 HG21 ILE 12 HG21 ILE 12 -1.220 11.561 1.342 83 HG22 ILE 12 HG22 ILE 12 -2.054 11.958 2.861 84 HG23 ILE 12 HG23 ILE 12 -2.941 11.197 1.557 85 HD11 ILE 12 HD11 ILE 12 -0.928 8.916 0.135 86 HD12 ILE 12 HD12 ILE 12 -2.398 9.855 -0.066 87 HD13 ILE 12 HD13 ILE 12 -2.448 8.117 -0.201 88 H ASN 13 H ASN 13 0.180 10.336 5.076 89 HA ASN 13 HA ASN 13 0.691 13.101 4.917 90 HB2 ASN 13 HB3 ASN 13 1.559 11.093 7.018 91 HB3 ASN 13 HB2 ASN 13 1.689 12.831 7.190 92 HD21 ASN 13 HD21 ASN 13 -0.148 10.578 8.403 93 HD22 ASN 13 HD22 ASN 13 -1.685 11.304 8.374 94 H VAL 14 H VAL 14 2.895 10.344 5.112 95 HA VAL 14 HA VAL 14 5.282 11.890 4.911 96 HB VAL 14 HB VAL 14 4.710 8.962 4.446 97 HG11 VAL 14 HG11 VAL 14 7.112 8.646 4.540 98 HG12 VAL 14 HG12 VAL 14 7.383 10.383 4.652 99 HG13 VAL 14 HG13 VAL 14 6.707 9.676 3.170 100 HG21 VAL 14 HG21 VAL 14 4.413 9.516 6.748 101 HG22 VAL 14 HG22 VAL 14 5.793 10.617 6.727 102 HG23 VAL 14 HG23 VAL 14 6.060 8.891 6.646 103 H PHE 15 H PHE 15 3.276 10.151 2.603 104 HA PHE 15 HA PHE 15 4.849 10.505 0.316 105 HB2 PHE 15 HB3 PHE 15 2.793 9.074 0.494 106 HB3 PHE 15 HB2 PHE 15 1.828 10.543 0.486 107 HD1 PHE 15 HD1 PHE 15 4.207 8.500 -1.516 108 HD2 PHE 15 HD2 PHE 15 1.381 11.745 -1.552 109 HE1 PHE 15 HE1 PHE 15 4.258 8.520 -3.988 110 HE2 PHE 15 HE2 PHE 15 1.438 11.759 -4.021 111 HZ PHE 15 HZ PHE 15 2.878 10.141 -5.245 112 H HIS 16 H HIS 16 2.291 12.535 1.708 113 HA HIS 16 HA HIS 16 2.319 14.591 -0.217 114 HB2 HIS 16 HB3 HIS 16 1.414 14.384 2.609 115 HB3 HIS 16 HB2 HIS 16 1.628 15.991 1.950 116 HD1 HIS 16 HD1 HIS 16 0.606 15.941 -0.803 117 HD2 HIS 16 HD2 HIS 16 -1.153 13.708 2.230 118 HE1 HIS 16 HE1 HIS 16 -1.732 15.427 -1.585 119 HE2 HIS 16 HE2 HIS 16 -2.837 14.026 0.251 120 H ALA 17 H ALA 17 4.019 14.301 2.861 121 HA ALA 17 HA ALA 17 5.213 16.794 2.867 122 HB1 ALA 17 HB1 ALA 17 6.904 15.858 4.386 123 HB2 ALA 17 HB2 ALA 17 6.430 14.231 3.924 124 HB3 ALA 17 HB3 ALA 17 5.300 15.262 4.799 125 H HIS 18 H HIS 18 6.513 13.769 1.575 126 HA HIS 18 HA HIS 18 8.830 14.999 0.459 127 HB2 HIS 18 HB3 HIS 18 7.493 12.358 -0.113 128 HB3 HIS 18 HB2 HIS 18 9.005 12.873 -0.848 129 HD1 HIS 18 HD1 HIS 18 11.033 13.523 0.927 130 HD2 HIS 18 HD2 HIS 18 7.806 11.332 2.474 131 HE1 HIS 18 HE1 HIS 18 11.783 12.565 3.141 132 HE2 HIS 18 HE2 HIS 18 9.866 11.243 4.100 133 H SER 19 H SER 19 5.627 14.221 -0.833 134 HA SER 19 HA SER 19 6.086 14.942 -3.516 135 HB2 SER 19 HB3 SER 19 3.548 15.422 -1.916 136 HB3 SER 19 HB2 SER 19 3.705 15.371 -3.656 137 HG SER 19 HG SER 19 4.327 13.211 -1.874 138 H GLY 20 H GLY 20 5.245 16.809 -0.657 139 HA2 GLY 20 HA3 GLY 20 4.815 19.323 -1.767 140 HA3 GLY 20 HA2 GLY 20 5.413 18.990 -0.153 141 H LYS 21 H LYS 21 7.824 17.723 -0.746 142 HA LYS 21 HA LYS 21 9.485 20.011 -0.927 143 HB2 LYS 21 HB3 LYS 21 10.382 17.147 -1.303 144 HB3 LYS 21 HB2 LYS 21 11.347 18.510 -0.752 145 HG2 LYS 21 HG3 LYS 21 9.035 17.217 0.693 146 HG3 LYS 21 HG2 LYS 21 10.712 17.132 1.150 147 HD2 LYS 21 HD3 LYS 21 10.786 19.577 1.486 148 HD3 LYS 21 HD2 LYS 21 9.068 19.709 1.114 149 HE2 LYS 21 HE2 LYS 21 10.298 18.166 3.427 150 HE3 LYS 21 HE1 LYS 21 9.337 19.640 3.531 151 HZ1 LYS 21 HZ1 LYS 21 7.537 18.413 3.581 152 HZ2 LYS 21 HZ2 LYS 21 8.491 17.006 3.519 153 HZ3 LYS 21 HZ3 LYS 21 7.874 17.681 2.093 154 H GLU 22 H GLU 22 8.963 17.333 -3.184 155 HA GLU 22 HA GLU 22 10.881 18.239 -5.026 156 HB2 GLU 22 HB3 GLU 22 8.626 16.259 -5.475 157 HB3 GLU 22 HB2 GLU 22 9.999 16.508 -6.518 158 HG2 GLU 22 HG3 GLU 22 11.566 15.851 -4.731 159 HG3 GLU 22 HG2 GLU 22 10.216 15.759 -3.612 160 H GLY 23 H GLY 23 7.320 18.579 -5.101 161 HA2 GLY 23 HA3 GLY 23 7.103 21.069 -6.039 162 HA3 GLY 23 HA2 GLY 23 7.565 20.236 -7.503 163 H ASP 24 H ASP 24 5.929 17.815 -6.638 164 HA ASP 24 HA ASP 24 3.556 18.660 -8.013 165 HB2 ASP 24 HB3 ASP 24 4.718 16.321 -8.060 166 HB3 ASP 24 HB2 ASP 24 3.753 16.027 -6.631 167 H LYS 25 H LYS 25 1.360 18.204 -7.291 168 HA LYS 25 HA LYS 25 0.600 19.272 -4.701 169 HB2 LYS 25 HB3 LYS 25 -0.921 17.389 -6.534 170 HB3 LYS 25 HB2 LYS 25 -1.540 18.284 -5.157 171 HG2 LYS 25 HG3 LYS 25 -0.370 19.488 -7.614 172 HG3 LYS 25 HG2 LYS 25 -2.077 19.147 -7.294 173 HD2 LYS 25 HD3 LYS 25 -1.994 20.574 -5.240 174 HD3 LYS 25 HD2 LYS 25 -0.333 21.031 -5.645 175 HE2 LYS 25 HE2 LYS 25 -1.125 22.009 -7.787 176 HE3 LYS 25 HE1 LYS 25 -2.748 21.448 -7.336 177 HZ1 LYS 25 HZ1 LYS 25 -1.585 23.056 -5.260 178 HZ2 LYS 25 HZ2 LYS 25 -3.069 23.238 -6.065 179 HZ3 LYS 25 HZ3 LYS 25 -1.655 23.869 -6.736 180 H TYR 26 H TYR 26 0.717 16.145 -6.281 181 HA TYR 26 HA TYR 26 1.498 14.934 -3.921 182 HB2 TYR 26 HB3 TYR 26 -0.529 13.170 -4.274 183 HB3 TYR 26 HB2 TYR 26 -0.611 14.545 -3.173 184 HD1 TYR 26 HD2 TYR 26 -1.643 13.246 -6.498 185 HD2 TYR 26 HD1 TYR 26 -1.953 16.566 -3.749 186 HE1 TYR 26 HE2 TYR 26 -3.484 14.204 -7.822 187 HE2 TYR 26 HE1 TYR 26 -3.788 17.494 -5.096 188 HH TYR 26 HH TYR 26 -5.492 15.761 -7.299 189 H LYS 27 H LYS 27 3.206 14.197 -5.096 190 HA LYS 27 HA LYS 27 2.925 11.811 -6.612 191 HB2 LYS 27 HB3 LYS 27 4.148 14.288 -7.866 192 HB3 LYS 27 HB2 LYS 27 4.563 12.682 -8.393 193 HG2 LYS 27 HG3 LYS 27 1.666 13.643 -8.359 194 HG3 LYS 27 HG2 LYS 27 2.725 13.873 -9.722 195 HD2 LYS 27 HD3 LYS 27 2.203 11.140 -8.518 196 HD3 LYS 27 HD2 LYS 27 1.317 11.820 -9.875 197 HE2 LYS 27 HE2 LYS 27 3.691 12.227 -10.947 198 HE3 LYS 27 HE1 LYS 27 4.210 11.040 -9.751 199 HZ1 LYS 27 HZ1 LYS 27 2.068 10.568 -11.781 200 HZ2 LYS 27 HZ2 LYS 27 2.705 9.401 -10.717 201 HZ3 LYS 27 HZ3 LYS 27 3.673 10.114 -11.901 202 H LEU 28 H LEU 28 5.102 10.768 -6.652 203 HA LEU 28 HA LEU 28 6.979 12.155 -4.871 204 HB2 LEU 28 HB3 LEU 28 5.842 10.312 -3.697 205 HB3 LEU 28 HB2 LEU 28 6.386 9.174 -4.921 206 HG LEU 28 HG LEU 28 8.766 9.908 -4.370 207 HD11 LEU 28 HD11 LEU 28 8.936 10.881 -2.008 208 HD12 LEU 28 HD12 LEU 28 7.249 11.343 -2.189 209 HD13 LEU 28 HD13 LEU 28 8.466 11.996 -3.286 210 HD21 LEU 28 HD21 LEU 28 7.807 7.800 -3.517 211 HD22 LEU 28 HD22 LEU 28 7.097 8.671 -2.155 212 HD23 LEU 28 HD23 LEU 28 8.851 8.553 -2.313 213 H SER 29 H SER 29 8.901 12.431 -5.720 214 HA SER 29 HA SER 29 9.534 10.997 -8.205 215 HB2 SER 29 HB3 SER 29 11.148 13.362 -7.424 216 HB3 SER 29 HB2 SER 29 10.489 12.895 -8.979 217 HG SER 29 HG SER 29 9.108 13.952 -6.754 218 H LYS 30 H LYS 30 12.134 11.044 -8.345 219 HA LYS 30 HA LYS 30 12.823 9.180 -6.230 220 HB2 LYS 30 HB3 LYS 30 14.609 10.095 -8.470 221 HB3 LYS 30 HB2 LYS 30 14.727 8.597 -7.555 222 HG2 LYS 30 HG3 LYS 30 12.550 9.406 -9.495 223 HG3 LYS 30 HG2 LYS 30 13.713 8.143 -9.761 224 HD2 LYS 30 HD3 LYS 30 12.139 7.734 -7.240 225 HD3 LYS 30 HD2 LYS 30 11.185 7.747 -8.695 226 HE2 LYS 30 HE2 LYS 30 13.339 5.860 -7.886 227 HE3 LYS 30 HE1 LYS 30 11.763 5.506 -8.559 228 HZ1 LYS 30 HZ1 LYS 30 13.003 6.861 -10.633 229 HZ2 LYS 30 HZ2 LYS 30 13.036 5.183 -10.488 230 HZ3 LYS 30 HZ3 LYS 30 14.271 6.079 -9.862 231 H LYS 31 H LYS 31 13.044 12.461 -6.432 232 HA LYS 31 HA LYS 31 15.638 12.993 -5.322 233 HB2 LYS 31 HB3 LYS 31 13.239 14.654 -4.606 234 HB3 LYS 31 HB2 LYS 31 14.870 15.168 -4.993 235 HG2 LYS 31 HG3 LYS 31 14.464 14.472 -7.409 236 HG3 LYS 31 HG2 LYS 31 12.844 14.075 -6.935 237 HD2 LYS 31 HD3 LYS 31 12.463 16.415 -6.220 238 HD3 LYS 31 HD2 LYS 31 14.079 16.808 -6.819 239 HE2 LYS 31 HE2 LYS 31 13.191 15.556 -8.967 240 HE3 LYS 31 HE1 LYS 31 11.647 15.970 -8.306 241 HZ1 LYS 31 HZ1 LYS 31 11.984 17.925 -9.414 242 HZ2 LYS 31 HZ2 LYS 31 13.658 17.851 -9.325 243 HZ3 LYS 31 HZ3 LYS 31 12.761 18.345 -7.990 244 H GLU 32 H GLU 32 12.405 12.553 -4.073 245 HA GLU 32 HA GLU 32 13.336 12.561 -1.320 246 HB2 GLU 32 HB3 GLU 32 10.595 12.573 -2.564 247 HB3 GLU 32 HB2 GLU 32 10.937 12.591 -0.826 248 HG2 GLU 32 HG3 GLU 32 11.960 14.649 -2.805 249 HG3 GLU 32 HG2 GLU 32 10.532 14.863 -1.796 250 H LEU 33 H LEU 33 11.674 10.385 -3.579 251 HA LEU 33 HA LEU 33 10.861 8.482 -1.750 252 HB2 LEU 33 HB3 LEU 33 10.112 8.447 -4.082 253 HB3 LEU 33 HB2 LEU 33 11.723 8.017 -4.598 254 HG LEU 33 HG LEU 33 9.977 6.108 -4.400 255 HD11 LEU 33 HD11 LEU 33 11.661 4.671 -4.416 256 HD12 LEU 33 HD12 LEU 33 12.281 5.173 -2.860 257 HD13 LEU 33 HD13 LEU 33 12.715 6.075 -4.309 258 HD21 LEU 33 HD21 LEU 33 9.027 6.461 -2.215 259 HD22 LEU 33 HD22 LEU 33 10.605 6.538 -1.426 260 HD23 LEU 33 HD23 LEU 33 10.027 5.039 -2.096 261 H LYS 34 H LYS 34 13.926 8.590 -3.518 262 HA LYS 34 HA LYS 34 14.918 6.138 -2.567 263 HB2 LYS 34 HB3 LYS 34 16.363 8.650 -3.454 264 HB3 LYS 34 HB2 LYS 34 17.162 7.125 -3.098 265 HG2 LYS 34 HG3 LYS 34 15.896 5.970 -4.852 266 HG3 LYS 34 HG2 LYS 34 14.946 7.414 -5.160 267 HD2 LYS 34 HD3 LYS 34 16.688 7.291 -6.859 268 HD3 LYS 34 HD2 LYS 34 17.022 8.634 -5.783 269 HE2 LYS 34 HE2 LYS 34 18.996 7.082 -6.371 270 HE3 LYS 34 HE1 LYS 34 18.775 7.505 -4.686 271 HZ1 LYS 34 HZ1 LYS 34 17.620 5.036 -5.874 272 HZ2 LYS 34 HZ2 LYS 34 17.827 5.390 -4.214 273 HZ3 LYS 34 HZ3 LYS 34 19.151 5.101 -5.218 274 H GLU 35 H GLU 35 15.127 9.413 -1.359 275 HA GLU 35 HA GLU 35 16.735 8.793 0.933 276 HB2 GLU 35 HB3 GLU 35 14.919 11.154 0.390 277 HB3 GLU 35 HB2 GLU 35 16.195 11.047 1.604 278 HG2 GLU 35 HG3 GLU 35 16.659 10.793 -1.392 279 HG3 GLU 35 HG2 GLU 35 16.982 12.236 -0.486 280 H LEU 36 H LEU 36 13.329 9.325 0.281 281 HA LEU 36 HA LEU 36 12.281 9.154 2.870 282 HB2 LEU 36 HB3 LEU 36 10.768 10.018 1.380 283 HB3 LEU 36 HB2 LEU 36 11.253 8.937 0.095 284 HG LEU 36 HG LEU 36 10.086 7.071 1.201 285 HD11 LEU 36 HD11 LEU 36 9.589 7.227 3.356 286 HD12 LEU 36 HD12 LEU 36 8.343 8.382 2.921 287 HD13 LEU 36 HD13 LEU 36 9.942 8.962 3.408 288 HD21 LEU 36 HD21 LEU 36 8.878 9.416 0.016 289 HD22 LEU 36 HD22 LEU 36 7.749 8.642 1.131 290 HD23 LEU 36 HD23 LEU 36 8.490 7.712 -0.174 291 H LEU 37 H LEU 37 12.592 6.621 0.397 292 HA LEU 37 HA LEU 37 11.266 4.718 1.926 293 HB2 LEU 37 HB3 LEU 37 11.551 4.412 -0.476 294 HB3 LEU 37 HB2 LEU 37 13.290 4.264 -0.301 295 HG LEU 37 HG LEU 37 11.881 2.107 -0.560 296 HD11 LEU 37 HD11 LEU 37 14.340 2.498 0.465 297 HD12 LEU 37 HD12 LEU 37 13.572 0.921 0.396 298 HD13 LEU 37 HD13 LEU 37 13.549 1.829 1.897 299 HD21 LEU 37 HD21 LEU 37 10.292 2.948 1.364 300 HD22 LEU 37 HD22 LEU 37 11.534 2.263 2.423 301 HD23 LEU 37 HD23 LEU 37 10.729 1.250 1.248 302 H GLN 38 H GLN 38 14.720 5.302 1.619 303 HA GLN 38 HA GLN 38 15.456 3.275 3.478 304 HB2 GLN 38 HB3 GLN 38 17.631 4.446 3.637 305 HB3 GLN 38 HB2 GLN 38 17.170 4.201 1.958 306 HG2 GLN 38 HG3 GLN 38 16.242 6.574 1.989 307 HG3 GLN 38 HG2 GLN 38 16.980 6.762 3.580 308 HE21 GLN 38 HE21 GLN 38 17.565 6.721 0.172 309 HE22 GLN 38 HE22 GLN 38 19.238 6.993 0.250 310 H THR 39 H THR 39 14.758 6.709 3.772 311 HA THR 39 HA THR 39 15.461 6.994 6.458 312 HB THR 39 HB THR 39 13.495 8.532 4.775 313 HG1 THR 39 HG2 THR 39 15.398 8.786 3.886 314 HG21 THR 39 HG21 THR 39 12.956 9.158 6.902 315 HG22 THR 39 HG22 THR 39 14.168 10.355 6.470 316 HG23 THR 39 HG23 THR 39 14.596 9.001 7.537 317 H GLU 40 H GLU 40 12.167 6.499 5.062 318 HA GLU 40 HA GLU 40 11.079 6.444 7.697 319 HB2 GLU 40 HB3 GLU 40 9.770 5.855 5.045 320 HB3 GLU 40 HB2 GLU 40 8.925 5.938 6.595 321 HG2 GLU 40 HG3 GLU 40 10.574 8.186 5.400 322 HG3 GLU 40 HG2 GLU 40 8.812 8.111 5.428 323 H LEU 41 H LEU 41 11.840 3.913 5.407 324 HA LEU 41 HA LEU 41 10.727 1.914 7.210 325 HB2 LEU 41 HB3 LEU 41 11.822 1.894 4.452 326 HB3 LEU 41 HB2 LEU 41 11.860 0.396 5.328 327 HG LEU 41 HG LEU 41 9.398 0.708 5.892 328 HD11 LEU 41 HD11 LEU 41 9.677 2.972 3.903 329 HD12 LEU 41 HD12 LEU 41 9.160 3.078 5.590 330 HD13 LEU 41 HD13 LEU 41 8.141 2.273 4.410 331 HD21 LEU 41 HD21 LEU 41 8.802 -0.468 4.035 332 HD22 LEU 41 HD22 LEU 41 10.530 -0.448 3.685 333 HD23 LEU 41 HD23 LEU 41 9.458 0.733 2.928 334 H SER 42 H SER 42 12.753 3.420 8.311 335 HA SER 42 HA SER 42 15.325 2.638 8.247 336 HB2 SER 42 HB3 SER 42 14.854 2.801 10.953 337 HB3 SER 42 HB2 SER 42 15.178 4.148 9.877 338 HG SER 42 HG SER 42 12.551 3.047 10.270 339 H GLY 43 H GLY 43 12.870 0.998 10.263 340 HA2 GLY 43 HA3 GLY 43 14.623 -1.049 11.141 341 HA3 GLY 43 HA2 GLY 43 12.863 -1.073 11.236 342 H PHE 44 H PHE 44 12.263 -0.878 8.545 343 HA PHE 44 HA PHE 44 12.524 -3.623 7.755 344 HB2 PHE 44 HB3 PHE 44 11.340 -1.214 6.415 345 HB3 PHE 44 HB2 PHE 44 11.500 -2.732 5.533 346 HD1 PHE 44 HD2 PHE 44 10.497 -4.836 6.642 347 HD2 PHE 44 HD1 PHE 44 9.515 -0.840 7.868 348 HE1 PHE 44 HE2 PHE 44 8.433 -5.678 7.737 349 HE2 PHE 44 HE1 PHE 44 7.455 -1.684 8.954 350 HZ PHE 44 HZ PHE 44 6.918 -4.109 8.887 351 H LEU 45 H LEU 45 13.914 -0.603 6.713 352 HA LEU 45 HA LEU 45 15.462 -1.600 4.593 353 HB2 LEU 45 HB3 LEU 45 15.087 0.749 4.809 354 HB3 LEU 45 HB2 LEU 45 15.790 0.787 6.419 355 HG LEU 45 HG LEU 45 17.889 0.079 5.554 356 HD11 LEU 45 HD11 LEU 45 18.122 0.378 2.903 357 HD12 LEU 45 HD12 LEU 45 16.397 0.041 2.910 358 HD13 LEU 45 HD13 LEU 45 17.539 -1.147 3.553 359 HD21 LEU 45 HD21 LEU 45 16.738 2.610 5.218 360 HD22 LEU 45 HD22 LEU 45 17.647 2.329 3.722 361 HD23 LEU 45 HD23 LEU 45 18.455 2.229 5.279 362 H ASP 46 H ASP 46 16.194 -1.043 8.033 363 HA ASP 46 HA ASP 46 18.841 -2.009 7.952 364 HB2 ASP 46 HB3 ASP 46 18.070 -0.696 9.805 365 HB3 ASP 46 HB2 ASP 46 16.856 -1.897 10.223 366 H ALA 47 H ALA 47 15.755 -3.573 8.596 367 HA ALA 47 HA ALA 47 16.933 -6.113 9.194 368 HB1 ALA 47 HB1 ALA 47 14.872 -5.784 10.238 369 HB2 ALA 47 HB2 ALA 47 14.485 -6.889 8.924 370 HB3 ALA 47 HB3 ALA 47 14.127 -5.167 8.769 371 H GLN 48 H GLN 48 16.413 -4.496 6.286 372 HA GLN 48 HA GLN 48 16.317 -7.053 4.805 373 HB2 GLN 48 HB3 GLN 48 15.378 -4.308 3.963 374 HB3 GLN 48 HB2 GLN 48 15.467 -5.710 2.899 375 HG2 GLN 48 HG3 GLN 48 13.871 -5.657 5.486 376 HG3 GLN 48 HG2 GLN 48 13.182 -5.444 3.878 377 HE21 GLN 48 HE21 GLN 48 14.513 -7.792 6.111 378 HE22 GLN 48 HE22 GLN 48 14.205 -9.158 5.161 379 H LYS 49 H LYS 49 18.568 -5.025 5.795 380 HA LYS 49 HA LYS 49 20.075 -4.500 3.442 381 HB2 LYS 49 HB3 LYS 49 21.047 -4.975 6.274 382 HB3 LYS 49 HB2 LYS 49 22.049 -4.398 4.946 383 HG2 LYS 49 HG3 LYS 49 20.522 -2.448 4.636 384 HG3 LYS 49 HG2 LYS 49 19.588 -2.989 6.027 385 HD2 LYS 49 HD3 LYS 49 22.520 -2.229 6.087 386 HD3 LYS 49 HD2 LYS 49 21.180 -1.212 6.617 387 HE2 LYS 49 HE2 LYS 49 20.585 -3.317 8.144 388 HE3 LYS 49 HE1 LYS 49 22.285 -3.692 7.873 389 HZ1 LYS 49 HZ1 LYS 49 22.821 -2.193 9.419 390 HZ2 LYS 49 HZ2 LYS 49 21.164 -1.909 9.647 391 HZ3 LYS 49 HZ3 LYS 49 22.023 -0.956 8.564 392 H ASP 50 H ASP 50 19.650 -7.293 5.450 393 HA ASP 50 HA ASP 50 21.763 -8.808 4.207 394 HB2 ASP 50 HB3 ASP 50 20.850 -10.676 5.539 395 HB3 ASP 50 HB2 ASP 50 21.256 -9.278 6.520 396 H VAL 51 H VAL 51 19.025 -7.722 2.864 397 HA VAL 51 HA VAL 51 18.391 -10.294 1.570 398 HB VAL 51 HB VAL 51 16.622 -7.932 2.226 399 HG11 VAL 51 HG11 VAL 51 14.794 -9.298 1.269 400 HG12 VAL 51 HG12 VAL 51 15.991 -10.408 0.628 401 HG13 VAL 51 HG13 VAL 51 15.946 -8.722 0.068 402 HG21 VAL 51 HG21 VAL 51 16.591 -10.836 3.121 403 HG22 VAL 51 HG22 VAL 51 15.391 -9.628 3.559 404 HG23 VAL 51 HG23 VAL 51 17.054 -9.459 4.121 405 H ASP 52 H ASP 52 18.621 -10.402 -0.527 406 HA ASP 52 HA ASP 52 19.830 -8.383 -2.123 407 HB2 ASP 52 HB3 ASP 52 20.167 -10.695 -2.613 408 HB3 ASP 52 HB2 ASP 52 18.432 -10.946 -2.796 409 H ALA 53 H ALA 53 16.559 -9.559 -1.802 410 HA ALA 53 HA ALA 53 15.428 -8.436 -4.034 411 HB1 ALA 53 HB1 ALA 53 14.113 -9.059 -1.385 412 HB2 ALA 53 HB2 ALA 53 14.178 -10.065 -2.833 413 HB3 ALA 53 HB3 ALA 53 13.232 -8.583 -2.835 414 H VAL 54 H VAL 54 15.949 -6.818 -0.928 415 HA VAL 54 HA VAL 54 14.182 -4.727 -1.352 416 HB VAL 54 HB VAL 54 15.229 -5.036 0.831 417 HG11 VAL 54 HG11 VAL 54 17.515 -4.759 1.266 418 HG12 VAL 54 HG12 VAL 54 17.795 -3.861 -0.208 419 HG13 VAL 54 HG13 VAL 54 17.523 -5.603 -0.276 420 HG21 VAL 54 HG21 VAL 54 15.001 -2.458 -0.480 421 HG22 VAL 54 HG22 VAL 54 16.410 -2.436 0.553 422 HG23 VAL 54 HG23 VAL 54 14.849 -2.836 1.237 423 H ASP 55 H ASP 55 17.574 -4.924 -2.317 424 HA ASP 55 HA ASP 55 17.808 -2.367 -3.495 425 HB2 ASP 55 HB3 ASP 55 19.771 -3.764 -3.165 426 HB3 ASP 55 HB2 ASP 55 19.117 -4.998 -4.221 427 H LYS 56 H LYS 56 16.890 -5.478 -4.831 428 HA LYS 56 HA LYS 56 16.372 -4.474 -7.433 429 HB2 LYS 56 HB3 LYS 56 15.727 -7.110 -6.119 430 HB3 LYS 56 HB2 LYS 56 15.153 -6.704 -7.733 431 HG2 LYS 56 HG3 LYS 56 17.212 -7.740 -8.188 432 HG3 LYS 56 HG2 LYS 56 17.608 -6.029 -8.268 433 HD2 LYS 56 HD3 LYS 56 18.390 -6.216 -5.818 434 HD3 LYS 56 HD2 LYS 56 18.160 -7.956 -5.980 435 HE2 LYS 56 HE2 LYS 56 20.453 -7.420 -6.379 436 HE3 LYS 56 HE1 LYS 56 19.745 -7.922 -7.913 437 HZ1 LYS 56 HZ1 LYS 56 19.929 -5.042 -7.101 438 HZ2 LYS 56 HZ2 LYS 56 19.671 -5.684 -8.663 439 HZ3 LYS 56 HZ3 LYS 56 21.166 -5.843 -7.915 440 H VAL 57 H VAL 57 14.276 -5.068 -4.656 441 HA VAL 57 HA VAL 57 11.833 -4.372 -5.931 442 HB VAL 57 HB VAL 57 12.760 -4.062 -3.054 443 HG11 VAL 57 HG11 VAL 57 10.131 -4.034 -2.762 444 HG12 VAL 57 HG12 VAL 57 10.174 -3.343 -4.382 445 HG13 VAL 57 HG13 VAL 57 11.026 -2.551 -3.056 446 HG21 VAL 57 HG21 VAL 57 10.630 -5.972 -3.927 447 HG22 VAL 57 HG22 VAL 57 11.796 -6.101 -2.629 448 HG23 VAL 57 HG23 VAL 57 12.306 -6.412 -4.293 449 H MET 58 H MET 58 14.296 -2.536 -4.195 450 HA MET 58 HA MET 58 13.180 0.058 -4.398 451 HB2 MET 58 HB3 MET 58 16.008 -1.004 -4.207 452 HB3 MET 58 HB2 MET 58 15.625 0.717 -4.229 453 HG2 MET 58 HG3 MET 58 14.097 -1.001 -2.439 454 HG3 MET 58 HG2 MET 58 15.767 -0.723 -1.955 455 HE1 MET 58 HE1 MET 58 16.857 1.238 -2.375 456 HE2 MET 58 HE2 MET 58 16.499 2.360 -1.070 457 HE3 MET 58 HE3 MET 58 16.184 2.838 -2.737 458 H LYS 59 H LYS 59 15.411 -1.791 -6.382 459 HA LYS 59 HA LYS 59 15.890 0.225 -8.258 460 HB2 LYS 59 HB3 LYS 59 17.366 -1.672 -7.810 461 HB3 LYS 59 HB2 LYS 59 16.210 -2.759 -8.588 462 HG2 LYS 59 HG3 LYS 59 17.924 -2.176 -10.197 463 HG3 LYS 59 HG2 LYS 59 16.426 -1.391 -10.693 464 HD2 LYS 59 HD3 LYS 59 17.152 0.746 -9.999 465 HD3 LYS 59 HD2 LYS 59 18.356 0.097 -8.900 466 HE2 LYS 59 HE2 LYS 59 19.227 1.121 -11.070 467 HE3 LYS 59 HE1 LYS 59 19.807 -0.480 -10.607 468 HZ1 LYS 59 HZ1 LYS 59 18.280 -1.506 -12.152 469 HZ2 LYS 59 HZ2 LYS 59 19.177 -0.341 -12.957 470 HZ3 LYS 59 HZ3 LYS 59 17.577 -0.018 -12.589 471 H GLU 60 H GLU 60 13.687 -2.578 -8.323 472 HA GLU 60 HA GLU 60 12.730 -2.168 -10.938 473 HB2 GLU 60 HB3 GLU 60 12.235 -4.234 -9.706 474 HB3 GLU 60 HB2 GLU 60 11.261 -3.330 -8.549 475 HG2 GLU 60 HG3 GLU 60 9.740 -4.355 -10.142 476 HG3 GLU 60 HG2 GLU 60 9.742 -2.637 -10.430 477 H LEU 61 H LEU 61 11.568 -0.970 -7.842 478 HA LEU 61 HA LEU 61 9.492 0.648 -8.931 479 HB2 LEU 61 HB3 LEU 61 10.933 0.544 -6.311 480 HB3 LEU 61 HB2 LEU 61 9.908 1.925 -6.662 481 HG LEU 61 HG LEU 61 8.803 -0.091 -5.447 482 HD11 LEU 61 HD11 LEU 61 7.586 1.819 -6.500 483 HD12 LEU 61 HD12 LEU 61 6.701 0.302 -6.495 484 HD13 LEU 61 HD13 LEU 61 7.458 0.860 -7.976 485 HD21 LEU 61 HD21 LEU 61 8.626 -1.196 -8.281 486 HD22 LEU 61 HD22 LEU 61 8.057 -1.924 -6.795 487 HD23 LEU 61 HD23 LEU 61 9.778 -1.811 -7.088 488 H ASP 62 H ASP 62 12.914 1.170 -8.207 489 HA ASP 62 HA ASP 62 12.920 3.896 -8.810 490 HB2 ASP 62 HB3 ASP 62 14.834 2.861 -7.710 491 HB3 ASP 62 HB2 ASP 62 15.198 1.946 -9.175 492 H GLU 63 H GLU 63 13.392 1.037 -10.826 493 HA GLU 63 HA GLU 63 14.019 2.259 -13.278 494 HB2 GLU 63 HB3 GLU 63 12.379 -0.238 -12.713 495 HB3 GLU 63 HB2 GLU 63 12.947 0.257 -14.297 496 HG2 GLU 63 HG3 GLU 63 14.791 -0.242 -11.950 497 HG3 GLU 63 HG2 GLU 63 14.362 -1.431 -13.177 498 H ASN 64 H ASN 64 10.921 1.432 -11.825 499 HA ASN 64 HA ASN 64 9.315 2.483 -13.927 500 HB2 ASN 64 HB3 ASN 64 8.720 0.960 -11.878 501 HB3 ASN 64 HB2 ASN 64 8.371 2.536 -11.132 502 HD21 ASN 64 HD21 ASN 64 6.435 0.322 -12.204 503 HD22 ASN 64 HD22 ASN 64 5.377 1.182 -13.200 504 H GLY 65 H GLY 65 10.550 3.766 -10.911 505 HA2 GLY 65 HA3 GLY 65 9.332 6.346 -11.168 506 HA3 GLY 65 HA2 GLY 65 10.658 5.965 -10.080 507 H ASP 66 H ASP 66 10.504 5.654 -13.591 508 HA ASP 66 HA ASP 66 13.040 6.869 -13.959 509 HB2 ASP 66 HB3 ASP 66 11.889 5.302 -15.560 510 HB3 ASP 66 HB2 ASP 66 10.849 6.644 -16.024 511 H GLY 67 H GLY 67 9.754 7.939 -13.919 512 HA2 GLY 67 HA3 GLY 67 10.634 10.758 -14.251 513 HA3 GLY 67 HA2 GLY 67 9.003 10.177 -14.569 514 H GLU 68 H GLU 68 7.993 8.984 -12.668 515 HA GLU 68 HA GLU 68 8.738 10.150 -10.072 516 HB2 GLU 68 HB3 GLU 68 5.854 10.000 -10.462 517 HB3 GLU 68 HB2 GLU 68 6.791 11.285 -9.731 518 HG2 GLU 68 HG3 GLU 68 5.942 12.339 -11.633 519 HG3 GLU 68 HG2 GLU 68 7.516 11.795 -12.215 520 H VAL 69 H VAL 69 7.377 9.150 -8.331 521 HA VAL 69 HA VAL 69 6.474 6.463 -8.974 522 HB VAL 69 HB VAL 69 8.499 5.978 -7.867 523 HG11 VAL 69 HG11 VAL 69 9.317 7.133 -5.888 524 HG12 VAL 69 HG12 VAL 69 7.849 8.096 -5.799 525 HG13 VAL 69 HG13 VAL 69 8.974 8.325 -7.132 526 HG21 VAL 69 HG21 VAL 69 6.346 6.078 -5.709 527 HG22 VAL 69 HG22 VAL 69 7.825 5.133 -5.614 528 HG23 VAL 69 HG23 VAL 69 6.631 4.769 -6.851 529 H ASP 70 H ASP 70 4.379 6.192 -8.250 530 HA ASP 70 HA ASP 70 3.259 8.520 -6.879 531 HB2 ASP 70 HB3 ASP 70 1.323 8.178 -7.960 532 HB3 ASP 70 HB2 ASP 70 2.315 7.199 -9.026 533 H PHE 71 H PHE 71 1.179 7.862 -5.596 534 HA PHE 71 HA PHE 71 2.158 6.904 -3.152 535 HB2 PHE 71 HB3 PHE 71 0.176 8.429 -3.367 536 HB3 PHE 71 HB2 PHE 71 -0.752 7.038 -3.939 537 HD1 PHE 71 HD1 PHE 71 1.621 7.846 -1.160 538 HD2 PHE 71 HD2 PHE 71 -2.028 5.880 -2.317 539 HE1 PHE 71 HE1 PHE 71 1.253 7.163 1.174 540 HE2 PHE 71 HE2 PHE 71 -2.386 5.206 0.054 541 HZ PHE 71 HZ PHE 71 -0.759 5.837 1.782 542 H GLN 72 H GLN 72 0.169 5.397 -5.663 543 HA GLN 72 HA GLN 72 -0.295 2.953 -4.341 544 HB2 GLN 72 HB3 GLN 72 -0.192 3.667 -7.273 545 HB3 GLN 72 HB2 GLN 72 -0.630 2.057 -6.694 546 HG2 GLN 72 HG3 GLN 72 -2.481 3.017 -5.409 547 HG3 GLN 72 HG2 GLN 72 -2.036 4.644 -5.934 548 HE21 GLN 72 HE21 GLN 72 -3.656 5.233 -7.447 549 HE22 GLN 72 HE22 GLN 72 -4.142 4.251 -8.730 550 H GLU 73 H GLU 73 2.287 4.014 -6.539 551 HA GLU 73 HA GLU 73 3.744 1.572 -6.434 552 HB2 GLU 73 HB3 GLU 73 4.580 4.387 -7.141 553 HB3 GLU 73 HB2 GLU 73 5.673 3.000 -7.222 554 HG2 GLU 73 HG3 GLU 73 4.169 1.861 -8.762 555 HG3 GLU 73 HG2 GLU 73 3.024 3.177 -8.679 556 H TYR 74 H TYR 74 3.826 4.556 -4.585 557 HA TYR 74 HA TYR 74 6.088 4.016 -3.016 558 HB2 TYR 74 HB3 TYR 74 5.218 6.249 -3.079 559 HB3 TYR 74 HB2 TYR 74 3.653 5.694 -2.506 560 HD1 TYR 74 HD1 TYR 74 7.258 5.310 -1.296 561 HD2 TYR 74 HD2 TYR 74 3.171 6.317 -0.323 562 HE1 TYR 74 HE1 TYR 74 7.905 5.715 1.013 563 HE2 TYR 74 HE2 TYR 74 3.856 6.729 2.017 564 HH TYR 74 HH TYR 74 7.135 6.927 2.974 565 H VAL 75 H VAL 75 2.633 3.305 -2.315 566 HA VAL 75 HA VAL 75 3.227 2.139 0.180 567 HB VAL 75 HB VAL 75 1.020 1.164 0.179 568 HG11 VAL 75 HG11 VAL 75 0.467 3.764 -1.168 569 HG12 VAL 75 HG12 VAL 75 1.524 3.800 0.239 570 HG13 VAL 75 HG13 VAL 75 -0.099 3.149 0.378 571 HG21 VAL 75 HG21 VAL 75 1.141 0.550 -2.396 572 HG22 VAL 75 HG22 VAL 75 0.528 2.174 -2.627 573 HG23 VAL 75 HG23 VAL 75 -0.386 1.002 -1.687 574 H VAL 76 H VAL 76 2.986 0.704 -3.067 575 HA VAL 76 HA VAL 76 3.293 -1.917 -2.074 576 HB VAL 76 HB VAL 76 2.280 -1.497 -4.271 577 HG11 VAL 76 HG11 VAL 76 3.823 -1.038 -6.205 578 HG12 VAL 76 HG12 VAL 76 5.084 -0.626 -5.037 579 HG13 VAL 76 HG13 VAL 76 3.572 0.288 -5.084 580 HG21 VAL 76 HG21 VAL 76 3.215 -3.412 -5.354 581 HG22 VAL 76 HG22 VAL 76 3.468 -3.681 -3.636 582 HG23 VAL 76 HG23 VAL 76 4.805 -3.134 -4.642 583 H LEU 77 H LEU 77 5.569 0.534 -3.144 584 HA LEU 77 HA LEU 77 7.820 -1.115 -3.263 585 HB2 LEU 77 HB3 LEU 77 7.898 1.183 -4.117 586 HB3 LEU 77 HB2 LEU 77 7.592 1.806 -2.511 587 HG LEU 77 HG LEU 77 9.765 0.938 -1.704 588 HD11 LEU 77 HD11 LEU 77 9.719 -0.883 -3.815 589 HD12 LEU 77 HD12 LEU 77 11.079 -0.477 -2.796 590 HD13 LEU 77 HD13 LEU 77 10.890 0.331 -4.326 591 HD21 LEU 77 HD21 LEU 77 9.548 3.202 -2.847 592 HD22 LEU 77 HD22 LEU 77 10.216 2.444 -4.293 593 HD23 LEU 77 HD23 LEU 77 11.173 2.523 -2.817 594 H VAL 78 H VAL 78 6.484 0.778 -0.571 595 HA VAL 78 HA VAL 78 8.377 -0.265 1.300 596 HB VAL 78 HB VAL 78 7.099 0.855 3.013 597 HG11 VAL 78 HG11 VAL 78 7.632 2.983 2.300 598 HG12 VAL 78 HG12 VAL 78 6.740 2.809 0.800 599 HG13 VAL 78 HG13 VAL 78 8.346 2.115 0.938 600 HG21 VAL 78 HG21 VAL 78 5.018 1.298 0.852 601 HG22 VAL 78 HG22 VAL 78 4.941 1.972 2.470 602 HG23 VAL 78 HG23 VAL 78 4.794 0.234 2.242 603 H ALA 79 H ALA 79 5.035 -1.091 0.434 604 HA ALA 79 HA ALA 79 4.711 -3.078 2.412 605 HB1 ALA 79 HB1 ALA 79 2.840 -2.074 1.137 606 HB2 ALA 79 HB2 ALA 79 2.810 -3.841 1.157 607 HB3 ALA 79 HB3 ALA 79 3.368 -2.987 -0.281 608 H ALA 80 H ALA 80 5.965 -3.191 -0.886 609 HA ALA 80 HA ALA 80 6.151 -5.954 -1.202 610 HB1 ALA 80 HB1 ALA 80 8.139 -5.369 -2.694 611 HB2 ALA 80 HB2 ALA 80 7.875 -3.692 -2.219 612 HB3 ALA 80 HB3 ALA 80 6.622 -4.561 -3.094 613 H LEU 81 H LEU 81 8.404 -3.617 0.126 614 HA LEU 81 HA LEU 81 10.361 -5.479 1.023 615 HB2 LEU 81 HB3 LEU 81 9.667 -2.685 1.941 616 HB3 LEU 81 HB2 LEU 81 11.065 -3.592 2.509 617 HG LEU 81 HG LEU 81 10.532 -3.012 -0.428 618 HD11 LEU 81 HD11 LEU 81 12.587 -1.482 -0.059 619 HD12 LEU 81 HD12 LEU 81 12.152 -1.529 1.648 620 HD13 LEU 81 HD13 LEU 81 11.013 -0.896 0.458 621 HD21 LEU 81 HD21 LEU 81 13.060 -3.523 -0.396 622 HD22 LEU 81 HD22 LEU 81 11.943 -4.876 -0.368 623 HD23 LEU 81 HD23 LEU 81 12.753 -4.361 1.122 624 H THR 82 H THR 82 7.507 -4.013 2.485 625 HA THR 82 HA THR 82 7.852 -5.018 5.084 626 HB THR 82 HB THR 82 5.219 -4.575 3.704 627 HG1 THR 82 HG2 THR 82 6.846 -2.760 3.597 628 HG21 THR 82 HG21 THR 82 5.999 -4.240 6.607 629 HG22 THR 82 HG22 THR 82 5.199 -5.656 5.931 630 HG23 THR 82 HG23 THR 82 4.376 -4.113 5.925 631 H VAL 83 H VAL 83 5.939 -6.352 2.353 632 HA VAL 83 HA VAL 83 5.192 -8.678 3.780 633 HB VAL 83 HB VAL 83 4.019 -7.907 1.721 634 HG11 VAL 83 HG11 VAL 83 5.912 -7.284 0.360 635 HG12 VAL 83 HG12 VAL 83 4.912 -8.474 -0.475 636 HG13 VAL 83 HG13 VAL 83 6.432 -8.970 0.239 637 HG21 VAL 83 HG21 VAL 83 3.796 -10.179 0.650 638 HG22 VAL 83 HG22 VAL 83 3.555 -10.176 2.392 639 HG23 VAL 83 HG23 VAL 83 5.077 -10.756 1.709 640 H ALA 84 H ALA 84 7.879 -8.000 1.596 641 HA ALA 84 HA ALA 84 9.000 -10.563 1.573 642 HB1 ALA 84 HB1 ALA 84 11.071 -9.493 0.926 643 HB2 ALA 84 HB2 ALA 84 10.499 -7.935 1.515 644 HB3 ALA 84 HB3 ALA 84 9.734 -8.681 0.112 645 H MET 85 H MET 85 9.684 -7.794 3.720 646 HA MET 85 HA MET 85 11.443 -9.335 5.332 647 HB2 MET 85 HB3 MET 85 11.541 -6.845 5.207 648 HB3 MET 85 HB2 MET 85 10.039 -6.802 6.134 649 HG2 MET 85 HG3 MET 85 11.113 -8.112 7.954 650 HG3 MET 85 HG2 MET 85 12.624 -8.080 7.066 651 HE1 MET 85 HE1 MET 85 11.998 -7.381 9.844 652 HE2 MET 85 HE2 MET 85 10.649 -6.236 9.835 653 HE3 MET 85 HE3 MET 85 12.242 -5.689 10.336 654 H ASN 86 H ASN 86 8.040 -8.338 5.728 655 HA ASN 86 HA ASN 86 7.789 -9.461 8.290 656 HB2 ASN 86 HB3 ASN 86 5.766 -8.492 6.295 657 HB3 ASN 86 HB2 ASN 86 5.240 -9.459 7.653 658 HD21 ASN 86 HD21 ASN 86 6.322 -8.695 9.900 659 HD22 ASN 86 HD22 ASN 86 6.324 -7.022 10.093 660 H ASN 87 H ASN 87 7.686 -10.839 5.165 661 HA ASN 87 HA ASN 87 6.224 -13.179 5.614 662 HB2 ASN 87 HB3 ASN 87 7.083 -12.525 3.404 663 HB3 ASN 87 HB2 ASN 87 8.735 -12.812 3.954 664 HD21 ASN 87 HD21 ASN 87 9.415 -15.027 4.194 665 HD22 ASN 87 HD22 ASN 87 8.460 -16.310 3.637 666 H PHE 88 H PHE 88 9.514 -12.266 6.488 667 HA PHE 88 HA PHE 88 10.461 -14.782 7.343 668 HB2 PHE 88 HB3 PHE 88 11.177 -11.990 8.274 669 HB3 PHE 88 HB2 PHE 88 11.958 -13.439 8.864 670 HD1 PHE 88 HD1 PHE 88 12.871 -15.109 7.025 671 HD2 PHE 88 HD2 PHE 88 12.057 -10.941 6.367 672 HE1 PHE 88 HE1 PHE 88 14.410 -15.120 5.084 673 HE2 PHE 88 HE2 PHE 88 13.595 -10.961 4.401 674 HZ PHE 88 HZ PHE 88 14.770 -13.044 3.771 675 H PHE 89 H PHE 89 8.647 -12.264 9.048 676 HA PHE 89 HA PHE 89 8.868 -13.216 11.659 677 HB2 PHE 89 HB3 PHE 89 6.752 -11.677 10.210 678 HB3 PHE 89 HB2 PHE 89 6.397 -12.229 11.812 679 HD1 PHE 89 HD2 PHE 89 8.702 -10.153 9.784 680 HD2 PHE 89 HD1 PHE 89 7.481 -11.226 13.763 681 HE1 PHE 89 HE2 PHE 89 9.991 -8.261 10.691 682 HE2 PHE 89 HE1 PHE 89 8.780 -9.323 14.667 683 HZ PHE 89 HZ PHE 89 10.039 -7.836 13.131 684 H TRP 90 H TRP 90 6.463 -14.008 9.234 685 HA TRP 90 HA TRP 90 5.062 -15.851 10.914 686 HB2 TRP 90 HB3 TRP 90 4.893 -15.665 7.916 687 HB3 TRP 90 HB2 TRP 90 3.635 -16.188 9.055 688 HD1 TRP 90 HD TRP 90 4.936 -13.147 7.398 689 HE1 TRP 90 HE1 TRP 90 3.926 -11.050 8.412 690 HE3 TRP 90 HE3 TRP 90 2.758 -15.176 11.527 691 HZ2 TRP 90 HZ2 TRP 90 2.363 -10.287 10.733 692 HZ3 TRP 90 HZ3 TRP 90 1.527 -13.746 13.126 693 HH2 TRP 90 HH TRP 90 1.328 -11.298 12.725 694 H GLU 91 H GLU 91 7.440 -16.204 8.382 695 HA GLU 91 HA GLU 91 7.443 -19.090 8.554 696 HB2 GLU 91 HB3 GLU 91 9.543 -17.228 7.464 697 HB3 GLU 91 HB2 GLU 91 9.591 -18.960 7.330 698 HG2 GLU 91 HG3 GLU 91 7.364 -18.973 6.173 699 HG3 GLU 91 HG2 GLU 91 7.379 -17.224 6.207 700 H ASN 92 H ASN 92 9.267 -16.484 10.060 701 HA ASN 92 HA ASN 92 11.313 -17.813 11.314 702 HB2 ASN 92 HB3 ASN 92 11.092 -15.406 11.396 703 HB3 ASN 92 HB2 ASN 92 9.619 -15.521 12.362 704 HD21 ASN 92 HD21 ASN 92 10.612 -14.330 14.138 705 HD22 ASN 92 HD22 ASN 92 11.823 -15.015 15.101 706 H SER 93 H SER 93 11.228 -19.574 12.470 707 HA SER 93 HA SER 93 8.872 -20.107 14.145 708 HB2 SER 93 HB3 SER 93 9.441 -21.503 12.078 709 HB3 SER 93 HB2 SER 93 10.784 -22.117 13.022 710 HG SER 93 HG SER 93 9.196 -22.533 14.693 711 H1 GLY 1 H GLY 1 10.509 1.266 11.839 712 HA2 GLY 1 HA3 GLY 1 11.652 2.801 14.029 713 HA3 GLY 1 HA2 GLY 1 11.971 3.057 12.327 714 H SER 2 H SER 2 10.321 4.022 11.022 715 HA SER 2 HA SER 2 8.942 6.171 12.319 716 HB2 SER 2 HB3 SER 2 8.933 5.106 9.487 717 HB3 SER 2 HB2 SER 2 7.871 6.389 9.996 718 HG SER 2 HG SER 2 9.632 7.314 9.234 719 H GLU 3 H GLU 3 6.694 6.464 12.505 720 HA GLU 3 HA GLU 3 5.129 4.353 13.400 721 HB2 GLU 3 HB3 GLU 3 4.172 6.850 11.983 722 HB3 GLU 3 HB2 GLU 3 3.221 5.839 13.065 723 HG2 GLU 3 HG3 GLU 3 3.876 7.467 14.525 724 HG3 GLU 3 HG2 GLU 3 5.201 6.339 14.767 725 H LEU 4 H LEU 4 5.940 5.380 10.238 726 HA LEU 4 HA LEU 4 3.889 4.164 8.735 727 HB2 LEU 4 HB3 LEU 4 6.755 4.901 8.106 728 HB3 LEU 4 HB2 LEU 4 5.758 4.036 6.962 729 HG LEU 4 HG LEU 4 3.995 5.861 7.248 730 HD11 LEU 4 HD11 LEU 4 4.978 6.794 9.405 731 HD12 LEU 4 HD12 LEU 4 4.687 7.973 8.154 732 HD13 LEU 4 HD13 LEU 4 6.321 7.403 8.432 733 HD21 LEU 4 HD21 LEU 4 4.962 7.140 5.538 734 HD22 LEU 4 HD22 LEU 4 5.851 5.632 5.394 735 HD23 LEU 4 HD23 LEU 4 6.579 7.007 6.211 736 H GLU 5 H GLU 5 7.017 2.966 9.983 737 HA GLU 5 HA GLU 5 6.859 0.426 8.740 738 HB2 GLU 5 HB3 GLU 5 8.270 1.176 11.334 739 HB3 GLU 5 HB2 GLU 5 8.559 -0.267 10.377 740 HG2 GLU 5 HG3 GLU 5 9.089 1.292 8.417 741 HG3 GLU 5 HG2 GLU 5 9.144 2.595 9.585 742 H THR 6 H THR 6 5.805 1.683 11.841 743 HA THR 6 HA THR 6 4.640 -0.701 12.831 744 HB THR 6 HB THR 6 3.662 2.110 13.379 745 HG1 THR 6 HG2 THR 6 5.369 2.391 14.658 746 HG21 THR 6 HG21 THR 6 3.810 -0.414 15.057 747 HG22 THR 6 HG22 THR 6 2.352 0.264 14.335 748 HG23 THR 6 HG23 THR 6 3.188 1.142 15.604 749 H ALA 7 H ALA 7 3.416 2.041 10.891 750 HA ALA 7 HA ALA 7 0.771 1.236 10.676 751 HB1 ALA 7 HB1 ALA 7 0.593 2.759 8.877 752 HB2 ALA 7 HB2 ALA 7 2.269 2.556 8.412 753 HB3 ALA 7 HB3 ALA 7 1.861 3.434 9.895 754 H MET 8 H MET 8 3.590 0.436 8.661 755 HA MET 8 HA MET 8 2.160 -1.149 6.805 756 HB2 MET 8 HB3 MET 8 5.075 -1.339 7.606 757 HB3 MET 8 HB2 MET 8 4.373 -2.131 6.211 758 HG2 MET 8 HG3 MET 8 4.561 0.877 6.667 759 HG3 MET 8 HG2 MET 8 5.402 -0.072 5.459 760 HE1 MET 8 HE1 MET 8 4.453 -1.484 3.895 761 HE2 MET 8 HE2 MET 8 3.140 -0.987 2.832 762 HE3 MET 8 HE3 MET 8 2.792 -2.040 4.196 763 H GLU 9 H GLU 9 3.784 -1.972 9.848 764 HA GLU 9 HA GLU 9 3.134 -4.740 9.683 765 HB2 GLU 9 HB3 GLU 9 3.828 -2.988 12.035 766 HB3 GLU 9 HB2 GLU 9 3.481 -4.695 12.229 767 HG2 GLU 9 HG3 GLU 9 5.306 -5.211 10.564 768 HG3 GLU 9 HG2 GLU 9 5.628 -3.490 10.475 769 H THR 10 H THR 10 1.496 -1.908 10.914 770 HA THR 10 HA THR 10 -0.667 -3.235 12.162 771 HB THR 10 HB THR 10 -0.925 -0.584 10.683 772 HG1 THR 10 HG2 THR 10 0.992 -0.784 12.159 773 HG21 THR 10 HG21 THR 10 -2.626 -0.117 12.226 774 HG22 THR 10 HG22 THR 10 -2.148 -1.415 13.309 775 HG23 THR 10 HG23 THR 10 -2.920 -1.791 11.772 776 H LEU 11 H LEU 11 -0.057 -2.198 8.832 777 HA LEU 11 HA LEU 11 -2.492 -3.160 7.733 778 HB2 LEU 11 HB3 LEU 11 0.251 -2.788 6.492 779 HB3 LEU 11 HB2 LEU 11 -1.181 -3.230 5.569 780 HG LEU 11 HG LEU 11 -0.925 -0.710 7.247 781 HD11 LEU 11 HD11 LEU 11 0.550 -0.288 5.509 782 HD12 LEU 11 HD12 LEU 11 -0.968 0.298 4.840 783 HD13 LEU 11 HD13 LEU 11 -0.349 -1.272 4.355 784 HD21 LEU 11 HD21 LEU 11 -2.867 -0.394 5.264 785 HD22 LEU 11 HD22 LEU 11 -3.153 -0.649 6.974 786 HD23 LEU 11 HD23 LEU 11 -3.152 -2.030 5.866 787 H ILE 12 H ILE 12 0.709 -4.667 8.248 788 HA ILE 12 HA ILE 12 0.174 -7.118 6.938 789 HB ILE 12 HB ILE 12 1.995 -6.524 9.289 790 HG12 ILE 12 HG13 ILE 12 2.474 -5.406 7.018 791 HG13 ILE 12 HG12 ILE 12 3.767 -6.391 7.685 792 HG21 ILE 12 HG21 ILE 12 1.682 -9.066 7.670 793 HG22 ILE 12 HG22 ILE 12 1.627 -8.851 9.408 794 HG23 ILE 12 HG23 ILE 12 3.151 -8.669 8.561 795 HD11 ILE 12 HD11 ILE 12 3.041 -6.650 5.180 796 HD12 ILE 12 HD12 ILE 12 1.806 -7.728 5.823 797 HD13 ILE 12 HD13 ILE 12 3.522 -8.039 6.121 798 H ASN 13 H ASN 13 -0.135 -6.187 10.296 799 HA ASN 13 HA ASN 13 -1.000 -8.678 11.274 800 HB2 ASN 13 HB3 ASN 13 -1.418 -5.875 12.344 801 HB3 ASN 13 HB2 ASN 13 -1.964 -7.318 13.176 802 HD21 ASN 13 HD21 ASN 13 0.931 -5.600 12.167 803 HD22 ASN 13 HD22 ASN 13 2.019 -6.532 13.085 804 H VAL 14 H VAL 14 -2.833 -5.891 10.114 805 HA VAL 14 HA VAL 14 -5.409 -7.011 10.544 806 HB VAL 14 HB VAL 14 -4.478 -4.986 8.496 807 HG11 VAL 14 HG11 VAL 14 -6.803 -4.350 8.280 808 HG12 VAL 14 HG12 VAL 14 -7.280 -5.447 9.566 809 HG13 VAL 14 HG13 VAL 14 -6.716 -6.086 8.031 810 HG21 VAL 14 HG21 VAL 14 -4.721 -3.352 10.114 811 HG22 VAL 14 HG22 VAL 14 -4.284 -4.683 11.167 812 HG23 VAL 14 HG23 VAL 14 -5.973 -4.242 10.981 813 H PHE 15 H PHE 15 -3.202 -6.909 7.787 814 HA PHE 15 HA PHE 15 -4.695 -8.404 5.932 815 HB2 PHE 15 HB3 PHE 15 -2.583 -7.182 5.418 816 HB3 PHE 15 HB2 PHE 15 -1.696 -8.354 6.375 817 HD1 PHE 15 HD2 PHE 15 -1.359 -10.656 5.600 818 HD2 PHE 15 HD1 PHE 15 -3.557 -7.802 3.249 819 HE1 PHE 15 HE2 PHE 15 -1.198 -12.145 3.642 820 HE2 PHE 15 HE1 PHE 15 -3.390 -9.308 1.286 821 HZ PHE 15 HZ PHE 15 -2.212 -11.476 1.486 822 H HIS 16 H HIS 16 -2.311 -9.334 8.354 823 HA HIS 16 HA HIS 16 -2.337 -12.083 7.899 824 HB2 HIS 16 HB3 HIS 16 -0.882 -10.473 9.560 825 HB3 HIS 16 HB2 HIS 16 -1.919 -11.311 10.708 826 HD1 HIS 16 HD1 HIS 16 -1.843 -13.938 10.701 827 HD2 HIS 16 HD2 HIS 16 0.987 -12.022 8.340 828 HE1 HIS 16 HE1 HIS 16 -0.125 -15.712 10.065 829 HE2 HIS 16 HE2 HIS 16 1.573 -14.612 8.611 830 H ALA 17 H ALA 17 -4.210 -10.114 10.151 831 HA ALA 17 HA ALA 17 -5.460 -12.092 11.607 832 HB1 ALA 17 HB1 ALA 17 -5.710 -9.439 11.648 833 HB2 ALA 17 HB2 ALA 17 -6.960 -10.475 12.297 834 HB3 ALA 17 HB3 ALA 17 -7.142 -9.785 10.685 835 H HIS 18 H HIS 18 -6.282 -10.765 8.492 836 HA HIS 18 HA HIS 18 -8.522 -12.479 8.016 837 HB2 HIS 18 HB3 HIS 18 -6.818 -10.826 6.175 838 HB3 HIS 18 HB2 HIS 18 -8.267 -11.727 5.700 839 HD1 HIS 18 HD1 HIS 18 -10.563 -11.031 7.071 840 HD2 HIS 18 HD2 HIS 18 -7.378 -8.317 7.294 841 HE1 HIS 18 HE1 HIS 18 -11.517 -8.818 7.896 842 HE2 HIS 18 HE2 HIS 18 -9.591 -7.186 8.082 843 H SER 19 H SER 19 -5.039 -12.625 7.230 844 HA SER 19 HA SER 19 -5.099 -14.927 5.594 845 HB2 SER 19 HB3 SER 19 -2.948 -14.018 7.550 846 HB3 SER 19 HB2 SER 19 -2.739 -15.313 6.409 847 HG SER 19 HG SER 19 -3.526 -13.580 4.833 848 H GLY 20 H GLY 20 -5.046 -14.528 9.082 849 HA2 GLY 20 HA3 GLY 20 -4.801 -17.219 9.831 850 HA3 GLY 20 HA2 GLY 20 -5.643 -15.988 10.759 851 H LYS 21 H LYS 21 -7.678 -15.245 9.149 852 HA LYS 21 HA LYS 21 -9.518 -17.405 9.462 853 HB2 LYS 21 HB3 LYS 21 -9.885 -14.800 7.975 854 HB3 LYS 21 HB2 LYS 21 -11.172 -15.911 8.438 855 HG2 LYS 21 HG3 LYS 21 -9.312 -14.460 10.360 856 HG3 LYS 21 HG2 LYS 21 -11.012 -14.105 10.105 857 HD2 LYS 21 HD3 LYS 21 -11.607 -16.393 10.898 858 HD3 LYS 21 HD2 LYS 21 -9.899 -16.711 11.201 859 HE2 LYS 21 HE2 LYS 21 -9.959 -14.559 12.660 860 HE3 LYS 21 HE1 LYS 21 -11.714 -14.792 12.591 861 HZ1 LYS 21 HZ1 LYS 21 -10.960 -17.246 13.253 862 HZ2 LYS 21 HZ2 LYS 21 -11.250 -16.038 14.408 863 HZ3 LYS 21 HZ3 LYS 21 -9.684 -16.385 13.940 864 H GLU 22 H GLU 22 -7.878 -16.058 6.681 865 HA GLU 22 HA GLU 22 -9.176 -17.740 4.789 866 HB2 GLU 22 HB3 GLU 22 -8.179 -16.097 3.628 867 HB3 GLU 22 HB2 GLU 22 -6.862 -15.881 4.738 868 HG2 GLU 22 HG3 GLU 22 -5.945 -16.711 2.659 869 HG3 GLU 22 HG2 GLU 22 -5.829 -18.029 3.803 870 H GLY 23 H GLY 23 -6.396 -18.181 6.864 871 HA2 GLY 23 HA3 GLY 23 -6.015 -20.421 7.738 872 HA3 GLY 23 HA2 GLY 23 -6.517 -21.060 6.196 873 H ASP 24 H ASP 24 -4.799 -18.668 5.102 874 HA ASP 24 HA ASP 24 -2.441 -20.305 4.693 875 HB2 ASP 24 HB3 ASP 24 -3.470 -18.672 2.926 876 HB3 ASP 24 HB2 ASP 24 -2.651 -17.436 3.861 877 H LYS 25 H LYS 25 -0.355 -19.778 5.335 878 HA LYS 25 HA LYS 25 -0.144 -18.579 7.909 879 HB2 LYS 25 HB3 LYS 25 2.374 -18.624 7.369 880 HB3 LYS 25 HB2 LYS 25 1.546 -20.172 7.572 881 HG2 LYS 25 HG3 LYS 25 1.357 -20.350 5.100 882 HG3 LYS 25 HG2 LYS 25 2.194 -18.808 4.915 883 HD2 LYS 25 HD3 LYS 25 4.137 -19.782 6.192 884 HD3 LYS 25 HD2 LYS 25 3.302 -21.318 6.175 885 HE2 LYS 25 HE2 LYS 25 3.914 -19.785 3.648 886 HE3 LYS 25 HE1 LYS 25 4.987 -20.999 4.341 887 HZ1 LYS 25 HZ1 LYS 25 3.712 -22.595 3.443 888 HZ2 LYS 25 HZ2 LYS 25 2.775 -21.385 2.714 889 HZ3 LYS 25 HZ3 LYS 25 2.323 -21.994 4.205 890 H TYR 26 H TYR 26 0.182 -17.409 4.672 891 HA TYR 26 HA TYR 26 -0.299 -14.823 5.597 892 HB2 TYR 26 HB3 TYR 26 1.826 -13.826 4.363 893 HB3 TYR 26 HB2 TYR 26 1.875 -14.277 6.058 894 HD1 TYR 26 HD2 TYR 26 2.907 -15.248 2.642 895 HD2 TYR 26 HD1 TYR 26 2.982 -16.231 6.790 896 HE1 TYR 26 HE2 TYR 26 4.664 -16.893 2.185 897 HE2 TYR 26 HE1 TYR 26 4.799 -17.917 6.356 898 HH TYR 26 HH TYR 26 6.697 -18.031 4.091 899 H LYS 27 H LYS 27 -1.960 -14.900 4.233 900 HA LYS 27 HA LYS 27 -1.549 -13.892 1.670 901 HB2 LYS 27 HB3 LYS 27 -2.481 -16.769 1.807 902 HB3 LYS 27 HB2 LYS 27 -3.163 -15.688 0.606 903 HG2 LYS 27 HG3 LYS 27 -0.229 -16.367 0.918 904 HG3 LYS 27 HG2 LYS 27 -1.328 -16.894 -0.348 905 HD2 LYS 27 HD3 LYS 27 -1.544 -14.051 -0.327 906 HD3 LYS 27 HD2 LYS 27 0.172 -14.406 -0.191 907 HE2 LYS 27 HE2 LYS 27 -1.710 -14.993 -2.434 908 HE3 LYS 27 HE1 LYS 27 -0.079 -14.392 -2.473 909 HZ1 LYS 27 HZ1 LYS 27 0.103 -17.006 -1.423 910 HZ2 LYS 27 HZ2 LYS 27 0.560 -16.440 -2.925 911 HZ3 LYS 27 HZ3 LYS 27 -0.988 -17.046 -2.721 912 H LEU 28 H LEU 28 -3.643 -13.294 0.678 913 HA LEU 28 HA LEU 28 -5.797 -13.317 2.657 914 HB2 LEU 28 HB3 LEU 28 -4.755 -11.129 2.601 915 HB3 LEU 28 HB2 LEU 28 -5.015 -10.988 0.864 916 HG LEU 28 HG LEU 28 -7.497 -11.248 1.335 917 HD11 LEU 28 HD11 LEU 28 -7.584 -12.320 3.405 918 HD12 LEU 28 HD12 LEU 28 -7.992 -10.631 3.800 919 HD13 LEU 28 HD13 LEU 28 -6.368 -11.249 4.108 920 HD21 LEU 28 HD21 LEU 28 -6.576 -9.014 0.997 921 HD22 LEU 28 HD22 LEU 28 -5.987 -8.979 2.663 922 HD23 LEU 28 HD23 LEU 28 -7.719 -8.969 2.342 923 H SER 29 H SER 29 -7.531 -14.361 1.861 924 HA SER 29 HA SER 29 -7.734 -14.801 -0.999 925 HB2 SER 29 HB3 SER 29 -9.764 -16.179 -0.269 926 HB3 SER 29 HB2 SER 29 -8.180 -16.737 0.227 927 HG SER 29 HG SER 29 -9.059 -16.700 2.088 928 H LYS 30 H LYS 30 -10.032 -14.600 -1.876 929 HA LYS 30 HA LYS 30 -10.766 -11.814 -1.622 930 HB2 LYS 30 HB3 LYS 30 -12.362 -13.938 -3.051 931 HB3 LYS 30 HB2 LYS 30 -12.333 -12.210 -3.365 932 HG2 LYS 30 HG3 LYS 30 -10.026 -14.149 -3.827 933 HG3 LYS 30 HG2 LYS 30 -11.004 -13.430 -5.074 934 HD2 LYS 30 HD3 LYS 30 -9.636 -11.535 -3.169 935 HD3 LYS 30 HD2 LYS 30 -8.668 -12.353 -4.367 936 HE2 LYS 30 HE2 LYS 30 -11.038 -10.550 -4.849 937 HE3 LYS 30 HE1 LYS 30 -9.382 -10.321 -5.388 938 HZ1 LYS 30 HZ1 LYS 30 -11.499 -11.690 -6.647 939 HZ2 LYS 30 HZ2 LYS 30 -10.169 -12.793 -6.507 940 HZ3 LYS 30 HZ3 LYS 30 -10.022 -11.364 -7.308 941 H LYS 31 H LYS 31 -11.384 -14.490 0.192 942 HA LYS 31 HA LYS 31 -14.106 -14.190 0.961 943 HB2 LYS 31 HB3 LYS 31 -11.909 -15.108 2.887 944 HB3 LYS 31 HB2 LYS 31 -13.585 -15.561 2.768 945 HG2 LYS 31 HG3 LYS 31 -13.188 -16.826 0.727 946 HG3 LYS 31 HG2 LYS 31 -11.572 -16.181 0.639 947 HD2 LYS 31 HD3 LYS 31 -10.909 -17.244 2.717 948 HD3 LYS 31 HD2 LYS 31 -12.529 -17.893 2.944 949 HE2 LYS 31 HE2 LYS 31 -11.226 -18.461 0.341 950 HE3 LYS 31 HE1 LYS 31 -10.539 -19.270 1.740 951 HZ1 LYS 31 HZ1 LYS 31 -12.510 -20.433 0.548 952 HZ2 LYS 31 HZ2 LYS 31 -13.482 -19.312 1.394 953 HZ3 LYS 31 HZ3 LYS 31 -12.473 -20.361 2.221 954 H GLU 32 H GLU 32 -11.162 -13.388 2.678 955 HA GLU 32 HA GLU 32 -12.390 -11.675 4.543 956 HB2 GLU 32 HB3 GLU 32 -9.567 -12.314 3.849 957 HB3 GLU 32 HB2 GLU 32 -10.062 -11.306 5.233 958 HG2 GLU 32 HG3 GLU 32 -10.942 -14.179 4.731 959 HG3 GLU 32 HG2 GLU 32 -9.682 -13.726 5.850 960 H LEU 33 H LEU 33 -10.409 -11.127 1.664 961 HA LEU 33 HA LEU 33 -9.752 -8.481 2.160 962 HB2 LEU 33 HB3 LEU 33 -8.736 -9.819 0.330 963 HB3 LEU 33 HB2 LEU 33 -10.270 -9.744 -0.525 964 HG LEU 33 HG LEU 33 -8.411 -8.070 -1.221 965 HD11 LEU 33 HD11 LEU 33 -9.966 -6.741 -2.151 966 HD12 LEU 33 HD12 LEU 33 -10.903 -6.552 -0.682 967 HD13 LEU 33 HD13 LEU 33 -11.044 -8.025 -1.634 968 HD21 LEU 33 HD21 LEU 33 -9.480 -6.578 1.226 969 HD22 LEU 33 HD22 LEU 33 -8.342 -5.990 0.033 970 HD23 LEU 33 HD23 LEU 33 -7.869 -7.291 1.100 971 H LYS 34 H LYS 34 -12.571 -9.788 0.471 972 HA LYS 34 HA LYS 34 -13.669 -7.293 -0.231 973 HB2 LYS 34 HB3 LYS 34 -15.008 -9.968 0.253 974 HB3 LYS 34 HB2 LYS 34 -15.803 -8.520 -0.372 975 HG2 LYS 34 HG3 LYS 34 -14.334 -8.449 -2.311 976 HG3 LYS 34 HG2 LYS 34 -13.374 -9.783 -1.677 977 HD2 LYS 34 HD3 LYS 34 -14.769 -10.814 -3.252 978 HD3 LYS 34 HD2 LYS 34 -15.563 -11.171 -1.734 979 HE2 LYS 34 HE2 LYS 34 -16.310 -8.814 -3.520 980 HE3 LYS 34 HE1 LYS 34 -17.124 -10.371 -3.550 981 HZ1 LYS 34 HZ1 LYS 34 -18.424 -9.262 -2.047 982 HZ2 LYS 34 HZ2 LYS 34 -17.199 -8.290 -1.489 983 HZ3 LYS 34 HZ3 LYS 34 -17.314 -9.898 -0.956 984 H GLU 35 H GLU 35 -14.093 -9.368 2.604 985 HA GLU 35 HA GLU 35 -16.015 -7.739 3.935 986 HB2 GLU 35 HB3 GLU 35 -13.925 -9.646 5.046 987 HB3 GLU 35 HB2 GLU 35 -15.303 -8.996 5.929 988 HG2 GLU 35 HG3 GLU 35 -15.554 -10.663 3.405 989 HG3 GLU 35 HG2 GLU 35 -15.730 -11.327 5.010 990 H LEU 36 H LEU 36 -12.538 -8.092 4.064 991 HA LEU 36 HA LEU 36 -11.874 -6.233 6.041 992 HB2 LEU 36 HB3 LEU 36 -10.272 -7.840 5.471 993 HB3 LEU 36 HB2 LEU 36 -10.495 -7.558 3.764 994 HG LEU 36 HG LEU 36 -9.376 -5.447 3.865 995 HD11 LEU 36 HD11 LEU 36 -9.684 -5.794 6.812 996 HD12 LEU 36 HD12 LEU 36 -9.491 -4.343 5.826 997 HD13 LEU 36 HD13 LEU 36 -8.077 -5.264 6.279 998 HD21 LEU 36 HD21 LEU 36 -7.130 -6.445 4.973 999 HD22 LEU 36 HD22 LEU 36 -7.776 -6.949 3.408 1000 HD23 LEU 36 HD23 LEU 36 -8.086 -7.929 4.837 1001 H LEU 37 H LEU 37 -11.766 -5.812 2.501 1002 HA LEU 37 HA LEU 37 -10.684 -3.265 2.709 1003 HB2 LEU 37 HB3 LEU 37 -10.557 -4.595 0.643 1004 HB3 LEU 37 HB2 LEU 37 -12.276 -4.392 0.376 1005 HG LEU 37 HG LEU 37 -10.605 -2.844 -0.895 1006 HD11 LEU 37 HD11 LEU 37 -12.293 -1.371 -1.257 1007 HD12 LEU 37 HD12 LEU 37 -12.674 -1.164 0.444 1008 HD13 LEU 37 HD13 LEU 37 -13.227 -2.600 -0.420 1009 HD21 LEU 37 HD21 LEU 37 -10.787 -1.247 1.679 1010 HD22 LEU 37 HD22 LEU 37 -9.897 -0.850 0.236 1011 HD23 LEU 37 HD23 LEU 37 -9.377 -2.211 1.240 1012 H GLN 38 H GLN 38 -14.064 -4.171 2.224 1013 HA GLN 38 HA GLN 38 -15.001 -1.491 2.195 1014 HB2 GLN 38 HB3 GLN 38 -17.221 -2.421 2.475 1015 HB3 GLN 38 HB2 GLN 38 -16.342 -3.392 1.307 1016 HG2 GLN 38 HG3 GLN 38 -15.721 -4.946 3.257 1017 HG3 GLN 38 HG2 GLN 38 -16.901 -4.065 4.216 1018 HE21 GLN 38 HE21 GLN 38 -16.501 -6.461 1.757 1019 HE22 GLN 38 HE22 GLN 38 -18.139 -6.805 1.512 1020 H THR 39 H THR 39 -14.591 -3.893 4.742 1021 HA THR 39 HA THR 39 -15.848 -2.473 6.804 1022 HB THR 39 HB THR 39 -13.696 -4.577 6.829 1023 HG1 THR 39 HG2 THR 39 -15.327 -5.549 6.109 1024 HG21 THR 39 HG21 THR 39 -15.189 -3.253 9.079 1025 HG22 THR 39 HG22 THR 39 -13.492 -3.771 8.917 1026 HG23 THR 39 HG23 THR 39 -14.741 -4.975 9.155 1027 H GLU 40 H GLU 40 -12.311 -2.803 6.164 1028 HA GLU 40 HA GLU 40 -11.692 -0.963 8.223 1029 HB2 GLU 40 HB3 GLU 40 -9.970 -2.088 6.017 1030 HB3 GLU 40 HB2 GLU 40 -9.373 -1.058 7.316 1031 HG2 GLU 40 HG3 GLU 40 -10.822 -3.692 7.746 1032 HG3 GLU 40 HG2 GLU 40 -9.080 -3.474 7.851 1033 H LEU 41 H LEU 41 -11.950 -0.605 4.758 1034 HA LEU 41 HA LEU 41 -11.307 2.238 5.030 1035 HB2 LEU 41 HB3 LEU 41 -11.301 0.320 2.791 1036 HB3 LEU 41 HB2 LEU 41 -11.605 1.977 2.381 1037 HG LEU 41 HG LEU 41 -9.544 2.602 3.778 1038 HD11 LEU 41 HD11 LEU 41 -9.098 0.756 5.116 1039 HD12 LEU 41 HD12 LEU 41 -7.877 0.624 3.861 1040 HD13 LEU 41 HD13 LEU 41 -9.314 -0.402 3.799 1041 HD21 LEU 41 HD21 LEU 41 -8.160 2.431 1.923 1042 HD22 LEU 41 HD22 LEU 41 -9.728 2.210 1.172 1043 HD23 LEU 41 HD23 LEU 41 -8.711 0.809 1.505 1044 H SER 42 H SER 42 -13.875 0.905 5.849 1045 HA SER 42 HA SER 42 -15.941 1.454 4.136 1046 HB2 SER 42 HB3 SER 42 -17.155 2.102 6.414 1047 HB3 SER 42 HB2 SER 42 -16.747 0.454 6.014 1048 HG SER 42 HG SER 42 -15.028 0.521 7.407 1049 H GLY 43 H GLY 43 -14.084 3.709 6.107 1050 HA2 GLY 43 HA3 GLY 43 -15.659 6.032 5.633 1051 HA3 GLY 43 HA2 GLY 43 -13.961 5.989 6.104 1052 H PHE 44 H PHE 44 -12.731 4.736 4.094 1053 HA PHE 44 HA PHE 44 -12.554 6.695 2.019 1054 HB2 PHE 44 HB3 PHE 44 -11.344 3.971 2.393 1055 HB3 PHE 44 HB2 PHE 44 -11.164 4.811 0.865 1056 HD1 PHE 44 HD1 PHE 44 -10.569 5.075 4.508 1057 HD2 PHE 44 HD2 PHE 44 -9.613 6.608 0.632 1058 HE1 PHE 44 HE1 PHE 44 -8.702 6.422 5.487 1059 HE2 PHE 44 HE2 PHE 44 -7.759 7.950 1.610 1060 HZ PHE 44 HZ PHE 44 -7.314 7.845 4.043 1061 H LEU 45 H LEU 45 -13.943 3.497 2.249 1062 HA LEU 45 HA LEU 45 -14.765 3.198 -0.412 1063 HB2 LEU 45 HB3 LEU 45 -14.890 1.225 0.751 1064 HB3 LEU 45 HB2 LEU 45 -15.479 1.999 2.209 1065 HG LEU 45 HG LEU 45 -17.668 2.279 1.265 1066 HD11 LEU 45 HD11 LEU 45 -16.278 1.707 -1.257 1067 HD12 LEU 45 HD12 LEU 45 -17.852 2.445 -0.984 1068 HD13 LEU 45 HD13 LEU 45 -17.714 0.692 -1.076 1069 HD21 LEU 45 HD21 LEU 45 -16.680 -0.051 2.150 1070 HD22 LEU 45 HD22 LEU 45 -17.128 -0.572 0.529 1071 HD23 LEU 45 HD23 LEU 45 -18.346 0.092 1.608 1072 H ASP 46 H ASP 46 -16.508 4.507 2.389 1073 HA ASP 46 HA ASP 46 -18.799 5.327 0.880 1074 HB2 ASP 46 HB3 ASP 46 -18.987 5.090 3.200 1075 HB3 ASP 46 HB2 ASP 46 -17.704 6.235 3.545 1076 H ALA 47 H ALA 47 -15.787 6.863 1.822 1077 HA ALA 47 HA ALA 47 -16.398 9.452 1.009 1078 HB1 ALA 47 HB1 ALA 47 -14.427 8.994 2.367 1079 HB2 ALA 47 HB2 ALA 47 -13.988 9.848 0.890 1080 HB3 ALA 47 HB3 ALA 47 -13.692 8.120 1.016 1081 H GLN 48 H GLN 48 -14.815 6.874 -0.888 1082 HA GLN 48 HA GLN 48 -15.269 8.566 -3.287 1083 HB2 GLN 48 HB3 GLN 48 -13.564 6.984 -4.382 1084 HB3 GLN 48 HB2 GLN 48 -12.944 8.197 -3.274 1085 HG2 GLN 48 HG3 GLN 48 -13.696 5.551 -2.084 1086 HG3 GLN 48 HG2 GLN 48 -12.301 5.588 -3.143 1087 HE21 GLN 48 HE21 GLN 48 -13.032 8.519 -1.366 1088 HE22 GLN 48 HE22 GLN 48 -11.759 8.367 -0.262 1089 H LYS 49 H LYS 49 -17.196 6.677 -1.980 1090 HA LYS 49 HA LYS 49 -17.507 4.440 -3.651 1091 HB2 LYS 49 HB3 LYS 49 -18.821 4.972 -1.463 1092 HB3 LYS 49 HB2 LYS 49 -19.870 5.917 -2.505 1093 HG2 LYS 49 HG3 LYS 49 -19.533 3.469 -3.890 1094 HG3 LYS 49 HG2 LYS 49 -19.714 3.030 -2.212 1095 HD2 LYS 49 HD3 LYS 49 -21.907 3.370 -2.305 1096 HD3 LYS 49 HD2 LYS 49 -21.699 5.057 -2.733 1097 HE2 LYS 49 HE2 LYS 49 -21.594 2.754 -4.715 1098 HE3 LYS 49 HE1 LYS 49 -23.011 3.758 -4.427 1099 HZ1 LYS 49 HZ1 LYS 49 -21.777 4.568 -6.318 1100 HZ2 LYS 49 HZ2 LYS 49 -20.357 4.772 -5.455 1101 HZ3 LYS 49 HZ3 LYS 49 -21.725 5.700 -5.115 1102 H ASP 50 H ASP 50 -18.232 7.773 -4.004 1103 HA ASP 50 HA ASP 50 -19.995 7.506 -6.258 1104 HB2 ASP 50 HB3 ASP 50 -19.983 9.890 -6.360 1105 HB3 ASP 50 HB2 ASP 50 -20.112 9.433 -4.671 1106 H VAL 51 H VAL 51 -16.684 7.120 -5.953 1107 HA VAL 51 HA VAL 51 -16.001 8.298 -8.525 1108 HB VAL 51 HB VAL 51 -14.381 6.541 -6.666 1109 HG11 VAL 51 HG11 VAL 51 -13.224 6.334 -8.649 1110 HG12 VAL 51 HG12 VAL 51 -12.512 7.824 -8.041 1111 HG13 VAL 51 HG13 VAL 51 -13.773 7.894 -9.266 1112 HG21 VAL 51 HG21 VAL 51 -14.395 9.564 -7.045 1113 HG22 VAL 51 HG22 VAL 51 -13.263 8.675 -6.027 1114 HG23 VAL 51 HG23 VAL 51 -14.976 8.696 -5.625 1115 H ASP 52 H ASP 52 -16.142 7.190 -10.395 1116 HA ASP 52 HA ASP 52 -17.397 4.688 -10.567 1117 HB2 ASP 52 HB3 ASP 52 -17.165 6.409 -12.407 1118 HB3 ASP 52 HB2 ASP 52 -15.525 5.835 -12.621 1119 H ALA 53 H ALA 53 -14.049 5.617 -10.586 1120 HA ALA 53 HA ALA 53 -12.889 3.181 -11.269 1121 HB1 ALA 53 HB1 ALA 53 -11.767 5.502 -10.995 1122 HB2 ALA 53 HB2 ALA 53 -10.841 4.059 -10.611 1123 HB3 ALA 53 HB3 ALA 53 -11.531 5.019 -9.313 1124 H VAL 54 H VAL 54 -14.356 4.114 -8.213 1125 HA VAL 54 HA VAL 54 -12.856 2.508 -6.511 1126 HB VAL 54 HB VAL 54 -14.547 4.216 -5.750 1127 HG11 VAL 54 HG11 VAL 54 -16.716 2.179 -5.880 1128 HG12 VAL 54 HG12 VAL 54 -16.400 3.125 -7.335 1129 HG13 VAL 54 HG13 VAL 54 -16.801 3.923 -5.837 1130 HG21 VAL 54 HG21 VAL 54 -14.012 3.089 -3.835 1131 HG22 VAL 54 HG22 VAL 54 -14.191 1.501 -4.587 1132 HG23 VAL 54 HG23 VAL 54 -15.600 2.368 -4.012 1133 H ASP 55 H ASP 55 -15.729 1.647 -8.373 1134 HA ASP 55 HA ASP 55 -16.041 -1.019 -7.451 1135 HB2 ASP 55 HB3 ASP 55 -17.712 0.221 -8.844 1136 HB3 ASP 55 HB2 ASP 55 -16.584 0.111 -10.199 1137 H LYS 56 H LYS 56 -14.391 0.408 -10.165 1138 HA LYS 56 HA LYS 56 -13.348 -1.949 -11.254 1139 HB2 LYS 56 HB3 LYS 56 -12.558 0.938 -11.623 1140 HB3 LYS 56 HB2 LYS 56 -11.880 -0.400 -12.553 1141 HG2 LYS 56 HG3 LYS 56 -14.080 -1.113 -13.288 1142 HG3 LYS 56 HG2 LYS 56 -14.864 0.141 -12.338 1143 HD2 LYS 56 HD3 LYS 56 -13.861 1.840 -13.632 1144 HD3 LYS 56 HD2 LYS 56 -12.934 0.706 -14.645 1145 HE2 LYS 56 HE2 LYS 56 -15.935 1.188 -14.514 1146 HE3 LYS 56 HE1 LYS 56 -14.891 1.234 -15.921 1147 HZ1 LYS 56 HZ1 LYS 56 -15.946 -1.164 -14.523 1148 HZ2 LYS 56 HZ2 LYS 56 -14.487 -1.296 -15.309 1149 HZ3 LYS 56 HZ3 LYS 56 -15.851 -0.862 -16.157 1150 H VAL 57 H VAL 57 -12.010 0.340 -8.937 1151 HA VAL 57 HA VAL 57 -9.390 -0.718 -8.791 1152 HB VAL 57 HB VAL 57 -11.139 0.625 -6.705 1153 HG11 VAL 57 HG11 VAL 57 -8.475 1.065 -6.036 1154 HG12 VAL 57 HG12 VAL 57 -8.527 -0.652 -6.406 1155 HG13 VAL 57 HG13 VAL 57 -9.612 0.036 -5.191 1156 HG21 VAL 57 HG21 VAL 57 -8.913 2.210 -7.507 1157 HG22 VAL 57 HG22 VAL 57 -10.611 2.528 -7.796 1158 HG23 VAL 57 HG23 VAL 57 -9.672 1.624 -8.987 1159 H MET 58 H MET 58 -12.369 -1.425 -7.049 1160 HA MET 58 HA MET 58 -11.441 -3.557 -5.394 1161 HB2 MET 58 HB3 MET 58 -14.189 -3.185 -6.604 1162 HB3 MET 58 HB2 MET 58 -13.776 -4.109 -5.170 1163 HG2 MET 58 HG3 MET 58 -12.832 -1.339 -5.079 1164 HG3 MET 58 HG2 MET 58 -14.574 -1.455 -5.179 1165 HE1 MET 58 HE1 MET 58 -15.970 -2.708 -2.258 1166 HE2 MET 58 HE2 MET 58 -15.521 -4.087 -3.247 1167 HE3 MET 58 HE3 MET 58 -15.991 -2.587 -4.025 1168 H LYS 59 H LYS 59 -12.925 -3.361 -8.557 1169 HA LYS 59 HA LYS 59 -13.208 -6.079 -9.092 1170 HB2 LYS 59 HB3 LYS 59 -14.361 -4.298 -10.320 1171 HB3 LYS 59 HB2 LYS 59 -12.815 -3.804 -11.016 1172 HG2 LYS 59 HG3 LYS 59 -13.958 -5.177 -12.630 1173 HG3 LYS 59 HG2 LYS 59 -12.580 -6.079 -12.019 1174 HD2 LYS 59 HD3 LYS 59 -13.956 -7.471 -10.646 1175 HD3 LYS 59 HD2 LYS 59 -15.325 -6.376 -10.782 1176 HE2 LYS 59 HE2 LYS 59 -15.762 -8.219 -12.253 1177 HE3 LYS 59 HE1 LYS 59 -15.386 -6.784 -13.203 1178 HZ1 LYS 59 HZ1 LYS 59 -14.228 -8.690 -14.068 1179 HZ2 LYS 59 HZ2 LYS 59 -13.468 -9.006 -12.618 1180 HZ3 LYS 59 HZ3 LYS 59 -13.083 -7.602 -13.506 1181 H GLU 60 H GLU 60 -10.615 -3.816 -10.035 1182 HA GLU 60 HA GLU 60 -9.172 -5.654 -11.576 1183 HB2 GLU 60 HB3 GLU 60 -8.690 -3.168 -11.476 1184 HB3 GLU 60 HB2 GLU 60 -7.982 -3.431 -9.895 1185 HG2 GLU 60 HG3 GLU 60 -6.313 -4.957 -10.801 1186 HG3 GLU 60 HG2 GLU 60 -7.030 -4.842 -12.407 1187 H LEU 61 H LEU 61 -9.046 -4.926 -8.158 1188 HA LEU 61 HA LEU 61 -7.017 -6.823 -7.529 1189 HB2 LEU 61 HB3 LEU 61 -9.097 -5.380 -5.922 1190 HB3 LEU 61 HB2 LEU 61 -8.214 -6.712 -5.201 1191 HG LEU 61 HG LEU 61 -7.225 -4.389 -4.896 1192 HD11 LEU 61 HD11 LEU 61 -6.011 -6.645 -4.635 1193 HD12 LEU 61 HD12 LEU 61 -5.004 -5.225 -4.896 1194 HD13 LEU 61 HD13 LEU 61 -5.320 -6.321 -6.228 1195 HD21 LEU 61 HD21 LEU 61 -7.533 -3.682 -7.312 1196 HD22 LEU 61 HD22 LEU 61 -6.247 -4.812 -7.753 1197 HD23 LEU 61 HD23 LEU 61 -5.906 -3.459 -6.699 1198 H ASP 62 H ASP 62 -10.541 -6.952 -7.726 1199 HA ASP 62 HA ASP 62 -10.759 -9.557 -6.781 1200 HB2 ASP 62 HB3 ASP 62 -12.721 -8.055 -7.158 1201 HB3 ASP 62 HB2 ASP 62 -12.546 -8.350 -8.885 1202 H GLU 63 H GLU 63 -10.364 -8.264 -10.023 1203 HA GLU 63 HA GLU 63 -10.305 -10.710 -11.460 1204 HB2 GLU 63 HB3 GLU 63 -8.919 -8.087 -12.011 1205 HB3 GLU 63 HB2 GLU 63 -9.084 -9.410 -13.150 1206 HG2 GLU 63 HG3 GLU 63 -11.521 -9.309 -13.074 1207 HG3 GLU 63 HG2 GLU 63 -11.429 -8.072 -11.821 1208 H ASN 64 H ASN 64 -7.754 -8.703 -10.041 1209 HA ASN 64 HA ASN 64 -5.611 -10.387 -10.801 1210 HB2 ASN 64 HB3 ASN 64 -5.643 -7.954 -9.683 1211 HB3 ASN 64 HB2 ASN 64 -5.481 -8.980 -8.239 1212 HD21 ASN 64 HD21 ASN 64 -4.037 -11.110 -9.680 1213 HD22 ASN 64 HD22 ASN 64 -2.450 -10.549 -9.891 1214 H GLY 65 H GLY 65 -7.640 -10.169 -7.950 1215 HA2 GLY 65 HA3 GLY 65 -6.384 -12.273 -6.499 1216 HA3 GLY 65 HA2 GLY 65 -7.980 -11.606 -6.167 1217 H ASP 66 H ASP 66 -6.553 -13.227 -8.945 1218 HA ASP 66 HA ASP 66 -8.852 -14.708 -9.649 1219 HB2 ASP 66 HB3 ASP 66 -6.772 -14.251 -11.073 1220 HB3 ASP 66 HB2 ASP 66 -5.995 -15.515 -10.150 1221 H GLY 67 H GLY 67 -6.100 -15.247 -7.642 1222 HA2 GLY 67 HA3 GLY 67 -7.301 -17.763 -6.605 1223 HA3 GLY 67 HA2 GLY 67 -5.571 -17.438 -6.614 1224 H GLU 68 H GLU 68 -4.850 -15.537 -5.440 1225 HA GLU 68 HA GLU 68 -6.477 -14.925 -3.036 1226 HB2 GLU 68 HB3 GLU 68 -3.521 -14.951 -2.957 1227 HB3 GLU 68 HB2 GLU 68 -4.592 -15.261 -1.612 1228 HG2 GLU 68 HG3 GLU 68 -3.988 -17.421 -1.988 1229 HG3 GLU 68 HG2 GLU 68 -5.206 -17.372 -3.240 1230 H VAL 69 H VAL 69 -5.316 -12.997 -1.897 1231 HA VAL 69 HA VAL 69 -4.114 -11.190 -3.813 1232 HB VAL 69 HB VAL 69 -6.293 -10.268 -3.674 1233 HG11 VAL 69 HG11 VAL 69 -7.477 -9.880 -1.536 1234 HG12 VAL 69 HG12 VAL 69 -6.184 -10.714 -0.681 1235 HG13 VAL 69 HG13 VAL 69 -7.188 -11.589 -1.839 1236 HG21 VAL 69 HG21 VAL 69 -4.781 -8.495 -3.404 1237 HG22 VAL 69 HG22 VAL 69 -4.428 -8.874 -1.713 1238 HG23 VAL 69 HG23 VAL 69 -5.990 -8.202 -2.171 1239 H ASP 70 H ASP 70 -2.267 -10.285 -3.029 1240 HA ASP 70 HA ASP 70 -1.479 -11.289 -0.389 1241 HB2 ASP 70 HB3 ASP 70 0.624 -11.530 -1.117 1242 HB3 ASP 70 HB2 ASP 70 -0.125 -11.512 -2.704 1243 H PHE 71 H PHE 71 0.400 -9.844 0.509 1244 HA PHE 71 HA PHE 71 -0.912 -7.674 1.714 1245 HB2 PHE 71 HB3 PHE 71 0.980 -8.890 2.751 1246 HB3 PHE 71 HB2 PHE 71 2.069 -8.145 1.576 1247 HD1 PHE 71 HD1 PHE 71 -0.589 -7.221 4.032 1248 HD2 PHE 71 HD2 PHE 71 3.112 -6.067 2.157 1249 HE1 PHE 71 HE1 PHE 71 -0.470 -5.235 5.466 1250 HE2 PHE 71 HE2 PHE 71 3.211 -4.075 3.624 1251 HZ PHE 71 HZ PHE 71 1.455 -3.653 5.258 1252 H GLN 72 H GLN 72 1.485 -7.808 -0.883 1253 HA GLN 72 HA GLN 72 1.812 -5.027 -1.233 1254 HB2 GLN 72 HB3 GLN 72 2.173 -7.403 -3.042 1255 HB3 GLN 72 HB2 GLN 72 2.501 -5.750 -3.627 1256 HG2 GLN 72 HG3 GLN 72 4.136 -5.519 -1.821 1257 HG3 GLN 72 HG2 GLN 72 3.715 -7.127 -1.227 1258 HE21 GLN 72 HE21 GLN 72 4.431 -8.976 -2.479 1259 HE22 GLN 72 HE22 GLN 72 5.576 -8.837 -3.712 1260 H GLU 73 H GLU 73 -0.436 -7.356 -2.632 1261 HA GLU 73 HA GLU 73 -1.802 -5.497 -4.278 1262 HB2 GLU 73 HB3 GLU 73 -2.608 -8.213 -3.213 1263 HB3 GLU 73 HB2 GLU 73 -3.565 -7.272 -4.361 1264 HG2 GLU 73 HG3 GLU 73 -1.768 -7.208 -5.957 1265 HG3 GLU 73 HG2 GLU 73 -0.675 -7.955 -4.806 1266 H TYR 74 H TYR 74 -2.250 -6.654 -0.990 1267 HA TYR 74 HA TYR 74 -4.735 -5.430 -0.461 1268 HB2 TYR 74 HB3 TYR 74 -3.899 -7.113 1.049 1269 HB3 TYR 74 HB2 TYR 74 -2.470 -6.152 1.397 1270 HD1 TYR 74 HD1 TYR 74 -6.220 -5.423 1.368 1271 HD2 TYR 74 HD2 TYR 74 -2.501 -5.268 3.565 1272 HE1 TYR 74 HE1 TYR 74 -7.363 -4.361 3.241 1273 HE2 TYR 74 HE2 TYR 74 -3.682 -4.205 5.449 1274 HH TYR 74 HH TYR 74 -6.540 -2.740 5.265 1275 H VAL 75 H VAL 75 -1.422 -4.184 0.087 1276 HA VAL 75 HA VAL 75 -2.344 -1.733 1.140 1277 HB VAL 75 HB VAL 75 -0.116 -0.855 0.865 1278 HG11 VAL 75 HG11 VAL 75 0.680 -2.122 2.556 1279 HG12 VAL 75 HG12 VAL 75 0.678 -3.594 1.596 1280 HG13 VAL 75 HG13 VAL 75 -0.793 -3.065 2.395 1281 HG21 VAL 75 HG21 VAL 75 0.198 -2.031 -1.490 1282 HG22 VAL 75 HG22 VAL 75 0.750 -3.390 -0.528 1283 HG23 VAL 75 HG23 VAL 75 1.566 -1.832 -0.424 1284 H VAL 76 H VAL 76 -1.518 -2.671 -2.175 1285 HA VAL 76 HA VAL 76 -1.771 -0.051 -3.196 1286 HB VAL 76 HB VAL 76 -0.532 -1.779 -4.435 1287 HG11 VAL 76 HG11 VAL 76 -1.993 -3.651 -3.903 1288 HG12 VAL 76 HG12 VAL 76 -1.665 -3.550 -5.625 1289 HG13 VAL 76 HG13 VAL 76 -3.233 -3.042 -4.996 1290 HG21 VAL 76 HG21 VAL 76 -2.896 -0.965 -6.138 1291 HG22 VAL 76 HG22 VAL 76 -1.211 -1.121 -6.617 1292 HG23 VAL 76 HG23 VAL 76 -1.709 0.221 -5.594 1293 H LEU 77 H LEU 77 -4.089 -2.670 -2.816 1294 HA LEU 77 HA LEU 77 -6.185 -1.509 -4.273 1295 HB2 LEU 77 HB3 LEU 77 -6.223 -3.847 -3.440 1296 HB3 LEU 77 HB2 LEU 77 -6.305 -3.251 -1.812 1297 HG LEU 77 HG LEU 77 -8.482 -2.176 -2.203 1298 HD11 LEU 77 HD11 LEU 77 -9.298 -3.315 -4.677 1299 HD12 LEU 77 HD12 LEU 77 -7.831 -2.422 -5.010 1300 HD13 LEU 77 HD13 LEU 77 -9.197 -1.641 -4.210 1301 HD21 LEU 77 HD21 LEU 77 -8.571 -4.479 -1.450 1302 HD22 LEU 77 HD22 LEU 77 -8.358 -5.076 -3.097 1303 HD23 LEU 77 HD23 LEU 77 -9.837 -4.240 -2.648 1304 H VAL 78 H VAL 78 -5.388 -1.311 -0.826 1305 HA VAL 78 HA VAL 78 -7.447 0.578 -0.306 1306 HB VAL 78 HB VAL 78 -6.466 0.840 1.910 1307 HG11 VAL 78 HG11 VAL 78 -7.399 -1.545 0.761 1308 HG12 VAL 78 HG12 VAL 78 -7.324 -1.182 2.485 1309 HG13 VAL 78 HG13 VAL 78 -5.996 -2.033 1.703 1310 HG21 VAL 78 HG21 VAL 78 -4.061 0.866 1.291 1311 HG22 VAL 78 HG22 VAL 78 -4.184 -0.824 0.798 1312 HG23 VAL 78 HG23 VAL 78 -4.382 -0.389 2.484 1313 H ALA 79 H ALA 79 -3.994 0.833 -1.016 1314 HA ALA 79 HA ALA 79 -3.776 3.625 -0.664 1315 HB1 ALA 79 HB1 ALA 79 -2.211 1.969 -2.627 1316 HB2 ALA 79 HB2 ALA 79 -1.853 2.060 -0.894 1317 HB3 ALA 79 HB3 ALA 79 -1.733 3.502 -1.898 1318 H ALA 80 H ALA 80 -4.668 1.650 -3.461 1319 HA ALA 80 HA ALA 80 -4.652 3.639 -5.375 1320 HB1 ALA 80 HB1 ALA 80 -4.979 1.425 -6.142 1321 HB2 ALA 80 HB2 ALA 80 -6.489 2.242 -6.491 1322 HB3 ALA 80 HB3 ALA 80 -6.367 1.172 -5.089 1323 H LEU 81 H LEU 81 -7.261 2.588 -3.233 1324 HA LEU 81 HA LEU 81 -9.109 4.652 -3.964 1325 HB2 LEU 81 HB3 LEU 81 -8.885 2.938 -1.478 1326 HB3 LEU 81 HB2 LEU 81 -10.225 4.022 -1.805 1327 HG LEU 81 HG LEU 81 -9.398 1.764 -3.679 1328 HD11 LEU 81 HD11 LEU 81 -11.611 1.893 -1.615 1329 HD12 LEU 81 HD12 LEU 81 -10.231 0.793 -1.633 1330 HD13 LEU 81 HD13 LEU 81 -11.479 0.658 -2.865 1331 HD21 LEU 81 HD21 LEU 81 -11.777 3.654 -3.602 1332 HD22 LEU 81 HD22 LEU 81 -11.708 2.190 -4.584 1333 HD23 LEU 81 HD23 LEU 81 -10.587 3.495 -4.905 1334 H THR 82 H THR 82 -6.647 4.317 -1.443 1335 HA THR 82 HA THR 82 -7.226 6.686 -0.068 1336 HB THR 82 HB THR 82 -4.468 5.508 -0.398 1337 HG1 THR 82 HG2 THR 82 -6.119 3.924 0.265 1338 HG21 THR 82 HG21 THR 82 -5.538 6.727 2.124 1339 HG22 THR 82 HG22 THR 82 -4.994 7.789 0.829 1340 HG23 THR 82 HG23 THR 82 -3.882 6.630 1.540 1341 H VAL 83 H VAL 83 -4.996 6.079 -2.777 1342 HA VAL 83 HA VAL 83 -4.116 8.749 -2.924 1343 HB VAL 83 HB VAL 83 -3.063 6.631 -4.002 1344 HG11 VAL 83 HG11 VAL 83 -3.691 6.728 -6.549 1345 HG12 VAL 83 HG12 VAL 83 -5.283 7.134 -5.949 1346 HG13 VAL 83 HG13 VAL 83 -4.461 5.654 -5.412 1347 HG21 VAL 83 HG21 VAL 83 -3.146 8.970 -5.894 1348 HG22 VAL 83 HG22 VAL 83 -1.807 7.929 -5.476 1349 HG23 VAL 83 HG23 VAL 83 -2.363 9.133 -4.314 1350 H ALA 84 H ALA 84 -6.793 7.039 -4.445 1351 HA ALA 84 HA ALA 84 -7.750 9.195 -6.032 1352 HB1 ALA 84 HB1 ALA 84 -9.329 6.978 -4.695 1353 HB2 ALA 84 HB2 ALA 84 -8.597 6.888 -6.301 1354 HB3 ALA 84 HB3 ALA 84 -9.908 8.024 -5.988 1355 H MET 85 H MET 85 -8.494 8.130 -2.726 1356 HA MET 85 HA MET 85 -10.296 10.187 -2.063 1357 HB2 MET 85 HB3 MET 85 -9.959 8.182 -0.666 1358 HB3 MET 85 HB2 MET 85 -8.340 8.739 -0.273 1359 HG2 MET 85 HG3 MET 85 -9.890 9.335 1.542 1360 HG3 MET 85 HG2 MET 85 -9.282 10.794 0.776 1361 HE1 MET 85 HE1 MET 85 -11.289 11.872 2.145 1362 HE2 MET 85 HE2 MET 85 -11.955 10.318 2.634 1363 HE3 MET 85 HE3 MET 85 -12.996 11.495 1.867 1364 H ASN 86 H ASN 86 -6.796 9.938 -1.781 1365 HA ASN 86 HA ASN 86 -6.348 12.444 -0.550 1366 HB2 ASN 86 HB3 ASN 86 -4.601 10.786 -0.620 1367 HB3 ASN 86 HB2 ASN 86 -4.594 10.848 -2.382 1368 HD21 ASN 86 HD21 ASN 86 -2.774 12.002 -3.056 1369 HD22 ASN 86 HD22 ASN 86 -2.197 13.419 -2.344 1370 H ASN 87 H ASN 87 -6.476 11.470 -3.958 1371 HA ASN 87 HA ASN 87 -5.780 14.004 -5.032 1372 HB2 ASN 87 HB3 ASN 87 -5.744 12.016 -6.425 1373 HB3 ASN 87 HB2 ASN 87 -7.483 11.809 -6.229 1374 HD21 ASN 87 HD21 ASN 87 -8.374 12.371 -8.241 1375 HD22 ASN 87 HD22 ASN 87 -7.998 13.824 -9.040 1376 H PHE 88 H PHE 88 -8.880 12.529 -4.277 1377 HA PHE 88 HA PHE 88 -10.435 14.782 -5.045 1378 HB2 PHE 88 HB3 PHE 88 -10.988 12.298 -3.457 1379 HB3 PHE 88 HB2 PHE 88 -12.097 13.656 -3.325 1380 HD1 PHE 88 HD2 PHE 88 -10.507 11.333 -5.772 1381 HD2 PHE 88 HD1 PHE 88 -13.567 14.276 -5.094 1382 HE1 PHE 88 HE2 PHE 88 -11.521 10.788 -7.959 1383 HE2 PHE 88 HE1 PHE 88 -14.572 13.719 -7.289 1384 HZ PHE 88 HZ PHE 88 -13.556 11.987 -8.714 1385 H PHE 89 H PHE 89 -8.741 13.868 -2.127 1386 HA PHE 89 HA PHE 89 -9.884 15.474 -0.234 1387 HB2 PHE 89 HB3 PHE 89 -7.775 13.860 -0.287 1388 HB3 PHE 89 HB2 PHE 89 -6.894 15.375 -0.430 1389 HD1 PHE 89 HD1 PHE 89 -7.280 17.182 1.365 1390 HD2 PHE 89 HD2 PHE 89 -8.682 13.144 1.676 1391 HE1 PHE 89 HE1 PHE 89 -7.553 17.468 3.818 1392 HE2 PHE 89 HE2 PHE 89 -8.969 13.410 4.095 1393 HZ PHE 89 HZ PHE 89 -8.395 15.598 5.196 1394 H TRP 90 H TRP 90 -7.295 16.248 -2.515 1395 HA TRP 90 HA TRP 90 -7.276 19.045 -1.821 1396 HB2 TRP 90 HB3 TRP 90 -5.901 17.757 -4.173 1397 HB3 TRP 90 HB2 TRP 90 -5.470 19.265 -3.357 1398 HD1 TRP 90 HD TRP 90 -4.863 15.630 -3.215 1399 HE1 TRP 90 HE1 TRP 90 -3.651 14.992 -1.091 1400 HE3 TRP 90 HE3 TRP 90 -5.261 20.030 -0.690 1401 HZ2 TRP 90 HZ2 TRP 90 -2.875 16.245 1.454 1402 HZ3 TRP 90 HZ3 TRP 90 -4.287 20.292 1.563 1403 HH2 TRP 90 HH TRP 90 -3.090 18.393 2.636 1404 H GLU 91 H GLU 91 -8.368 17.141 -4.570 1405 HA GLU 91 HA GLU 91 -9.206 19.449 -6.024 1406 HB2 GLU 91 HB3 GLU 91 -10.020 16.580 -6.394 1407 HB3 GLU 91 HB2 GLU 91 -10.496 17.877 -7.473 1408 HG2 GLU 91 HG3 GLU 91 -8.037 18.449 -7.793 1409 HG3 GLU 91 HG2 GLU 91 -7.653 17.036 -6.858 1410 H ASN 92 H ASN 92 -10.939 17.382 -3.754 1411 HA ASN 92 HA ASN 92 -13.544 18.040 -4.231 1412 HB2 ASN 92 HB3 ASN 92 -12.896 16.499 -2.458 1413 HB3 ASN 92 HB2 ASN 92 -12.204 17.826 -1.518 1414 HD21 ASN 92 HD21 ASN 92 -13.893 16.860 0.090 1415 HD22 ASN 92 HD22 ASN 92 -15.457 17.499 0.022 1416 H SER 93 H SER 93 -14.477 19.958 -4.560 1417 HA SER 93 HA SER 93 -13.781 22.203 -2.822 1418 HB2 SER 93 HB3 SER 93 -12.513 22.085 -5.104 1419 HB3 SER 93 HB2 SER 93 -14.036 22.611 -5.776 1420 HG SER 93 HG SER 93 -13.934 24.259 -4.001 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -13.459 1.513 10.093 2 HA2 GLY 1 HA3 GLY 1 -11.892 2.853 8.216 3 HA3 GLY 1 HA2 GLY 1 -12.819 4.082 9.062 4 H SER 2 H SER 2 -11.074 1.105 9.943 5 HA SER 2 HA SER 2 -10.366 2.086 12.533 6 HB2 SER 2 HB3 SER 2 -8.878 -0.229 11.488 7 HB3 SER 2 HB2 SER 2 -9.807 -0.046 12.952 8 HG SER 2 HG SER 2 -10.425 -1.117 10.608 9 H GLU 3 H GLU 3 -7.852 1.374 13.047 10 HA GLU 3 HA GLU 3 -6.170 3.448 12.552 11 HB2 GLU 3 HB3 GLU 3 -5.277 0.568 12.557 12 HB3 GLU 3 HB2 GLU 3 -4.325 1.974 13.039 13 HG2 GLU 3 HG3 GLU 3 -4.961 1.198 15.045 14 HG3 GLU 3 HG2 GLU 3 -6.314 2.296 14.776 15 H LEU 4 H LEU 4 -7.119 0.943 10.427 16 HA LEU 4 HA LEU 4 -4.965 0.815 8.666 17 HB2 LEU 4 HB3 LEU 4 -7.906 0.219 8.396 18 HB3 LEU 4 HB2 LEU 4 -6.835 0.064 7.018 19 HG LEU 4 HG LEU 4 -7.215 -2.045 8.430 20 HD11 LEU 4 HD11 LEU 4 -5.443 -1.884 6.781 21 HD12 LEU 4 HD12 LEU 4 -4.902 -2.774 8.197 22 HD13 LEU 4 HD13 LEU 4 -4.368 -1.112 7.959 23 HD21 LEU 4 HD21 LEU 4 -5.660 -2.230 10.400 24 HD22 LEU 4 HD22 LEU 4 -6.999 -1.166 10.675 25 HD23 LEU 4 HD23 LEU 4 -5.385 -0.504 10.340 26 H GLU 5 H GLU 5 -7.856 2.885 8.655 27 HA GLU 5 HA GLU 5 -7.152 4.196 6.221 28 HB2 GLU 5 HB3 GLU 5 -8.923 5.036 8.516 29 HB3 GLU 5 HB2 GLU 5 -8.766 5.985 7.046 30 HG2 GLU 5 HG3 GLU 5 -9.430 3.769 5.799 31 HG3 GLU 5 HG2 GLU 5 -9.819 3.195 7.379 32 H THR 6 H THR 6 -6.613 4.878 9.637 33 HA THR 6 HA THR 6 -5.218 7.300 9.303 34 HB THR 6 HB THR 6 -4.728 5.252 11.474 35 HG1 THR 6 HG2 THR 6 -6.939 6.789 10.827 36 HG21 THR 6 HG21 THR 6 -4.732 8.266 11.677 37 HG22 THR 6 HG22 THR 6 -3.286 7.371 11.232 38 HG23 THR 6 HG23 THR 6 -4.040 7.092 12.790 39 H ALA 7 H ALA 7 -4.125 3.924 9.476 40 HA ALA 7 HA ALA 7 -1.379 4.353 9.286 41 HB1 ALA 7 HB1 ALA 7 -2.998 2.074 8.114 42 HB2 ALA 7 HB2 ALA 7 -2.340 2.143 9.748 43 HB3 ALA 7 HB3 ALA 7 -1.255 2.065 8.364 44 H MET 8 H MET 8 -3.794 3.942 6.702 45 HA MET 8 HA MET 8 -1.938 4.310 4.573 46 HB2 MET 8 HB3 MET 8 -4.938 4.769 4.621 47 HB3 MET 8 HB2 MET 8 -3.951 4.740 3.165 48 HG2 MET 8 HG3 MET 8 -4.353 2.435 5.102 49 HG3 MET 8 HG2 MET 8 -4.947 2.550 3.455 50 HE1 MET 8 HE1 MET 8 -3.671 2.877 1.540 51 HE2 MET 8 HE2 MET 8 -2.073 2.217 1.184 52 HE3 MET 8 HE3 MET 8 -2.212 3.826 1.883 53 H GLU 9 H GLU 9 -4.019 6.538 6.379 54 HA GLU 9 HA GLU 9 -3.450 8.836 4.864 55 HB2 GLU 9 HB3 GLU 9 -4.155 8.539 7.807 56 HB3 GLU 9 HB2 GLU 9 -4.040 10.086 6.984 57 HG2 GLU 9 HG3 GLU 9 -5.805 9.497 5.454 58 HG3 GLU 9 HG2 GLU 9 -5.912 7.861 6.069 59 H THR 10 H THR 10 -1.851 7.248 7.537 60 HA THR 10 HA THR 10 0.104 9.193 8.148 61 HB THR 10 HB THR 10 0.601 6.192 8.277 62 HG1 THR 10 HG2 THR 10 -1.534 6.854 9.160 63 HG21 THR 10 HG21 THR 10 1.957 6.761 10.166 64 HG22 THR 10 HG22 THR 10 1.355 8.411 10.189 65 HG23 THR 10 HG23 THR 10 2.409 7.886 8.887 66 H LEU 11 H LEU 11 0.053 6.499 5.848 67 HA LEU 11 HA LEU 11 2.623 6.963 4.729 68 HB2 LEU 11 HB3 LEU 11 0.155 5.630 3.594 69 HB3 LEU 11 HB2 LEU 11 1.707 5.660 2.771 70 HG LEU 11 HG LEU 11 1.370 4.549 5.581 71 HD11 LEU 11 HD11 LEU 11 1.454 3.019 2.965 72 HD12 LEU 11 HD12 LEU 11 0.004 3.269 3.945 73 HD13 LEU 11 HD13 LEU 11 1.353 2.347 4.588 74 HD21 LEU 11 HD21 LEU 11 3.531 4.089 3.485 75 HD22 LEU 11 HD22 LEU 11 3.528 3.522 5.141 76 HD23 LEU 11 HD23 LEU 11 3.720 5.234 4.815 77 H ILE 12 H ILE 12 -0.616 8.164 3.942 78 HA ILE 12 HA ILE 12 0.077 9.510 1.551 79 HB ILE 12 HB ILE 12 -2.047 10.144 3.613 80 HG12 ILE 12 HG13 ILE 12 -2.263 7.949 2.312 81 HG13 ILE 12 HG12 ILE 12 -3.594 9.080 2.089 82 HG21 ILE 12 HG21 ILE 12 -3.095 11.457 1.765 83 HG22 ILE 12 HG22 ILE 12 -1.528 11.456 0.943 84 HG23 ILE 12 HG23 ILE 12 -1.702 12.196 2.520 85 HD11 ILE 12 HD11 ILE 12 -2.650 9.834 -0.046 86 HD12 ILE 12 HD12 ILE 12 -2.873 8.102 -0.042 87 HD13 ILE 12 HD13 ILE 12 -1.262 8.762 0.149 88 H ASN 13 H ASN 13 -0.011 10.622 4.897 89 HA ASN 13 HA ASN 13 0.682 13.292 4.398 90 HB2 ASN 13 HB3 ASN 13 1.071 11.514 6.798 91 HB3 ASN 13 HB2 ASN 13 1.625 13.181 6.768 92 HD21 ASN 13 HD21 ASN 13 -1.263 11.157 6.744 93 HD22 ASN 13 HD22 ASN 13 -2.363 12.424 7.013 94 H VAL 14 H VAL 14 2.734 10.490 5.110 95 HA VAL 14 HA VAL 14 5.183 11.919 4.983 96 HB VAL 14 HB VAL 14 4.572 8.984 4.559 97 HG11 VAL 14 HG11 VAL 14 7.011 8.669 4.945 98 HG12 VAL 14 HG12 VAL 14 7.234 10.404 4.880 99 HG13 VAL 14 HG13 VAL 14 6.692 9.531 3.444 100 HG21 VAL 14 HG21 VAL 14 5.587 10.619 6.908 101 HG22 VAL 14 HG22 VAL 14 5.627 8.862 6.878 102 HG23 VAL 14 HG23 VAL 14 4.085 9.706 6.836 103 H PHE 15 H PHE 15 3.400 10.019 2.584 104 HA PHE 15 HA PHE 15 5.177 10.420 0.409 105 HB2 PHE 15 HB3 PHE 15 3.300 8.767 0.447 106 HB3 PHE 15 HB2 PHE 15 2.170 10.110 0.347 107 HD1 PHE 15 HD2 PHE 15 2.007 11.488 -1.671 108 HD2 PHE 15 HD1 PHE 15 4.676 8.139 -1.474 109 HE1 PHE 15 HE2 PHE 15 2.250 11.543 -4.126 110 HE2 PHE 15 HE1 PHE 15 4.929 8.198 -3.938 111 HZ PHE 15 HZ PHE 15 3.725 9.893 -5.260 112 H HIS 16 H HIS 16 2.279 12.124 1.448 113 HA HIS 16 HA HIS 16 2.142 13.999 -0.588 114 HB2 HIS 16 HB3 HIS 16 0.334 13.446 1.029 115 HB3 HIS 16 HB2 HIS 16 1.201 14.360 2.264 116 HD1 HIS 16 HD1 HIS 16 1.644 15.991 -0.931 117 HD2 HIS 16 HD2 HIS 16 -1.325 15.893 1.981 118 HE1 HIS 16 HE1 HIS 16 0.107 17.954 -1.426 119 HE2 HIS 16 HE2 HIS 16 -1.684 17.962 0.373 120 H ALA 17 H ALA 17 3.688 14.238 2.601 121 HA ALA 17 HA ALA 17 4.462 16.913 2.461 122 HB1 ALA 17 HB1 ALA 17 5.846 14.576 3.810 123 HB2 ALA 17 HB2 ALA 17 4.700 15.696 4.541 124 HB3 ALA 17 HB3 ALA 17 6.295 16.263 4.054 125 H HIS 18 H HIS 18 6.157 14.006 1.375 126 HA HIS 18 HA HIS 18 8.371 15.433 0.265 127 HB2 HIS 18 HB3 HIS 18 7.400 12.598 -0.138 128 HB3 HIS 18 HB2 HIS 18 8.787 13.273 -0.995 129 HD1 HIS 18 HD1 HIS 18 10.950 13.970 0.473 130 HD2 HIS 18 HD2 HIS 18 7.899 12.021 2.610 131 HE1 HIS 18 HE1 HIS 18 11.902 13.340 2.685 132 HE2 HIS 18 HE2 HIS 18 10.103 12.142 4.000 133 H SER 19 H SER 19 5.262 14.329 -1.060 134 HA SER 19 HA SER 19 5.770 14.938 -3.769 135 HB2 SER 19 HB3 SER 19 3.149 15.375 -2.297 136 HB3 SER 19 HB2 SER 19 3.388 15.200 -4.022 137 HG SER 19 HG SER 19 4.357 13.121 -3.464 138 H GLY 20 H GLY 20 4.784 16.949 -1.082 139 HA2 GLY 20 HA3 GLY 20 4.358 19.358 -2.461 140 HA3 GLY 20 HA2 GLY 20 4.892 19.214 -0.791 141 H LYS 21 H LYS 21 7.303 17.790 -1.296 142 HA LYS 21 HA LYS 21 9.041 19.995 -1.573 143 HB2 LYS 21 HB3 LYS 21 9.713 17.045 -1.717 144 HB3 LYS 21 HB2 LYS 21 10.856 18.347 -1.472 145 HG2 LYS 21 HG3 LYS 21 8.529 17.768 0.386 146 HG3 LYS 21 HG2 LYS 21 10.174 17.258 0.691 147 HD2 LYS 21 HD3 LYS 21 10.897 19.669 0.657 148 HD3 LYS 21 HD2 LYS 21 9.222 20.135 0.416 149 HE2 LYS 21 HE2 LYS 21 9.700 20.310 2.761 150 HE3 LYS 21 HE1 LYS 21 8.599 18.969 2.530 151 HZ1 LYS 21 HZ1 LYS 21 11.418 18.270 2.382 152 HZ2 LYS 21 HZ2 LYS 21 10.152 17.461 3.150 153 HZ3 LYS 21 HZ3 LYS 21 10.897 18.757 3.899 154 H GLU 22 H GLU 22 8.388 17.313 -3.829 155 HA GLU 22 HA GLU 22 9.168 19.040 -6.068 156 HB2 GLU 22 HB3 GLU 22 10.695 16.473 -5.545 157 HB3 GLU 22 HB2 GLU 22 10.809 17.458 -6.994 158 HG2 GLU 22 HG3 GLU 22 11.522 19.407 -5.500 159 HG3 GLU 22 HG2 GLU 22 11.589 18.249 -4.182 160 H GLY 23 H GLY 23 8.001 15.907 -5.007 161 HA2 GLY 23 HA3 GLY 23 7.415 14.823 -7.523 162 HA3 GLY 23 HA2 GLY 23 6.708 14.317 -6.012 163 H ASP 24 H ASP 24 6.328 16.318 -8.827 164 HA ASP 24 HA ASP 24 4.507 17.574 -9.656 165 HB2 ASP 24 HB3 ASP 24 4.183 15.052 -10.121 166 HB3 ASP 24 HB2 ASP 24 3.049 15.071 -8.794 167 H LYS 25 H LYS 25 1.686 16.965 -8.781 168 HA LYS 25 HA LYS 25 1.758 18.475 -6.277 169 HB2 LYS 25 HB3 LYS 25 -0.804 18.617 -6.613 170 HB3 LYS 25 HB2 LYS 25 0.222 19.648 -7.606 171 HG2 LYS 25 HG3 LYS 25 -0.046 18.146 -9.505 172 HG3 LYS 25 HG2 LYS 25 -0.923 16.970 -8.519 173 HD2 LYS 25 HD3 LYS 25 -2.656 18.678 -8.048 174 HD3 LYS 25 HD2 LYS 25 -1.824 19.812 -9.087 175 HE2 LYS 25 HE2 LYS 25 -2.741 17.104 -10.059 176 HE3 LYS 25 HE1 LYS 25 -3.758 18.528 -10.095 177 HZ1 LYS 25 HZ1 LYS 25 -1.987 19.672 -11.385 178 HZ2 LYS 25 HZ2 LYS 25 -2.677 18.397 -12.201 179 HZ3 LYS 25 HZ3 LYS 25 -1.137 18.224 -11.527 180 H TYR 26 H TYR 26 0.858 15.467 -7.723 181 HA TYR 26 HA TYR 26 1.048 14.327 -5.038 182 HB2 TYR 26 HB3 TYR 26 -0.692 12.595 -6.490 183 HB3 TYR 26 HB2 TYR 26 -0.975 13.375 -4.970 184 HD1 TYR 26 HD1 TYR 26 -1.582 16.063 -5.263 185 HD2 TYR 26 HD2 TYR 26 -2.229 12.946 -8.147 186 HE1 TYR 26 HE1 TYR 26 -3.374 17.413 -6.329 187 HE2 TYR 26 HE2 TYR 26 -3.992 14.259 -9.205 188 HH TYR 26 HH TYR 26 -4.908 17.548 -8.038 189 H LYS 27 H LYS 27 3.080 13.841 -5.456 190 HA LYS 27 HA LYS 27 3.481 11.349 -6.694 191 HB2 LYS 27 HB3 LYS 27 4.618 13.766 -8.114 192 HB3 LYS 27 HB2 LYS 27 5.466 12.225 -8.083 193 HG2 LYS 27 HG3 LYS 27 2.680 12.686 -9.183 194 HG3 LYS 27 HG2 LYS 27 4.147 12.407 -10.084 195 HD2 LYS 27 HD3 LYS 27 4.313 10.259 -8.449 196 HD3 LYS 27 HD2 LYS 27 2.574 10.487 -8.478 197 HE2 LYS 27 HE2 LYS 27 2.534 10.419 -10.970 198 HE3 LYS 27 HE1 LYS 27 4.284 10.311 -10.910 199 HZ1 LYS 27 HZ1 LYS 27 3.700 8.138 -9.454 200 HZ2 LYS 27 HZ2 LYS 27 3.811 8.108 -11.144 201 HZ3 LYS 27 HZ3 LYS 27 2.344 8.215 -10.437 202 H LEU 28 H LEU 28 5.759 10.667 -6.482 203 HA LEU 28 HA LEU 28 7.197 12.191 -4.455 204 HB2 LEU 28 HB3 LEU 28 6.269 10.337 -3.311 205 HB3 LEU 28 HB2 LEU 28 6.729 9.198 -4.569 206 HG LEU 28 HG LEU 28 9.156 9.831 -4.066 207 HD11 LEU 28 HD11 LEU 28 9.578 10.908 -1.918 208 HD12 LEU 28 HD12 LEU 28 7.851 11.107 -1.651 209 HD13 LEU 28 HD13 LEU 28 8.651 11.993 -2.946 210 HD21 LEU 28 HD21 LEU 28 7.470 8.653 -1.844 211 HD22 LEU 28 HD22 LEU 28 9.217 8.432 -2.035 212 HD23 LEU 28 HD23 LEU 28 8.106 7.780 -3.234 213 H SER 29 H SER 29 9.276 12.628 -5.139 214 HA SER 29 HA SER 29 9.999 11.678 -7.761 215 HB2 SER 29 HB3 SER 29 11.940 13.262 -6.082 216 HB3 SER 29 HB2 SER 29 11.531 13.309 -7.786 217 HG SER 29 HG SER 29 9.920 14.631 -7.410 218 H LYS 30 H LYS 30 12.019 10.603 -8.223 219 HA LYS 30 HA LYS 30 12.587 8.435 -6.433 220 HB2 LYS 30 HB3 LYS 30 14.129 9.332 -8.895 221 HB3 LYS 30 HB2 LYS 30 14.264 7.773 -8.099 222 HG2 LYS 30 HG3 LYS 30 11.695 8.840 -9.249 223 HG3 LYS 30 HG2 LYS 30 12.720 7.813 -10.192 224 HD2 LYS 30 HD3 LYS 30 11.803 6.897 -7.432 225 HD3 LYS 30 HD2 LYS 30 10.770 6.701 -8.828 226 HE2 LYS 30 HE2 LYS 30 13.309 5.321 -8.144 227 HE3 LYS 30 HE1 LYS 30 11.866 4.688 -8.923 228 HZ1 LYS 30 HZ1 LYS 30 13.926 6.439 -10.222 229 HZ2 LYS 30 HZ2 LYS 30 12.559 5.871 -11.020 230 HZ3 LYS 30 HZ3 LYS 30 13.754 4.800 -10.484 231 H LYS 31 H LYS 31 13.366 11.579 -6.391 232 HA LYS 31 HA LYS 31 16.108 11.516 -5.468 233 HB2 LYS 31 HB3 LYS 31 14.267 13.803 -4.806 234 HB3 LYS 31 HB2 LYS 31 15.922 13.789 -5.352 235 HG2 LYS 31 HG3 LYS 31 15.310 13.298 -7.601 236 HG3 LYS 31 HG2 LYS 31 13.635 13.024 -7.234 237 HD2 LYS 31 HD3 LYS 31 13.561 15.419 -6.357 238 HD3 LYS 31 HD2 LYS 31 15.166 15.616 -7.068 239 HE2 LYS 31 HE2 LYS 31 14.008 14.609 -9.221 240 HE3 LYS 31 HE1 LYS 31 12.555 15.077 -8.399 241 HZ1 LYS 31 HZ1 LYS 31 14.722 16.929 -9.199 242 HZ2 LYS 31 HZ2 LYS 31 13.524 17.359 -8.070 243 HZ3 LYS 31 HZ3 LYS 31 13.107 16.943 -9.661 244 H GLU 32 H GLU 32 12.986 12.419 -4.097 245 HA GLU 32 HA GLU 32 13.656 12.444 -1.358 246 HB2 GLU 32 HB3 GLU 32 11.040 12.230 -2.848 247 HB3 GLU 32 HB2 GLU 32 11.175 12.488 -1.106 248 HG2 GLU 32 HG3 GLU 32 12.362 14.337 -3.231 249 HG3 GLU 32 HG2 GLU 32 10.823 14.581 -2.430 250 H LEU 33 H LEU 33 12.188 10.099 -3.516 251 HA LEU 33 HA LEU 33 11.157 8.399 -1.640 252 HB2 LEU 33 HB3 LEU 33 10.566 8.247 -3.983 253 HB3 LEU 33 HB2 LEU 33 12.177 7.728 -4.421 254 HG LEU 33 HG LEU 33 10.370 5.916 -4.247 255 HD11 LEU 33 HD11 LEU 33 11.972 4.383 -3.955 256 HD12 LEU 33 HD12 LEU 33 12.509 5.038 -2.423 257 HD13 LEU 33 HD13 LEU 33 13.058 5.764 -3.934 258 HD21 LEU 33 HD21 LEU 33 9.203 6.339 -2.230 259 HD22 LEU 33 HD22 LEU 33 10.670 6.583 -1.273 260 HD23 LEU 33 HD23 LEU 33 10.234 4.995 -1.835 261 H LYS 34 H LYS 34 14.402 8.303 -3.076 262 HA LYS 34 HA LYS 34 15.226 5.873 -1.895 263 HB2 LYS 34 HB3 LYS 34 16.867 8.327 -2.583 264 HB3 LYS 34 HB2 LYS 34 17.515 6.745 -2.182 265 HG2 LYS 34 HG3 LYS 34 16.401 5.735 -4.095 266 HG3 LYS 34 HG2 LYS 34 15.668 7.283 -4.536 267 HD2 LYS 34 HD3 LYS 34 18.006 8.242 -4.740 268 HD3 LYS 34 HD2 LYS 34 18.616 6.629 -4.424 269 HE2 LYS 34 HE2 LYS 34 18.637 6.691 -6.737 270 HE3 LYS 34 HE1 LYS 34 17.105 5.882 -6.424 271 HZ1 LYS 34 HZ1 LYS 34 17.636 8.615 -7.314 272 HZ2 LYS 34 HZ2 LYS 34 16.215 8.382 -6.433 273 HZ3 LYS 34 HZ3 LYS 34 16.490 7.562 -7.906 274 H GLU 35 H GLU 35 15.515 9.240 -0.833 275 HA GLU 35 HA GLU 35 16.882 8.604 1.574 276 HB2 GLU 35 HB3 GLU 35 15.429 11.134 0.756 277 HB3 GLU 35 HB2 GLU 35 16.492 10.958 2.151 278 HG2 GLU 35 HG3 GLU 35 17.317 10.502 -0.728 279 HG3 GLU 35 HG2 GLU 35 17.709 11.908 0.241 280 H LEU 36 H LEU 36 13.558 9.565 0.873 281 HA LEU 36 HA LEU 36 12.714 9.398 3.551 282 HB2 LEU 36 HB3 LEU 36 10.881 10.321 2.741 283 HB3 LEU 36 HB2 LEU 36 11.557 10.258 1.145 284 HG LEU 36 HG LEU 36 10.613 7.778 1.125 285 HD11 LEU 36 HD11 LEU 36 8.298 8.302 2.529 286 HD12 LEU 36 HD12 LEU 36 9.534 8.930 3.600 287 HD13 LEU 36 HD13 LEU 36 9.592 7.234 3.076 288 HD21 LEU 36 HD21 LEU 36 9.869 9.591 -0.290 289 HD22 LEU 36 HD22 LEU 36 8.820 10.210 0.995 290 HD23 LEU 36 HD23 LEU 36 8.492 8.631 0.260 291 H LEU 37 H LEU 37 12.615 7.002 0.934 292 HA LEU 37 HA LEU 37 11.140 5.142 2.410 293 HB2 LEU 37 HB3 LEU 37 11.403 4.914 -0.010 294 HB3 LEU 37 HB2 LEU 37 13.122 4.610 0.152 295 HG LEU 37 HG LEU 37 11.557 2.591 -0.175 296 HD11 LEU 37 HD11 LEU 37 13.160 2.159 2.311 297 HD12 LEU 37 HD12 LEU 37 14.005 2.699 0.855 298 HD13 LEU 37 HD13 LEU 37 13.063 1.220 0.832 299 HD21 LEU 37 HD21 LEU 37 10.400 1.731 1.703 300 HD22 LEU 37 HD22 LEU 37 9.919 3.426 1.587 301 HD23 LEU 37 HD23 LEU 37 11.086 2.918 2.806 302 H GLN 38 H GLN 38 14.665 5.520 2.088 303 HA GLN 38 HA GLN 38 15.216 3.367 3.861 304 HB2 GLN 38 HB3 GLN 38 17.486 4.122 3.939 305 HB3 GLN 38 HB2 GLN 38 16.941 4.308 2.279 306 HG2 GLN 38 HG3 GLN 38 16.594 6.701 2.634 307 HG3 GLN 38 HG2 GLN 38 17.038 6.570 4.333 308 HE21 GLN 38 HE21 GLN 38 18.482 8.154 2.204 309 HE22 GLN 38 HE22 GLN 38 20.032 7.499 2.173 310 H THR 39 H THR 39 14.738 6.803 4.310 311 HA THR 39 HA THR 39 15.386 6.921 7.056 312 HB THR 39 HB THR 39 13.450 8.569 5.433 313 HG1 THR 39 HG2 THR 39 15.453 8.755 4.584 314 HG21 THR 39 HG21 THR 39 14.393 8.726 8.244 315 HG22 THR 39 HG22 THR 39 12.887 9.249 7.500 316 HG23 THR 39 HG23 THR 39 14.321 10.249 7.346 317 H GLU 40 H GLU 40 12.217 6.542 5.429 318 HA GLU 40 HA GLU 40 10.890 6.355 7.911 319 HB2 GLU 40 HB3 GLU 40 9.879 5.613 5.162 320 HB3 GLU 40 HB2 GLU 40 8.888 5.820 6.610 321 HG2 GLU 40 HG3 GLU 40 10.587 7.984 5.303 322 HG3 GLU 40 HG2 GLU 40 8.828 7.833 5.292 323 H LEU 41 H LEU 41 12.015 3.903 5.634 324 HA LEU 41 HA LEU 41 10.970 1.799 7.421 325 HB2 LEU 41 HB3 LEU 41 11.626 1.858 4.499 326 HB3 LEU 41 HB2 LEU 41 11.696 0.350 5.353 327 HG LEU 41 HG LEU 41 9.380 0.667 6.216 328 HD11 LEU 41 HD11 LEU 41 9.580 3.218 4.620 329 HD12 LEU 41 HD12 LEU 41 8.995 2.968 6.268 330 HD13 LEU 41 HD13 LEU 41 8.023 2.443 4.909 331 HD21 LEU 41 HD21 LEU 41 9.090 1.048 3.283 332 HD22 LEU 41 HD22 LEU 41 8.430 -0.220 4.324 333 HD23 LEU 41 HD23 LEU 41 10.105 -0.303 3.796 334 H SER 42 H SER 42 13.401 3.277 8.058 335 HA SER 42 HA SER 42 15.735 1.970 7.363 336 HB2 SER 42 HB3 SER 42 15.052 3.187 10.055 337 HB3 SER 42 HB2 SER 42 16.660 2.784 9.499 338 HG SER 42 HG SER 42 15.488 4.222 7.569 339 H GLY 43 H GLY 43 13.394 1.064 9.874 340 HA2 GLY 43 HA3 GLY 43 14.897 -1.039 10.990 341 HA3 GLY 43 HA2 GLY 43 13.149 -0.854 11.085 342 H PHE 44 H PHE 44 12.460 -0.986 8.403 343 HA PHE 44 HA PHE 44 12.673 -3.837 7.917 344 HB2 PHE 44 HB3 PHE 44 11.364 -1.603 6.357 345 HB3 PHE 44 HB2 PHE 44 11.538 -3.209 5.677 346 HD1 PHE 44 HD2 PHE 44 11.015 -5.073 7.798 347 HD2 PHE 44 HD1 PHE 44 9.175 -1.275 7.079 348 HE1 PHE 44 HE2 PHE 44 9.000 -5.827 9.021 349 HE2 PHE 44 HE1 PHE 44 7.147 -2.028 8.316 350 HZ PHE 44 HZ PHE 44 7.074 -4.320 9.285 351 H LEU 45 H LEU 45 13.927 -0.906 6.498 352 HA LEU 45 HA LEU 45 15.268 -2.094 4.366 353 HB2 LEU 45 HB3 LEU 45 14.913 0.255 4.351 354 HB3 LEU 45 HB2 LEU 45 15.775 0.479 5.865 355 HG LEU 45 HG LEU 45 17.791 -0.323 4.864 356 HD11 LEU 45 HD11 LEU 45 16.870 -1.790 3.066 357 HD12 LEU 45 HD12 LEU 45 17.940 -0.591 2.355 358 HD13 LEU 45 HD13 LEU 45 16.201 -0.372 2.245 359 HD21 LEU 45 HD21 LEU 45 16.683 1.871 3.085 360 HD22 LEU 45 HD22 LEU 45 18.350 1.644 3.601 361 HD23 LEU 45 HD23 LEU 45 17.127 2.119 4.780 362 H ASP 46 H ASP 46 16.421 -1.292 7.648 363 HA ASP 46 HA ASP 46 19.049 -2.281 7.220 364 HB2 ASP 46 HB3 ASP 46 18.450 -0.821 9.125 365 HB3 ASP 46 HB2 ASP 46 17.494 -2.140 9.787 366 H ALA 47 H ALA 47 16.073 -3.755 8.317 367 HA ALA 47 HA ALA 47 17.138 -6.226 9.124 368 HB1 ALA 47 HB1 ALA 47 15.004 -6.223 9.837 369 HB2 ALA 47 HB2 ALA 47 14.658 -6.939 8.275 370 HB3 ALA 47 HB3 ALA 47 14.431 -5.203 8.516 371 H GLN 48 H GLN 48 16.206 -5.020 5.959 372 HA GLN 48 HA GLN 48 17.462 -7.421 4.825 373 HB2 GLN 48 HB3 GLN 48 15.587 -6.913 2.867 374 HB3 GLN 48 HB2 GLN 48 15.449 -8.112 4.134 375 HG2 GLN 48 HG3 GLN 48 13.463 -7.033 4.393 376 HG3 GLN 48 HG2 GLN 48 14.396 -6.112 5.548 377 HE21 GLN 48 HE21 GLN 48 15.755 -4.965 2.809 378 HE22 GLN 48 HE22 GLN 48 14.639 -3.752 2.421 379 H LYS 49 H LYS 49 18.784 -5.062 5.233 380 HA LYS 49 HA LYS 49 18.768 -3.369 2.963 381 HB2 LYS 49 HB3 LYS 49 19.776 -2.704 5.120 382 HB3 LYS 49 HB2 LYS 49 21.094 -3.850 4.856 383 HG2 LYS 49 HG3 LYS 49 20.769 -2.236 2.461 384 HG3 LYS 49 HG2 LYS 49 20.835 -1.182 3.848 385 HD2 LYS 49 HD3 LYS 49 23.024 -1.541 4.194 386 HD3 LYS 49 HD2 LYS 49 22.890 -3.286 4.032 387 HE2 LYS 49 HE2 LYS 49 22.881 -1.357 1.681 388 HE3 LYS 49 HE1 LYS 49 24.307 -2.211 2.257 389 HZ1 LYS 49 HZ1 LYS 49 23.133 -3.359 0.409 390 HZ2 LYS 49 HZ2 LYS 49 21.800 -3.598 1.366 391 HZ3 LYS 49 HZ3 LYS 49 23.305 -4.300 1.791 392 H ASP 50 H ASP 50 20.549 -6.261 3.785 393 HA ASP 50 HA ASP 50 22.007 -6.141 1.237 394 HB2 ASP 50 HB3 ASP 50 22.547 -7.397 3.838 395 HB3 ASP 50 HB2 ASP 50 23.005 -8.366 2.450 396 H VAL 51 H VAL 51 19.116 -7.217 1.984 397 HA VAL 51 HA VAL 51 19.311 -9.810 0.676 398 HB VAL 51 HB VAL 51 16.802 -8.283 1.440 399 HG11 VAL 51 HG11 VAL 51 17.247 -11.271 1.158 400 HG12 VAL 51 HG12 VAL 51 16.667 -10.286 -0.177 401 HG13 VAL 51 HG13 VAL 51 15.715 -10.425 1.296 402 HG21 VAL 51 HG21 VAL 51 18.396 -8.705 3.390 403 HG22 VAL 51 HG22 VAL 51 18.258 -10.421 3.026 404 HG23 VAL 51 HG23 VAL 51 16.839 -9.529 3.539 405 H ASP 52 H ASP 52 19.368 -9.994 -1.437 406 HA ASP 52 HA ASP 52 19.466 -7.939 -3.246 407 HB2 ASP 52 HB3 ASP 52 20.197 -10.135 -3.865 408 HB3 ASP 52 HB2 ASP 52 18.564 -10.780 -3.724 409 H ALA 53 H ALA 53 16.664 -9.584 -2.087 410 HA ALA 53 HA ALA 53 14.721 -8.840 -3.880 411 HB1 ALA 53 HB1 ALA 53 14.645 -9.221 -0.898 412 HB2 ALA 53 HB2 ALA 53 13.928 -10.212 -2.168 413 HB3 ALA 53 HB3 ALA 53 13.213 -8.665 -1.754 414 H VAL 54 H VAL 54 16.330 -6.850 -1.440 415 HA VAL 54 HA VAL 54 14.508 -4.714 -1.461 416 HB VAL 54 HB VAL 54 16.375 -5.073 0.216 417 HG11 VAL 54 HG11 VAL 54 18.195 -5.346 -1.624 418 HG12 VAL 54 HG12 VAL 54 18.573 -4.418 -0.198 419 HG13 VAL 54 HG13 VAL 54 18.174 -3.580 -1.682 420 HG21 VAL 54 HG21 VAL 54 15.690 -2.423 -1.041 421 HG22 VAL 54 HG22 VAL 54 16.991 -2.474 0.139 422 HG23 VAL 54 HG23 VAL 54 15.391 -3.018 0.594 423 H ASP 55 H ASP 55 17.395 -5.301 -3.446 424 HA ASP 55 HA ASP 55 17.264 -2.886 -4.962 425 HB2 ASP 55 HB3 ASP 55 19.226 -4.566 -4.912 426 HB3 ASP 55 HB2 ASP 55 18.210 -5.548 -5.977 427 H LYS 56 H LYS 56 15.930 -6.093 -5.289 428 HA LYS 56 HA LYS 56 14.780 -5.705 -7.841 429 HB2 LYS 56 HB3 LYS 56 13.924 -7.628 -5.661 430 HB3 LYS 56 HB2 LYS 56 13.452 -7.711 -7.352 431 HG2 LYS 56 HG3 LYS 56 16.283 -7.976 -6.264 432 HG3 LYS 56 HG2 LYS 56 15.308 -9.240 -6.999 433 HD2 LYS 56 HD3 LYS 56 15.178 -7.585 -9.035 434 HD3 LYS 56 HD2 LYS 56 16.579 -6.861 -8.304 435 HE2 LYS 56 HE2 LYS 56 16.408 -9.814 -8.959 436 HE3 LYS 56 HE1 LYS 56 17.183 -8.607 -9.975 437 HZ1 LYS 56 HZ1 LYS 56 18.455 -8.057 -7.733 438 HZ2 LYS 56 HZ2 LYS 56 18.961 -9.327 -8.699 439 HZ3 LYS 56 HZ3 LYS 56 18.023 -9.622 -7.330 440 H VAL 57 H VAL 57 13.557 -5.237 -4.577 441 HA VAL 57 HA VAL 57 10.935 -4.406 -5.292 442 HB VAL 57 HB VAL 57 12.692 -3.749 -2.897 443 HG11 VAL 57 HG11 VAL 57 10.115 -2.615 -3.717 444 HG12 VAL 57 HG12 VAL 57 11.324 -2.086 -2.539 445 HG13 VAL 57 HG13 VAL 57 10.139 -3.289 -2.078 446 HG21 VAL 57 HG21 VAL 57 12.080 -5.873 -2.323 447 HG22 VAL 57 HG22 VAL 57 10.903 -5.974 -3.633 448 HG23 VAL 57 HG23 VAL 57 10.462 -5.227 -2.111 449 H MET 58 H MET 58 13.985 -2.730 -4.848 450 HA MET 58 HA MET 58 13.144 -0.065 -5.369 451 HB2 MET 58 HB3 MET 58 15.812 -1.414 -5.961 452 HB3 MET 58 HB2 MET 58 15.504 0.314 -5.926 453 HG2 MET 58 HG3 MET 58 14.716 -1.319 -3.603 454 HG3 MET 58 HG2 MET 58 16.424 -0.897 -3.747 455 HE1 MET 58 HE1 MET 58 17.168 1.056 -4.420 456 HE2 MET 58 HE2 MET 58 17.177 1.990 -2.936 457 HE3 MET 58 HE3 MET 58 16.444 2.679 -4.387 458 H LYS 59 H LYS 59 14.243 -2.717 -7.389 459 HA LYS 59 HA LYS 59 14.347 -1.369 -9.859 460 HB2 LYS 59 HB3 LYS 59 15.511 -3.440 -9.487 461 HB3 LYS 59 HB2 LYS 59 13.997 -4.290 -9.188 462 HG2 LYS 59 HG3 LYS 59 14.762 -4.742 -11.430 463 HG3 LYS 59 HG2 LYS 59 13.274 -3.808 -11.518 464 HD2 LYS 59 HD3 LYS 59 14.397 -1.836 -12.143 465 HD3 LYS 59 HD2 LYS 59 15.960 -2.408 -11.567 466 HE2 LYS 59 HE2 LYS 59 15.414 -2.415 -14.158 467 HE3 LYS 59 HE1 LYS 59 16.323 -3.712 -13.366 468 HZ1 LYS 59 HZ1 LYS 59 14.602 -4.589 -14.821 469 HZ2 LYS 59 HZ2 LYS 59 13.361 -3.852 -13.943 470 HZ3 LYS 59 HZ3 LYS 59 14.353 -5.049 -13.244 471 H GLU 60 H GLU 60 11.844 -3.383 -8.360 472 HA GLU 60 HA GLU 60 9.994 -3.299 -10.454 473 HB2 GLU 60 HB3 GLU 60 9.573 -3.419 -7.466 474 HB3 GLU 60 HB2 GLU 60 8.287 -3.645 -8.638 475 HG2 GLU 60 HG3 GLU 60 10.822 -5.329 -8.533 476 HG3 GLU 60 HG2 GLU 60 9.260 -5.799 -7.886 477 H LEU 61 H LEU 61 10.483 -1.148 -7.714 478 HA LEU 61 HA LEU 61 8.484 0.741 -8.466 479 HB2 LEU 61 HB3 LEU 61 10.752 0.772 -6.525 480 HB3 LEU 61 HB2 LEU 61 9.979 2.288 -6.957 481 HG LEU 61 HG LEU 61 9.048 1.107 -4.960 482 HD11 LEU 61 HD11 LEU 61 6.574 1.294 -6.067 483 HD12 LEU 61 HD12 LEU 61 7.495 2.177 -7.274 484 HD13 LEU 61 HD13 LEU 61 7.525 2.684 -5.586 485 HD21 LEU 61 HD21 LEU 61 7.584 -0.802 -5.249 486 HD22 LEU 61 HD22 LEU 61 9.096 -1.217 -6.035 487 HD23 LEU 61 HD23 LEU 61 7.707 -0.717 -6.998 488 H ASP 62 H ASP 62 11.945 0.494 -9.072 489 HA ASP 62 HA ASP 62 12.291 3.054 -10.097 490 HB2 ASP 62 HB3 ASP 62 14.139 1.368 -9.526 491 HB3 ASP 62 HB2 ASP 62 13.827 0.672 -11.107 492 H GLU 63 H GLU 63 11.238 0.126 -11.681 493 HA GLU 63 HA GLU 63 11.319 1.057 -14.360 494 HB2 GLU 63 HB3 GLU 63 9.533 -0.960 -12.990 495 HB3 GLU 63 HB2 GLU 63 9.615 -0.734 -14.743 496 HG2 GLU 63 HG3 GLU 63 12.012 -1.255 -14.717 497 HG3 GLU 63 HG2 GLU 63 11.946 -1.363 -12.963 498 H ASN 64 H ASN 64 8.752 1.043 -11.942 499 HA ASN 64 HA ASN 64 6.845 2.586 -13.460 500 HB2 ASN 64 HB3 ASN 64 7.262 1.946 -10.591 501 HB3 ASN 64 HB2 ASN 64 6.121 3.224 -11.073 502 HD21 ASN 64 HD21 ASN 64 5.506 1.501 -13.643 503 HD22 ASN 64 HD22 ASN 64 4.502 0.283 -13.050 504 H GLY 65 H GLY 65 9.253 3.308 -10.995 505 HA2 GLY 65 HA3 GLY 65 8.775 6.115 -11.044 506 HA3 GLY 65 HA2 GLY 65 10.099 5.299 -10.217 507 H ASP 66 H ASP 66 9.064 5.587 -13.580 508 HA ASP 66 HA ASP 66 11.683 5.646 -14.639 509 HB2 ASP 66 HB3 ASP 66 9.595 5.215 -15.969 510 HB3 ASP 66 HB2 ASP 66 9.195 6.912 -15.819 511 H GLY 67 H GLY 67 9.455 8.046 -13.540 512 HA2 GLY 67 HA3 GLY 67 11.655 10.048 -13.459 513 HA3 GLY 67 HA2 GLY 67 10.030 10.516 -13.955 514 H GLU 68 H GLU 68 8.298 9.868 -12.398 515 HA GLU 68 HA GLU 68 9.143 10.425 -9.621 516 HB2 GLU 68 HB3 GLU 68 6.585 11.013 -11.095 517 HB3 GLU 68 HB2 GLU 68 6.729 11.168 -9.366 518 HG2 GLU 68 HG3 GLU 68 8.470 12.820 -9.545 519 HG3 GLU 68 HG2 GLU 68 8.631 12.614 -11.273 520 H VAL 69 H VAL 69 7.786 9.424 -7.979 521 HA VAL 69 HA VAL 69 6.661 6.893 -8.875 522 HB VAL 69 HB VAL 69 8.655 6.263 -7.785 523 HG11 VAL 69 HG11 VAL 69 9.422 8.236 -6.744 524 HG12 VAL 69 HG12 VAL 69 9.131 7.122 -5.402 525 HG13 VAL 69 HG13 VAL 69 7.967 8.382 -5.764 526 HG21 VAL 69 HG21 VAL 69 7.919 5.134 -5.722 527 HG22 VAL 69 HG22 VAL 69 6.726 4.990 -7.007 528 HG23 VAL 69 HG23 VAL 69 6.452 6.124 -5.682 529 H ASP 70 H ASP 70 4.619 6.567 -8.203 530 HA ASP 70 HA ASP 70 3.400 8.810 -6.778 531 HB2 ASP 70 HB3 ASP 70 2.052 8.576 -8.527 532 HB3 ASP 70 HB2 ASP 70 2.417 6.857 -8.752 533 H PHE 71 H PHE 71 1.399 8.198 -5.563 534 HA PHE 71 HA PHE 71 2.267 7.093 -3.095 535 HB2 PHE 71 HB3 PHE 71 0.347 8.708 -3.252 536 HB3 PHE 71 HB2 PHE 71 -0.611 7.399 -3.945 537 HD1 PHE 71 HD1 PHE 71 1.661 7.959 -1.027 538 HD2 PHE 71 HD2 PHE 71 -1.969 6.182 -2.480 539 HE1 PHE 71 HE1 PHE 71 1.162 7.154 1.247 540 HE2 PHE 71 HE2 PHE 71 -2.472 5.372 -0.147 541 HZ PHE 71 HZ PHE 71 -0.913 5.857 1.683 542 H GLN 72 H GLN 72 0.223 5.707 -5.632 543 HA GLN 72 HA GLN 72 -0.335 3.245 -4.346 544 HB2 GLN 72 HB3 GLN 72 -0.167 3.963 -7.287 545 HB3 GLN 72 HB2 GLN 72 -0.785 2.433 -6.682 546 HG2 GLN 72 HG3 GLN 72 -2.529 3.622 -5.386 547 HG3 GLN 72 HG2 GLN 72 -1.904 5.163 -5.970 548 HE21 GLN 72 HE21 GLN 72 -1.390 3.877 -8.727 549 HE22 GLN 72 HE22 GLN 72 -2.937 3.809 -9.418 550 H GLU 73 H GLU 73 2.259 4.401 -6.352 551 HA GLU 73 HA GLU 73 3.703 1.932 -6.525 552 HB2 GLU 73 HB3 GLU 73 4.497 4.827 -6.950 553 HB3 GLU 73 HB2 GLU 73 5.522 3.435 -7.291 554 HG2 GLU 73 HG3 GLU 73 4.012 2.569 -8.936 555 HG3 GLU 73 HG2 GLU 73 2.759 3.722 -8.487 556 H TYR 74 H TYR 74 3.917 4.838 -4.497 557 HA TYR 74 HA TYR 74 6.171 4.087 -2.970 558 HB2 TYR 74 HB3 TYR 74 5.459 6.365 -2.931 559 HB3 TYR 74 HB2 TYR 74 3.870 5.921 -2.314 560 HD1 TYR 74 HD1 TYR 74 7.486 5.339 -1.380 561 HD2 TYR 74 HD2 TYR 74 3.509 6.283 -0.030 562 HE1 TYR 74 HE1 TYR 74 8.314 5.545 0.943 563 HE2 TYR 74 HE2 TYR 74 4.350 6.496 2.289 564 HH TYR 74 HH TYR 74 7.484 6.852 3.116 565 H VAL 75 H VAL 75 2.723 3.652 -2.236 566 HA VAL 75 HA VAL 75 3.155 2.461 0.254 567 HB VAL 75 HB VAL 75 0.860 1.466 -0.011 568 HG11 VAL 75 HG11 VAL 75 0.764 4.356 -0.826 569 HG12 VAL 75 HG12 VAL 75 1.560 3.935 0.685 570 HG13 VAL 75 HG13 VAL 75 -0.131 3.525 0.439 571 HG21 VAL 75 HG21 VAL 75 1.424 2.131 -2.783 572 HG22 VAL 75 HG22 VAL 75 0.041 3.007 -2.257 573 HG23 VAL 75 HG23 VAL 75 0.062 1.233 -2.131 574 H VAL 76 H VAL 76 2.913 0.910 -2.969 575 HA VAL 76 HA VAL 76 3.126 -1.690 -1.882 576 HB VAL 76 HB VAL 76 2.171 -1.278 -4.141 577 HG11 VAL 76 HG11 VAL 76 3.547 0.429 -5.027 578 HG12 VAL 76 HG12 VAL 76 3.824 -0.993 -6.021 579 HG13 VAL 76 HG13 VAL 76 5.024 -0.518 -4.828 580 HG21 VAL 76 HG21 VAL 76 3.235 -3.197 -5.235 581 HG22 VAL 76 HG22 VAL 76 3.075 -3.522 -3.514 582 HG23 VAL 76 HG23 VAL 76 4.638 -3.058 -4.182 583 H LEU 77 H LEU 77 5.417 0.742 -2.885 584 HA LEU 77 HA LEU 77 7.733 -0.856 -2.930 585 HB2 LEU 77 HB3 LEU 77 7.679 1.474 -3.759 586 HB3 LEU 77 HB2 LEU 77 7.381 2.030 -2.147 587 HG LEU 77 HG LEU 77 9.568 1.235 -1.335 588 HD11 LEU 77 HD11 LEU 77 11.017 0.604 -3.635 589 HD12 LEU 77 HD12 LEU 77 9.569 -0.389 -3.740 590 HD13 LEU 77 HD13 LEU 77 10.569 -0.401 -2.283 591 HD21 LEU 77 HD21 LEU 77 9.196 3.440 -2.863 592 HD22 LEU 77 HD22 LEU 77 10.381 2.598 -3.857 593 HD23 LEU 77 HD23 LEU 77 10.758 2.988 -2.183 594 H VAL 78 H VAL 78 6.282 1.036 -0.310 595 HA VAL 78 HA VAL 78 8.150 0.044 1.606 596 HB VAL 78 HB VAL 78 6.741 1.081 3.321 597 HG11 VAL 78 HG11 VAL 78 7.442 3.165 2.722 598 HG12 VAL 78 HG12 VAL 78 6.466 3.157 1.260 599 HG13 VAL 78 HG13 VAL 78 8.047 2.399 1.251 600 HG21 VAL 78 HG21 VAL 78 4.635 2.191 2.695 601 HG22 VAL 78 HG22 VAL 78 4.500 0.471 2.341 602 HG23 VAL 78 HG23 VAL 78 4.837 1.637 1.047 603 H ALA 79 H ALA 79 4.889 -0.867 0.650 604 HA ALA 79 HA ALA 79 4.520 -2.914 2.556 605 HB1 ALA 79 HB1 ALA 79 3.457 -3.066 -0.236 606 HB2 ALA 79 HB2 ALA 79 2.778 -1.919 0.923 607 HB3 ALA 79 HB3 ALA 79 2.741 -3.656 1.254 608 H ALA 80 H ALA 80 5.970 -2.884 -0.658 609 HA ALA 80 HA ALA 80 6.280 -5.576 -1.002 610 HB1 ALA 80 HB1 ALA 80 6.743 -4.252 -2.863 611 HB2 ALA 80 HB2 ALA 80 8.325 -4.878 -2.422 612 HB3 ALA 80 HB3 ALA 80 7.870 -3.224 -1.983 613 H LEU 81 H LEU 81 8.521 -3.205 0.386 614 HA LEU 81 HA LEU 81 10.478 -5.087 1.295 615 HB2 LEU 81 HB3 LEU 81 9.828 -2.285 2.245 616 HB3 LEU 81 HB2 LEU 81 11.186 -3.233 2.834 617 HG LEU 81 HG LEU 81 10.742 -2.519 -0.089 618 HD11 LEU 81 HD11 LEU 81 12.796 -1.077 0.320 619 HD12 LEU 81 HD12 LEU 81 12.482 -1.281 2.042 620 HD13 LEU 81 HD13 LEU 81 11.283 -0.496 1.009 621 HD21 LEU 81 HD21 LEU 81 13.260 -3.198 -0.077 622 HD22 LEU 81 HD22 LEU 81 12.055 -4.472 -0.093 623 HD23 LEU 81 HD23 LEU 81 12.873 -4.053 1.417 624 H THR 82 H THR 82 7.603 -3.647 2.723 625 HA THR 82 HA THR 82 7.929 -4.697 5.297 626 HB THR 82 HB THR 82 5.280 -4.310 3.889 627 HG1 THR 82 HG2 THR 82 6.765 -2.441 3.799 628 HG21 THR 82 HG21 THR 82 5.645 -5.381 6.312 629 HG22 THR 82 HG22 THR 82 4.303 -4.308 5.951 630 HG23 THR 82 HG23 THR 82 5.730 -3.680 6.763 631 H VAL 83 H VAL 83 6.160 -6.081 2.468 632 HA VAL 83 HA VAL 83 5.625 -8.512 3.858 633 HB VAL 83 HB VAL 83 4.275 -7.823 1.896 634 HG11 VAL 83 HG11 VAL 83 6.769 -8.469 0.302 635 HG12 VAL 83 HG12 VAL 83 5.951 -6.912 0.458 636 HG13 VAL 83 HG13 VAL 83 5.159 -8.239 -0.380 637 HG21 VAL 83 HG21 VAL 83 4.260 -10.057 0.744 638 HG22 VAL 83 HG22 VAL 83 4.147 -10.161 2.498 639 HG23 VAL 83 HG23 VAL 83 5.673 -10.512 1.688 640 H ALA 84 H ALA 84 8.196 -7.494 1.661 641 HA ALA 84 HA ALA 84 9.507 -9.957 1.456 642 HB1 ALA 84 HB1 ALA 84 11.348 -8.796 0.639 643 HB2 ALA 84 HB2 ALA 84 11.047 -7.373 1.635 644 HB3 ALA 84 HB3 ALA 84 10.019 -7.717 0.245 645 H MET 85 H MET 85 10.067 -7.304 3.788 646 HA MET 85 HA MET 85 11.894 -8.855 5.340 647 HB2 MET 85 HB3 MET 85 11.580 -6.247 5.335 648 HB3 MET 85 HB2 MET 85 10.324 -6.593 6.516 649 HG2 MET 85 HG3 MET 85 12.873 -8.023 7.030 650 HG3 MET 85 HG2 MET 85 12.950 -6.267 7.162 651 HE1 MET 85 HE1 MET 85 13.347 -8.714 9.016 652 HE2 MET 85 HE2 MET 85 11.816 -9.557 9.162 653 HE3 MET 85 HE3 MET 85 12.408 -8.611 10.514 654 H ASN 86 H ASN 86 8.436 -8.110 5.626 655 HA ASN 86 HA ASN 86 8.152 -9.458 8.061 656 HB2 ASN 86 HB3 ASN 86 6.077 -8.644 6.028 657 HB3 ASN 86 HB2 ASN 86 5.617 -9.627 7.387 658 HD21 ASN 86 HD21 ASN 86 4.549 -7.103 7.334 659 HD22 ASN 86 HD22 ASN 86 5.276 -6.164 8.551 660 H ASN 87 H ASN 87 8.126 -10.643 4.798 661 HA ASN 87 HA ASN 87 7.030 -13.149 5.040 662 HB2 ASN 87 HB3 ASN 87 8.088 -12.310 2.971 663 HB3 ASN 87 HB2 ASN 87 9.668 -12.479 3.722 664 HD21 ASN 87 HD21 ASN 87 8.106 -15.137 4.974 665 HD22 ASN 87 HD22 ASN 87 8.447 -16.246 3.764 666 H PHE 88 H PHE 88 10.112 -11.963 6.202 667 HA PHE 88 HA PHE 88 11.138 -14.373 7.275 668 HB2 PHE 88 HB3 PHE 88 12.570 -12.423 6.895 669 HB3 PHE 88 HB2 PHE 88 11.638 -11.490 8.058 670 HD1 PHE 88 HD2 PHE 88 13.707 -14.595 7.750 671 HD2 PHE 88 HD1 PHE 88 12.183 -11.503 10.316 672 HE1 PHE 88 HE2 PHE 88 15.129 -15.419 9.601 673 HE2 PHE 88 HE1 PHE 88 13.590 -12.312 12.145 674 HZ PHE 88 HZ PHE 88 15.090 -14.295 11.794 675 H PHE 89 H PHE 89 9.165 -11.774 8.631 676 HA PHE 89 HA PHE 89 9.068 -12.684 11.287 677 HB2 PHE 89 HB3 PHE 89 7.432 -10.788 9.690 678 HB3 PHE 89 HB2 PHE 89 6.766 -11.352 11.196 679 HD1 PHE 89 HD1 PHE 89 8.762 -11.483 13.156 680 HD2 PHE 89 HD2 PHE 89 8.619 -8.711 9.845 681 HE1 PHE 89 HE1 PHE 89 10.203 -9.900 14.390 682 HE2 PHE 89 HE2 PHE 89 10.047 -7.167 11.080 683 HZ PHE 89 HZ PHE 89 10.852 -7.745 13.359 684 H TRP 90 H TRP 90 6.725 -13.305 8.671 685 HA TRP 90 HA TRP 90 4.837 -14.659 10.305 686 HB2 TRP 90 HB3 TRP 90 5.413 -15.739 7.558 687 HB3 TRP 90 HB2 TRP 90 3.863 -15.589 8.371 688 HD1 TRP 90 HD TRP 90 6.587 -13.444 6.938 689 HE1 TRP 90 HE1 TRP 90 5.545 -11.319 5.830 690 HE3 TRP 90 HE3 TRP 90 1.769 -14.213 8.129 691 HZ2 TRP 90 HZ2 TRP 90 2.953 -10.149 5.534 692 HZ3 TRP 90 HZ3 TRP 90 0.019 -12.628 7.443 693 HH2 TRP 90 HH TRP 90 0.604 -10.579 6.144 694 H GLU 91 H GLU 91 7.562 -15.857 8.477 695 HA GLU 91 HA GLU 91 7.346 -18.570 9.299 696 HB2 GLU 91 HB3 GLU 91 9.566 -16.936 8.161 697 HB3 GLU 91 HB2 GLU 91 9.633 -18.700 8.294 698 HG2 GLU 91 HG3 GLU 91 7.546 -18.872 6.903 699 HG3 GLU 91 HG2 GLU 91 7.509 -17.132 6.777 700 H ASN 92 H ASN 92 9.426 -15.851 10.318 701 HA ASN 92 HA ASN 92 10.297 -17.424 12.658 702 HB2 ASN 92 HB3 ASN 92 12.074 -16.238 11.400 703 HB3 ASN 92 HB2 ASN 92 11.240 -14.712 11.707 704 HD21 ASN 92 HD21 ASN 92 13.477 -14.294 12.849 705 HD22 ASN 92 HD22 ASN 92 13.577 -14.748 14.470 706 H SER 93 H SER 93 8.631 -17.375 14.058 707 HA SER 93 HA SER 93 8.149 -15.187 15.689 708 HB2 SER 93 HB3 SER 93 6.357 -15.428 13.303 709 HB3 SER 93 HB2 SER 93 5.654 -14.910 14.839 710 HG SER 93 HG SER 93 7.808 -13.859 13.361 711 H1 GLY 1 H GLY 1 11.518 0.668 11.498 712 HA2 GLY 1 HA3 GLY 1 12.687 3.194 10.745 713 HA3 GLY 1 HA2 GLY 1 11.381 2.374 9.926 714 H SER 2 H SER 2 10.306 4.352 9.748 715 HA SER 2 HA SER 2 9.479 5.875 12.035 716 HB2 SER 2 HB3 SER 2 8.484 5.852 9.183 717 HB3 SER 2 HB2 SER 2 7.997 7.005 10.406 718 HG SER 2 HG SER 2 9.678 7.640 9.029 719 H GLU 3 H GLU 3 7.022 6.349 12.166 720 HA GLU 3 HA GLU 3 5.661 4.152 13.220 721 HB2 GLU 3 HB3 GLU 3 4.497 6.669 11.999 722 HB3 GLU 3 HB2 GLU 3 3.697 5.597 13.118 723 HG2 GLU 3 HG3 GLU 3 4.482 7.233 14.582 724 HG3 GLU 3 HG2 GLU 3 5.772 6.043 14.672 725 H LEU 4 H LEU 4 6.285 5.153 10.037 726 HA LEU 4 HA LEU 4 4.054 4.177 8.655 727 HB2 LEU 4 HB3 LEU 4 6.939 4.322 7.754 728 HB3 LEU 4 HB2 LEU 4 5.566 4.002 6.711 729 HG LEU 4 HG LEU 4 6.059 6.531 8.299 730 HD11 LEU 4 HD11 LEU 4 6.686 5.683 5.641 731 HD12 LEU 4 HD12 LEU 4 7.051 7.208 6.448 732 HD13 LEU 4 HD13 LEU 4 5.525 7.005 5.585 733 HD21 LEU 4 HD21 LEU 4 3.928 7.243 6.978 734 HD22 LEU 4 HD22 LEU 4 3.737 6.291 8.439 735 HD23 LEU 4 HD23 LEU 4 3.593 5.510 6.861 736 H GLU 5 H GLU 5 7.038 2.599 9.793 737 HA GLU 5 HA GLU 5 6.480 0.095 8.589 738 HB2 GLU 5 HB3 GLU 5 8.032 0.776 11.097 739 HB3 GLU 5 HB2 GLU 5 7.958 -0.835 10.405 740 HG2 GLU 5 HG3 GLU 5 8.874 0.136 8.253 741 HG3 GLU 5 HG2 GLU 5 9.096 1.637 9.113 742 H THR 6 H THR 6 5.606 1.586 11.681 743 HA THR 6 HA THR 6 4.170 -0.608 12.733 744 HB THR 6 HB THR 6 3.513 2.315 13.231 745 HG1 THR 6 HG2 THR 6 5.189 2.353 14.624 746 HG21 THR 6 HG21 THR 6 2.936 1.468 15.454 747 HG22 THR 6 HG22 THR 6 3.429 -0.155 14.992 748 HG23 THR 6 HG23 THR 6 2.028 0.588 14.230 749 H ALA 7 H ALA 7 3.238 2.210 10.759 750 HA ALA 7 HA ALA 7 0.505 1.633 10.518 751 HB1 ALA 7 HB1 ALA 7 1.586 3.780 9.825 752 HB2 ALA 7 HB2 ALA 7 0.534 3.107 8.585 753 HB3 ALA 7 HB3 ALA 7 2.274 2.947 8.434 754 H MET 8 H MET 8 3.265 0.699 8.486 755 HA MET 8 HA MET 8 1.750 -0.891 6.663 756 HB2 MET 8 HB3 MET 8 4.682 -1.060 7.414 757 HB3 MET 8 HB2 MET 8 3.945 -1.900 6.060 758 HG2 MET 8 HG3 MET 8 4.061 1.120 6.415 759 HG3 MET 8 HG2 MET 8 4.973 0.176 5.257 760 HE1 MET 8 HE1 MET 8 2.758 -0.961 2.662 761 HE2 MET 8 HE2 MET 8 2.498 -1.984 4.074 762 HE3 MET 8 HE3 MET 8 4.109 -1.334 3.751 763 H GLU 9 H GLU 9 3.473 -1.631 9.667 764 HA GLU 9 HA GLU 9 2.976 -4.378 9.634 765 HB2 GLU 9 HB3 GLU 9 3.542 -2.399 11.825 766 HB3 GLU 9 HB2 GLU 9 3.097 -4.047 12.240 767 HG2 GLU 9 HG3 GLU 9 5.297 -3.553 10.220 768 HG3 GLU 9 HG2 GLU 9 5.629 -3.484 11.949 769 H THR 10 H THR 10 1.089 -1.619 10.668 770 HA THR 10 HA THR 10 -1.046 -3.020 11.883 771 HB THR 10 HB THR 10 -1.344 -0.414 10.337 772 HG1 THR 10 HG2 THR 10 0.498 -0.471 11.882 773 HG21 THR 10 HG21 THR 10 -2.787 -1.724 12.646 774 HG22 THR 10 HG22 THR 10 -3.446 -1.207 11.098 775 HG23 THR 10 HG23 THR 10 -2.935 -0.008 12.280 776 H LEU 11 H LEU 11 -0.406 -2.007 8.552 777 HA LEU 11 HA LEU 11 -2.759 -3.111 7.399 778 HB2 LEU 11 HB3 LEU 11 -0.013 -2.558 6.224 779 HB3 LEU 11 HB2 LEU 11 -1.371 -3.139 5.269 780 HG LEU 11 HG LEU 11 -1.505 -0.610 6.938 781 HD11 LEU 11 HD11 LEU 11 0.168 -0.082 5.381 782 HD12 LEU 11 HD12 LEU 11 -1.308 0.463 4.604 783 HD13 LEU 11 HD13 LEU 11 -0.565 -1.048 4.098 784 HD21 LEU 11 HD21 LEU 11 -3.556 -2.078 5.756 785 HD22 LEU 11 HD22 LEU 11 -3.101 -0.968 4.480 786 HD23 LEU 11 HD23 LEU 11 -3.585 -0.335 6.043 787 H ILE 12 H ILE 12 0.488 -4.385 8.020 788 HA ILE 12 HA ILE 12 0.143 -6.928 6.803 789 HB ILE 12 HB ILE 12 1.920 -6.089 9.123 790 HG12 ILE 12 HG13 ILE 12 2.152 -5.079 6.741 791 HG13 ILE 12 HG12 ILE 12 3.597 -5.717 7.480 792 HG21 ILE 12 HG21 ILE 12 3.198 -8.175 8.482 793 HG22 ILE 12 HG22 ILE 12 1.756 -8.704 7.605 794 HG23 ILE 12 HG23 ILE 12 1.685 -8.440 9.317 795 HD11 ILE 12 HD11 ILE 12 1.802 -7.196 5.501 796 HD12 ILE 12 HD12 ILE 12 3.289 -7.851 6.189 797 HD13 ILE 12 HD13 ILE 12 3.347 -6.453 5.131 798 H ASN 13 H ASN 13 -0.364 -5.788 10.119 799 HA ASN 13 HA ASN 13 -1.047 -8.251 11.260 800 HB2 ASN 13 HB3 ASN 13 -1.783 -5.416 11.958 801 HB3 ASN 13 HB2 ASN 13 -2.436 -6.764 12.869 802 HD21 ASN 13 HD21 ASN 13 0.427 -4.886 12.277 803 HD22 ASN 13 HD22 ASN 13 1.420 -5.649 13.432 804 H VAL 14 H VAL 14 -3.124 -5.768 9.784 805 HA VAL 14 HA VAL 14 -5.552 -7.202 10.144 806 HB VAL 14 HB VAL 14 -4.731 -4.978 8.285 807 HG11 VAL 14 HG11 VAL 14 -6.383 -5.833 6.949 808 HG12 VAL 14 HG12 VAL 14 -7.384 -4.913 8.056 809 HG13 VAL 14 HG13 VAL 14 -7.216 -6.657 8.266 810 HG21 VAL 14 HG21 VAL 14 -6.604 -3.908 9.728 811 HG22 VAL 14 HG22 VAL 14 -5.023 -4.189 10.489 812 HG23 VAL 14 HG23 VAL 14 -6.364 -5.279 10.805 813 H PHE 15 H PHE 15 -3.357 -6.930 7.401 814 HA PHE 15 HA PHE 15 -4.722 -8.684 5.665 815 HB2 PHE 15 HB3 PHE 15 -2.897 -7.178 4.983 816 HB3 PHE 15 HB2 PHE 15 -1.754 -8.139 5.912 817 HD1 PHE 15 HD1 PHE 15 -3.891 -8.045 2.917 818 HD2 PHE 15 HD2 PHE 15 -1.116 -10.388 5.203 819 HE1 PHE 15 HE1 PHE 15 -3.624 -9.597 1.010 820 HE2 PHE 15 HE2 PHE 15 -0.858 -11.935 3.304 821 HZ PHE 15 HZ PHE 15 -2.110 -11.542 1.209 822 H HIS 16 H HIS 16 -2.112 -9.168 7.981 823 HA HIS 16 HA HIS 16 -1.670 -11.867 7.605 824 HB2 HIS 16 HB3 HIS 16 -0.218 -10.291 8.900 825 HB3 HIS 16 HB2 HIS 16 -1.393 -10.359 10.218 826 HD1 HIS 16 HD1 HIS 16 -1.652 -13.612 9.120 827 HD2 HIS 16 HD2 HIS 16 1.467 -11.529 10.943 828 HE1 HIS 16 HE1 HIS 16 -0.063 -15.358 10.048 829 HE2 HIS 16 HE2 HIS 16 1.818 -14.102 11.220 830 H ALA 17 H ALA 17 -3.853 -10.196 9.822 831 HA ALA 17 HA ALA 17 -4.760 -12.358 11.276 832 HB1 ALA 17 HB1 ALA 17 -6.617 -10.163 10.369 833 HB2 ALA 17 HB2 ALA 17 -5.344 -9.862 11.543 834 HB3 ALA 17 HB3 ALA 17 -6.612 -11.036 11.897 835 H HIS 18 H HIS 18 -6.053 -11.028 8.258 836 HA HIS 18 HA HIS 18 -8.018 -13.064 7.923 837 HB2 HIS 18 HB3 HIS 18 -6.811 -11.114 5.982 838 HB3 HIS 18 HB2 HIS 18 -8.134 -12.226 5.571 839 HD1 HIS 18 HD1 HIS 18 -10.446 -11.930 7.055 840 HD2 HIS 18 HD2 HIS 18 -7.634 -8.820 7.357 841 HE1 HIS 18 HE1 HIS 18 -11.609 -9.997 8.116 842 HE2 HIS 18 HE2 HIS 18 -9.939 -8.093 8.318 843 H SER 19 H SER 19 -4.674 -12.711 6.753 844 HA SER 19 HA SER 19 -4.641 -15.053 5.143 845 HB2 SER 19 HB3 SER 19 -2.346 -14.002 6.838 846 HB3 SER 19 HB2 SER 19 -2.257 -15.063 5.451 847 HG SER 19 HG SER 19 -3.332 -13.290 4.286 848 H GLY 20 H GLY 20 -4.175 -14.472 8.569 849 HA2 GLY 20 HA3 GLY 20 -3.560 -17.101 9.354 850 HA3 GLY 20 HA2 GLY 20 -4.273 -15.848 10.377 851 H LYS 21 H LYS 21 -6.625 -15.444 8.727 852 HA LYS 21 HA LYS 21 -8.326 -17.392 9.914 853 HB2 LYS 21 HB3 LYS 21 -8.919 -15.529 7.589 854 HB3 LYS 21 HB2 LYS 21 -10.107 -16.438 8.493 855 HG2 LYS 21 HG3 LYS 21 -8.277 -14.333 9.690 856 HG3 LYS 21 HG2 LYS 21 -9.960 -14.103 9.255 857 HD2 LYS 21 HD3 LYS 21 -10.595 -15.917 10.851 858 HD3 LYS 21 HD2 LYS 21 -8.910 -16.038 11.337 859 HE2 LYS 21 HE2 LYS 21 -9.612 -14.530 12.932 860 HE3 LYS 21 HE1 LYS 21 -9.127 -13.415 11.687 861 HZ1 LYS 21 HZ1 LYS 21 -11.915 -14.428 11.676 862 HZ2 LYS 21 HZ2 LYS 21 -11.264 -13.033 10.995 863 HZ3 LYS 21 HZ3 LYS 21 -11.481 -13.121 12.662 864 H GLU 22 H GLU 22 -7.281 -16.927 6.557 865 HA GLU 22 HA GLU 22 -7.448 -19.813 6.061 866 HB2 GLU 22 HB3 GLU 22 -9.243 -17.930 4.470 867 HB3 GLU 22 HB2 GLU 22 -8.990 -19.632 4.166 868 HG2 GLU 22 HG3 GLU 22 -9.918 -20.164 6.438 869 HG3 GLU 22 HG2 GLU 22 -10.185 -18.452 6.688 870 H GLY 23 H GLY 23 -6.694 -16.592 4.960 871 HA2 GLY 23 HA3 GLY 23 -5.866 -17.147 2.385 872 HA3 GLY 23 HA2 GLY 23 -5.309 -15.773 3.317 873 H ASP 24 H ASP 24 -4.794 -19.244 2.928 874 HA ASP 24 HA ASP 24 -2.979 -20.584 3.329 875 HB2 ASP 24 HB3 ASP 24 -2.816 -19.696 0.960 876 HB3 ASP 24 HB2 ASP 24 -1.575 -18.593 1.550 877 H LYS 25 H LYS 25 -0.118 -19.769 3.143 878 HA LYS 25 HA LYS 25 0.315 -19.357 5.919 879 HB2 LYS 25 HB3 LYS 25 2.258 -18.739 3.715 880 HB3 LYS 25 HB2 LYS 25 2.631 -19.182 5.382 881 HG2 LYS 25 HG3 LYS 25 1.026 -21.243 4.572 882 HG3 LYS 25 HG2 LYS 25 1.916 -20.852 3.100 883 HD2 LYS 25 HD3 LYS 25 3.149 -21.575 5.800 884 HD3 LYS 25 HD2 LYS 25 3.142 -22.564 4.366 885 HE2 LYS 25 HE2 LYS 25 5.048 -21.626 3.681 886 HE3 LYS 25 HE1 LYS 25 4.256 -20.057 3.540 887 HZ1 LYS 25 HZ1 LYS 25 4.723 -20.369 6.235 888 HZ2 LYS 25 HZ2 LYS 25 5.648 -19.464 5.118 889 HZ3 LYS 25 HZ3 LYS 25 6.085 -21.045 5.487 890 H TYR 26 H TYR 26 0.580 -17.293 3.083 891 HA TYR 26 HA TYR 26 -0.281 -15.182 4.702 892 HB2 TYR 26 HB3 TYR 26 1.909 -13.938 3.300 893 HB3 TYR 26 HB2 TYR 26 1.627 -14.040 5.022 894 HD1 TYR 26 HD2 TYR 26 3.276 -15.667 2.146 895 HD2 TYR 26 HD1 TYR 26 2.680 -15.763 6.406 896 HE1 TYR 26 HE2 TYR 26 5.141 -17.274 2.374 897 HE2 TYR 26 HE1 TYR 26 4.538 -17.366 6.625 898 HH TYR 26 HH TYR 26 6.862 -17.858 4.575 899 H LYS 27 H LYS 27 -2.041 -15.069 3.367 900 HA LYS 27 HA LYS 27 -1.847 -13.506 1.001 901 HB2 LYS 27 HB3 LYS 27 -2.844 -16.373 0.789 902 HB3 LYS 27 HB2 LYS 27 -3.377 -15.114 -0.305 903 HG2 LYS 27 HG3 LYS 27 -0.462 -15.903 0.077 904 HG3 LYS 27 HG2 LYS 27 -1.476 -16.511 -1.188 905 HD2 LYS 27 HD3 LYS 27 -1.149 -13.497 -0.887 906 HD3 LYS 27 HD2 LYS 27 0.027 -14.475 -1.740 907 HE2 LYS 27 HE2 LYS 27 -1.991 -15.414 -3.106 908 HE3 LYS 27 HE1 LYS 27 -2.883 -14.050 -2.453 909 HZ1 LYS 27 HZ1 LYS 27 -0.296 -13.356 -3.624 910 HZ2 LYS 27 HZ2 LYS 27 -1.775 -12.593 -3.917 911 HZ3 LYS 27 HZ3 LYS 27 -1.374 -14.011 -4.676 912 H LEU 28 H LEU 28 -4.175 -13.019 0.220 913 HA LEU 28 HA LEU 28 -5.991 -13.100 2.543 914 HB2 LEU 28 HB3 LEU 28 -5.076 -10.941 2.388 915 HB3 LEU 28 HB2 LEU 28 -5.368 -10.847 0.647 916 HG LEU 28 HG LEU 28 -7.855 -11.035 1.192 917 HD11 LEU 28 HD11 LEU 28 -7.641 -12.024 3.421 918 HD12 LEU 28 HD12 LEU 28 -8.466 -10.459 3.524 919 HD13 LEU 28 HD13 LEU 28 -6.764 -10.590 3.964 920 HD21 LEU 28 HD21 LEU 28 -8.029 -8.695 1.837 921 HD22 LEU 28 HD22 LEU 28 -6.672 -8.877 0.725 922 HD23 LEU 28 HD23 LEU 28 -6.381 -8.714 2.458 923 H SER 29 H SER 29 -7.893 -14.081 2.106 924 HA SER 29 HA SER 29 -8.564 -14.833 -0.600 925 HB2 SER 29 HB3 SER 29 -10.550 -15.881 0.594 926 HB3 SER 29 HB2 SER 29 -8.969 -16.493 1.022 927 HG SER 29 HG SER 29 -10.002 -16.040 2.950 928 H LYS 30 H LYS 30 -10.692 -14.466 -1.511 929 HA LYS 30 HA LYS 30 -11.489 -11.666 -1.389 930 HB2 LYS 30 HB3 LYS 30 -13.031 -13.917 -2.679 931 HB3 LYS 30 HB2 LYS 30 -13.019 -12.222 -3.128 932 HG2 LYS 30 HG3 LYS 30 -10.795 -14.242 -3.478 933 HG3 LYS 30 HG2 LYS 30 -11.704 -13.489 -4.743 934 HD2 LYS 30 HD3 LYS 30 -10.343 -11.491 -2.946 935 HD3 LYS 30 HD2 LYS 30 -9.299 -12.541 -3.858 936 HE2 LYS 30 HE2 LYS 30 -11.359 -10.644 -4.898 937 HE3 LYS 30 HE1 LYS 30 -9.629 -10.723 -5.240 938 HZ1 LYS 30 HZ1 LYS 30 -11.837 -12.417 -6.281 939 HZ2 LYS 30 HZ2 LYS 30 -10.374 -13.147 -6.196 940 HZ3 LYS 30 HZ3 LYS 30 -10.601 -11.789 -7.180 941 H LYS 31 H LYS 31 -12.041 -14.397 0.355 942 HA LYS 31 HA LYS 31 -14.754 -14.263 1.212 943 HB2 LYS 31 HB3 LYS 31 -12.255 -15.091 2.706 944 HB3 LYS 31 HB2 LYS 31 -13.916 -15.546 3.060 945 HG2 LYS 31 HG3 LYS 31 -14.111 -16.728 0.963 946 HG3 LYS 31 HG2 LYS 31 -12.519 -16.247 0.453 947 HD2 LYS 31 HD3 LYS 31 -11.627 -17.372 2.537 948 HD3 LYS 31 HD2 LYS 31 -13.254 -18.017 2.771 949 HE2 LYS 31 HE2 LYS 31 -13.003 -18.727 0.265 950 HE3 LYS 31 HE1 LYS 31 -11.318 -18.527 0.567 951 HZ1 LYS 31 HZ1 LYS 31 -13.010 -20.614 1.721 952 HZ2 LYS 31 HZ2 LYS 31 -11.897 -19.871 2.778 953 HZ3 LYS 31 HZ3 LYS 31 -11.360 -20.623 1.391 954 H GLU 32 H GLU 32 -11.686 -13.086 2.229 955 HA GLU 32 HA GLU 32 -12.727 -11.568 4.475 956 HB2 GLU 32 HB3 GLU 32 -9.935 -12.179 3.544 957 HB3 GLU 32 HB2 GLU 32 -10.385 -11.467 5.098 958 HG2 GLU 32 HG3 GLU 32 -11.188 -14.247 4.110 959 HG3 GLU 32 HG2 GLU 32 -9.960 -13.905 5.310 960 H LEU 33 H LEU 33 -10.819 -11.136 1.522 961 HA LEU 33 HA LEU 33 -9.962 -8.571 1.945 962 HB2 LEU 33 HB3 LEU 33 -9.084 -9.944 0.146 963 HB3 LEU 33 HB2 LEU 33 -10.622 -9.914 -0.684 964 HG LEU 33 HG LEU 33 -8.753 -8.353 -1.530 965 HD11 LEU 33 HD11 LEU 33 -11.364 -8.245 -1.923 966 HD12 LEU 33 HD12 LEU 33 -10.286 -6.980 -2.492 967 HD13 LEU 33 HD13 LEU 33 -11.201 -6.739 -1.015 968 HD21 LEU 33 HD21 LEU 33 -9.511 -6.885 1.048 969 HD22 LEU 33 HD22 LEU 33 -8.944 -6.045 -0.370 970 HD23 LEU 33 HD23 LEU 33 -7.916 -7.234 0.378 971 H LYS 34 H LYS 34 -12.953 -9.583 0.314 972 HA LYS 34 HA LYS 34 -13.824 -6.963 -0.329 973 HB2 LYS 34 HB3 LYS 34 -15.403 -9.508 0.123 974 HB3 LYS 34 HB2 LYS 34 -16.088 -8.002 -0.470 975 HG2 LYS 34 HG3 LYS 34 -14.580 -8.032 -2.404 976 HG3 LYS 34 HG2 LYS 34 -13.845 -9.532 -1.828 977 HD2 LYS 34 HD3 LYS 34 -16.054 -10.660 -1.943 978 HD3 LYS 34 HD2 LYS 34 -16.776 -9.201 -2.588 979 HE2 LYS 34 HE2 LYS 34 -14.448 -10.628 -3.904 980 HE3 LYS 34 HE1 LYS 34 -16.126 -10.902 -4.342 981 HZ1 LYS 34 HZ1 LYS 34 -14.909 -8.180 -4.372 982 HZ2 LYS 34 HZ2 LYS 34 -16.373 -8.665 -5.026 983 HZ3 LYS 34 HZ3 LYS 34 -14.913 -9.210 -5.719 984 H GLU 35 H GLU 35 -14.429 -9.080 2.428 985 HA GLU 35 HA GLU 35 -16.204 -7.327 3.790 986 HB2 GLU 35 HB3 GLU 35 -14.497 -9.631 4.777 987 HB3 GLU 35 HB2 GLU 35 -15.714 -8.774 5.720 988 HG2 GLU 35 HG3 GLU 35 -16.325 -10.090 3.065 989 HG3 GLU 35 HG2 GLU 35 -16.562 -10.922 4.573 990 H LEU 36 H LEU 36 -12.772 -8.079 4.186 991 HA LEU 36 HA LEU 36 -12.307 -6.286 6.297 992 HB2 LEU 36 HB3 LEU 36 -10.435 -7.442 6.339 993 HB3 LEU 36 HB2 LEU 36 -10.737 -8.178 4.796 994 HG LEU 36 HG LEU 36 -9.775 -5.976 3.775 995 HD11 LEU 36 HD11 LEU 36 -7.965 -5.290 5.687 996 HD12 LEU 36 HD12 LEU 36 -9.410 -5.544 6.668 997 HD13 LEU 36 HD13 LEU 36 -9.427 -4.382 5.337 998 HD21 LEU 36 HD21 LEU 36 -8.676 -8.278 4.003 999 HD22 LEU 36 HD22 LEU 36 -7.815 -7.602 5.393 1000 HD23 LEU 36 HD23 LEU 36 -7.608 -6.891 3.794 1001 H LEU 37 H LEU 37 -11.841 -5.857 2.806 1002 HA LEU 37 HA LEU 37 -10.571 -3.409 3.076 1003 HB2 LEU 37 HB3 LEU 37 -10.493 -4.661 0.974 1004 HB3 LEU 37 HB2 LEU 37 -12.216 -4.398 0.714 1005 HG LEU 37 HG LEU 37 -10.524 -2.886 -0.543 1006 HD11 LEU 37 HD11 LEU 37 -12.352 -1.027 0.823 1007 HD12 LEU 37 HD12 LEU 37 -13.139 -2.481 0.215 1008 HD13 LEU 37 HD13 LEU 37 -12.226 -1.456 -0.876 1009 HD21 LEU 37 HD21 LEU 37 -9.698 -0.961 0.642 1010 HD22 LEU 37 HD22 LEU 37 -9.167 -2.398 1.515 1011 HD23 LEU 37 HD23 LEU 37 -10.509 -1.439 2.125 1012 H GLN 38 H GLN 38 -14.012 -4.059 2.531 1013 HA GLN 38 HA GLN 38 -14.765 -1.308 2.594 1014 HB2 GLN 38 HB3 GLN 38 -17.060 -2.104 2.880 1015 HB3 GLN 38 HB2 GLN 38 -16.262 -3.031 1.621 1016 HG2 GLN 38 HG3 GLN 38 -15.719 -4.767 3.425 1017 HG3 GLN 38 HG2 GLN 38 -16.834 -3.890 4.470 1018 HE21 GLN 38 HE21 GLN 38 -16.594 -5.971 1.674 1019 HE22 GLN 38 HE22 GLN 38 -18.268 -6.223 1.499 1020 H THR 39 H THR 39 -14.530 -3.819 5.030 1021 HA THR 39 HA THR 39 -15.641 -2.374 7.160 1022 HB THR 39 HB THR 39 -13.598 -4.598 7.148 1023 HG1 THR 39 HG2 THR 39 -15.342 -5.398 6.270 1024 HG21 THR 39 HG21 THR 39 -13.538 -3.595 9.268 1025 HG22 THR 39 HG22 THR 39 -14.540 -5.032 9.421 1026 HG23 THR 39 HG23 THR 39 -15.298 -3.431 9.360 1027 H GLU 40 H GLU 40 -12.180 -2.827 6.238 1028 HA GLU 40 HA GLU 40 -11.300 -1.104 8.338 1029 HB2 GLU 40 HB3 GLU 40 -9.852 -2.198 5.937 1030 HB3 GLU 40 HB2 GLU 40 -9.085 -1.269 7.225 1031 HG2 GLU 40 HG3 GLU 40 -10.582 -3.894 7.617 1032 HG3 GLU 40 HG2 GLU 40 -8.831 -3.666 7.583 1033 H LEU 41 H LEU 41 -11.809 -0.609 4.879 1034 HA LEU 41 HA LEU 41 -11.016 2.208 5.227 1035 HB2 LEU 41 HB3 LEU 41 -11.053 0.348 2.897 1036 HB3 LEU 41 HB2 LEU 41 -11.222 2.046 2.589 1037 HG LEU 41 HG LEU 41 -9.155 2.463 4.015 1038 HD11 LEU 41 HD11 LEU 41 -8.972 0.491 5.312 1039 HD12 LEU 41 HD12 LEU 41 -7.643 0.403 4.168 1040 HD13 LEU 41 HD13 LEU 41 -9.097 -0.559 3.901 1041 HD21 LEU 41 HD21 LEU 41 -8.462 0.631 1.738 1042 HD22 LEU 41 HD22 LEU 41 -7.727 2.172 2.199 1043 HD23 LEU 41 HD23 LEU 41 -9.291 2.155 1.399 1044 H SER 42 H SER 42 -13.569 1.286 6.154 1045 HA SER 42 HA SER 42 -15.666 1.640 4.391 1046 HB2 SER 42 HB3 SER 42 -15.632 2.605 7.253 1047 HB3 SER 42 HB2 SER 42 -17.038 2.197 6.284 1048 HG SER 42 HG SER 42 -15.464 0.101 6.111 1049 H GLY 43 H GLY 43 -13.792 4.144 6.097 1050 HA2 GLY 43 HA3 GLY 43 -15.378 6.350 5.250 1051 HA3 GLY 43 HA2 GLY 43 -13.722 6.398 5.846 1052 H PHE 44 H PHE 44 -12.399 4.879 4.071 1053 HA PHE 44 HA PHE 44 -12.112 6.667 1.843 1054 HB2 PHE 44 HB3 PHE 44 -10.811 4.052 2.551 1055 HB3 PHE 44 HB2 PHE 44 -10.583 4.748 0.951 1056 HD1 PHE 44 HD2 PHE 44 -9.640 7.026 0.732 1057 HD2 PHE 44 HD1 PHE 44 -9.715 4.973 4.461 1058 HE1 PHE 44 HE2 PHE 44 -7.907 8.604 1.624 1059 HE2 PHE 44 HE1 PHE 44 -7.971 6.539 5.362 1060 HZ PHE 44 HZ PHE 44 -7.090 8.337 3.940 1061 H LEU 45 H LEU 45 -13.509 3.506 2.290 1062 HA LEU 45 HA LEU 45 -14.316 3.007 -0.415 1063 HB2 LEU 45 HB3 LEU 45 -14.364 1.174 1.059 1064 HB3 LEU 45 HB2 LEU 45 -15.192 2.080 2.309 1065 HG LEU 45 HG LEU 45 -17.192 2.171 1.031 1066 HD11 LEU 45 HD11 LEU 45 -15.430 1.236 -1.173 1067 HD12 LEU 45 HD12 LEU 45 -16.923 2.191 -1.205 1068 HD13 LEU 45 HD13 LEU 45 -17.015 0.442 -1.108 1069 HD21 LEU 45 HD21 LEU 45 -17.858 -0.121 1.166 1070 HD22 LEU 45 HD22 LEU 45 -16.624 0.116 2.396 1071 HD23 LEU 45 HD23 LEU 45 -16.217 -0.690 0.870 1072 H ASP 46 H ASP 46 -16.059 4.462 2.303 1073 HA ASP 46 HA ASP 46 -18.285 5.149 0.670 1074 HB2 ASP 46 HB3 ASP 46 -18.611 4.897 2.904 1075 HB3 ASP 46 HB2 ASP 46 -17.405 6.111 3.376 1076 H ALA 47 H ALA 47 -15.436 6.954 1.717 1077 HA ALA 47 HA ALA 47 -16.199 9.466 0.862 1078 HB1 ALA 47 HB1 ALA 47 -14.207 9.164 2.180 1079 HB2 ALA 47 HB2 ALA 47 -13.776 9.963 0.672 1080 HB3 ALA 47 HB3 ALA 47 -13.440 8.243 0.887 1081 H GLN 48 H GLN 48 -14.486 6.976 -1.016 1082 HA GLN 48 HA GLN 48 -15.229 8.507 -3.431 1083 HB2 GLN 48 HB3 GLN 48 -13.217 7.266 -4.526 1084 HB3 GLN 48 HB2 GLN 48 -12.895 8.637 -3.469 1085 HG2 GLN 48 HG3 GLN 48 -11.372 6.994 -2.799 1086 HG3 GLN 48 HG2 GLN 48 -12.632 6.880 -1.581 1087 HE21 GLN 48 HE21 GLN 48 -13.573 4.838 -1.346 1088 HE22 GLN 48 HE22 GLN 48 -13.365 3.545 -2.436 1089 H LYS 49 H LYS 49 -16.793 6.471 -2.069 1090 HA LYS 49 HA LYS 49 -16.739 4.011 -3.415 1091 HB2 LYS 49 HB3 LYS 49 -18.202 4.473 -1.376 1092 HB3 LYS 49 HB2 LYS 49 -19.239 5.419 -2.421 1093 HG2 LYS 49 HG3 LYS 49 -19.513 3.416 -3.892 1094 HG3 LYS 49 HG2 LYS 49 -18.576 2.530 -2.715 1095 HD2 LYS 49 HD3 LYS 49 -20.139 2.953 -0.940 1096 HD3 LYS 49 HD2 LYS 49 -21.145 3.967 -1.966 1097 HE2 LYS 49 HE2 LYS 49 -20.627 0.990 -2.294 1098 HE3 LYS 49 HE1 LYS 49 -22.132 1.816 -1.873 1099 HZ1 LYS 49 HZ1 LYS 49 -20.748 1.775 -4.480 1100 HZ2 LYS 49 HZ2 LYS 49 -21.788 3.042 -4.129 1101 HZ3 LYS 49 HZ3 LYS 49 -22.356 1.457 -4.167 1102 H ASP 50 H ASP 50 -18.479 6.993 -4.072 1103 HA ASP 50 HA ASP 50 -19.842 6.088 -6.394 1104 HB2 ASP 50 HB3 ASP 50 -20.547 8.059 -5.009 1105 HB3 ASP 50 HB2 ASP 50 -19.218 8.971 -5.715 1106 H VAL 51 H VAL 51 -16.623 7.028 -5.907 1107 HA VAL 51 HA VAL 51 -16.142 8.298 -8.370 1108 HB VAL 51 HB VAL 51 -14.162 6.940 -6.516 1109 HG11 VAL 51 HG11 VAL 51 -12.648 8.725 -7.614 1110 HG12 VAL 51 HG12 VAL 51 -13.850 8.791 -8.893 1111 HG13 VAL 51 HG13 VAL 51 -12.998 7.286 -8.559 1112 HG21 VAL 51 HG21 VAL 51 -14.859 9.883 -6.750 1113 HG22 VAL 51 HG22 VAL 51 -13.898 9.116 -5.511 1114 HG23 VAL 51 HG23 VAL 51 -15.640 8.836 -5.572 1115 H ASP 52 H ASP 52 -17.083 5.194 -7.971 1116 HA ASP 52 HA ASP 52 -17.094 3.370 -9.341 1117 HB2 ASP 52 HB3 ASP 52 -17.716 4.630 -11.209 1118 HB3 ASP 52 HB2 ASP 52 -16.202 5.505 -11.275 1119 H ALA 53 H ALA 53 -14.098 5.191 -9.660 1120 HA ALA 53 HA ALA 53 -12.382 3.212 -10.461 1121 HB1 ALA 53 HB1 ALA 53 -10.584 4.471 -9.345 1122 HB2 ALA 53 HB2 ALA 53 -11.784 5.402 -8.462 1123 HB3 ALA 53 HB3 ALA 53 -11.671 5.546 -10.225 1124 H VAL 54 H VAL 54 -13.912 3.679 -7.395 1125 HA VAL 54 HA VAL 54 -12.256 2.126 -5.770 1126 HB VAL 54 HB VAL 54 -14.079 3.511 -4.854 1127 HG11 VAL 54 HG11 VAL 54 -16.390 2.842 -5.024 1128 HG12 VAL 54 HG12 VAL 54 -16.004 1.448 -5.984 1129 HG13 VAL 54 HG13 VAL 54 -15.778 3.079 -6.650 1130 HG21 VAL 54 HG21 VAL 54 -13.516 1.915 -3.226 1131 HG22 VAL 54 HG22 VAL 54 -14.013 0.553 -4.228 1132 HG23 VAL 54 HG23 VAL 54 -15.219 1.566 -3.460 1133 H ASP 55 H ASP 55 -14.953 1.296 -7.867 1134 HA ASP 55 HA ASP 55 -14.917 -1.550 -7.452 1135 HB2 ASP 55 HB3 ASP 55 -16.811 -0.418 -8.630 1136 HB3 ASP 55 HB2 ASP 55 -15.664 -0.025 -9.933 1137 H LYS 56 H LYS 56 -13.472 0.645 -9.719 1138 HA LYS 56 HA LYS 56 -12.326 -1.247 -11.415 1139 HB2 LYS 56 HB3 LYS 56 -11.275 1.530 -10.846 1140 HB3 LYS 56 HB2 LYS 56 -10.972 0.565 -12.274 1141 HG2 LYS 56 HG3 LYS 56 -13.730 1.534 -11.412 1142 HG3 LYS 56 HG2 LYS 56 -12.743 2.204 -12.703 1143 HD2 LYS 56 HD3 LYS 56 -12.724 -0.190 -13.659 1144 HD3 LYS 56 HD2 LYS 56 -14.056 -0.508 -12.573 1145 HE2 LYS 56 HE2 LYS 56 -14.513 0.385 -15.053 1146 HE3 LYS 56 HE1 LYS 56 -15.537 0.843 -13.700 1147 HZ1 LYS 56 HZ1 LYS 56 -13.173 2.462 -14.537 1148 HZ2 LYS 56 HZ2 LYS 56 -14.467 2.934 -13.513 1149 HZ3 LYS 56 HZ3 LYS 56 -14.720 2.714 -15.147 1150 H VAL 57 H VAL 57 -10.943 0.446 -8.643 1151 HA VAL 57 HA VAL 57 -8.390 -0.806 -8.777 1152 HB VAL 57 HB VAL 57 -9.876 0.372 -6.410 1153 HG11 VAL 57 HG11 VAL 57 -7.898 -1.270 -5.987 1154 HG12 VAL 57 HG12 VAL 57 -7.858 0.297 -5.192 1155 HG13 VAL 57 HG13 VAL 57 -6.903 0.011 -6.659 1156 HG21 VAL 57 HG21 VAL 57 -7.605 1.617 -7.973 1157 HG22 VAL 57 HG22 VAL 57 -8.740 2.407 -6.878 1158 HG23 VAL 57 HG23 VAL 57 -9.280 1.871 -8.458 1159 H MET 58 H MET 58 -11.356 -1.507 -6.987 1160 HA MET 58 HA MET 58 -10.392 -3.823 -5.690 1161 HB2 MET 58 HB3 MET 58 -12.434 -3.917 -4.701 1162 HB3 MET 58 HB2 MET 58 -12.664 -2.333 -5.412 1163 HG2 MET 58 HG3 MET 58 -14.499 -3.242 -6.316 1164 HG3 MET 58 HG2 MET 58 -13.476 -3.933 -7.518 1165 HE1 MET 58 HE1 MET 58 -14.765 -6.815 -7.829 1166 HE2 MET 58 HE2 MET 58 -15.332 -5.160 -7.924 1167 HE3 MET 58 HE3 MET 58 -16.172 -6.302 -6.887 1168 H LYS 59 H LYS 59 -11.822 -3.312 -8.814 1169 HA LYS 59 HA LYS 59 -12.589 -5.898 -9.452 1170 HB2 LYS 59 HB3 LYS 59 -12.913 -3.681 -10.780 1171 HB3 LYS 59 HB2 LYS 59 -11.340 -4.065 -11.470 1172 HG2 LYS 59 HG3 LYS 59 -12.860 -5.059 -12.974 1173 HG3 LYS 59 HG2 LYS 59 -12.282 -6.371 -11.969 1174 HD2 LYS 59 HD3 LYS 59 -14.469 -6.846 -11.564 1175 HD3 LYS 59 HD2 LYS 59 -14.478 -5.447 -10.500 1176 HE2 LYS 59 HE2 LYS 59 -15.295 -5.580 -13.401 1177 HE3 LYS 59 HE1 LYS 59 -16.285 -5.136 -12.012 1178 HZ1 LYS 59 HZ1 LYS 59 -13.876 -3.508 -12.542 1179 HZ2 LYS 59 HZ2 LYS 59 -15.385 -3.029 -11.920 1180 HZ3 LYS 59 HZ3 LYS 59 -15.192 -3.347 -13.565 1181 H GLU 60 H GLU 60 -9.527 -4.263 -9.846 1182 HA GLU 60 HA GLU 60 -8.173 -6.338 -11.213 1183 HB2 GLU 60 HB3 GLU 60 -7.185 -4.220 -9.344 1184 HB3 GLU 60 HB2 GLU 60 -6.109 -5.319 -10.209 1185 HG2 GLU 60 HG3 GLU 60 -7.066 -4.509 -12.357 1186 HG3 GLU 60 HG2 GLU 60 -8.111 -3.414 -11.447 1187 H LEU 61 H LEU 61 -8.514 -5.593 -7.799 1188 HA LEU 61 HA LEU 61 -7.054 -7.846 -6.833 1189 HB2 LEU 61 HB3 LEU 61 -9.100 -5.992 -5.644 1190 HB3 LEU 61 HB2 LEU 61 -8.647 -7.452 -4.785 1191 HG LEU 61 HG LEU 61 -7.317 -5.380 -4.180 1192 HD11 LEU 61 HD11 LEU 61 -5.489 -7.490 -5.260 1193 HD12 LEU 61 HD12 LEU 61 -6.620 -7.854 -3.952 1194 HD13 LEU 61 HD13 LEU 61 -5.405 -6.599 -3.742 1195 HD21 LEU 61 HD21 LEU 61 -5.552 -4.656 -5.676 1196 HD22 LEU 61 HD22 LEU 61 -7.064 -4.533 -6.554 1197 HD23 LEU 61 HD23 LEU 61 -5.963 -5.883 -6.864 1198 H ASP 62 H ASP 62 -10.430 -7.215 -7.597 1199 HA ASP 62 HA ASP 62 -11.478 -9.678 -6.754 1200 HB2 ASP 62 HB3 ASP 62 -12.725 -7.530 -7.542 1201 HB3 ASP 62 HB2 ASP 62 -12.523 -8.198 -9.150 1202 H GLU 63 H GLU 63 -10.263 -8.646 -9.918 1203 HA GLU 63 HA GLU 63 -10.610 -11.151 -11.250 1204 HB2 GLU 63 HB3 GLU 63 -8.705 -8.855 -11.764 1205 HB3 GLU 63 HB2 GLU 63 -8.944 -10.227 -12.840 1206 HG2 GLU 63 HG3 GLU 63 -11.307 -9.669 -13.099 1207 HG3 GLU 63 HG2 GLU 63 -11.107 -8.387 -11.894 1208 H ASN 64 H ASN 64 -7.783 -9.582 -9.826 1209 HA ASN 64 HA ASN 64 -5.963 -11.655 -10.343 1210 HB2 ASN 64 HB3 ASN 64 -6.030 -9.379 -8.445 1211 HB3 ASN 64 HB2 ASN 64 -4.720 -10.591 -8.377 1212 HD21 ASN 64 HD21 ASN 64 -6.121 -7.979 -10.292 1213 HD22 ASN 64 HD22 ASN 64 -4.882 -7.904 -11.453 1214 H GLY 65 H GLY 65 -7.923 -10.958 -7.499 1215 HA2 GLY 65 HA3 GLY 65 -6.831 -13.045 -5.915 1216 HA3 GLY 65 HA2 GLY 65 -8.356 -12.231 -5.611 1217 H ASP 66 H ASP 66 -7.094 -14.321 -8.190 1218 HA ASP 66 HA ASP 66 -9.554 -15.655 -8.694 1219 HB2 ASP 66 HB3 ASP 66 -7.496 -15.653 -10.195 1220 HB3 ASP 66 HB2 ASP 66 -6.780 -16.807 -9.077 1221 H GLY 67 H GLY 67 -6.878 -16.166 -6.584 1222 HA2 GLY 67 HA3 GLY 67 -8.433 -18.213 -5.085 1223 HA3 GLY 67 HA2 GLY 67 -6.676 -18.229 -5.156 1224 H GLU 68 H GLU 68 -5.642 -16.112 -4.526 1225 HA GLU 68 HA GLU 68 -7.143 -14.662 -2.468 1226 HB2 GLU 68 HB3 GLU 68 -4.417 -15.900 -2.040 1227 HB3 GLU 68 HB2 GLU 68 -5.175 -14.682 -1.007 1228 HG2 GLU 68 HG3 GLU 68 -5.764 -16.677 0.078 1229 HG3 GLU 68 HG2 GLU 68 -7.183 -16.369 -0.910 1230 H VAL 69 H VAL 69 -5.987 -12.732 -1.778 1231 HA VAL 69 HA VAL 69 -4.315 -11.611 -3.904 1232 HB VAL 69 HB VAL 69 -5.643 -9.828 -4.010 1233 HG11 VAL 69 HG11 VAL 69 -7.871 -9.883 -3.080 1234 HG12 VAL 69 HG12 VAL 69 -7.367 -10.931 -1.774 1235 HG13 VAL 69 HG13 VAL 69 -7.421 -11.553 -3.430 1236 HG21 VAL 69 HG21 VAL 69 -6.216 -8.464 -1.978 1237 HG22 VAL 69 HG22 VAL 69 -4.481 -8.694 -2.200 1238 HG23 VAL 69 HG23 VAL 69 -5.361 -9.634 -0.988 1239 H ASP 70 H ASP 70 -2.344 -10.703 -3.238 1240 HA ASP 70 HA ASP 70 -1.526 -11.569 -0.581 1241 HB2 ASP 70 HB3 ASP 70 0.476 -12.013 -1.543 1242 HB3 ASP 70 HB2 ASP 70 -0.287 -11.598 -3.066 1243 H PHE 71 H PHE 71 0.301 -10.111 0.381 1244 HA PHE 71 HA PHE 71 -1.031 -7.879 1.430 1245 HB2 PHE 71 HB3 PHE 71 0.823 -9.054 2.593 1246 HB3 PHE 71 HB2 PHE 71 1.968 -8.331 1.462 1247 HD1 PHE 71 HD1 PHE 71 -0.855 -7.342 3.716 1248 HD2 PHE 71 HD2 PHE 71 2.968 -6.235 2.080 1249 HE1 PHE 71 HE1 PHE 71 -0.842 -5.320 5.106 1250 HE2 PHE 71 HE2 PHE 71 2.973 -4.207 3.510 1251 HZ PHE 71 HZ PHE 71 1.092 -3.742 5.004 1252 H GLN 72 H GLN 72 1.472 -8.144 -1.044 1253 HA GLN 72 HA GLN 72 1.679 -5.370 -1.574 1254 HB2 GLN 72 HB3 GLN 72 2.406 -7.823 -3.126 1255 HB3 GLN 72 HB2 GLN 72 2.539 -6.208 -3.889 1256 HG2 GLN 72 HG3 GLN 72 3.996 -5.572 -1.975 1257 HG3 GLN 72 HG2 GLN 72 3.818 -7.208 -1.340 1258 HE21 GLN 72 HE21 GLN 72 3.810 -8.190 -4.305 1259 HE22 GLN 72 HE22 GLN 72 5.457 -8.186 -4.692 1260 H GLU 73 H GLU 73 -0.433 -7.916 -2.792 1261 HA GLU 73 HA GLU 73 -1.823 -6.299 -4.707 1262 HB2 GLU 73 HB3 GLU 73 -2.644 -8.791 -3.188 1263 HB3 GLU 73 HB2 GLU 73 -3.636 -8.066 -4.443 1264 HG2 GLU 73 HG3 GLU 73 -1.831 -8.367 -6.070 1265 HG3 GLU 73 HG2 GLU 73 -0.796 -9.061 -4.840 1266 H TYR 74 H TYR 74 -2.390 -7.162 -1.335 1267 HA TYR 74 HA TYR 74 -4.820 -5.782 -0.937 1268 HB2 TYR 74 HB3 TYR 74 -4.204 -7.486 0.598 1269 HB3 TYR 74 HB2 TYR 74 -2.690 -6.692 0.985 1270 HD1 TYR 74 HD1 TYR 74 -6.364 -5.739 0.932 1271 HD2 TYR 74 HD2 TYR 74 -2.622 -5.644 3.076 1272 HE1 TYR 74 HE1 TYR 74 -7.452 -4.550 2.798 1273 HE2 TYR 74 HE2 TYR 74 -3.743 -4.450 4.943 1274 HH TYR 74 HH TYR 74 -6.403 -2.843 4.745 1275 H VAL 75 H VAL 75 -1.496 -4.719 -0.194 1276 HA VAL 75 HA VAL 75 -2.334 -2.334 0.972 1277 HB VAL 75 HB VAL 75 0.008 -1.498 0.607 1278 HG11 VAL 75 HG11 VAL 75 -0.826 -2.913 2.565 1279 HG12 VAL 75 HG12 VAL 75 0.902 -2.960 2.258 1280 HG13 VAL 75 HG13 VAL 75 -0.113 -4.302 1.743 1281 HG21 VAL 75 HG21 VAL 75 1.189 -3.987 -0.055 1282 HG22 VAL 75 HG22 VAL 75 1.255 -2.494 -0.997 1283 HG23 VAL 75 HG23 VAL 75 -0.003 -3.674 -1.306 1284 H VAL 76 H VAL 76 -1.481 -2.944 -2.427 1285 HA VAL 76 HA VAL 76 -1.671 -0.232 -3.182 1286 HB VAL 76 HB VAL 76 -0.539 -1.873 -4.625 1287 HG11 VAL 76 HG11 VAL 76 -1.950 -3.831 -4.281 1288 HG12 VAL 76 HG12 VAL 76 -1.891 -3.436 -5.986 1289 HG13 VAL 76 HG13 VAL 76 -3.319 -3.030 -5.056 1290 HG21 VAL 76 HG21 VAL 76 -1.213 -0.925 -6.656 1291 HG22 VAL 76 HG22 VAL 76 -1.836 0.254 -5.511 1292 HG23 VAL 76 HG23 VAL 76 -2.917 -0.932 -6.227 1293 H LEU 77 H LEU 77 -4.021 -2.811 -2.886 1294 HA LEU 77 HA LEU 77 -6.192 -1.554 -4.149 1295 HB2 LEU 77 HB3 LEU 77 -6.281 -3.882 -3.576 1296 HB3 LEU 77 HB2 LEU 77 -6.117 -3.526 -1.865 1297 HG LEU 77 HG LEU 77 -8.292 -2.344 -1.862 1298 HD11 LEU 77 HD11 LEU 77 -8.417 -1.443 -4.038 1299 HD12 LEU 77 HD12 LEU 77 -9.749 -2.569 -3.892 1300 HD13 LEU 77 HD13 LEU 77 -8.307 -3.032 -4.810 1301 HD21 LEU 77 HD21 LEU 77 -9.089 -4.839 -3.254 1302 HD22 LEU 77 HD22 LEU 77 -9.502 -4.263 -1.654 1303 HD23 LEU 77 HD23 LEU 77 -7.951 -5.059 -1.923 1304 H VAL 78 H VAL 78 -5.235 -1.570 -0.721 1305 HA VAL 78 HA VAL 78 -7.288 0.277 -0.028 1306 HB VAL 78 HB VAL 78 -6.200 0.472 2.147 1307 HG11 VAL 78 HG11 VAL 78 -7.141 -1.912 0.975 1308 HG12 VAL 78 HG12 VAL 78 -6.993 -1.567 2.701 1309 HG13 VAL 78 HG13 VAL 78 -5.685 -2.374 1.851 1310 HG21 VAL 78 HG21 VAL 78 -3.822 0.555 1.370 1311 HG22 VAL 78 HG22 VAL 78 -3.968 -1.142 0.894 1312 HG23 VAL 78 HG23 VAL 78 -4.070 -0.700 2.584 1313 H ALA 79 H ALA 79 -3.882 0.617 -0.829 1314 HA ALA 79 HA ALA 79 -3.712 3.397 -0.352 1315 HB1 ALA 79 HB1 ALA 79 -1.654 3.328 -1.275 1316 HB2 ALA 79 HB2 ALA 79 -2.093 2.115 -2.491 1317 HB3 ALA 79 HB3 ALA 79 -1.834 1.636 -0.810 1318 H ALA 80 H ALA 80 -4.487 1.588 -3.307 1319 HA ALA 80 HA ALA 80 -4.598 3.850 -4.964 1320 HB1 ALA 80 HB1 ALA 80 -5.683 1.084 -5.102 1321 HB2 ALA 80 HB2 ALA 80 -4.612 1.928 -6.223 1322 HB3 ALA 80 HB3 ALA 80 -6.337 2.284 -6.217 1323 H LEU 81 H LEU 81 -7.023 2.227 -3.002 1324 HA LEU 81 HA LEU 81 -9.200 3.946 -3.650 1325 HB2 LEU 81 HB3 LEU 81 -8.617 2.292 -1.182 1326 HB3 LEU 81 HB2 LEU 81 -10.150 3.100 -1.503 1327 HG LEU 81 HG LEU 81 -8.886 1.059 -3.357 1328 HD11 LEU 81 HD11 LEU 81 -9.575 -0.064 -1.349 1329 HD12 LEU 81 HD12 LEU 81 -10.746 -0.413 -2.609 1330 HD13 LEU 81 HD13 LEU 81 -11.138 0.758 -1.350 1331 HD21 LEU 81 HD21 LEU 81 -10.274 2.337 -4.726 1332 HD22 LEU 81 HD22 LEU 81 -11.398 2.710 -3.427 1333 HD23 LEU 81 HD23 LEU 81 -11.383 1.097 -4.157 1334 H THR 82 H THR 82 -6.663 3.955 -1.227 1335 HA THR 82 HA THR 82 -7.480 6.264 0.183 1336 HB THR 82 HB THR 82 -4.625 5.354 -0.260 1337 HG1 THR 82 HG2 THR 82 -6.133 3.665 0.507 1338 HG21 THR 82 HG21 THR 82 -5.696 6.527 2.277 1339 HG22 THR 82 HG22 THR 82 -5.311 7.613 0.943 1340 HG23 THR 82 HG23 THR 82 -4.067 6.580 1.622 1341 H VAL 83 H VAL 83 -5.222 5.818 -2.541 1342 HA VAL 83 HA VAL 83 -4.679 8.573 -2.826 1343 HB VAL 83 HB VAL 83 -3.539 6.350 -3.895 1344 HG11 VAL 83 HG11 VAL 83 -5.141 5.771 -5.515 1345 HG12 VAL 83 HG12 VAL 83 -3.789 6.504 -6.341 1346 HG13 VAL 83 HG13 VAL 83 -5.262 7.431 -6.123 1347 HG21 VAL 83 HG21 VAL 83 -2.165 7.811 -5.229 1348 HG22 VAL 83 HG22 VAL 83 -2.562 8.673 -3.740 1349 HG23 VAL 83 HG23 VAL 83 -3.402 9.060 -5.245 1350 H ALA 84 H ALA 84 -7.125 6.483 -4.272 1351 HA ALA 84 HA ALA 84 -8.218 8.315 -6.099 1352 HB1 ALA 84 HB1 ALA 84 -9.551 6.127 -4.473 1353 HB2 ALA 84 HB2 ALA 84 -9.018 6.042 -6.147 1354 HB3 ALA 84 HB3 ALA 84 -10.385 7.057 -5.711 1355 H MET 85 H MET 85 -9.090 7.723 -2.707 1356 HA MET 85 HA MET 85 -10.882 9.952 -2.503 1357 HB2 MET 85 HB3 MET 85 -10.907 8.047 -0.883 1358 HB3 MET 85 HB2 MET 85 -9.320 8.602 -0.318 1359 HG2 MET 85 HG3 MET 85 -10.283 10.769 0.340 1360 HG3 MET 85 HG2 MET 85 -11.869 10.249 -0.216 1361 HE1 MET 85 HE1 MET 85 -11.880 11.449 2.016 1362 HE2 MET 85 HE2 MET 85 -11.047 10.878 3.458 1363 HE3 MET 85 HE3 MET 85 -12.710 10.410 3.187 1364 H ASN 86 H ASN 86 -7.471 9.445 -1.751 1365 HA ASN 86 HA ASN 86 -7.040 11.851 -0.462 1366 HB2 ASN 86 HB3 ASN 86 -5.422 9.812 -0.754 1367 HB3 ASN 86 HB2 ASN 86 -4.813 10.746 -2.130 1368 HD21 ASN 86 HD21 ASN 86 -3.009 11.919 -1.429 1369 HD22 ASN 86 HD22 ASN 86 -2.910 12.712 0.061 1370 H ASN 87 H ASN 87 -7.355 11.195 -3.811 1371 HA ASN 87 HA ASN 87 -6.111 13.344 -5.042 1372 HB2 ASN 87 HB3 ASN 87 -7.365 11.575 -6.213 1373 HB3 ASN 87 HB2 ASN 87 -8.877 12.255 -5.636 1374 HD21 ASN 87 HD21 ASN 87 -7.496 12.057 -8.447 1375 HD22 ASN 87 HD22 ASN 87 -7.693 13.619 -9.074 1376 H PHE 88 H PHE 88 -9.100 13.214 -3.219 1377 HA PHE 88 HA PHE 88 -9.987 15.894 -3.494 1378 HB2 PHE 88 HB3 PHE 88 -11.371 14.074 -2.543 1379 HB3 PHE 88 HB2 PHE 88 -10.285 13.944 -1.176 1380 HD1 PHE 88 HD1 PHE 88 -10.217 15.690 0.570 1381 HD2 PHE 88 HD2 PHE 88 -12.904 15.970 -2.782 1382 HE1 PHE 88 HE1 PHE 88 -11.498 17.440 1.741 1383 HE2 PHE 88 HE2 PHE 88 -14.183 17.729 -1.604 1384 HZ PHE 88 HZ PHE 88 -13.492 18.472 0.647 1385 H PHE 89 H PHE 89 -7.881 14.259 -1.195 1386 HA PHE 89 HA PHE 89 -7.518 16.272 0.675 1387 HB2 PHE 89 HB3 PHE 89 -6.022 13.827 -0.049 1388 HB3 PHE 89 HB2 PHE 89 -5.236 14.961 0.999 1389 HD1 PHE 89 HD2 PHE 89 -8.590 13.301 0.544 1390 HD2 PHE 89 HD1 PHE 89 -5.669 14.831 3.310 1391 HE1 PHE 89 HE2 PHE 89 -9.947 12.490 2.424 1392 HE2 PHE 89 HE1 PHE 89 -7.036 14.011 5.202 1393 HZ PHE 89 HZ PHE 89 -9.177 12.840 4.769 1394 H TRP 90 H TRP 90 -5.305 15.522 -2.024 1395 HA TRP 90 HA TRP 90 -3.294 17.298 -1.205 1396 HB2 TRP 90 HB3 TRP 90 -3.789 17.044 -4.151 1397 HB3 TRP 90 HB2 TRP 90 -2.275 17.090 -3.265 1398 HD1 TRP 90 HD TRP 90 -5.280 14.804 -3.758 1399 HE1 TRP 90 HE1 TRP 90 -4.484 12.352 -3.679 1400 HE3 TRP 90 HE3 TRP 90 -0.389 15.527 -2.593 1401 HZ2 TRP 90 HZ2 TRP 90 -2.093 10.896 -3.175 1402 HZ3 TRP 90 HZ3 TRP 90 1.140 13.573 -2.317 1403 HH2 TRP 90 HH TRP 90 0.258 11.257 -2.612 1404 H GLU 91 H GLU 91 -5.995 17.839 -3.325 1405 HA GLU 91 HA GLU 91 -5.320 20.595 -3.784 1406 HB2 GLU 91 HB3 GLU 91 -7.874 19.222 -4.449 1407 HB3 GLU 91 HB2 GLU 91 -7.170 20.608 -5.274 1408 HG2 GLU 91 HG3 GLU 91 -5.447 18.126 -5.197 1409 HG3 GLU 91 HG2 GLU 91 -6.846 18.058 -6.228 1410 H ASN 92 H ASN 92 -7.859 18.838 -1.989 1411 HA ASN 92 HA ASN 92 -9.069 21.263 -1.030 1412 HB2 ASN 92 HB3 ASN 92 -9.359 18.400 -0.061 1413 HB3 ASN 92 HB2 ASN 92 -10.260 19.760 0.561 1414 HD21 ASN 92 HD21 ASN 92 -9.837 17.767 -2.283 1415 HD22 ASN 92 HD22 ASN 92 -11.230 18.266 -3.109 1416 H SER 93 H SER 93 -7.921 22.553 0.146 1417 HA SER 93 HA SER 93 -6.890 21.810 2.692 1418 HB2 SER 93 HB3 SER 93 -5.087 22.064 0.328 1419 HB3 SER 93 HB2 SER 93 -4.492 22.570 1.917 1420 HG SER 93 HG SER 93 -5.820 20.099 1.456 Start of MODEL 13 1 H1 GLY 1 H GLY 1 -11.930 6.017 8.984 2 HA2 GLY 1 HA3 GLY 1 -10.379 7.437 10.198 3 HA3 GLY 1 HA2 GLY 1 -11.492 7.416 11.551 4 H SER 2 H SER 2 -10.722 4.624 9.580 5 HA SER 2 HA SER 2 -10.149 3.017 11.876 6 HB2 SER 2 HB3 SER 2 -9.519 2.287 9.011 7 HB3 SER 2 HB2 SER 2 -9.897 1.213 10.329 8 HG SER 2 HG SER 2 -11.528 1.753 8.735 9 H GLU 3 H GLU 3 -8.096 1.783 12.197 10 HA GLU 3 HA GLU 3 -5.774 3.399 12.245 11 HB2 GLU 3 HB3 GLU 3 -5.955 0.383 12.198 12 HB3 GLU 3 HB2 GLU 3 -4.581 1.339 12.714 13 HG2 GLU 3 HG3 GLU 3 -5.528 0.880 14.708 14 HG3 GLU 3 HG2 GLU 3 -6.213 2.463 14.399 15 H LEU 4 H LEU 4 -7.013 0.950 10.114 16 HA LEU 4 HA LEU 4 -4.806 0.723 8.351 17 HB2 LEU 4 HB3 LEU 4 -7.774 0.172 8.081 18 HB3 LEU 4 HB2 LEU 4 -6.707 -0.016 6.711 19 HG LEU 4 HG LEU 4 -7.131 -2.107 8.110 20 HD11 LEU 4 HD11 LEU 4 -5.118 -1.578 6.554 21 HD12 LEU 4 HD12 LEU 4 -5.062 -2.973 7.607 22 HD13 LEU 4 HD13 LEU 4 -4.185 -1.509 8.056 23 HD21 LEU 4 HD21 LEU 4 -6.992 -1.172 10.349 24 HD22 LEU 4 HD22 LEU 4 -5.310 -0.625 10.073 25 HD23 LEU 4 HD23 LEU 4 -5.675 -2.308 10.160 26 H GLU 5 H GLU 5 -7.641 2.737 8.375 27 HA GLU 5 HA GLU 5 -7.094 4.225 5.991 28 HB2 GLU 5 HB3 GLU 5 -8.730 4.871 8.459 29 HB3 GLU 5 HB2 GLU 5 -8.722 5.837 7.001 30 HG2 GLU 5 HG3 GLU 5 -9.523 3.959 5.680 31 HG3 GLU 5 HG2 GLU 5 -9.469 2.894 7.058 32 H THR 6 H THR 6 -6.480 4.703 9.426 33 HA THR 6 HA THR 6 -5.159 7.190 9.233 34 HB THR 6 HB THR 6 -4.547 5.043 11.272 35 HG1 THR 6 HG2 THR 6 -6.858 5.414 10.975 36 HG21 THR 6 HG21 THR 6 -4.372 7.126 12.740 37 HG22 THR 6 HG22 THR 6 -4.416 8.069 11.254 38 HG23 THR 6 HG23 THR 6 -3.116 6.914 11.530 39 H ALA 7 H ALA 7 -3.955 3.849 9.204 40 HA ALA 7 HA ALA 7 -1.216 4.379 8.983 41 HB1 ALA 7 HB1 ALA 7 -1.730 2.123 9.367 42 HB2 ALA 7 HB2 ALA 7 -1.291 2.119 7.652 43 HB3 ALA 7 HB3 ALA 7 -2.979 2.112 8.126 44 H MET 8 H MET 8 -3.626 3.934 6.438 45 HA MET 8 HA MET 8 -1.806 4.359 4.295 46 HB2 MET 8 HB3 MET 8 -4.806 4.816 4.387 47 HB3 MET 8 HB2 MET 8 -3.855 4.758 2.923 48 HG2 MET 8 HG3 MET 8 -4.239 2.481 4.891 49 HG3 MET 8 HG2 MET 8 -4.831 2.560 3.240 50 HE1 MET 8 HE1 MET 8 -1.762 3.648 1.690 51 HE2 MET 8 HE2 MET 8 -3.455 3.162 1.418 52 HE3 MET 8 HE3 MET 8 -2.138 2.054 1.000 53 H GLU 9 H GLU 9 -3.932 6.492 6.110 54 HA GLU 9 HA GLU 9 -3.305 8.892 4.759 55 HB2 GLU 9 HB3 GLU 9 -4.367 8.282 7.510 56 HB3 GLU 9 HB2 GLU 9 -4.112 9.930 6.950 57 HG2 GLU 9 HG3 GLU 9 -5.725 7.932 5.357 58 HG3 GLU 9 HG2 GLU 9 -6.488 8.981 6.521 59 H THR 10 H THR 10 -1.804 7.167 7.424 60 HA THR 10 HA THR 10 0.058 9.151 8.208 61 HB THR 10 HB THR 10 0.665 6.170 8.189 62 HG1 THR 10 HG2 THR 10 -1.521 7.014 9.132 63 HG21 THR 10 HG21 THR 10 2.337 8.032 8.927 64 HG22 THR 10 HG22 THR 10 2.088 6.665 10.003 65 HG23 THR 10 HG23 THR 10 1.288 8.194 10.325 66 H LEU 11 H LEU 11 0.160 6.560 5.770 67 HA LEU 11 HA LEU 11 2.760 7.117 4.760 68 HB2 LEU 11 HB3 LEU 11 0.344 5.810 3.487 69 HB3 LEU 11 HB2 LEU 11 1.937 5.896 2.728 70 HG LEU 11 HG LEU 11 1.475 4.639 5.459 71 HD11 LEU 11 HD11 LEU 11 1.549 3.335 2.727 72 HD12 LEU 11 HD12 LEU 11 0.178 3.378 3.847 73 HD13 LEU 11 HD13 LEU 11 1.627 2.477 4.263 74 HD21 LEU 11 HD21 LEU 11 3.879 5.428 4.491 75 HD22 LEU 11 HD22 LEU 11 3.694 3.956 3.551 76 HD23 LEU 11 HD23 LEU 11 3.656 3.881 5.300 77 H ILE 12 H ILE 12 -0.444 8.324 3.946 78 HA ILE 12 HA ILE 12 0.280 9.751 1.623 79 HB ILE 12 HB ILE 12 -1.893 10.320 3.658 80 HG12 ILE 12 HG13 ILE 12 -2.023 8.182 2.253 81 HG13 ILE 12 HG12 ILE 12 -3.395 9.277 2.097 82 HG21 ILE 12 HG21 ILE 12 -2.898 11.698 1.785 83 HG22 ILE 12 HG22 ILE 12 -1.298 11.720 1.049 84 HG23 ILE 12 HG23 ILE 12 -1.548 12.425 2.641 85 HD11 ILE 12 HD11 ILE 12 -2.231 8.251 -0.049 86 HD12 ILE 12 HD12 ILE 12 -1.102 9.580 0.151 87 HD13 ILE 12 HD13 ILE 12 -2.827 9.898 -0.040 88 H ASN 13 H ASN 13 0.193 10.707 5.002 89 HA ASN 13 HA ASN 13 0.789 13.425 4.619 90 HB2 ASN 13 HB3 ASN 13 1.263 11.542 6.913 91 HB3 ASN 13 HB2 ASN 13 1.833 13.206 6.971 92 HD21 ASN 13 HD21 ASN 13 -1.117 11.205 6.816 93 HD22 ASN 13 HD22 ASN 13 -2.154 12.477 7.209 94 H VAL 14 H VAL 14 2.968 10.677 5.097 95 HA VAL 14 HA VAL 14 5.346 12.211 4.921 96 HB VAL 14 HB VAL 14 4.833 9.293 4.311 97 HG11 VAL 14 HG11 VAL 14 6.892 10.016 3.197 98 HG12 VAL 14 HG12 VAL 14 7.271 9.048 4.624 99 HG13 VAL 14 HG13 VAL 14 7.439 10.793 4.692 100 HG21 VAL 14 HG21 VAL 14 5.494 10.880 6.771 101 HG22 VAL 14 HG22 VAL 14 6.199 9.279 6.610 102 HG23 VAL 14 HG23 VAL 14 4.449 9.470 6.606 103 H PHE 15 H PHE 15 3.519 10.334 2.547 104 HA PHE 15 HA PHE 15 5.126 10.810 0.266 105 HB2 PHE 15 HB3 PHE 15 3.271 9.140 0.432 106 HB3 PHE 15 HB2 PHE 15 2.126 10.478 0.398 107 HD1 PHE 15 HD1 PHE 15 4.693 8.647 -1.552 108 HD2 PHE 15 HD2 PHE 15 1.642 11.693 -1.654 109 HE1 PHE 15 HE1 PHE 15 4.789 8.682 -4.018 110 HE2 PHE 15 HE2 PHE 15 1.747 11.705 -4.109 111 HZ PHE 15 HZ PHE 15 3.315 10.216 -5.294 112 H HIS 16 H HIS 16 2.292 12.456 1.505 113 HA HIS 16 HA HIS 16 2.063 14.531 -0.373 114 HB2 HIS 16 HB3 HIS 16 0.294 13.811 1.153 115 HB3 HIS 16 HB2 HIS 16 1.252 14.341 2.525 116 HD1 HIS 16 HD1 HIS 16 0.978 16.523 -0.621 117 HD2 HIS 16 HD2 HIS 16 -0.625 16.214 3.221 118 HE1 HIS 16 HE1 HIS 16 -0.300 18.619 -0.244 119 HE2 HIS 16 HE2 HIS 16 -1.303 18.507 2.097 120 H ALA 17 H ALA 17 3.683 14.337 2.798 121 HA ALA 17 HA ALA 17 4.610 16.974 2.936 122 HB1 ALA 17 HB1 ALA 17 4.738 15.562 4.879 123 HB2 ALA 17 HB2 ALA 17 6.390 16.023 4.435 124 HB3 ALA 17 HB3 ALA 17 5.791 14.420 4.045 125 H HIS 18 H HIS 18 6.200 14.059 1.652 126 HA HIS 18 HA HIS 18 8.521 15.437 0.711 127 HB2 HIS 18 HB3 HIS 18 7.369 12.720 0.051 128 HB3 HIS 18 HB2 HIS 18 8.770 13.402 -0.779 129 HD1 HIS 18 HD1 HIS 18 11.029 13.591 0.508 130 HD2 HIS 18 HD2 HIS 18 7.867 12.158 2.864 131 HE1 HIS 18 HE1 HIS 18 12.024 12.800 2.666 132 HE2 HIS 18 HE2 HIS 18 10.148 11.909 4.102 133 H SER 19 H SER 19 5.420 14.661 -0.780 134 HA SER 19 HA SER 19 6.009 15.351 -3.421 135 HB2 SER 19 HB3 SER 19 3.446 16.035 -1.947 136 HB3 SER 19 HB2 SER 19 3.676 15.899 -3.666 137 HG SER 19 HG SER 19 4.205 13.737 -1.851 138 H GLY 20 H GLY 20 5.082 17.359 -0.666 139 HA2 GLY 20 HA3 GLY 20 5.056 19.809 -2.021 140 HA3 GLY 20 HA2 GLY 20 5.263 19.616 -0.278 141 H LYS 21 H LYS 21 7.616 17.920 -0.540 142 HA LYS 21 HA LYS 21 9.659 19.926 -0.527 143 HB2 LYS 21 HB3 LYS 21 9.949 16.915 -0.818 144 HB3 LYS 21 HB2 LYS 21 11.238 18.031 -0.468 145 HG2 LYS 21 HG3 LYS 21 8.803 17.703 1.329 146 HG3 LYS 21 HG2 LYS 21 10.361 16.908 1.573 147 HD2 LYS 21 HD3 LYS 21 11.459 19.102 1.745 148 HD3 LYS 21 HD2 LYS 21 9.907 19.909 1.506 149 HE2 LYS 21 HE2 LYS 21 9.014 18.860 3.559 150 HE3 LYS 21 HE1 LYS 21 10.525 18.003 3.792 151 HZ1 LYS 21 HZ1 LYS 21 10.303 20.069 5.114 152 HZ2 LYS 21 HZ2 LYS 21 10.464 20.994 3.673 153 HZ3 LYS 21 HZ3 LYS 21 11.671 19.981 4.182 154 H GLU 22 H GLU 22 8.775 17.421 -2.906 155 HA GLU 22 HA GLU 22 10.701 18.366 -4.805 156 HB2 GLU 22 HB3 GLU 22 8.350 16.420 -5.270 157 HB3 GLU 22 HB2 GLU 22 9.565 16.910 -6.420 158 HG2 GLU 22 HG3 GLU 22 11.327 16.001 -5.117 159 HG3 GLU 22 HG2 GLU 22 10.223 15.691 -3.765 160 H GLY 23 H GLY 23 7.231 18.914 -4.299 161 HA2 GLY 23 HA3 GLY 23 6.945 21.440 -4.862 162 HA3 GLY 23 HA2 GLY 23 7.224 20.870 -6.503 163 H ASP 24 H ASP 24 5.767 18.320 -5.868 164 HA ASP 24 HA ASP 24 3.169 19.232 -6.708 165 HB2 ASP 24 HB3 ASP 24 4.394 16.973 -7.294 166 HB3 ASP 24 HB2 ASP 24 3.698 16.434 -5.791 167 H LYS 25 H LYS 25 1.173 18.858 -5.637 168 HA LYS 25 HA LYS 25 1.265 19.219 -2.777 169 HB2 LYS 25 HB3 LYS 25 -1.325 18.469 -3.155 170 HB3 LYS 25 HB2 LYS 25 -0.759 20.112 -3.398 171 HG2 LYS 25 HG3 LYS 25 -0.645 18.161 -5.697 172 HG3 LYS 25 HG2 LYS 25 -2.176 18.890 -5.236 173 HD2 LYS 25 HD3 LYS 25 -1.195 21.129 -5.445 174 HD3 LYS 25 HD2 LYS 25 0.343 20.439 -5.978 175 HE2 LYS 25 HE2 LYS 25 -0.840 19.365 -7.905 176 HE3 LYS 25 HE1 LYS 25 -2.335 20.092 -7.335 177 HZ1 LYS 25 HZ1 LYS 25 -0.365 21.227 -8.945 178 HZ2 LYS 25 HZ2 LYS 25 -0.456 22.155 -7.522 179 HZ3 LYS 25 HZ3 LYS 25 -1.830 21.897 -8.473 180 H TYR 26 H TYR 26 0.562 16.591 -5.020 181 HA TYR 26 HA TYR 26 1.617 14.756 -3.094 182 HB2 TYR 26 HB3 TYR 26 -0.365 13.159 -3.351 183 HB3 TYR 26 HB2 TYR 26 -0.559 14.512 -2.247 184 HD1 TYR 26 HD1 TYR 26 -1.935 16.463 -2.880 185 HD2 TYR 26 HD2 TYR 26 -1.614 13.043 -5.451 186 HE1 TYR 26 HE1 TYR 26 -3.892 17.258 -4.193 187 HE2 TYR 26 HE2 TYR 26 -3.536 13.823 -6.745 188 HH TYR 26 HH TYR 26 -5.763 15.852 -5.830 189 H LYS 27 H LYS 27 3.172 14.397 -4.470 190 HA LYS 27 HA LYS 27 2.880 12.209 -6.160 191 HB2 LYS 27 HB3 LYS 27 3.673 14.820 -7.506 192 HB3 LYS 27 HB2 LYS 27 4.216 13.270 -8.106 193 HG2 LYS 27 HG3 LYS 27 1.295 14.017 -7.750 194 HG3 LYS 27 HG2 LYS 27 2.129 14.175 -9.256 195 HD2 LYS 27 HD3 LYS 27 1.919 11.498 -7.783 196 HD3 LYS 27 HD2 LYS 27 0.827 12.007 -9.045 197 HE2 LYS 27 HE2 LYS 27 3.718 11.237 -9.264 198 HE3 LYS 27 HE1 LYS 27 2.365 10.755 -10.261 199 HZ1 LYS 27 HZ1 LYS 27 3.808 12.269 -11.422 200 HZ2 LYS 27 HZ2 LYS 27 3.594 13.482 -10.267 201 HZ3 LYS 27 HZ3 LYS 27 2.307 12.988 -11.236 202 H LEU 28 H LEU 28 5.016 11.281 -6.527 203 HA LEU 28 HA LEU 28 7.114 12.705 -5.051 204 HB2 LEU 28 HB3 LEU 28 6.023 10.985 -3.640 205 HB3 LEU 28 HB2 LEU 28 6.489 9.752 -4.798 206 HG LEU 28 HG LEU 28 8.901 10.534 -4.488 207 HD11 LEU 28 HD11 LEU 28 7.447 12.370 -2.647 208 HD12 LEU 28 HD12 LEU 28 8.900 12.652 -3.595 209 HD13 LEU 28 HD13 LEU 28 8.982 11.709 -2.099 210 HD21 LEU 28 HD21 LEU 28 7.949 8.544 -3.280 211 HD22 LEU 28 HD22 LEU 28 7.440 9.634 -1.992 212 HD23 LEU 28 HD23 LEU 28 9.165 9.428 -2.349 213 H SER 29 H SER 29 9.134 12.519 -5.904 214 HA SER 29 HA SER 29 9.288 11.064 -8.417 215 HB2 SER 29 HB3 SER 29 11.208 13.192 -7.493 216 HB3 SER 29 HB2 SER 29 10.994 12.566 -9.118 217 HG SER 29 HG SER 29 9.231 14.019 -7.491 218 H LYS 30 H LYS 30 11.390 9.936 -8.794 219 HA LYS 30 HA LYS 30 11.824 8.261 -6.559 220 HB2 LYS 30 HB3 LYS 30 13.582 8.344 -9.005 221 HB3 LYS 30 HB2 LYS 30 13.347 6.985 -7.926 222 HG2 LYS 30 HG3 LYS 30 11.368 8.187 -9.870 223 HG3 LYS 30 HG2 LYS 30 12.025 6.543 -9.857 224 HD2 LYS 30 HD3 LYS 30 10.718 6.947 -7.310 225 HD3 LYS 30 HD2 LYS 30 9.659 7.549 -8.601 226 HE2 LYS 30 HE2 LYS 30 10.935 4.955 -9.104 227 HE3 LYS 30 HE1 LYS 30 9.870 4.947 -7.760 228 HZ1 LYS 30 HZ1 LYS 30 9.008 4.890 -10.441 229 HZ2 LYS 30 HZ2 LYS 30 8.491 6.364 -9.881 230 HZ3 LYS 30 HZ3 LYS 30 8.012 4.973 -9.124 231 H LYS 31 H LYS 31 13.132 11.219 -7.125 232 HA LYS 31 HA LYS 31 15.746 10.852 -6.057 233 HB2 LYS 31 HB3 LYS 31 15.755 13.270 -5.687 234 HB3 LYS 31 HB2 LYS 31 15.159 12.883 -7.298 235 HG2 LYS 31 HG3 LYS 31 12.766 13.025 -6.255 236 HG3 LYS 31 HG2 LYS 31 13.575 13.725 -4.861 237 HD2 LYS 31 HD3 LYS 31 12.719 15.452 -6.234 238 HD3 LYS 31 HD2 LYS 31 14.456 15.588 -6.314 239 HE2 LYS 31 HE2 LYS 31 12.930 13.958 -8.373 240 HE3 LYS 31 HE1 LYS 31 12.977 15.705 -8.470 241 HZ1 LYS 31 HZ1 LYS 31 14.865 15.334 -9.590 242 HZ2 LYS 31 HZ2 LYS 31 15.104 13.810 -8.976 243 HZ3 LYS 31 HZ3 LYS 31 15.602 15.168 -8.091 244 H GLU 32 H GLU 32 12.692 11.937 -4.563 245 HA GLU 32 HA GLU 32 13.708 11.914 -1.886 246 HB2 GLU 32 HB3 GLU 32 10.953 11.997 -3.066 247 HB3 GLU 32 HB2 GLU 32 11.236 12.021 -1.317 248 HG2 GLU 32 HG3 GLU 32 12.334 14.025 -3.316 249 HG3 GLU 32 HG2 GLU 32 10.935 14.300 -2.312 250 H LEU 33 H LEU 33 12.017 9.710 -3.976 251 HA LEU 33 HA LEU 33 10.980 7.986 -2.114 252 HB2 LEU 33 HB3 LEU 33 10.472 7.940 -4.547 253 HB3 LEU 33 HB2 LEU 33 12.006 7.158 -4.840 254 HG LEU 33 HG LEU 33 9.979 5.644 -4.700 255 HD11 LEU 33 HD11 LEU 33 11.896 4.612 -2.698 256 HD12 LEU 33 HD12 LEU 33 12.619 5.198 -4.190 257 HD13 LEU 33 HD13 LEU 33 11.387 3.945 -4.242 258 HD21 LEU 33 HD21 LEU 33 9.126 6.789 -2.550 259 HD22 LEU 33 HD22 LEU 33 10.378 5.887 -1.688 260 HD23 LEU 33 HD23 LEU 33 9.121 5.034 -2.566 261 H LYS 34 H LYS 34 14.214 7.783 -3.609 262 HA LYS 34 HA LYS 34 14.966 5.363 -2.322 263 HB2 LYS 34 HB3 LYS 34 16.662 7.688 -3.266 264 HB3 LYS 34 HB2 LYS 34 17.319 6.190 -2.646 265 HG2 LYS 34 HG3 LYS 34 16.203 4.919 -4.433 266 HG3 LYS 34 HG2 LYS 34 15.510 6.411 -5.080 267 HD2 LYS 34 HD3 LYS 34 17.717 7.322 -5.502 268 HD3 LYS 34 HD2 LYS 34 18.513 5.929 -4.784 269 HE2 LYS 34 HE2 LYS 34 16.657 5.766 -7.183 270 HE3 LYS 34 HE1 LYS 34 18.403 5.897 -7.298 271 HZ1 LYS 34 HZ1 LYS 34 18.273 3.639 -7.223 272 HZ2 LYS 34 HZ2 LYS 34 16.800 3.634 -6.393 273 HZ3 LYS 34 HZ3 LYS 34 18.236 3.900 -5.561 274 H GLU 35 H GLU 35 15.392 8.756 -1.449 275 HA GLU 35 HA GLU 35 16.737 8.312 1.011 276 HB2 GLU 35 HB3 GLU 35 15.126 10.629 -0.060 277 HB3 GLU 35 HB2 GLU 35 16.025 10.680 1.458 278 HG2 GLU 35 HG3 GLU 35 18.110 10.210 0.286 279 HG3 GLU 35 HG2 GLU 35 17.271 10.041 -1.241 280 H LEU 36 H LEU 36 13.428 8.857 0.068 281 HA LEU 36 HA LEU 36 12.161 8.990 2.544 282 HB2 LEU 36 HB3 LEU 36 11.083 9.698 0.542 283 HB3 LEU 36 HB2 LEU 36 11.331 8.124 -0.201 284 HG LEU 36 HG LEU 36 9.836 7.096 1.260 285 HD11 LEU 36 HD11 LEU 36 8.490 8.454 2.907 286 HD12 LEU 36 HD12 LEU 36 9.403 9.903 2.450 287 HD13 LEU 36 HD13 LEU 36 10.205 8.569 3.292 288 HD21 LEU 36 HD21 LEU 36 7.715 8.383 0.647 289 HD22 LEU 36 HD22 LEU 36 8.843 7.944 -0.642 290 HD23 LEU 36 HD23 LEU 36 8.817 9.605 -0.015 291 H LEU 37 H LEU 37 12.656 6.197 0.379 292 HA LEU 37 HA LEU 37 11.225 4.383 1.974 293 HB2 LEU 37 HB3 LEU 37 12.017 4.154 -0.473 294 HB3 LEU 37 HB2 LEU 37 13.537 3.549 0.205 295 HG LEU 37 HG LEU 37 10.787 2.352 0.180 296 HD11 LEU 37 HD11 LEU 37 11.891 0.438 -0.626 297 HD12 LEU 37 HD12 LEU 37 13.463 0.958 -0.015 298 HD13 LEU 37 HD13 LEU 37 12.740 1.771 -1.395 299 HD21 LEU 37 HD21 LEU 37 11.260 2.315 2.542 300 HD22 LEU 37 HD22 LEU 37 12.920 1.706 2.259 301 HD23 LEU 37 HD23 LEU 37 11.534 0.700 1.915 302 H GLN 38 H GLN 38 14.722 4.948 1.810 303 HA GLN 38 HA GLN 38 15.371 3.085 3.861 304 HB2 GLN 38 HB3 GLN 38 17.560 4.230 3.978 305 HB3 GLN 38 HB2 GLN 38 17.114 3.885 2.310 306 HG2 GLN 38 HG3 GLN 38 16.230 6.270 2.158 307 HG3 GLN 38 HG2 GLN 38 16.923 6.556 3.750 308 HE21 GLN 38 HE21 GLN 38 18.249 8.212 2.455 309 HE22 GLN 38 HE22 GLN 38 19.637 7.651 1.684 310 H THR 39 H THR 39 14.692 6.534 3.908 311 HA THR 39 HA THR 39 15.324 7.020 6.576 312 HB THR 39 HB THR 39 13.351 8.326 4.716 313 HG1 THR 39 HG2 THR 39 15.226 8.658 3.854 314 HG21 THR 39 HG21 THR 39 12.819 8.925 6.961 315 HG22 THR 39 HG22 THR 39 13.589 10.278 6.145 316 HG23 THR 39 HG23 THR 39 14.507 9.329 7.335 317 H GLU 40 H GLU 40 12.113 6.335 5.099 318 HA GLU 40 HA GLU 40 10.913 6.328 7.691 319 HB2 GLU 40 HB3 GLU 40 9.753 5.552 5.018 320 HB3 GLU 40 HB2 GLU 40 8.839 5.738 6.516 321 HG2 GLU 40 HG3 GLU 40 10.504 7.892 5.208 322 HG3 GLU 40 HG2 GLU 40 8.747 7.811 5.182 323 H LEU 41 H LEU 41 11.919 3.777 5.494 324 HA LEU 41 HA LEU 41 10.972 1.769 7.432 325 HB2 LEU 41 HB3 LEU 41 11.751 1.680 4.545 326 HB3 LEU 41 HB2 LEU 41 11.866 0.237 5.476 327 HG LEU 41 HG LEU 41 9.487 0.500 6.250 328 HD11 LEU 41 HD11 LEU 41 9.690 2.927 4.503 329 HD12 LEU 41 HD12 LEU 41 8.880 2.704 6.058 330 HD13 LEU 41 HD13 LEU 41 8.151 2.066 4.598 331 HD21 LEU 41 HD21 LEU 41 8.549 -0.430 4.277 332 HD22 LEU 41 HD22 LEU 41 10.250 -0.840 4.187 333 HD23 LEU 41 HD23 LEU 41 9.615 0.505 3.228 334 H SER 42 H SER 42 13.173 3.311 8.277 335 HA SER 42 HA SER 42 15.607 2.129 7.524 336 HB2 SER 42 HB3 SER 42 14.976 3.543 10.135 337 HB3 SER 42 HB2 SER 42 16.564 3.115 9.540 338 HG SER 42 HG SER 42 15.243 4.375 7.555 339 H GLY 43 H GLY 43 13.327 1.271 10.071 340 HA2 GLY 43 HA3 GLY 43 14.922 -0.781 11.234 341 HA3 GLY 43 HA2 GLY 43 13.170 -0.635 11.375 342 H PHE 44 H PHE 44 12.507 -0.773 8.660 343 HA PHE 44 HA PHE 44 12.630 -3.617 8.210 344 HB2 PHE 44 HB3 PHE 44 11.388 -1.327 6.711 345 HB3 PHE 44 HB2 PHE 44 11.538 -2.895 5.928 346 HD1 PHE 44 HD2 PHE 44 10.503 -4.870 6.933 347 HD2 PHE 44 HD1 PHE 44 9.768 -0.971 8.484 348 HE1 PHE 44 HE2 PHE 44 8.517 -5.754 8.172 349 HE2 PHE 44 HE1 PHE 44 7.773 -1.825 9.714 350 HZ PHE 44 HZ PHE 44 7.161 -4.214 9.562 351 H LEU 45 H LEU 45 14.056 -0.768 6.760 352 HA LEU 45 HA LEU 45 15.547 -2.054 4.756 353 HB2 LEU 45 HB3 LEU 45 15.211 0.298 4.673 354 HB3 LEU 45 HB2 LEU 45 15.930 0.542 6.251 355 HG LEU 45 HG LEU 45 18.040 -0.279 5.454 356 HD11 LEU 45 HD11 LEU 45 18.329 -0.487 2.875 357 HD12 LEU 45 HD12 LEU 45 16.576 -0.514 2.791 358 HD13 LEU 45 HD13 LEU 45 17.441 -1.787 3.661 359 HD21 LEU 45 HD21 LEU 45 17.244 2.192 5.170 360 HD22 LEU 45 HD22 LEU 45 17.218 1.816 3.448 361 HD23 LEU 45 HD23 LEU 45 18.724 1.687 4.355 362 H ASP 46 H ASP 46 16.232 -1.238 8.109 363 HA ASP 46 HA ASP 46 18.907 -2.220 8.227 364 HB2 ASP 46 HB3 ASP 46 17.933 -0.776 9.973 365 HB3 ASP 46 HB2 ASP 46 16.749 -2.024 10.337 366 H ALA 47 H ALA 47 15.777 -3.736 8.608 367 HA ALA 47 HA ALA 47 16.807 -6.282 9.428 368 HB1 ALA 47 HB1 ALA 47 14.275 -6.588 8.163 369 HB2 ALA 47 HB2 ALA 47 14.218 -5.119 9.119 370 HB3 ALA 47 HB3 ALA 47 14.662 -6.653 9.875 371 H GLN 48 H GLN 48 15.796 -4.967 6.289 372 HA GLN 48 HA GLN 48 17.013 -7.368 5.048 373 HB2 GLN 48 HB3 GLN 48 15.409 -6.333 3.023 374 HB3 GLN 48 HB2 GLN 48 15.030 -7.681 4.080 375 HG2 GLN 48 HG3 GLN 48 13.167 -6.407 4.346 376 HG3 GLN 48 HG2 GLN 48 14.083 -5.798 5.703 377 HE21 GLN 48 HE21 GLN 48 15.832 -4.431 3.315 378 HE22 GLN 48 HE22 GLN 48 14.900 -3.045 3.027 379 H LYS 49 H LYS 49 18.872 -5.785 5.591 380 HA LYS 49 HA LYS 49 19.400 -3.588 3.864 381 HB2 LYS 49 HB3 LYS 49 21.168 -5.457 5.420 382 HB3 LYS 49 HB2 LYS 49 21.795 -4.037 4.536 383 HG2 LYS 49 HG3 LYS 49 20.331 -2.645 5.983 384 HG3 LYS 49 HG2 LYS 49 19.803 -4.122 6.806 385 HD2 LYS 49 HD3 LYS 49 22.196 -4.619 7.403 386 HD3 LYS 49 HD2 LYS 49 22.649 -3.100 6.646 387 HE2 LYS 49 HE2 LYS 49 22.501 -2.508 8.884 388 HE3 LYS 49 HE1 LYS 49 20.930 -2.013 8.276 389 HZ1 LYS 49 HZ1 LYS 49 20.133 -4.320 8.996 390 HZ2 LYS 49 HZ2 LYS 49 20.520 -3.170 10.184 391 HZ3 LYS 49 HZ3 LYS 49 21.607 -4.428 9.862 392 H ASP 50 H ASP 50 20.246 -7.017 3.824 393 HA ASP 50 HA ASP 50 21.368 -6.755 1.100 394 HB2 ASP 50 HB3 ASP 50 22.115 -8.379 3.469 395 HB3 ASP 50 HB2 ASP 50 22.388 -9.068 1.884 396 H VAL 51 H VAL 51 18.591 -7.779 2.409 397 HA VAL 51 HA VAL 51 18.277 -10.367 1.370 398 HB VAL 51 HB VAL 51 16.208 -8.213 1.892 399 HG11 VAL 51 HG11 VAL 51 15.918 -10.833 0.573 400 HG12 VAL 51 HG12 VAL 51 14.790 -9.478 0.638 401 HG13 VAL 51 HG13 VAL 51 14.867 -10.621 1.962 402 HG21 VAL 51 HG21 VAL 51 17.466 -9.169 3.853 403 HG22 VAL 51 HG22 VAL 51 16.910 -10.770 3.388 404 HG23 VAL 51 HG23 VAL 51 15.751 -9.564 3.905 405 H ASP 52 H ASP 52 17.740 -11.178 -0.604 406 HA ASP 52 HA ASP 52 18.485 -9.823 -2.903 407 HB2 ASP 52 HB3 ASP 52 18.145 -12.320 -2.658 408 HB3 ASP 52 HB2 ASP 52 16.424 -12.024 -2.816 409 H ALA 53 H ALA 53 15.283 -10.366 -1.564 410 HA ALA 53 HA ALA 53 13.768 -9.280 -3.603 411 HB1 ALA 53 HB1 ALA 53 12.906 -10.571 -1.590 412 HB2 ALA 53 HB2 ALA 53 11.938 -9.205 -2.127 413 HB3 ALA 53 HB3 ALA 53 12.968 -9.039 -0.708 414 H VAL 54 H VAL 54 15.259 -7.581 -0.848 415 HA VAL 54 HA VAL 54 13.817 -5.245 -1.252 416 HB VAL 54 HB VAL 54 15.018 -5.493 0.864 417 HG11 VAL 54 HG11 VAL 54 17.416 -5.835 -0.870 418 HG12 VAL 54 HG12 VAL 54 17.029 -6.531 0.707 419 HG13 VAL 54 HG13 VAL 54 17.613 -4.902 0.597 420 HG21 VAL 54 HG21 VAL 54 15.065 -3.106 -0.714 421 HG22 VAL 54 HG22 VAL 54 16.618 -3.219 0.094 422 HG23 VAL 54 HG23 VAL 54 15.143 -3.260 1.036 423 H ASP 55 H ASP 55 16.907 -6.170 -2.711 424 HA ASP 55 HA ASP 55 17.287 -3.715 -4.093 425 HB2 ASP 55 HB3 ASP 55 18.995 -5.642 -3.877 426 HB3 ASP 55 HB2 ASP 55 18.052 -6.395 -5.185 427 H LYS 56 H LYS 56 15.623 -6.704 -4.878 428 HA LYS 56 HA LYS 56 14.943 -5.993 -7.524 429 HB2 LYS 56 HB3 LYS 56 13.428 -7.808 -5.628 430 HB3 LYS 56 HB2 LYS 56 13.201 -7.697 -7.367 431 HG2 LYS 56 HG3 LYS 56 15.705 -8.611 -5.936 432 HG3 LYS 56 HG2 LYS 56 14.599 -9.605 -6.866 433 HD2 LYS 56 HD3 LYS 56 15.219 -7.711 -8.744 434 HD3 LYS 56 HD2 LYS 56 16.655 -7.678 -7.782 435 HE2 LYS 56 HE2 LYS 56 16.946 -9.342 -9.550 436 HE3 LYS 56 HE1 LYS 56 16.978 -10.109 -7.968 437 HZ1 LYS 56 HZ1 LYS 56 14.923 -11.089 -8.303 438 HZ2 LYS 56 HZ2 LYS 56 15.479 -11.039 -9.890 439 HZ3 LYS 56 HZ3 LYS 56 14.384 -9.881 -9.355 440 H VAL 57 H VAL 57 13.261 -5.564 -4.456 441 HA VAL 57 HA VAL 57 10.946 -4.342 -5.579 442 HB VAL 57 HB VAL 57 12.141 -4.037 -2.806 443 HG11 VAL 57 HG11 VAL 57 10.491 -2.282 -3.566 444 HG12 VAL 57 HG12 VAL 57 9.985 -3.189 -2.153 445 HG13 VAL 57 HG13 VAL 57 9.304 -3.563 -3.740 446 HG21 VAL 57 HG21 VAL 57 10.844 -5.892 -2.156 447 HG22 VAL 57 HG22 VAL 57 11.374 -6.408 -3.759 448 HG23 VAL 57 HG23 VAL 57 9.770 -5.763 -3.538 449 H MET 58 H MET 58 13.973 -3.127 -4.296 450 HA MET 58 HA MET 58 13.508 -0.349 -4.630 451 HB2 MET 58 HB3 MET 58 16.098 -1.929 -4.833 452 HB3 MET 58 HB2 MET 58 15.967 -0.188 -4.646 453 HG2 MET 58 HG3 MET 58 14.444 -1.773 -2.701 454 HG3 MET 58 HG2 MET 58 16.194 -1.906 -2.558 455 HE1 MET 58 HE1 MET 58 17.599 1.197 -1.541 456 HE2 MET 58 HE2 MET 58 17.377 1.153 -3.291 457 HE3 MET 58 HE3 MET 58 17.716 -0.332 -2.432 458 H LYS 59 H LYS 59 14.757 -2.926 -6.670 459 HA LYS 59 HA LYS 59 15.600 -1.350 -8.814 460 HB2 LYS 59 HB3 LYS 59 16.324 -3.664 -8.330 461 HB3 LYS 59 HB2 LYS 59 14.737 -4.247 -8.830 462 HG2 LYS 59 HG3 LYS 59 16.256 -4.484 -10.695 463 HG3 LYS 59 HG2 LYS 59 15.139 -3.187 -11.093 464 HD2 LYS 59 HD3 LYS 59 16.763 -1.506 -10.775 465 HD3 LYS 59 HD2 LYS 59 17.724 -2.503 -9.695 466 HE2 LYS 59 HE2 LYS 59 18.749 -2.186 -11.964 467 HE3 LYS 59 HE1 LYS 59 18.513 -3.851 -11.469 468 HZ1 LYS 59 HZ1 LYS 59 17.796 -3.190 -13.818 469 HZ2 LYS 59 HZ2 LYS 59 16.401 -2.531 -13.161 470 HZ3 LYS 59 HZ3 LYS 59 16.787 -4.164 -12.950 471 H GLU 60 H GLU 60 12.579 -3.158 -8.244 472 HA GLU 60 HA GLU 60 11.405 -2.509 -10.733 473 HB2 GLU 60 HB3 GLU 60 10.096 -3.146 -8.083 474 HB3 GLU 60 HB2 GLU 60 9.190 -2.828 -9.550 475 HG2 GLU 60 HG3 GLU 60 10.405 -4.679 -10.687 476 HG3 GLU 60 HG2 GLU 60 11.260 -5.018 -9.185 477 H LEU 61 H LEU 61 11.409 -0.762 -7.690 478 HA LEU 61 HA LEU 61 9.734 1.351 -8.603 479 HB2 LEU 61 HB3 LEU 61 11.758 1.104 -6.379 480 HB3 LEU 61 HB2 LEU 61 11.125 2.682 -6.834 481 HG LEU 61 HG LEU 61 9.896 1.351 -4.971 482 HD11 LEU 61 HD11 LEU 61 9.012 3.406 -5.885 483 HD12 LEU 61 HD12 LEU 61 7.722 2.222 -5.717 484 HD13 LEU 61 HD13 LEU 61 8.386 2.557 -7.307 485 HD21 LEU 61 HD21 LEU 61 8.622 0.036 -7.416 486 HD22 LEU 61 HD22 LEU 61 8.190 -0.205 -5.736 487 HD23 LEU 61 HD23 LEU 61 9.734 -0.792 -6.323 488 H ASP 62 H ASP 62 13.187 0.735 -8.736 489 HA ASP 62 HA ASP 62 13.904 3.189 -10.012 490 HB2 ASP 62 HB3 ASP 62 15.497 1.499 -8.858 491 HB3 ASP 62 HB2 ASP 62 15.356 0.581 -10.340 492 H GLU 63 H GLU 63 13.017 -0.018 -11.178 493 HA GLU 63 HA GLU 63 13.322 0.460 -13.983 494 HB2 GLU 63 HB3 GLU 63 11.302 -1.308 -12.538 495 HB3 GLU 63 HB2 GLU 63 11.704 -1.350 -14.254 496 HG2 GLU 63 HG3 GLU 63 13.739 -1.826 -12.058 497 HG3 GLU 63 HG2 GLU 63 12.864 -3.104 -12.886 498 H ASN 64 H ASN 64 10.743 0.939 -11.663 499 HA ASN 64 HA ASN 64 9.080 2.325 -13.618 500 HB2 ASN 64 HB3 ASN 64 8.310 0.783 -11.609 501 HB3 ASN 64 HB2 ASN 64 8.450 2.300 -10.711 502 HD21 ASN 64 HD21 ASN 64 5.891 0.938 -11.380 503 HD22 ASN 64 HD22 ASN 64 5.028 2.035 -12.335 504 H GLY 65 H GLY 65 11.722 3.360 -12.929 505 HA2 GLY 65 HA3 GLY 65 11.122 5.843 -11.467 506 HA3 GLY 65 HA2 GLY 65 12.718 5.291 -12.003 507 H ASP 66 H ASP 66 10.144 4.932 -14.180 508 HA ASP 66 HA ASP 66 11.382 6.280 -16.275 509 HB2 ASP 66 HB3 ASP 66 9.465 4.531 -16.307 510 HB3 ASP 66 HB2 ASP 66 8.413 5.915 -16.097 511 H GLY 67 H GLY 67 8.748 7.308 -14.134 512 HA2 GLY 67 HA3 GLY 67 9.171 10.112 -15.053 513 HA3 GLY 67 HA2 GLY 67 7.571 9.457 -14.732 514 H GLU 68 H GLU 68 7.156 8.719 -12.537 515 HA GLU 68 HA GLU 68 8.758 10.063 -10.449 516 HB2 GLU 68 HB3 GLU 68 5.734 10.245 -10.507 517 HB3 GLU 68 HB2 GLU 68 6.826 11.173 -9.509 518 HG2 GLU 68 HG3 GLU 68 6.481 12.761 -11.055 519 HG3 GLU 68 HG2 GLU 68 7.732 11.936 -11.954 520 H VAL 69 H VAL 69 7.036 9.496 -8.332 521 HA VAL 69 HA VAL 69 6.293 6.711 -8.541 522 HB VAL 69 HB VAL 69 8.366 6.454 -7.417 523 HG11 VAL 69 HG11 VAL 69 7.626 9.015 -6.099 524 HG12 VAL 69 HG12 VAL 69 9.170 8.565 -6.808 525 HG13 VAL 69 HG13 VAL 69 8.689 7.927 -5.239 526 HG21 VAL 69 HG21 VAL 69 5.996 6.471 -5.536 527 HG22 VAL 69 HG22 VAL 69 7.603 6.201 -4.900 528 HG23 VAL 69 HG23 VAL 69 6.978 5.137 -6.146 529 H ASP 70 H ASP 70 4.297 6.439 -7.771 530 HA ASP 70 HA ASP 70 3.118 8.799 -6.515 531 HB2 ASP 70 HB3 ASP 70 1.109 8.312 -7.400 532 HB3 ASP 70 HB2 ASP 70 2.122 7.640 -8.654 533 H PHE 71 H PHE 71 1.062 7.977 -5.245 534 HA PHE 71 HA PHE 71 2.078 7.070 -2.801 535 HB2 PHE 71 HB3 PHE 71 -0.000 8.453 -3.090 536 HB3 PHE 71 HB2 PHE 71 -0.809 7.014 -3.693 537 HD1 PHE 71 HD1 PHE 71 1.356 8.013 -0.804 538 HD2 PHE 71 HD2 PHE 71 -2.039 5.741 -2.154 539 HE1 PHE 71 HE1 PHE 71 0.909 7.320 1.501 540 HE2 PHE 71 HE2 PHE 71 -2.478 5.047 0.187 541 HZ PHE 71 HZ PHE 71 -1.027 5.827 2.009 542 H GLN 72 H GLN 72 0.301 5.430 -5.394 543 HA GLN 72 HA GLN 72 -0.026 2.981 -4.102 544 HB2 GLN 72 HB3 GLN 72 0.078 3.716 -7.013 545 HB3 GLN 72 HB2 GLN 72 -0.254 2.067 -6.458 546 HG2 GLN 72 HG3 GLN 72 -2.177 2.904 -5.155 547 HG3 GLN 72 HG2 GLN 72 -1.802 4.547 -5.658 548 HE21 GLN 72 HE21 GLN 72 -2.153 1.382 -7.396 549 HE22 GLN 72 HE22 GLN 72 -3.169 2.010 -8.587 550 H GLU 73 H GLU 73 2.608 4.208 -6.221 551 HA GLU 73 HA GLU 73 4.175 1.803 -6.091 552 HB2 GLU 73 HB3 GLU 73 5.033 4.666 -6.621 553 HB3 GLU 73 HB2 GLU 73 6.132 3.292 -6.656 554 HG2 GLU 73 HG3 GLU 73 4.778 2.262 -8.449 555 HG3 GLU 73 HG2 GLU 73 3.691 3.647 -8.428 556 H TYR 74 H TYR 74 4.017 4.739 -4.178 557 HA TYR 74 HA TYR 74 6.217 4.201 -2.501 558 HB2 TYR 74 HB3 TYR 74 5.239 6.415 -2.581 559 HB3 TYR 74 HB2 TYR 74 3.710 5.812 -1.980 560 HD1 TYR 74 HD1 TYR 74 7.330 5.379 -0.905 561 HD2 TYR 74 HD2 TYR 74 3.308 6.451 0.214 562 HE1 TYR 74 HE1 TYR 74 8.063 5.728 1.406 563 HE2 TYR 74 HE2 TYR 74 4.073 6.804 2.548 564 HH TYR 74 HH TYR 74 7.332 7.005 3.420 565 H VAL 75 H VAL 75 2.760 3.414 -2.002 566 HA VAL 75 HA VAL 75 3.300 2.112 0.442 567 HB VAL 75 HB VAL 75 1.093 1.235 0.423 568 HG11 VAL 75 HG11 VAL 75 0.114 3.239 0.679 569 HG12 VAL 75 HG12 VAL 75 0.383 3.708 -0.988 570 HG13 VAL 75 HG13 VAL 75 1.664 3.914 0.205 571 HG21 VAL 75 HG21 VAL 75 0.654 2.137 -2.415 572 HG22 VAL 75 HG22 VAL 75 -0.267 0.959 -1.456 573 HG23 VAL 75 HG23 VAL 75 1.239 0.495 -2.131 574 H VAL 76 H VAL 76 3.091 0.905 -2.878 575 HA VAL 76 HA VAL 76 3.309 -1.822 -2.148 576 HB VAL 76 HB VAL 76 2.624 -0.724 -4.459 577 HG11 VAL 76 HG11 VAL 76 4.880 0.268 -4.836 578 HG12 VAL 76 HG12 VAL 76 4.311 -0.755 -6.132 579 HG13 VAL 76 HG13 VAL 76 5.530 -1.361 -5.020 580 HG21 VAL 76 HG21 VAL 76 2.518 -3.155 -3.890 581 HG22 VAL 76 HG22 VAL 76 4.213 -3.311 -4.347 582 HG23 VAL 76 HG23 VAL 76 3.013 -2.873 -5.556 583 H LEU 77 H LEU 77 5.694 0.635 -2.878 584 HA LEU 77 HA LEU 77 7.978 -1.003 -2.911 585 HB2 LEU 77 HB3 LEU 77 8.060 1.283 -3.664 586 HB3 LEU 77 HB2 LEU 77 7.604 1.869 -2.072 587 HG LEU 77 HG LEU 77 9.693 0.995 -1.117 588 HD11 LEU 77 HD11 LEU 77 11.392 0.381 -3.159 589 HD12 LEU 77 HD12 LEU 77 9.897 -0.317 -3.773 590 HD13 LEU 77 HD13 LEU 77 10.522 -0.789 -2.182 591 HD21 LEU 77 HD21 LEU 77 9.674 2.932 -3.379 592 HD22 LEU 77 HD22 LEU 77 11.257 2.361 -2.834 593 HD23 LEU 77 HD23 LEU 77 10.167 3.146 -1.699 594 H VAL 78 H VAL 78 6.481 0.824 -0.232 595 HA VAL 78 HA VAL 78 8.288 -0.311 1.671 596 HB VAL 78 HB VAL 78 6.943 0.746 3.399 597 HG11 VAL 78 HG11 VAL 78 8.504 2.172 2.103 598 HG12 VAL 78 HG12 VAL 78 7.076 3.086 2.583 599 HG13 VAL 78 HG13 VAL 78 7.225 2.500 0.933 600 HG21 VAL 78 HG21 VAL 78 4.892 2.021 2.757 601 HG22 VAL 78 HG22 VAL 78 4.689 0.294 2.519 602 HG23 VAL 78 HG23 VAL 78 5.034 1.355 1.136 603 H ALA 79 H ALA 79 4.980 -1.030 0.693 604 HA ALA 79 HA ALA 79 4.456 -3.038 2.594 605 HB1 ALA 79 HB1 ALA 79 2.717 -2.012 1.111 606 HB2 ALA 79 HB2 ALA 79 2.715 -3.777 1.138 607 HB3 ALA 79 HB3 ALA 79 3.428 -2.922 -0.226 608 H ALA 80 H ALA 80 5.800 -3.224 -0.670 609 HA ALA 80 HA ALA 80 6.015 -5.987 -0.883 610 HB1 ALA 80 HB1 ALA 80 7.737 -3.769 -1.957 611 HB2 ALA 80 HB2 ALA 80 6.500 -4.696 -2.808 612 HB3 ALA 80 HB3 ALA 80 8.023 -5.466 -2.352 613 H LEU 81 H LEU 81 8.303 -3.636 0.405 614 HA LEU 81 HA LEU 81 10.216 -5.532 1.322 615 HB2 LEU 81 HB3 LEU 81 9.626 -2.704 2.219 616 HB3 LEU 81 HB2 LEU 81 10.999 -3.657 2.777 617 HG LEU 81 HG LEU 81 10.432 -3.001 -0.129 618 HD11 LEU 81 HD11 LEU 81 12.087 -1.646 1.958 619 HD12 LEU 81 HD12 LEU 81 11.097 -0.966 0.663 620 HD13 LEU 81 HD13 LEU 81 12.664 -1.675 0.288 621 HD21 LEU 81 HD21 LEU 81 12.933 -3.701 -0.215 622 HD22 LEU 81 HD22 LEU 81 11.723 -4.967 -0.166 623 HD23 LEU 81 HD23 LEU 81 12.615 -4.532 1.304 624 H THR 82 H THR 82 7.401 -3.998 2.792 625 HA THR 82 HA THR 82 7.798 -5.005 5.387 626 HB THR 82 HB THR 82 5.106 -4.522 4.112 627 HG1 THR 82 HG2 THR 82 6.757 -2.744 3.885 628 HG21 THR 82 HG21 THR 82 4.354 -4.083 6.337 629 HG22 THR 82 HG22 THR 82 6.005 -4.037 6.954 630 HG23 THR 82 HG23 THR 82 5.308 -5.562 6.438 631 H VAL 83 H VAL 83 5.834 -6.319 2.687 632 HA VAL 83 HA VAL 83 5.139 -8.666 4.129 633 HB VAL 83 HB VAL 83 3.812 -7.955 2.215 634 HG11 VAL 83 HG11 VAL 83 4.615 -8.369 -0.090 635 HG12 VAL 83 HG12 VAL 83 6.228 -8.685 0.531 636 HG13 VAL 83 HG13 VAL 83 5.490 -7.084 0.730 637 HG21 VAL 83 HG21 VAL 83 3.565 -10.099 1.050 638 HG22 VAL 83 HG22 VAL 83 3.698 -10.338 2.797 639 HG23 VAL 83 HG23 VAL 83 5.074 -10.680 1.740 640 H ALA 84 H ALA 84 7.753 -7.929 1.866 641 HA ALA 84 HA ALA 84 8.912 -10.498 1.831 642 HB1 ALA 84 HB1 ALA 84 10.238 -7.785 1.548 643 HB2 ALA 84 HB2 ALA 84 9.578 -8.761 0.241 644 HB3 ALA 84 HB3 ALA 84 10.979 -9.335 1.139 645 H MET 85 H MET 85 9.539 -7.657 3.926 646 HA MET 85 HA MET 85 11.443 -9.025 5.508 647 HB2 MET 85 HB3 MET 85 11.337 -6.551 5.437 648 HB3 MET 85 HB2 MET 85 9.777 -6.644 6.266 649 HG2 MET 85 HG3 MET 85 11.741 -6.238 7.834 650 HG3 MET 85 HG2 MET 85 10.767 -7.645 8.233 651 HE1 MET 85 HE1 MET 85 13.687 -9.653 9.141 652 HE2 MET 85 HE2 MET 85 11.940 -9.460 9.201 653 HE3 MET 85 HE3 MET 85 12.972 -8.144 9.730 654 H ASN 86 H ASN 86 7.988 -8.338 5.953 655 HA ASN 86 HA ASN 86 7.787 -9.541 8.479 656 HB2 ASN 86 HB3 ASN 86 5.759 -8.840 6.385 657 HB3 ASN 86 HB2 ASN 86 5.270 -9.894 7.694 658 HD21 ASN 86 HD21 ASN 86 4.552 -8.822 9.580 659 HD22 ASN 86 HD22 ASN 86 4.975 -7.240 9.974 660 H ASN 87 H ASN 87 7.908 -10.888 5.319 661 HA ASN 87 HA ASN 87 6.839 -13.434 5.852 662 HB2 ASN 87 HB3 ASN 87 7.445 -12.750 3.587 663 HB3 ASN 87 HB2 ASN 87 9.148 -12.693 4.038 664 HD21 ASN 87 HD21 ASN 87 10.293 -14.624 3.619 665 HD22 ASN 87 HD22 ASN 87 9.544 -16.134 3.458 666 H PHE 88 H PHE 88 10.032 -12.016 6.406 667 HA PHE 88 HA PHE 88 11.289 -14.350 7.451 668 HB2 PHE 88 HB3 PHE 88 11.874 -11.404 7.898 669 HB3 PHE 88 HB2 PHE 88 12.813 -12.704 8.589 670 HD1 PHE 88 HD1 PHE 88 13.833 -14.466 7.016 671 HD2 PHE 88 HD2 PHE 88 12.294 -10.703 5.670 672 HE1 PHE 88 HE1 PHE 88 15.146 -14.680 4.923 673 HE2 PHE 88 HE2 PHE 88 13.601 -10.916 3.571 674 HZ PHE 88 HZ PHE 88 15.032 -12.909 3.204 675 H PHE 89 H PHE 89 9.357 -11.760 8.897 676 HA PHE 89 HA PHE 89 9.828 -12.259 11.638 677 HB2 PHE 89 HB3 PHE 89 7.336 -11.352 10.211 678 HB3 PHE 89 HB2 PHE 89 7.410 -11.430 11.927 679 HD1 PHE 89 HD1 PHE 89 10.712 -10.525 11.477 680 HD2 PHE 89 HD2 PHE 89 6.781 -8.900 10.656 681 HE1 PHE 89 HE1 PHE 89 11.620 -8.282 11.492 682 HE2 PHE 89 HE2 PHE 89 7.750 -6.636 10.674 683 HZ PHE 89 HZ PHE 89 10.154 -6.315 11.089 684 H TRP 90 H TRP 90 7.275 -13.629 9.624 685 HA TRP 90 HA TRP 90 6.364 -15.349 11.737 686 HB2 TRP 90 HB3 TRP 90 5.727 -15.557 8.824 687 HB3 TRP 90 HB2 TRP 90 4.751 -16.117 10.199 688 HD1 TRP 90 HD TRP 90 5.312 -13.198 8.018 689 HE1 TRP 90 HE1 TRP 90 4.095 -11.152 8.879 690 HE3 TRP 90 HE3 TRP 90 4.007 -14.887 12.641 691 HZ2 TRP 90 HZ2 TRP 90 2.708 -10.289 11.276 692 HZ3 TRP 90 HZ3 TRP 90 2.746 -13.433 14.203 693 HH2 TRP 90 HH TRP 90 2.097 -11.130 13.516 694 H GLU 91 H GLU 91 8.222 -15.830 8.824 695 HA GLU 91 HA GLU 91 8.470 -18.640 9.193 696 HB2 GLU 91 HB3 GLU 91 10.115 -16.675 7.677 697 HB3 GLU 91 HB2 GLU 91 10.422 -18.414 7.608 698 HG2 GLU 91 HG3 GLU 91 8.041 -18.732 6.850 699 HG3 GLU 91 HG2 GLU 91 7.852 -17.003 6.841 700 H ASN 92 H ASN 92 10.487 -15.868 10.174 701 HA ASN 92 HA ASN 92 12.603 -17.450 11.212 702 HB2 ASN 92 HB3 ASN 92 12.783 -15.000 10.681 703 HB3 ASN 92 HB2 ASN 92 11.790 -14.674 12.102 704 HD21 ASN 92 HD21 ASN 92 14.904 -16.092 11.094 705 HD22 ASN 92 HD22 ASN 92 15.667 -15.922 12.595 706 H SER 93 H SER 93 12.194 -18.932 12.666 707 HA SER 93 HA SER 93 11.080 -18.283 15.238 708 HB2 SER 93 HB3 SER 93 9.547 -19.728 13.118 709 HB3 SER 93 HB2 SER 93 9.262 -20.119 14.832 710 HG SER 93 HG SER 93 9.321 -17.457 13.835 711 H1 GLY 1 H GLY 1 9.669 2.037 15.310 712 HA2 GLY 1 HA3 GLY 1 11.534 2.627 13.216 713 HA3 GLY 1 HA2 GLY 1 10.269 1.539 12.684 714 H SER 2 H SER 2 10.098 3.590 11.323 715 HA SER 2 HA SER 2 8.827 5.926 12.335 716 HB2 SER 2 HB3 SER 2 8.483 4.763 9.579 717 HB3 SER 2 HB2 SER 2 8.430 6.455 10.062 718 HG SER 2 HG SER 2 10.475 4.795 9.436 719 H GLU 3 H GLU 3 6.611 6.478 12.349 720 HA GLU 3 HA GLU 3 4.808 4.551 13.184 721 HB2 GLU 3 HB3 GLU 3 4.287 7.173 11.768 722 HB3 GLU 3 HB2 GLU 3 3.061 6.226 12.610 723 HG2 GLU 3 HG3 GLU 3 3.648 7.605 14.339 724 HG3 GLU 3 HG2 GLU 3 4.828 6.340 14.601 725 H LEU 4 H LEU 4 5.809 5.490 10.023 726 HA LEU 4 HA LEU 4 3.735 4.331 8.475 727 HB2 LEU 4 HB3 LEU 4 6.675 4.680 7.855 728 HB3 LEU 4 HB2 LEU 4 5.418 4.253 6.699 729 HG LEU 4 HG LEU 4 5.660 6.834 8.259 730 HD11 LEU 4 HD11 LEU 4 6.249 5.940 5.559 731 HD12 LEU 4 HD12 LEU 4 6.876 7.323 6.452 732 HD13 LEU 4 HD13 LEU 4 5.321 7.432 5.617 733 HD21 LEU 4 HD21 LEU 4 3.339 6.285 8.257 734 HD22 LEU 4 HD22 LEU 4 3.357 5.797 6.554 735 HD23 LEU 4 HD23 LEU 4 3.586 7.493 7.010 736 H GLU 5 H GLU 5 6.767 3.086 9.865 737 HA GLU 5 HA GLU 5 6.590 0.504 8.730 738 HB2 GLU 5 HB3 GLU 5 8.012 1.519 11.235 739 HB3 GLU 5 HB2 GLU 5 8.190 -0.093 10.573 740 HG2 GLU 5 HG3 GLU 5 9.004 0.830 8.428 741 HG3 GLU 5 HG2 GLU 5 8.788 2.450 9.035 742 H THR 6 H THR 6 5.456 1.931 11.756 743 HA THR 6 HA THR 6 4.207 -0.416 12.810 744 HB THR 6 HB THR 6 3.182 2.406 13.213 745 HG1 THR 6 HG2 THR 6 4.698 2.683 14.697 746 HG21 THR 6 HG21 THR 6 2.370 1.605 15.255 747 HG22 THR 6 HG22 THR 6 3.406 0.185 15.244 748 HG23 THR 6 HG23 THR 6 2.031 0.285 14.145 749 H ALA 7 H ALA 7 3.113 2.265 10.752 750 HA ALA 7 HA ALA 7 0.438 1.514 10.440 751 HB1 ALA 7 HB1 ALA 7 1.490 3.706 9.702 752 HB2 ALA 7 HB2 ALA 7 0.406 2.966 8.530 753 HB3 ALA 7 HB3 ALA 7 2.136 2.835 8.310 754 H MET 8 H MET 8 3.312 0.670 8.545 755 HA MET 8 HA MET 8 1.925 -0.979 6.691 756 HB2 MET 8 HB3 MET 8 4.827 -1.049 7.556 757 HB3 MET 8 HB2 MET 8 4.181 -1.935 6.180 758 HG2 MET 8 HG3 MET 8 4.245 1.089 6.504 759 HG3 MET 8 HG2 MET 8 5.147 0.122 5.356 760 HE1 MET 8 HE1 MET 8 2.523 -1.986 4.122 761 HE2 MET 8 HE2 MET 8 4.226 -1.516 3.992 762 HE3 MET 8 HE3 MET 8 3.082 -0.986 2.770 763 H GLU 9 H GLU 9 3.489 -1.659 9.812 764 HA GLU 9 HA GLU 9 2.956 -4.435 9.700 765 HB2 GLU 9 HB3 GLU 9 3.401 -2.601 12.065 766 HB3 GLU 9 HB2 GLU 9 3.159 -4.326 12.243 767 HG2 GLU 9 HG3 GLU 9 5.156 -4.710 10.702 768 HG3 GLU 9 HG2 GLU 9 5.356 -2.983 10.649 769 H THR 10 H THR 10 1.157 -1.623 10.804 770 HA THR 10 HA THR 10 -1.055 -2.981 11.929 771 HB THR 10 HB THR 10 -1.261 -0.338 10.428 772 HG1 THR 10 HG2 THR 10 0.531 -0.594 12.103 773 HG21 THR 10 HG21 THR 10 -3.025 0.115 12.009 774 HG22 THR 10 HG22 THR 10 -2.715 -1.395 12.871 775 HG23 THR 10 HG23 THR 10 -3.351 -1.430 11.237 776 H LEU 11 H LEU 11 -0.293 -1.944 8.638 777 HA LEU 11 HA LEU 11 -2.640 -2.945 7.380 778 HB2 LEU 11 HB3 LEU 11 0.158 -2.475 6.327 779 HB3 LEU 11 HB2 LEU 11 -1.173 -2.990 5.301 780 HG LEU 11 HG LEU 11 -1.269 -0.475 7.006 781 HD11 LEU 11 HD11 LEU 11 0.259 0.305 5.522 782 HD12 LEU 11 HD12 LEU 11 -1.120 0.397 4.430 783 HD13 LEU 11 HD13 LEU 11 -0.040 -0.980 4.353 784 HD21 LEU 11 HD21 LEU 11 -2.892 -0.536 4.595 785 HD22 LEU 11 HD22 LEU 11 -3.394 -0.279 6.248 786 HD23 LEU 11 HD23 LEU 11 -3.280 -1.920 5.610 787 H ILE 12 H ILE 12 0.526 -4.392 8.115 788 HA ILE 12 HA ILE 12 0.091 -6.881 6.835 789 HB ILE 12 HB ILE 12 1.780 -6.214 9.263 790 HG12 ILE 12 HG13 ILE 12 2.440 -5.175 7.018 791 HG13 ILE 12 HG12 ILE 12 3.654 -6.232 7.726 792 HG21 ILE 12 HG21 ILE 12 2.938 -8.430 8.561 793 HG22 ILE 12 HG22 ILE 12 1.406 -8.812 7.792 794 HG23 ILE 12 HG23 ILE 12 1.466 -8.526 9.518 795 HD11 ILE 12 HD11 ILE 12 2.969 -8.069 6.245 796 HD12 ILE 12 HD12 ILE 12 3.372 -6.639 5.322 797 HD13 ILE 12 HD13 ILE 12 1.694 -7.063 5.548 798 H ASN 13 H ASN 13 -0.564 -5.783 10.119 799 HA ASN 13 HA ASN 13 -1.278 -8.267 11.175 800 HB2 ASN 13 HB3 ASN 13 -2.054 -5.465 11.961 801 HB3 ASN 13 HB2 ASN 13 -2.716 -6.863 12.778 802 HD21 ASN 13 HD21 ASN 13 0.228 -5.029 12.292 803 HD22 ASN 13 HD22 ASN 13 1.163 -5.871 13.429 804 H VAL 14 H VAL 14 -3.372 -5.857 9.634 805 HA VAL 14 HA VAL 14 -5.750 -7.376 9.947 806 HB VAL 14 HB VAL 14 -4.983 -5.296 7.881 807 HG11 VAL 14 HG11 VAL 14 -7.349 -5.079 7.449 808 HG12 VAL 14 HG12 VAL 14 -7.722 -6.368 8.578 809 HG13 VAL 14 HG13 VAL 14 -6.858 -6.730 7.073 810 HG21 VAL 14 HG21 VAL 14 -6.363 -5.221 10.573 811 HG22 VAL 14 HG22 VAL 14 -6.626 -3.971 9.376 812 HG23 VAL 14 HG23 VAL 14 -4.994 -4.267 10.001 813 H PHE 15 H PHE 15 -3.440 -7.048 7.337 814 HA PHE 15 HA PHE 15 -4.572 -8.850 5.500 815 HB2 PHE 15 HB3 PHE 15 -2.795 -7.227 4.999 816 HB3 PHE 15 HB2 PHE 15 -1.669 -8.148 5.980 817 HD1 PHE 15 HD1 PHE 15 -3.645 -8.112 2.851 818 HD2 PHE 15 HD2 PHE 15 -0.751 -10.275 5.203 819 HE1 PHE 15 HE1 PHE 15 -3.106 -9.533 0.913 820 HE2 PHE 15 HE2 PHE 15 -0.235 -11.681 3.263 821 HZ PHE 15 HZ PHE 15 -1.402 -11.317 1.119 822 H HIS 16 H HIS 16 -2.052 -9.299 7.934 823 HA HIS 16 HA HIS 16 -1.724 -12.094 7.576 824 HB2 HIS 16 HB3 HIS 16 0.123 -10.941 8.478 825 HB3 HIS 16 HB2 HIS 16 -0.865 -10.136 9.685 826 HD1 HIS 16 HD1 HIS 16 -0.303 -13.926 8.901 827 HD2 HIS 16 HD2 HIS 16 -0.179 -11.142 12.030 828 HE1 HIS 16 HE1 HIS 16 0.298 -15.207 10.950 829 HE2 HIS 16 HE2 HIS 16 0.380 -13.549 12.904 830 H ALA 17 H ALA 17 -3.636 -10.186 9.901 831 HA ALA 17 HA ALA 17 -4.558 -12.387 11.410 832 HB1 ALA 17 HB1 ALA 17 -4.888 -10.064 12.158 833 HB2 ALA 17 HB2 ALA 17 -6.411 -10.944 12.064 834 HB3 ALA 17 HB3 ALA 17 -5.991 -9.783 10.805 835 H HIS 18 H HIS 18 -5.913 -10.717 8.583 836 HA HIS 18 HA HIS 18 -8.055 -12.558 8.278 837 HB2 HIS 18 HB3 HIS 18 -6.863 -10.518 6.402 838 HB3 HIS 18 HB2 HIS 18 -8.154 -11.621 5.909 839 HD1 HIS 18 HD1 HIS 18 -10.549 -11.317 6.997 840 HD2 HIS 18 HD2 HIS 18 -7.704 -8.552 8.375 841 HE1 HIS 18 HE1 HIS 18 -11.787 -9.558 8.278 842 HE2 HIS 18 HE2 HIS 18 -10.091 -7.880 9.127 843 H SER 19 H SER 19 -4.748 -12.491 7.099 844 HA SER 19 HA SER 19 -4.900 -14.684 5.308 845 HB2 SER 19 HB3 SER 19 -2.598 -14.124 7.235 846 HB3 SER 19 HB2 SER 19 -2.581 -15.060 5.764 847 HG SER 19 HG SER 19 -3.428 -12.370 5.655 848 H GLY 20 H GLY 20 -4.460 -14.390 8.793 849 HA2 GLY 20 HA3 GLY 20 -4.380 -17.147 9.429 850 HA3 GLY 20 HA2 GLY 20 -4.799 -15.840 10.544 851 H LYS 21 H LYS 21 -6.982 -14.815 9.172 852 HA LYS 21 HA LYS 21 -9.081 -16.461 10.125 853 HB2 LYS 21 HB3 LYS 21 -9.194 -14.256 8.038 854 HB3 LYS 21 HB2 LYS 21 -10.570 -14.952 8.842 855 HG2 LYS 21 HG3 LYS 21 -8.324 -13.631 10.394 856 HG3 LYS 21 HG2 LYS 21 -9.761 -12.766 9.859 857 HD2 LYS 21 HD3 LYS 21 -11.142 -14.406 11.173 858 HD3 LYS 21 HD2 LYS 21 -9.643 -15.159 11.715 859 HE2 LYS 21 HE2 LYS 21 -8.902 -13.075 12.791 860 HE3 LYS 21 HE1 LYS 21 -10.293 -12.229 12.149 861 HZ1 LYS 21 HZ1 LYS 21 -10.877 -14.602 13.755 862 HZ2 LYS 21 HZ2 LYS 21 -11.664 -13.101 13.674 863 HZ3 LYS 21 HZ3 LYS 21 -10.277 -13.259 14.579 864 H GLU 22 H GLU 22 -7.871 -15.867 6.825 865 HA GLU 22 HA GLU 22 -9.662 -17.753 5.608 866 HB2 GLU 22 HB3 GLU 22 -7.145 -16.466 4.485 867 HB3 GLU 22 HB2 GLU 22 -8.252 -17.467 3.615 868 HG2 GLU 22 HG3 GLU 22 -10.073 -15.936 3.940 869 HG3 GLU 22 HG2 GLU 22 -9.095 -14.995 5.071 870 H GLY 23 H GLY 23 -6.144 -17.878 6.364 871 HA2 GLY 23 HA3 GLY 23 -5.958 -20.448 7.224 872 HA3 GLY 23 HA2 GLY 23 -6.032 -20.636 5.488 873 H ASP 24 H ASP 24 -4.493 -18.449 4.614 874 HA ASP 24 HA ASP 24 -1.911 -19.560 4.905 875 HB2 ASP 24 HB3 ASP 24 -2.780 -18.166 2.918 876 HB3 ASP 24 HB2 ASP 24 -2.370 -16.761 3.896 877 H LYS 25 H LYS 25 -0.066 -18.778 5.886 878 HA LYS 25 HA LYS 25 -0.461 -17.466 8.394 879 HB2 LYS 25 HB3 LYS 25 2.156 -17.306 8.360 880 HB3 LYS 25 HB2 LYS 25 1.375 -18.877 8.474 881 HG2 LYS 25 HG3 LYS 25 1.643 -19.154 6.003 882 HG3 LYS 25 HG2 LYS 25 2.497 -17.623 5.951 883 HD2 LYS 25 HD3 LYS 25 4.241 -18.520 7.493 884 HD3 LYS 25 HD2 LYS 25 3.351 -20.009 7.624 885 HE2 LYS 25 HE2 LYS 25 5.160 -20.284 5.984 886 HE3 LYS 25 HE1 LYS 25 3.568 -20.418 5.247 887 HZ1 LYS 25 HZ1 LYS 25 3.764 -18.125 4.449 888 HZ2 LYS 25 HZ2 LYS 25 5.023 -19.083 3.939 889 HZ3 LYS 25 HZ3 LYS 25 5.318 -17.980 5.135 890 H TYR 26 H TYR 26 0.523 -16.386 5.236 891 HA TYR 26 HA TYR 26 -0.487 -13.841 5.906 892 HB2 TYR 26 HB3 TYR 26 1.682 -12.621 5.060 893 HB3 TYR 26 HB2 TYR 26 1.520 -13.077 6.755 894 HD1 TYR 26 HD1 TYR 26 2.621 -15.044 7.628 895 HD2 TYR 26 HD2 TYR 26 3.246 -13.775 3.599 896 HE1 TYR 26 HE1 TYR 26 4.638 -16.575 7.435 897 HE2 TYR 26 HE2 TYR 26 5.185 -15.256 3.407 898 HH TYR 26 HH TYR 26 6.810 -16.412 4.865 899 H LYS 27 H LYS 27 -1.829 -14.219 4.287 900 HA LYS 27 HA LYS 27 -1.189 -13.107 1.849 901 HB2 LYS 27 HB3 LYS 27 -1.993 -16.060 1.657 902 HB3 LYS 27 HB2 LYS 27 -2.141 -14.845 0.377 903 HG2 LYS 27 HG3 LYS 27 0.501 -15.434 1.685 904 HG3 LYS 27 HG2 LYS 27 -0.070 -16.319 0.300 905 HD2 LYS 27 HD3 LYS 27 0.015 -13.255 0.193 906 HD3 LYS 27 HD2 LYS 27 1.410 -14.222 -0.195 907 HE2 LYS 27 HE2 LYS 27 -1.265 -14.243 -1.582 908 HE3 LYS 27 HE1 LYS 27 0.294 -13.843 -2.259 909 HZ1 LYS 27 HZ1 LYS 27 -0.868 -16.452 -1.684 910 HZ2 LYS 27 HZ2 LYS 27 0.838 -16.315 -1.490 911 HZ3 LYS 27 HZ3 LYS 27 0.086 -15.944 -2.964 912 H LEU 28 H LEU 28 -3.263 -12.664 0.697 913 HA LEU 28 HA LEU 28 -5.535 -13.102 2.515 914 HB2 LEU 28 HB3 LEU 28 -4.638 -10.826 2.615 915 HB3 LEU 28 HB2 LEU 28 -4.920 -10.638 0.878 916 HG LEU 28 HG LEU 28 -7.358 -11.161 1.331 917 HD11 LEU 28 HD11 LEU 28 -7.469 -12.283 3.345 918 HD12 LEU 28 HD12 LEU 28 -7.875 -10.653 3.869 919 HD13 LEU 28 HD13 LEU 28 -6.252 -11.275 4.123 920 HD21 LEU 28 HD21 LEU 28 -6.605 -8.846 1.079 921 HD22 LEU 28 HD22 LEU 28 -6.123 -8.798 2.782 922 HD23 LEU 28 HD23 LEU 28 -7.824 -8.961 2.347 923 H SER 29 H SER 29 -7.322 -13.830 1.615 924 HA SER 29 HA SER 29 -7.260 -14.277 -1.275 925 HB2 SER 29 HB3 SER 29 -9.164 -15.518 0.671 926 HB3 SER 29 HB2 SER 29 -8.700 -16.084 -0.953 927 HG SER 29 HG SER 29 -7.166 -15.906 1.416 928 H LYS 30 H LYS 30 -9.684 -14.318 -2.102 929 HA LYS 30 HA LYS 30 -10.663 -11.639 -1.639 930 HB2 LYS 30 HB3 LYS 30 -11.926 -13.854 -3.282 931 HB3 LYS 30 HB2 LYS 30 -12.316 -12.135 -3.301 932 HG2 LYS 30 HG3 LYS 30 -9.608 -13.255 -3.943 933 HG3 LYS 30 HG2 LYS 30 -10.718 -12.854 -5.214 934 HD2 LYS 30 HD3 LYS 30 -10.190 -10.654 -3.189 935 HD3 LYS 30 HD2 LYS 30 -8.869 -11.091 -4.239 936 HE2 LYS 30 HE2 LYS 30 -11.333 -9.649 -4.873 937 HE3 LYS 30 HE1 LYS 30 -9.788 -9.631 -5.716 938 HZ1 LYS 30 HZ1 LYS 30 -10.484 -11.835 -6.728 939 HZ2 LYS 30 HZ2 LYS 30 -11.521 -10.546 -7.106 940 HZ3 LYS 30 HZ3 LYS 30 -11.968 -11.647 -5.934 941 H LYS 31 H LYS 31 -10.863 -14.408 -0.002 942 HA LYS 31 HA LYS 31 -13.528 -14.836 0.774 943 HB2 LYS 31 HB3 LYS 31 -11.018 -15.024 2.453 944 HB3 LYS 31 HB2 LYS 31 -12.535 -15.836 2.733 945 HG2 LYS 31 HG3 LYS 31 -12.338 -17.149 0.774 946 HG3 LYS 31 HG2 LYS 31 -10.944 -16.247 0.193 947 HD2 LYS 31 HD3 LYS 31 -9.734 -17.045 2.242 948 HD3 LYS 31 HD2 LYS 31 -11.104 -18.116 2.590 949 HE2 LYS 31 HE2 LYS 31 -9.607 -17.992 0.017 950 HE3 LYS 31 HE1 LYS 31 -9.192 -19.174 1.266 951 HZ1 LYS 31 HZ1 LYS 31 -11.801 -18.934 -0.201 952 HZ2 LYS 31 HZ2 LYS 31 -11.536 -19.991 1.099 953 HZ3 LYS 31 HZ3 LYS 31 -10.677 -20.179 -0.326 954 H GLU 32 H GLU 32 -10.899 -12.911 2.098 955 HA GLU 32 HA GLU 32 -12.700 -11.530 3.978 956 HB2 GLU 32 HB3 GLU 32 -9.716 -11.930 3.926 957 HB3 GLU 32 HB2 GLU 32 -10.616 -11.046 5.162 958 HG2 GLU 32 HG3 GLU 32 -11.162 -13.926 4.423 959 HG3 GLU 32 HG2 GLU 32 -10.072 -13.482 5.704 960 H LEU 33 H LEU 33 -10.423 -11.017 1.365 961 HA LEU 33 HA LEU 33 -9.649 -8.431 1.898 962 HB2 LEU 33 HB3 LEU 33 -8.581 -9.740 0.184 963 HB3 LEU 33 HB2 LEU 33 -10.042 -9.757 -0.792 964 HG LEU 33 HG LEU 33 -8.157 -8.098 -1.441 965 HD11 LEU 33 HD11 LEU 33 -10.595 -6.476 -1.190 966 HD12 LEU 33 HD12 LEU 33 -10.836 -8.060 -1.921 967 HD13 LEU 33 HD13 LEU 33 -9.679 -6.941 -2.611 968 HD21 LEU 33 HD21 LEU 33 -9.423 -6.281 0.619 969 HD22 LEU 33 HD22 LEU 33 -7.921 -6.099 -0.264 970 HD23 LEU 33 HD23 LEU 33 -8.010 -7.254 1.049 971 H LYS 34 H LYS 34 -12.392 -9.368 -0.167 972 HA LYS 34 HA LYS 34 -13.192 -6.647 -0.540 973 HB2 LYS 34 HB3 LYS 34 -15.103 -7.466 -1.668 974 HB3 LYS 34 HB2 LYS 34 -13.804 -8.557 -2.091 975 HG2 LYS 34 HG3 LYS 34 -14.583 -10.142 -0.313 976 HG3 LYS 34 HG2 LYS 34 -15.950 -9.069 0.009 977 HD2 LYS 34 HD3 LYS 34 -16.515 -9.288 -2.497 978 HD3 LYS 34 HD2 LYS 34 -15.346 -10.588 -2.532 979 HE2 LYS 34 HE2 LYS 34 -17.375 -11.684 -2.128 980 HE3 LYS 34 HE1 LYS 34 -16.615 -11.612 -0.541 981 HZ1 LYS 34 HZ1 LYS 34 -18.121 -10.112 0.216 982 HZ2 LYS 34 HZ2 LYS 34 -19.086 -10.815 -0.999 983 HZ3 LYS 34 HZ3 LYS 34 -18.315 -9.350 -1.287 984 H GLU 35 H GLU 35 -14.094 -9.168 1.699 985 HA GLU 35 HA GLU 35 -16.257 -7.837 2.964 986 HB2 GLU 35 HB3 GLU 35 -14.394 -10.005 3.966 987 HB3 GLU 35 HB2 GLU 35 -15.916 -9.517 4.713 988 HG2 GLU 35 HG3 GLU 35 -15.678 -10.563 1.873 989 HG3 GLU 35 HG2 GLU 35 -16.131 -11.553 3.236 990 H LEU 36 H LEU 36 -12.787 -8.127 3.730 991 HA LEU 36 HA LEU 36 -13.032 -6.525 6.072 992 HB2 LEU 36 HB3 LEU 36 -10.905 -7.113 6.605 993 HB3 LEU 36 HB2 LEU 36 -11.298 -8.444 5.542 994 HG LEU 36 HG LEU 36 -10.301 -6.884 3.641 995 HD11 LEU 36 HD11 LEU 36 -9.234 -5.010 4.278 996 HD12 LEU 36 HD12 LEU 36 -8.329 -5.876 5.511 997 HD13 LEU 36 HD13 LEU 36 -9.909 -5.217 5.891 998 HD21 LEU 36 HD21 LEU 36 -8.620 -8.282 5.736 999 HD22 LEU 36 HD22 LEU 36 -8.026 -7.771 4.174 1000 HD23 LEU 36 HD23 LEU 36 -9.316 -9.000 4.279 1001 H LEU 37 H LEU 37 -11.913 -5.941 2.773 1002 HA LEU 37 HA LEU 37 -10.639 -3.513 3.246 1003 HB2 LEU 37 HB3 LEU 37 -10.398 -4.645 1.124 1004 HB3 LEU 37 HB2 LEU 37 -12.113 -4.498 0.775 1005 HG LEU 37 HG LEU 37 -10.512 -2.864 -0.392 1006 HD11 LEU 37 HD11 LEU 37 -13.128 -2.616 0.188 1007 HD12 LEU 37 HD12 LEU 37 -12.202 -1.386 -0.654 1008 HD13 LEU 37 HD13 LEU 37 -12.516 -1.204 1.059 1009 HD21 LEU 37 HD21 LEU 37 -9.693 -0.998 0.797 1010 HD22 LEU 37 HD22 LEU 37 -9.262 -2.386 1.802 1011 HD23 LEU 37 HD23 LEU 37 -10.634 -1.365 2.235 1012 H GLN 38 H GLN 38 -14.009 -4.162 2.417 1013 HA GLN 38 HA GLN 38 -14.832 -1.453 2.526 1014 HB2 GLN 38 HB3 GLN 38 -17.124 -2.348 2.770 1015 HB3 GLN 38 HB2 GLN 38 -16.251 -3.191 1.496 1016 HG2 GLN 38 HG3 GLN 38 -15.774 -5.052 3.069 1017 HG3 GLN 38 HG2 GLN 38 -16.632 -4.188 4.347 1018 HE21 GLN 38 HE21 GLN 38 -18.050 -6.199 4.356 1019 HE22 GLN 38 HE22 GLN 38 -19.314 -6.267 3.240 1020 H THR 39 H THR 39 -14.621 -4.036 4.896 1021 HA THR 39 HA THR 39 -15.871 -2.693 7.003 1022 HB THR 39 HB THR 39 -13.815 -4.902 7.083 1023 HG1 THR 39 HG2 THR 39 -15.549 -5.709 5.994 1024 HG21 THR 39 HG21 THR 39 -15.682 -3.714 9.095 1025 HG22 THR 39 HG22 THR 39 -13.951 -4.040 9.215 1026 HG23 THR 39 HG23 THR 39 -15.103 -5.381 9.242 1027 H GLU 40 H GLU 40 -12.359 -3.164 6.365 1028 HA GLU 40 HA GLU 40 -11.520 -1.543 8.572 1029 HB2 GLU 40 HB3 GLU 40 -10.013 -2.515 6.143 1030 HB3 GLU 40 HB2 GLU 40 -9.279 -1.707 7.527 1031 HG2 GLU 40 HG3 GLU 40 -10.849 -4.312 7.680 1032 HG3 GLU 40 HG2 GLU 40 -9.097 -4.164 7.707 1033 H LEU 41 H LEU 41 -11.888 -0.860 5.121 1034 HA LEU 41 HA LEU 41 -11.105 1.914 5.635 1035 HB2 LEU 41 HB3 LEU 41 -11.422 0.288 3.136 1036 HB3 LEU 41 HB2 LEU 41 -11.511 2.021 3.049 1037 HG LEU 41 HG LEU 41 -9.304 2.262 4.167 1038 HD11 LEU 41 HD11 LEU 41 -7.908 0.128 4.323 1039 HD12 LEU 41 HD12 LEU 41 -9.429 -0.758 4.236 1040 HD13 LEU 41 HD13 LEU 41 -9.136 0.382 5.553 1041 HD21 LEU 41 HD21 LEU 41 -8.457 0.375 2.121 1042 HD22 LEU 41 HD22 LEU 41 -8.292 2.123 2.148 1043 HD23 LEU 41 HD23 LEU 41 -9.771 1.387 1.528 1044 H SER 42 H SER 42 -13.466 1.014 6.792 1045 HA SER 42 HA SER 42 -15.791 1.400 5.366 1046 HB2 SER 42 HB3 SER 42 -16.388 2.286 7.925 1047 HB3 SER 42 HB2 SER 42 -16.462 0.634 7.338 1048 HG SER 42 HG SER 42 -14.571 0.188 8.281 1049 H GLY 43 H GLY 43 -13.651 3.793 6.825 1050 HA2 GLY 43 HA3 GLY 43 -15.368 6.058 6.581 1051 HA3 GLY 43 HA2 GLY 43 -13.627 6.057 6.768 1052 H PHE 44 H PHE 44 -12.686 4.799 4.641 1053 HA PHE 44 HA PHE 44 -12.999 6.708 2.514 1054 HB2 PHE 44 HB3 PHE 44 -11.547 4.069 2.635 1055 HB3 PHE 44 HB2 PHE 44 -11.664 4.989 1.142 1056 HD1 PHE 44 HD2 PHE 44 -11.099 7.640 1.489 1057 HD2 PHE 44 HD1 PHE 44 -9.687 4.412 3.921 1058 HE1 PHE 44 HE2 PHE 44 -9.206 9.047 2.242 1059 HE2 PHE 44 HE1 PHE 44 -7.776 5.840 4.686 1060 HZ PHE 44 HZ PHE 44 -7.547 8.138 3.844 1061 H LEU 45 H LEU 45 -14.073 3.430 3.096 1062 HA LEU 45 HA LEU 45 -15.154 2.818 0.648 1063 HB2 LEU 45 HB3 LEU 45 -15.198 1.015 2.051 1064 HB3 LEU 45 HB2 LEU 45 -15.653 1.983 3.439 1065 HG LEU 45 HG LEU 45 -17.919 2.187 2.655 1066 HD11 LEU 45 HD11 LEU 45 -16.801 1.445 0.104 1067 HD12 LEU 45 HD12 LEU 45 -18.436 1.956 0.488 1068 HD13 LEU 45 HD13 LEU 45 -18.022 0.249 0.545 1069 HD21 LEU 45 HD21 LEU 45 -16.660 -0.341 3.286 1070 HD22 LEU 45 HD22 LEU 45 -18.058 -0.608 2.264 1071 HD23 LEU 45 HD23 LEU 45 -18.236 0.261 3.783 1072 H ASP 46 H ASP 46 -16.680 4.472 3.356 1073 HA ASP 46 HA ASP 46 -19.135 4.877 2.055 1074 HB2 ASP 46 HB3 ASP 46 -19.053 5.160 4.361 1075 HB3 ASP 46 HB2 ASP 46 -17.786 6.372 4.290 1076 H ALA 47 H ALA 47 -16.216 6.871 2.223 1077 HA ALA 47 HA ALA 47 -17.250 9.036 0.723 1078 HB1 ALA 47 HB1 ALA 47 -14.369 8.194 1.096 1079 HB2 ALA 47 HB2 ALA 47 -15.273 9.304 2.126 1080 HB3 ALA 47 HB3 ALA 47 -14.927 9.738 0.461 1081 H GLN 48 H GLN 48 -15.498 6.146 -0.272 1082 HA GLN 48 HA GLN 48 -15.237 7.094 -2.968 1083 HB2 GLN 48 HB3 GLN 48 -14.568 4.588 -3.391 1084 HB3 GLN 48 HB2 GLN 48 -13.470 5.655 -2.533 1085 HG2 GLN 48 HG3 GLN 48 -13.670 4.509 -0.624 1086 HG3 GLN 48 HG2 GLN 48 -15.429 4.331 -0.766 1087 HE21 GLN 48 HE21 GLN 48 -16.192 2.417 -1.950 1088 HE22 GLN 48 HE22 GLN 48 -15.146 1.118 -2.249 1089 H LYS 49 H LYS 49 -17.897 5.845 -1.430 1090 HA LYS 49 HA LYS 49 -18.926 4.026 -3.306 1091 HB2 LYS 49 HB3 LYS 49 -20.482 6.009 -1.620 1092 HB3 LYS 49 HB2 LYS 49 -21.197 4.712 -2.552 1093 HG2 LYS 49 HG3 LYS 49 -19.687 3.089 -1.266 1094 HG3 LYS 49 HG2 LYS 49 -19.344 4.421 -0.168 1095 HD2 LYS 49 HD3 LYS 49 -22.220 3.800 -0.793 1096 HD3 LYS 49 HD2 LYS 49 -21.364 2.729 0.276 1097 HE2 LYS 49 HE2 LYS 49 -22.654 4.802 1.255 1098 HE3 LYS 49 HE1 LYS 49 -21.113 4.349 1.956 1099 HZ1 LYS 49 HZ1 LYS 49 -20.128 6.095 0.288 1100 HZ2 LYS 49 HZ2 LYS 49 -20.964 6.546 1.659 1101 HZ3 LYS 49 HZ3 LYS 49 -21.758 6.605 0.167 1102 H ASP 50 H ASP 50 -19.124 7.531 -3.203 1103 HA ASP 50 HA ASP 50 -20.549 7.565 -5.757 1104 HB2 ASP 50 HB3 ASP 50 -21.156 9.025 -3.723 1105 HB3 ASP 50 HB2 ASP 50 -19.757 10.001 -4.188 1106 H VAL 51 H VAL 51 -17.512 6.956 -5.319 1107 HA VAL 51 HA VAL 51 -16.486 9.054 -7.130 1108 HB VAL 51 HB VAL 51 -14.904 7.217 -5.324 1109 HG11 VAL 51 HG11 VAL 51 -13.593 8.051 -7.249 1110 HG12 VAL 51 HG12 VAL 51 -13.080 8.869 -5.793 1111 HG13 VAL 51 HG13 VAL 51 -14.143 9.690 -6.923 1112 HG21 VAL 51 HG21 VAL 51 -14.669 9.130 -3.849 1113 HG22 VAL 51 HG22 VAL 51 -16.402 8.894 -4.109 1114 HG23 VAL 51 HG23 VAL 51 -15.535 10.162 -4.968 1115 H ASP 52 H ASP 52 -17.339 5.776 -6.998 1116 HA ASP 52 HA ASP 52 -17.158 4.025 -8.453 1117 HB2 ASP 52 HB3 ASP 52 -18.010 5.797 -10.040 1118 HB3 ASP 52 HB2 ASP 52 -16.344 6.054 -10.534 1119 H ALA 53 H ALA 53 -14.390 6.105 -8.154 1120 HA ALA 53 HA ALA 53 -12.450 4.796 -9.571 1121 HB1 ALA 53 HB1 ALA 53 -10.854 5.527 -7.761 1122 HB2 ALA 53 HB2 ALA 53 -12.242 6.121 -6.859 1123 HB3 ALA 53 HB3 ALA 53 -11.853 6.799 -8.451 1124 H VAL 54 H VAL 54 -13.860 3.889 -6.503 1125 HA VAL 54 HA VAL 54 -12.041 1.848 -5.854 1126 HB VAL 54 HB VAL 54 -13.607 2.668 -4.180 1127 HG11 VAL 54 HG11 VAL 54 -16.009 2.045 -4.296 1128 HG12 VAL 54 HG12 VAL 54 -15.783 1.379 -5.887 1129 HG13 VAL 54 HG13 VAL 54 -15.589 3.117 -5.622 1130 HG21 VAL 54 HG21 VAL 54 -13.385 0.621 -3.190 1131 HG22 VAL 54 HG22 VAL 54 -13.140 -0.123 -4.755 1132 HG23 VAL 54 HG23 VAL 54 -14.763 0.042 -4.111 1133 H ASP 55 H ASP 55 -14.939 1.856 -7.868 1134 HA ASP 55 HA ASP 55 -15.142 -0.919 -8.280 1135 HB2 ASP 55 HB3 ASP 55 -16.870 0.615 -9.066 1136 HB3 ASP 55 HB2 ASP 55 -15.759 1.305 -10.233 1137 H LYS 56 H LYS 56 -13.379 1.518 -10.080 1138 HA LYS 56 HA LYS 56 -12.220 -0.219 -11.997 1139 HB2 LYS 56 HB3 LYS 56 -11.266 2.442 -10.946 1140 HB3 LYS 56 HB2 LYS 56 -10.559 1.586 -12.313 1141 HG2 LYS 56 HG3 LYS 56 -12.058 2.903 -13.452 1142 HG3 LYS 56 HG2 LYS 56 -13.070 1.500 -13.173 1143 HD2 LYS 56 HD3 LYS 56 -14.505 2.678 -11.877 1144 HD3 LYS 56 HD2 LYS 56 -13.213 3.311 -10.878 1145 HE2 LYS 56 HE2 LYS 56 -14.139 4.390 -13.542 1146 HE3 LYS 56 HE1 LYS 56 -14.363 5.142 -11.964 1147 HZ1 LYS 56 HZ1 LYS 56 -12.113 5.316 -13.682 1148 HZ2 LYS 56 HZ2 LYS 56 -11.614 4.706 -12.178 1149 HZ3 LYS 56 HZ3 LYS 56 -12.452 6.152 -12.287 1150 H VAL 57 H VAL 57 -11.082 0.939 -8.861 1151 HA VAL 57 HA VAL 57 -8.508 -0.277 -9.008 1152 HB VAL 57 HB VAL 57 -10.181 0.522 -6.602 1153 HG11 VAL 57 HG11 VAL 57 -8.427 -1.200 -6.107 1154 HG12 VAL 57 HG12 VAL 57 -8.125 0.345 -5.314 1155 HG13 VAL 57 HG13 VAL 57 -7.229 -0.100 -6.773 1156 HG21 VAL 57 HG21 VAL 57 -7.832 1.899 -7.951 1157 HG22 VAL 57 HG22 VAL 57 -8.740 2.517 -6.571 1158 HG23 VAL 57 HG23 VAL 57 -9.508 2.399 -8.145 1159 H MET 58 H MET 58 -11.601 -1.182 -7.628 1160 HA MET 58 HA MET 58 -10.892 -3.738 -6.692 1161 HB2 MET 58 HB3 MET 58 -12.952 -2.691 -5.976 1162 HB3 MET 58 HB2 MET 58 -13.502 -2.555 -7.642 1163 HG2 MET 58 HG3 MET 58 -13.599 -4.856 -7.899 1164 HG3 MET 58 HG2 MET 58 -12.934 -5.213 -6.286 1165 HE1 MET 58 HE1 MET 58 -15.370 -3.668 -8.477 1166 HE2 MET 58 HE2 MET 58 -16.231 -2.607 -7.384 1167 HE3 MET 58 HE3 MET 58 -16.951 -4.135 -7.828 1168 H LYS 59 H LYS 59 -12.118 -2.533 -9.778 1169 HA LYS 59 HA LYS 59 -12.459 -5.010 -11.031 1170 HB2 LYS 59 HB3 LYS 59 -13.482 -2.923 -11.853 1171 HB3 LYS 59 HB2 LYS 59 -11.877 -2.293 -12.270 1172 HG2 LYS 59 HG3 LYS 59 -12.996 -3.143 -14.202 1173 HG3 LYS 59 HG2 LYS 59 -11.634 -4.200 -13.834 1174 HD2 LYS 59 HD3 LYS 59 -13.060 -5.918 -12.951 1175 HD3 LYS 59 HD2 LYS 59 -14.395 -4.793 -12.740 1176 HE2 LYS 59 HE2 LYS 59 -14.346 -6.496 -14.751 1177 HE3 LYS 59 HE1 LYS 59 -15.017 -4.865 -14.891 1178 HZ1 LYS 59 HZ1 LYS 59 -12.149 -5.219 -15.463 1179 HZ2 LYS 59 HZ2 LYS 59 -13.300 -4.158 -16.160 1180 HZ3 LYS 59 HZ3 LYS 59 -13.273 -5.784 -16.597 1181 H GLU 60 H GLU 60 -9.751 -2.736 -10.987 1182 HA GLU 60 HA GLU 60 -8.074 -4.337 -12.652 1183 HB2 GLU 60 HB3 GLU 60 -7.461 -2.066 -10.755 1184 HB3 GLU 60 HB2 GLU 60 -6.253 -2.841 -11.765 1185 HG2 GLU 60 HG3 GLU 60 -7.538 -2.279 -13.799 1186 HG3 GLU 60 HG2 GLU 60 -8.801 -1.579 -12.789 1187 H LEU 61 H LEU 61 -8.342 -3.956 -9.150 1188 HA LEU 61 HA LEU 61 -6.204 -5.738 -8.533 1189 HB2 LEU 61 HB3 LEU 61 -8.409 -4.495 -6.954 1190 HB3 LEU 61 HB2 LEU 61 -7.615 -5.889 -6.256 1191 HG LEU 61 HG LEU 61 -6.601 -3.620 -5.649 1192 HD11 LEU 61 HD11 LEU 61 -5.093 -5.957 -6.723 1193 HD12 LEU 61 HD12 LEU 61 -5.212 -5.345 -5.082 1194 HD13 LEU 61 HD13 LEU 61 -4.207 -4.513 -6.255 1195 HD21 LEU 61 HD21 LEU 61 -5.462 -3.779 -8.480 1196 HD22 LEU 61 HD22 LEU 61 -5.144 -2.556 -7.271 1197 HD23 LEU 61 HD23 LEU 61 -6.730 -2.649 -7.999 1198 H ASP 62 H ASP 62 -9.645 -6.240 -9.016 1199 HA ASP 62 HA ASP 62 -9.830 -8.829 -8.031 1200 HB2 ASP 62 HB3 ASP 62 -11.751 -7.364 -8.792 1201 HB3 ASP 62 HB2 ASP 62 -11.355 -7.844 -10.443 1202 H GLU 63 H GLU 63 -8.483 -7.711 -11.026 1203 HA GLU 63 HA GLU 63 -8.420 -10.040 -12.582 1204 HB2 GLU 63 HB3 GLU 63 -6.344 -7.860 -12.218 1205 HB3 GLU 63 HB2 GLU 63 -6.285 -9.072 -13.482 1206 HG2 GLU 63 HG3 GLU 63 -8.654 -7.253 -13.066 1207 HG3 GLU 63 HG2 GLU 63 -7.271 -6.859 -14.084 1208 H ASN 64 H ASN 64 -5.941 -8.787 -10.407 1209 HA ASN 64 HA ASN 64 -4.405 -11.185 -10.254 1210 HB2 ASN 64 HB3 ASN 64 -4.542 -8.656 -8.736 1211 HB3 ASN 64 HB2 ASN 64 -3.575 -10.012 -8.069 1212 HD21 ASN 64 HD21 ASN 64 -2.247 -7.643 -8.767 1213 HD22 ASN 64 HD22 ASN 64 -1.382 -7.852 -10.211 1214 H GLY 65 H GLY 65 -6.940 -9.745 -8.306 1215 HA2 GLY 65 HA3 GLY 65 -6.846 -11.667 -6.219 1216 HA3 GLY 65 HA2 GLY 65 -8.181 -10.568 -6.528 1217 H ASP 66 H ASP 66 -6.845 -13.000 -8.718 1218 HA ASP 66 HA ASP 66 -9.387 -14.020 -9.434 1219 HB2 ASP 66 HB3 ASP 66 -7.218 -14.298 -10.759 1220 HB3 ASP 66 HB2 ASP 66 -6.773 -15.512 -9.576 1221 H GLY 67 H GLY 67 -6.942 -15.024 -7.154 1222 HA2 GLY 67 HA3 GLY 67 -8.963 -16.602 -5.685 1223 HA3 GLY 67 HA2 GLY 67 -7.370 -17.290 -6.004 1224 H GLU 68 H GLU 68 -5.510 -15.958 -5.325 1225 HA GLU 68 HA GLU 68 -5.958 -14.902 -2.629 1226 HB2 GLU 68 HB3 GLU 68 -3.439 -15.574 -4.148 1227 HB3 GLU 68 HB2 GLU 68 -3.452 -14.853 -2.547 1228 HG2 GLU 68 HG3 GLU 68 -4.624 -16.723 -1.627 1229 HG3 GLU 68 HG2 GLU 68 -4.824 -17.500 -3.178 1230 H VAL 69 H VAL 69 -5.164 -12.919 -1.990 1231 HA VAL 69 HA VAL 69 -4.227 -11.063 -4.016 1232 HB VAL 69 HB VAL 69 -6.456 -10.307 -3.716 1233 HG11 VAL 69 HG11 VAL 69 -6.138 -10.576 -0.711 1234 HG12 VAL 69 HG12 VAL 69 -6.978 -11.733 -1.750 1235 HG13 VAL 69 HG13 VAL 69 -7.588 -10.099 -1.589 1236 HG21 VAL 69 HG21 VAL 69 -5.041 -8.427 -3.553 1237 HG22 VAL 69 HG22 VAL 69 -4.577 -8.784 -1.878 1238 HG23 VAL 69 HG23 VAL 69 -6.199 -8.220 -2.253 1239 H ASP 70 H ASP 70 -2.294 -10.323 -3.388 1240 HA ASP 70 HA ASP 70 -1.354 -11.235 -0.817 1241 HB2 ASP 70 HB3 ASP 70 0.024 -11.747 -2.699 1242 HB3 ASP 70 HB2 ASP 70 0.089 -10.089 -3.187 1243 H PHE 71 H PHE 71 0.345 -9.775 0.268 1244 HA PHE 71 HA PHE 71 -0.995 -7.589 1.385 1245 HB2 PHE 71 HB3 PHE 71 0.913 -8.843 2.441 1246 HB3 PHE 71 HB2 PHE 71 1.982 -8.018 1.300 1247 HD1 PHE 71 HD1 PHE 71 -0.807 -7.160 3.630 1248 HD2 PHE 71 HD2 PHE 71 3.043 -6.023 2.092 1249 HE1 PHE 71 HE1 PHE 71 -0.775 -5.227 5.138 1250 HE2 PHE 71 HE2 PHE 71 3.067 -4.079 3.619 1251 HZ PHE 71 HZ PHE 71 1.169 -3.673 5.142 1252 H GLN 72 H GLN 72 1.470 -7.889 -1.089 1253 HA GLN 72 HA GLN 72 1.806 -5.139 -1.650 1254 HB2 GLN 72 HB3 GLN 72 2.295 -7.685 -3.148 1255 HB3 GLN 72 HB2 GLN 72 2.608 -6.100 -3.942 1256 HG2 GLN 72 HG3 GLN 72 4.125 -5.626 -2.011 1257 HG3 GLN 72 HG2 GLN 72 3.741 -7.234 -1.386 1258 HE21 GLN 72 HE21 GLN 72 5.570 -8.561 -1.801 1259 HE22 GLN 72 HE22 GLN 72 6.377 -8.592 -3.280 1260 H GLU 73 H GLU 73 -0.532 -7.544 -2.758 1261 HA GLU 73 HA GLU 73 -1.861 -5.792 -4.644 1262 HB2 GLU 73 HB3 GLU 73 -2.832 -8.279 -3.212 1263 HB3 GLU 73 HB2 GLU 73 -3.688 -7.390 -4.476 1264 HG2 GLU 73 HG3 GLU 73 -0.930 -8.589 -4.855 1265 HG3 GLU 73 HG2 GLU 73 -2.472 -9.329 -5.310 1266 H TYR 74 H TYR 74 -2.326 -6.763 -1.317 1267 HA TYR 74 HA TYR 74 -4.727 -5.455 -0.805 1268 HB2 TYR 74 HB3 TYR 74 -3.917 -7.167 0.693 1269 HB3 TYR 74 HB2 TYR 74 -2.486 -6.197 1.055 1270 HD1 TYR 74 HD1 TYR 74 -6.189 -5.485 0.964 1271 HD2 TYR 74 HD2 TYR 74 -2.529 -5.359 3.220 1272 HE1 TYR 74 HE1 TYR 74 -7.379 -4.408 2.842 1273 HE2 TYR 74 HE2 TYR 74 -3.731 -4.295 5.104 1274 HH TYR 74 HH TYR 74 -7.035 -4.227 5.405 1275 H VAL 75 H VAL 75 -1.406 -4.304 -0.275 1276 HA VAL 75 HA VAL 75 -2.235 -1.889 0.907 1277 HB VAL 75 HB VAL 75 0.092 -1.079 0.432 1278 HG11 VAL 75 HG11 VAL 75 0.965 -2.362 2.210 1279 HG12 VAL 75 HG12 VAL 75 0.156 -3.831 1.676 1280 HG13 VAL 75 HG13 VAL 75 -0.766 -2.556 2.443 1281 HG21 VAL 75 HG21 VAL 75 0.048 -3.206 -1.468 1282 HG22 VAL 75 HG22 VAL 75 1.127 -3.715 -0.199 1283 HG23 VAL 75 HG23 VAL 75 1.418 -2.194 -1.038 1284 H VAL 76 H VAL 76 -1.525 -2.726 -2.470 1285 HA VAL 76 HA VAL 76 -1.774 -0.063 -3.352 1286 HB VAL 76 HB VAL 76 -1.898 -0.965 -5.583 1287 HG11 VAL 76 HG11 VAL 76 0.146 -2.406 -3.871 1288 HG12 VAL 76 HG12 VAL 76 0.305 -0.771 -4.510 1289 HG13 VAL 76 HG13 VAL 76 0.280 -2.141 -5.605 1290 HG21 VAL 76 HG21 VAL 76 -3.320 -2.974 -4.953 1291 HG22 VAL 76 HG22 VAL 76 -1.831 -3.724 -4.351 1292 HG23 VAL 76 HG23 VAL 76 -1.989 -3.314 -6.055 1293 H LEU 77 H LEU 77 -4.070 -2.690 -2.879 1294 HA LEU 77 HA LEU 77 -6.255 -1.486 -4.203 1295 HB2 LEU 77 HB3 LEU 77 -6.371 -3.816 -3.472 1296 HB3 LEU 77 HB2 LEU 77 -6.209 -3.327 -1.796 1297 HG LEU 77 HG LEU 77 -8.360 -2.114 -1.891 1298 HD11 LEU 77 HD11 LEU 77 -8.177 -2.790 -4.798 1299 HD12 LEU 77 HD12 LEU 77 -8.691 -1.304 -3.997 1300 HD13 LEU 77 HD13 LEU 77 -9.766 -2.681 -4.043 1301 HD21 LEU 77 HD21 LEU 77 -8.337 -5.008 -2.785 1302 HD22 LEU 77 HD22 LEU 77 -9.843 -4.147 -2.504 1303 HD23 LEU 77 HD23 LEU 77 -8.691 -4.339 -1.186 1304 H VAL 78 H VAL 78 -5.224 -1.324 -0.791 1305 HA VAL 78 HA VAL 78 -7.222 0.631 -0.200 1306 HB VAL 78 HB VAL 78 -6.190 0.838 1.988 1307 HG11 VAL 78 HG11 VAL 78 -6.896 -1.245 2.678 1308 HG12 VAL 78 HG12 VAL 78 -5.837 -2.076 1.542 1309 HG13 VAL 78 HG13 VAL 78 -7.359 -1.428 0.982 1310 HG21 VAL 78 HG21 VAL 78 -4.040 -1.004 0.941 1311 HG22 VAL 78 HG22 VAL 78 -4.118 -0.317 2.551 1312 HG23 VAL 78 HG23 VAL 78 -3.769 0.723 1.174 1313 H ALA 79 H ALA 79 -3.772 0.806 -1.002 1314 HA ALA 79 HA ALA 79 -3.553 3.604 -0.619 1315 HB1 ALA 79 HB1 ALA 79 -1.609 3.431 -2.228 1316 HB2 ALA 79 HB2 ALA 79 -1.992 1.722 -2.356 1317 HB3 ALA 79 HB3 ALA 79 -1.519 2.413 -0.791 1318 H ALA 80 H ALA 80 -4.389 1.674 -3.479 1319 HA ALA 80 HA ALA 80 -4.440 3.786 -5.265 1320 HB1 ALA 80 HB1 ALA 80 -4.601 1.560 -6.142 1321 HB2 ALA 80 HB2 ALA 80 -6.114 2.358 -6.534 1322 HB3 ALA 80 HB3 ALA 80 -6.039 1.226 -5.181 1323 H LEU 81 H LEU 81 -6.912 2.412 -3.130 1324 HA LEU 81 HA LEU 81 -9.013 4.207 -3.761 1325 HB2 LEU 81 HB3 LEU 81 -8.389 2.640 -1.238 1326 HB3 LEU 81 HB2 LEU 81 -9.878 3.530 -1.498 1327 HG LEU 81 HG LEU 81 -8.893 1.331 -3.346 1328 HD11 LEU 81 HD11 LEU 81 -10.690 -0.027 -2.333 1329 HD12 LEU 81 HD12 LEU 81 -10.991 1.236 -1.155 1330 HD13 LEU 81 HD13 LEU 81 -9.441 0.378 -1.164 1331 HD21 LEU 81 HD21 LEU 81 -11.365 1.428 -3.977 1332 HD22 LEU 81 HD22 LEU 81 -10.384 2.760 -4.575 1333 HD23 LEU 81 HD23 LEU 81 -11.432 2.981 -3.162 1334 H THR 82 H THR 82 -6.406 4.223 -1.362 1335 HA THR 82 HA THR 82 -7.170 6.590 -0.050 1336 HB THR 82 HB THR 82 -4.350 5.613 -0.400 1337 HG1 THR 82 HG2 THR 82 -5.873 3.937 0.338 1338 HG21 THR 82 HG21 THR 82 -5.745 7.197 1.773 1339 HG22 THR 82 HG22 THR 82 -4.483 7.765 0.673 1340 HG23 THR 82 HG23 THR 82 -4.102 6.575 1.904 1341 H VAL 83 H VAL 83 -4.819 6.052 -2.699 1342 HA VAL 83 HA VAL 83 -4.152 8.774 -2.959 1343 HB VAL 83 HB VAL 83 -2.893 6.663 -3.870 1344 HG11 VAL 83 HG11 VAL 83 -4.708 5.858 -5.291 1345 HG12 VAL 83 HG12 VAL 83 -3.234 6.178 -6.184 1346 HG13 VAL 83 HG13 VAL 83 -4.577 7.305 -6.301 1347 HG21 VAL 83 HG21 VAL 83 -2.137 9.070 -4.143 1348 HG22 VAL 83 HG22 VAL 83 -3.049 9.122 -5.650 1349 HG23 VAL 83 HG23 VAL 83 -1.706 8.005 -5.477 1350 H ALA 84 H ALA 84 -6.540 6.763 -4.656 1351 HA ALA 84 HA ALA 84 -7.420 8.714 -6.479 1352 HB1 ALA 84 HB1 ALA 84 -9.484 7.416 -6.604 1353 HB2 ALA 84 HB2 ALA 84 -9.031 6.520 -5.153 1354 HB3 ALA 84 HB3 ALA 84 -8.087 6.341 -6.631 1355 H MET 85 H MET 85 -8.679 7.844 -3.267 1356 HA MET 85 HA MET 85 -10.558 9.979 -3.174 1357 HB2 MET 85 HB3 MET 85 -9.303 8.418 -0.908 1358 HB3 MET 85 HB2 MET 85 -10.673 9.504 -0.736 1359 HG2 MET 85 HG3 MET 85 -10.611 6.991 -2.459 1360 HG3 MET 85 HG2 MET 85 -11.494 7.207 -0.951 1361 HE1 MET 85 HE1 MET 85 -12.645 10.403 -1.458 1362 HE2 MET 85 HE2 MET 85 -13.031 8.995 -0.482 1363 HE3 MET 85 HE3 MET 85 -14.222 9.622 -1.621 1364 H ASN 86 H ASN 86 -7.233 9.636 -2.003 1365 HA ASN 86 HA ASN 86 -7.148 12.159 -0.749 1366 HB2 ASN 86 HB3 ASN 86 -4.986 10.276 -1.637 1367 HB3 ASN 86 HB2 ASN 86 -4.663 11.972 -1.285 1368 HD21 ASN 86 HD21 ASN 86 -6.015 9.048 0.260 1369 HD22 ASN 86 HD22 ASN 86 -5.770 9.638 1.847 1370 H ASN 87 H ASN 87 -6.444 11.196 -4.066 1371 HA ASN 87 HA ASN 87 -5.376 13.650 -4.873 1372 HB2 ASN 87 HB3 ASN 87 -5.353 11.735 -6.379 1373 HB3 ASN 87 HB2 ASN 87 -7.103 11.732 -6.483 1374 HD21 ASN 87 HD21 ASN 87 -7.995 14.108 -7.167 1375 HD22 ASN 87 HD22 ASN 87 -7.146 14.823 -8.440 1376 H PHE 88 H PHE 88 -8.728 12.555 -4.643 1377 HA PHE 88 HA PHE 88 -9.893 15.051 -5.460 1378 HB2 PHE 88 HB3 PHE 88 -11.039 12.762 -3.815 1379 HB3 PHE 88 HB2 PHE 88 -11.928 14.172 -4.324 1380 HD1 PHE 88 HD1 PHE 88 -11.806 14.749 -6.937 1381 HD2 PHE 88 HD2 PHE 88 -11.061 10.870 -5.236 1382 HE1 PHE 88 HE1 PHE 88 -12.285 13.696 -9.118 1383 HE2 PHE 88 HE2 PHE 88 -11.542 9.822 -7.438 1384 HZ PHE 88 HZ PHE 88 -12.153 11.230 -9.368 1385 H PHE 89 H PHE 89 -9.070 13.519 -2.359 1386 HA PHE 89 HA PHE 89 -10.331 15.145 -0.599 1387 HB2 PHE 89 HB3 PHE 89 -8.813 13.041 -0.343 1388 HB3 PHE 89 HB2 PHE 89 -7.569 14.222 0.059 1389 HD1 PHE 89 HD1 PHE 89 -8.094 15.923 1.937 1390 HD2 PHE 89 HD2 PHE 89 -10.418 12.435 1.112 1391 HE1 PHE 89 HE1 PHE 89 -9.085 16.057 4.210 1392 HE2 PHE 89 HE2 PHE 89 -11.430 12.557 3.344 1393 HZ PHE 89 HZ PHE 89 -10.763 14.378 4.924 1394 H TRP 90 H TRP 90 -7.005 15.552 -1.742 1395 HA TRP 90 HA TRP 90 -6.495 17.924 -0.229 1396 HB2 TRP 90 HB3 TRP 90 -5.171 16.871 -2.719 1397 HB3 TRP 90 HB2 TRP 90 -4.515 18.175 -1.710 1398 HD1 TRP 90 HD TRP 90 -4.656 14.498 -1.991 1399 HE1 TRP 90 HE1 TRP 90 -3.742 13.389 0.083 1400 HE3 TRP 90 HE3 TRP 90 -4.341 18.551 1.057 1401 HZ2 TRP 90 HZ2 TRP 90 -2.934 14.100 2.752 1402 HZ3 TRP 90 HZ3 TRP 90 -3.489 18.315 3.383 1403 HH2 TRP 90 HH TRP 90 -2.784 16.089 4.231 1404 H GLU 91 H GLU 91 -7.597 17.295 -3.364 1405 HA GLU 91 HA GLU 91 -7.801 20.044 -4.243 1406 HB2 GLU 91 HB3 GLU 91 -9.295 17.597 -5.173 1407 HB3 GLU 91 HB2 GLU 91 -9.348 19.162 -5.953 1408 HG2 GLU 91 HG3 GLU 91 -6.873 19.116 -6.262 1409 HG3 GLU 91 HG2 GLU 91 -6.832 17.546 -5.514 1410 H ASN 92 H ASN 92 -9.928 17.708 -2.713 1411 HA ASN 92 HA ASN 92 -12.333 18.922 -2.948 1412 HB2 ASN 92 HB3 ASN 92 -12.147 16.711 -1.989 1413 HB3 ASN 92 HB2 ASN 92 -11.365 17.373 -0.546 1414 HD21 ASN 92 HD21 ASN 92 -14.445 17.543 -2.388 1415 HD22 ASN 92 HD22 ASN 92 -15.384 17.940 -1.039 1416 H SER 93 H SER 93 -12.992 20.836 -2.483 1417 HA SER 93 HA SER 93 -12.983 22.105 -0.008 1418 HB2 SER 93 HB3 SER 93 -10.641 22.623 -1.792 1419 HB3 SER 93 HB2 SER 93 -11.311 23.971 -0.873 1420 HG SER 93 HG SER 93 -10.578 21.422 0.129 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -11.724 6.304 8.641 2 HA2 GLY 1 HA3 GLY 1 -10.438 7.435 10.288 3 HA3 GLY 1 HA2 GLY 1 -11.775 7.248 11.428 4 H SER 2 H SER 2 -10.986 4.475 9.612 5 HA SER 2 HA SER 2 -10.343 2.945 11.920 6 HB2 SER 2 HB3 SER 2 -9.568 1.827 9.304 7 HB3 SER 2 HB2 SER 2 -10.587 1.180 10.570 8 HG SER 2 HG SER 2 -11.344 2.118 8.331 9 H GLU 3 H GLU 3 -8.345 1.621 12.117 10 HA GLU 3 HA GLU 3 -6.029 3.159 12.195 11 HB2 GLU 3 HB3 GLU 3 -6.440 0.162 12.164 12 HB3 GLU 3 HB2 GLU 3 -4.893 0.948 12.408 13 HG2 GLU 3 HG3 GLU 3 -5.592 0.628 14.552 14 HG3 GLU 3 HG2 GLU 3 -6.038 2.302 14.274 15 H LEU 4 H LEU 4 -7.329 0.950 9.781 16 HA LEU 4 HA LEU 4 -5.087 0.863 8.035 17 HB2 LEU 4 HB3 LEU 4 -8.051 0.500 7.641 18 HB3 LEU 4 HB2 LEU 4 -6.976 0.557 6.266 19 HG LEU 4 HG LEU 4 -7.502 -1.782 7.312 20 HD11 LEU 4 HD11 LEU 4 -4.965 -0.676 6.301 21 HD12 LEU 4 HD12 LEU 4 -6.025 -1.913 5.641 22 HD13 LEU 4 HD13 LEU 4 -4.939 -2.310 6.969 23 HD21 LEU 4 HD21 LEU 4 -5.670 -2.372 8.936 24 HD22 LEU 4 HD22 LEU 4 -7.007 -1.485 9.623 25 HD23 LEU 4 HD23 LEU 4 -5.466 -0.672 9.323 26 H GLU 5 H GLU 5 -7.867 3.067 8.178 27 HA GLU 5 HA GLU 5 -6.934 4.661 6.011 28 HB2 GLU 5 HB3 GLU 5 -8.862 5.285 8.279 29 HB3 GLU 5 HB2 GLU 5 -8.525 6.372 6.940 30 HG2 GLU 5 HG3 GLU 5 -9.278 4.647 5.328 31 HG3 GLU 5 HG2 GLU 5 -9.576 3.537 6.659 32 H THR 6 H THR 6 -6.562 4.736 9.482 33 HA THR 6 HA THR 6 -5.087 7.149 9.678 34 HB THR 6 HB THR 6 -4.713 4.751 11.473 35 HG1 THR 6 HG2 THR 6 -7.007 5.247 11.029 36 HG21 THR 6 HG21 THR 6 -4.803 7.715 12.043 37 HG22 THR 6 HG22 THR 6 -3.329 6.827 11.722 38 HG23 THR 6 HG23 THR 6 -4.308 6.426 13.144 39 H ALA 7 H ALA 7 -4.020 3.744 9.430 40 HA ALA 7 HA ALA 7 -1.247 4.259 9.358 41 HB1 ALA 7 HB1 ALA 7 -1.709 2.009 9.715 42 HB2 ALA 7 HB2 ALA 7 -1.299 1.993 8.009 43 HB3 ALA 7 HB3 ALA 7 -2.983 1.953 8.502 44 H MET 8 H MET 8 -3.621 3.833 6.756 45 HA MET 8 HA MET 8 -1.737 4.236 4.705 46 HB2 MET 8 HB3 MET 8 -4.739 4.646 4.667 47 HB3 MET 8 HB2 MET 8 -3.711 4.618 3.236 48 HG2 MET 8 HG3 MET 8 -4.074 2.297 5.191 49 HG3 MET 8 HG2 MET 8 -4.682 2.380 3.546 50 HE1 MET 8 HE1 MET 8 -3.475 2.830 1.715 51 HE2 MET 8 HE2 MET 8 -2.232 1.648 1.300 52 HE3 MET 8 HE3 MET 8 -1.754 3.294 1.729 53 H GLU 9 H GLU 9 -3.834 6.506 6.484 54 HA GLU 9 HA GLU 9 -3.072 8.742 4.978 55 HB2 GLU 9 HB3 GLU 9 -4.192 8.487 7.741 56 HB3 GLU 9 HB2 GLU 9 -3.667 10.063 7.156 57 HG2 GLU 9 HG3 GLU 9 -5.163 9.735 5.160 58 HG3 GLU 9 HG2 GLU 9 -5.724 8.237 5.893 59 H THR 10 H THR 10 -1.623 7.108 7.675 60 HA THR 10 HA THR 10 0.349 9.019 8.337 61 HB THR 10 HB THR 10 0.730 6.004 8.395 62 HG1 THR 10 HG2 THR 10 -1.298 6.836 9.405 63 HG21 THR 10 HG21 THR 10 2.710 6.668 9.202 64 HG22 THR 10 HG22 THR 10 1.855 7.099 10.671 65 HG23 THR 10 HG23 THR 10 2.197 8.327 9.459 66 H LEU 11 H LEU 11 0.239 6.427 5.939 67 HA LEU 11 HA LEU 11 2.796 6.967 4.790 68 HB2 LEU 11 HB3 LEU 11 0.348 5.564 3.701 69 HB3 LEU 11 HB2 LEU 11 1.859 5.669 2.802 70 HG LEU 11 HG LEU 11 1.632 4.464 5.593 71 HD11 LEU 11 HD11 LEU 11 1.972 2.321 4.369 72 HD12 LEU 11 HD12 LEU 11 1.568 3.158 2.872 73 HD13 LEU 11 HD13 LEU 11 0.369 3.025 4.180 74 HD21 LEU 11 HD21 LEU 11 3.880 3.943 5.417 75 HD22 LEU 11 HD22 LEU 11 3.941 5.349 4.345 76 HD23 LEU 11 HD23 LEU 11 3.786 3.740 3.686 77 H ILE 12 H ILE 12 -0.460 8.125 4.105 78 HA ILE 12 HA ILE 12 0.117 9.567 1.753 79 HB ILE 12 HB ILE 12 -1.924 10.076 3.931 80 HG12 ILE 12 HG13 ILE 12 -2.064 7.909 2.566 81 HG13 ILE 12 HG12 ILE 12 -3.484 8.939 2.492 82 HG21 ILE 12 HG21 ILE 12 -1.852 12.148 2.926 83 HG22 ILE 12 HG22 ILE 12 -3.096 11.328 2.004 84 HG23 ILE 12 HG23 ILE 12 -1.480 11.495 1.328 85 HD11 ILE 12 HD11 ILE 12 -2.160 7.940 0.313 86 HD12 ILE 12 HD12 ILE 12 -1.483 9.561 0.384 87 HD13 ILE 12 HD13 ILE 12 -3.235 9.313 0.304 88 H ASN 13 H ASN 13 0.174 10.483 5.144 89 HA ASN 13 HA ASN 13 0.698 13.209 4.828 90 HB2 ASN 13 HB3 ASN 13 1.324 11.285 7.052 91 HB3 ASN 13 HB2 ASN 13 1.706 12.998 7.151 92 HD21 ASN 13 HD21 ASN 13 -0.691 10.889 7.990 93 HD22 ASN 13 HD22 ASN 13 -2.019 11.949 7.956 94 H VAL 14 H VAL 14 2.941 10.486 5.183 95 HA VAL 14 HA VAL 14 5.309 12.043 5.025 96 HB VAL 14 HB VAL 14 4.784 9.111 4.426 97 HG11 VAL 14 HG11 VAL 14 6.769 9.661 3.255 98 HG12 VAL 14 HG12 VAL 14 7.327 8.979 4.788 99 HG13 VAL 14 HG13 VAL 14 7.333 10.720 4.545 100 HG21 VAL 14 HG21 VAL 14 4.691 8.996 6.695 101 HG22 VAL 14 HG22 VAL 14 5.135 10.684 6.862 102 HG23 VAL 14 HG23 VAL 14 6.385 9.462 6.726 103 H PHE 15 H PHE 15 3.310 10.342 2.681 104 HA PHE 15 HA PHE 15 4.870 10.697 0.395 105 HB2 PHE 15 HB3 PHE 15 2.823 9.289 0.537 106 HB3 PHE 15 HB2 PHE 15 1.840 10.744 0.585 107 HD1 PHE 15 HD1 PHE 15 4.014 8.617 -1.492 108 HD2 PHE 15 HD2 PHE 15 1.560 12.145 -1.410 109 HE1 PHE 15 HE1 PHE 15 4.044 8.697 -3.964 110 HE2 PHE 15 HE2 PHE 15 1.594 12.218 -3.892 111 HZ PHE 15 HZ PHE 15 2.834 10.489 -5.162 112 H HIS 16 H HIS 16 2.316 12.770 1.758 113 HA HIS 16 HA HIS 16 2.516 14.868 -0.123 114 HB2 HIS 16 HB3 HIS 16 1.331 14.597 2.577 115 HB3 HIS 16 HB2 HIS 16 1.730 16.227 2.061 116 HD1 HIS 16 HD1 HIS 16 0.220 17.324 0.403 117 HD2 HIS 16 HD2 HIS 16 -0.463 13.225 0.660 118 HE1 HIS 16 HE1 HIS 16 -1.800 16.859 -1.025 119 HE2 HIS 16 HE2 HIS 16 -2.254 14.372 -0.862 120 H ALA 17 H ALA 17 4.152 14.389 2.965 121 HA ALA 17 HA ALA 17 5.485 16.846 3.102 122 HB1 ALA 17 HB1 ALA 17 5.532 15.328 4.987 123 HB2 ALA 17 HB2 ALA 17 7.180 15.657 4.476 124 HB3 ALA 17 HB3 ALA 17 6.417 14.123 4.051 125 H HIS 18 H HIS 18 6.491 13.821 1.605 126 HA HIS 18 HA HIS 18 8.864 14.964 0.520 127 HB2 HIS 18 HB3 HIS 18 7.464 12.357 -0.033 128 HB3 HIS 18 HB2 HIS 18 8.917 12.905 -0.899 129 HD1 HIS 18 HD1 HIS 18 11.155 13.167 0.468 130 HD2 HIS 18 HD2 HIS 18 7.931 11.628 2.660 131 HE1 HIS 18 HE1 HIS 18 12.094 12.344 2.658 132 HE2 HIS 18 HE2 HIS 18 10.177 11.381 4.008 133 H SER 19 H SER 19 5.572 14.542 -0.763 134 HA SER 19 HA SER 19 6.089 15.392 -3.408 135 HB2 SER 19 HB3 SER 19 3.689 15.954 -1.614 136 HB3 SER 19 HB2 SER 19 3.723 16.312 -3.326 137 HG SER 19 HG SER 19 4.425 13.969 -3.418 138 H GLY 20 H GLY 20 5.643 17.124 -0.393 139 HA2 GLY 20 HA3 GLY 20 5.824 19.778 -1.348 140 HA3 GLY 20 HA2 GLY 20 6.279 19.224 0.252 141 H LYS 21 H LYS 21 8.262 17.390 -0.348 142 HA LYS 21 HA LYS 21 10.525 19.092 -0.665 143 HB2 LYS 21 HB3 LYS 21 10.341 16.068 -0.674 144 HB3 LYS 21 HB2 LYS 21 11.832 16.980 -0.615 145 HG2 LYS 21 HG3 LYS 21 11.118 18.080 1.474 146 HG3 LYS 21 HG2 LYS 21 9.612 17.160 1.440 147 HD2 LYS 21 HD3 LYS 21 11.005 15.049 1.454 148 HD3 LYS 21 HD2 LYS 21 12.426 16.053 1.736 149 HE2 LYS 21 HE2 LYS 21 10.003 15.738 3.516 150 HE3 LYS 21 HE1 LYS 21 11.674 15.300 3.879 151 HZ1 LYS 21 HZ1 LYS 21 12.231 17.709 3.750 152 HZ2 LYS 21 HZ2 LYS 21 11.069 17.340 4.934 153 HZ3 LYS 21 HZ3 LYS 21 10.582 18.031 3.479 154 H GLU 22 H GLU 22 9.030 16.622 -2.757 155 HA GLU 22 HA GLU 22 11.012 16.879 -4.748 156 HB2 GLU 22 HB3 GLU 22 9.979 15.196 -5.908 157 HB3 GLU 22 HB2 GLU 22 9.331 14.889 -4.328 158 HG2 GLU 22 HG3 GLU 22 7.362 14.875 -5.492 159 HG3 GLU 22 HG2 GLU 22 7.406 16.605 -5.218 160 H GLY 23 H GLY 23 7.925 18.426 -4.358 161 HA2 GLY 23 HA3 GLY 23 8.006 20.788 -5.120 162 HA3 GLY 23 HA2 GLY 23 8.597 20.198 -6.660 163 H ASP 24 H ASP 24 6.694 17.903 -6.626 164 HA ASP 24 HA ASP 24 4.592 19.151 -8.058 165 HB2 ASP 24 HB3 ASP 24 5.368 16.762 -8.351 166 HB3 ASP 24 HB2 ASP 24 4.477 16.402 -6.874 167 H LYS 25 H LYS 25 2.367 19.219 -7.628 168 HA LYS 25 HA LYS 25 1.640 20.204 -5.091 169 HB2 LYS 25 HB3 LYS 25 -0.677 19.837 -5.868 170 HB3 LYS 25 HB2 LYS 25 0.293 20.846 -6.955 171 HG2 LYS 25 HG3 LYS 25 0.724 18.715 -8.339 172 HG3 LYS 25 HG2 LYS 25 -0.422 17.892 -7.300 173 HD2 LYS 25 HD3 LYS 25 -2.175 19.507 -7.937 174 HD3 LYS 25 HD2 LYS 25 -1.031 20.316 -8.991 175 HE2 LYS 25 HE2 LYS 25 -0.953 18.571 -10.531 176 HE3 LYS 25 HE1 LYS 25 -1.435 17.344 -9.368 177 HZ1 LYS 25 HZ1 LYS 25 -3.143 17.997 -11.038 178 HZ2 LYS 25 HZ2 LYS 25 -3.257 19.507 -10.267 179 HZ3 LYS 25 HZ3 LYS 25 -3.644 18.080 -9.431 180 H TYR 26 H TYR 26 1.273 17.034 -6.587 181 HA TYR 26 HA TYR 26 1.590 15.746 -4.091 182 HB2 TYR 26 HB3 TYR 26 -0.618 14.413 -4.364 183 HB3 TYR 26 HB2 TYR 26 -0.680 15.970 -3.552 184 HD1 TYR 26 HD2 TYR 26 -1.392 14.196 -6.748 185 HD2 TYR 26 HD1 TYR 26 -1.807 17.878 -4.564 186 HE1 TYR 26 HE2 TYR 26 -2.972 15.015 -8.440 187 HE2 TYR 26 HE1 TYR 26 -3.402 18.702 -6.271 188 HH TYR 26 HH TYR 26 -4.984 16.844 -8.393 189 H LYS 27 H LYS 27 3.240 14.887 -4.983 190 HA LYS 27 HA LYS 27 2.818 12.426 -6.304 191 HB2 LYS 27 HB3 LYS 27 4.387 14.579 -7.786 192 HB3 LYS 27 HB2 LYS 27 4.548 12.875 -8.098 193 HG2 LYS 27 HG3 LYS 27 1.939 14.376 -8.288 194 HG3 LYS 27 HG2 LYS 27 2.951 13.998 -9.662 195 HD2 LYS 27 HD3 LYS 27 2.830 11.531 -8.610 196 HD3 LYS 27 HD2 LYS 27 1.350 12.156 -7.946 197 HE2 LYS 27 HE2 LYS 27 1.958 12.390 -10.900 198 HE3 LYS 27 HE1 LYS 27 1.075 11.047 -10.210 199 HZ1 LYS 27 HZ1 LYS 27 -0.256 13.116 -11.022 200 HZ2 LYS 27 HZ2 LYS 27 0.263 13.816 -9.583 201 HZ3 LYS 27 HZ3 LYS 27 -0.663 12.376 -9.565 202 H LEU 28 H LEU 28 4.928 11.273 -6.437 203 HA LEU 28 HA LEU 28 6.900 12.414 -4.607 204 HB2 LEU 28 HB3 LEU 28 5.613 10.638 -3.513 205 HB3 LEU 28 HB2 LEU 28 6.047 9.495 -4.785 206 HG LEU 28 HG LEU 28 8.486 10.008 -4.195 207 HD11 LEU 28 HD11 LEU 28 7.017 11.421 -1.979 208 HD12 LEU 28 HD12 LEU 28 8.278 12.103 -3.008 209 HD13 LEU 28 HD13 LEU 28 8.671 10.880 -1.786 210 HD21 LEU 28 HD21 LEU 28 6.698 8.822 -2.038 211 HD22 LEU 28 HD22 LEU 28 8.444 8.647 -2.125 212 HD23 LEU 28 HD23 LEU 28 7.440 7.918 -3.369 213 H SER 29 H SER 29 8.880 12.499 -5.583 214 HA SER 29 HA SER 29 9.135 11.395 -8.253 215 HB2 SER 29 HB3 SER 29 11.232 12.583 -8.326 216 HB3 SER 29 HB2 SER 29 9.986 13.625 -7.708 217 HG SER 29 HG SER 29 11.469 13.883 -6.174 218 H LYS 30 H LYS 30 11.210 10.064 -8.748 219 HA LYS 30 HA LYS 30 11.250 7.948 -6.803 220 HB2 LYS 30 HB3 LYS 30 13.288 8.122 -8.998 221 HB3 LYS 30 HB2 LYS 30 12.554 6.698 -8.302 222 HG2 LYS 30 HG3 LYS 30 11.433 8.633 -10.304 223 HG3 LYS 30 HG2 LYS 30 11.508 6.909 -10.480 224 HD2 LYS 30 HD3 LYS 30 9.712 8.218 -8.377 225 HD3 LYS 30 HD2 LYS 30 9.279 7.980 -10.063 226 HE2 LYS 30 HE2 LYS 30 10.272 5.476 -9.150 227 HE3 LYS 30 HE1 LYS 30 9.176 6.039 -7.940 228 HZ1 LYS 30 HZ1 LYS 30 7.829 6.611 -10.323 229 HZ2 LYS 30 HZ2 LYS 30 7.483 5.297 -9.364 230 HZ3 LYS 30 HZ3 LYS 30 8.599 5.171 -10.607 231 H LYS 31 H LYS 31 12.638 10.902 -7.007 232 HA LYS 31 HA LYS 31 15.302 10.483 -5.992 233 HB2 LYS 31 HB3 LYS 31 13.760 12.997 -5.393 234 HB3 LYS 31 HB2 LYS 31 15.422 12.776 -5.895 235 HG2 LYS 31 HG3 LYS 31 14.812 12.387 -8.170 236 HG3 LYS 31 HG2 LYS 31 13.118 12.302 -7.786 237 HD2 LYS 31 HD3 LYS 31 13.209 14.652 -6.926 238 HD3 LYS 31 HD2 LYS 31 14.861 14.788 -7.541 239 HE2 LYS 31 HE2 LYS 31 12.354 14.202 -9.086 240 HE3 LYS 31 HE1 LYS 31 13.294 15.680 -9.185 241 HZ1 LYS 31 HZ1 LYS 31 15.003 13.483 -9.690 242 HZ2 LYS 31 HZ2 LYS 31 14.572 14.710 -10.749 243 HZ3 LYS 31 HZ3 LYS 31 13.637 13.309 -10.648 244 H GLU 32 H GLU 32 12.319 11.784 -4.608 245 HA GLU 32 HA GLU 32 13.094 11.665 -1.877 246 HB2 GLU 32 HB3 GLU 32 10.396 11.781 -3.218 247 HB3 GLU 32 HB2 GLU 32 10.664 11.981 -1.479 248 HG2 GLU 32 HG3 GLU 32 11.900 13.739 -3.635 249 HG3 GLU 32 HG2 GLU 32 10.480 14.168 -2.712 250 H LEU 33 H LEU 33 11.298 9.528 -4.022 251 HA LEU 33 HA LEU 33 10.248 7.809 -2.105 252 HB2 LEU 33 HB3 LEU 33 9.476 7.810 -4.381 253 HB3 LEU 33 HB2 LEU 33 11.053 7.294 -4.972 254 HG LEU 33 HG LEU 33 9.204 5.542 -4.783 255 HD11 LEU 33 HD11 LEU 33 10.809 3.959 -4.771 256 HD12 LEU 33 HD12 LEU 33 11.520 4.495 -3.255 257 HD13 LEU 33 HD13 LEU 33 11.919 5.317 -4.750 258 HD21 LEU 33 HD21 LEU 33 8.536 4.729 -2.717 259 HD22 LEU 33 HD22 LEU 33 8.787 6.405 -2.273 260 HD23 LEU 33 HD23 LEU 33 10.023 5.201 -1.909 261 H LYS 34 H LYS 34 13.282 7.535 -3.920 262 HA LYS 34 HA LYS 34 14.036 5.147 -2.601 263 HB2 LYS 34 HB3 LYS 34 15.685 7.151 -4.156 264 HB3 LYS 34 HB2 LYS 34 16.325 5.639 -3.517 265 HG2 LYS 34 HG3 LYS 34 13.894 5.757 -5.308 266 HG3 LYS 34 HG2 LYS 34 15.513 5.564 -5.942 267 HD2 LYS 34 HD3 LYS 34 14.704 3.660 -3.732 268 HD3 LYS 34 HD2 LYS 34 13.985 3.419 -5.313 269 HE2 LYS 34 HE2 LYS 34 16.948 3.524 -4.691 270 HE3 LYS 34 HE1 LYS 34 16.014 2.108 -5.143 271 HZ1 LYS 34 HZ1 LYS 34 17.051 4.206 -6.864 272 HZ2 LYS 34 HZ2 LYS 34 15.448 3.650 -7.249 273 HZ3 LYS 34 HZ3 LYS 34 16.670 2.623 -7.187 274 H GLU 35 H GLU 35 14.816 8.555 -2.035 275 HA GLU 35 HA GLU 35 16.603 7.968 0.115 276 HB2 GLU 35 HB3 GLU 35 15.212 10.549 -0.595 277 HB3 GLU 35 HB2 GLU 35 16.553 10.394 0.550 278 HG2 GLU 35 HG3 GLU 35 16.638 9.723 -2.412 279 HG3 GLU 35 HG2 GLU 35 17.433 11.085 -1.645 280 H LEU 36 H LEU 36 13.179 8.965 0.016 281 HA LEU 36 HA LEU 36 13.000 9.095 2.825 282 HB2 LEU 36 HB3 LEU 36 10.898 9.759 2.574 283 HB3 LEU 36 HB2 LEU 36 11.349 10.007 0.895 284 HG LEU 36 HG LEU 36 10.522 7.502 0.609 285 HD11 LEU 36 HD11 LEU 36 9.355 6.546 2.333 286 HD12 LEU 36 HD12 LEU 36 8.542 8.063 2.719 287 HD13 LEU 36 HD13 LEU 36 10.138 7.743 3.359 288 HD21 LEU 36 HD21 LEU 36 8.483 9.650 1.215 289 HD22 LEU 36 HD22 LEU 36 8.297 8.306 0.106 290 HD23 LEU 36 HD23 LEU 36 9.447 9.613 -0.256 291 H LEU 37 H LEU 37 12.378 6.507 0.536 292 HA LEU 37 HA LEU 37 11.058 4.798 2.281 293 HB2 LEU 37 HB3 LEU 37 11.087 4.345 -0.084 294 HB3 LEU 37 HB2 LEU 37 12.824 4.170 -0.102 295 HG LEU 37 HG LEU 37 11.407 2.022 -0.150 296 HD11 LEU 37 HD11 LEU 37 13.209 1.604 2.128 297 HD12 LEU 37 HD12 LEU 37 13.955 2.510 0.816 298 HD13 LEU 37 HD13 LEU 37 13.258 0.934 0.507 299 HD21 LEU 37 HD21 LEU 37 11.339 2.155 2.843 300 HD22 LEU 37 HD22 LEU 37 10.334 1.247 1.750 301 HD23 LEU 37 HD23 LEU 37 10.036 2.967 1.972 302 H GLN 38 H GLN 38 14.471 4.992 1.549 303 HA GLN 38 HA GLN 38 15.288 3.014 3.438 304 HB2 GLN 38 HB3 GLN 38 17.565 4.014 3.211 305 HB3 GLN 38 HB2 GLN 38 16.812 3.706 1.651 306 HG2 GLN 38 HG3 GLN 38 16.076 6.104 1.585 307 HG3 GLN 38 HG2 GLN 38 17.006 6.402 3.049 308 HE21 GLN 38 HE21 GLN 38 17.150 5.961 -0.377 309 HE22 GLN 38 HE22 GLN 38 18.828 6.150 -0.524 310 H THR 39 H THR 39 14.941 6.504 3.570 311 HA THR 39 HA THR 39 15.976 6.927 6.144 312 HB THR 39 HB THR 39 13.892 8.490 4.609 313 HG1 THR 39 HG2 THR 39 15.665 8.486 3.420 314 HG21 THR 39 HG21 THR 39 15.535 9.110 7.062 315 HG22 THR 39 HG22 THR 39 13.794 9.231 6.811 316 HG23 THR 39 HG23 THR 39 14.869 10.381 6.019 317 H GLU 40 H GLU 40 12.537 6.617 5.114 318 HA GLU 40 HA GLU 40 11.585 6.812 7.798 319 HB2 GLU 40 HB3 GLU 40 10.134 5.908 5.293 320 HB3 GLU 40 HB2 GLU 40 9.387 6.260 6.853 321 HG2 GLU 40 HG3 GLU 40 11.013 8.246 5.235 322 HG3 GLU 40 HG2 GLU 40 9.258 8.201 5.292 323 H LEU 41 H LEU 41 12.204 4.090 5.663 324 HA LEU 41 HA LEU 41 11.231 2.230 7.737 325 HB2 LEU 41 HB3 LEU 41 11.681 2.011 4.798 326 HB3 LEU 41 HB2 LEU 41 11.641 0.578 5.752 327 HG LEU 41 HG LEU 41 9.441 1.291 6.760 328 HD11 LEU 41 HD11 LEU 41 8.217 2.999 5.130 329 HD12 LEU 41 HD12 LEU 41 9.864 3.551 4.824 330 HD13 LEU 41 HD13 LEU 41 9.214 3.564 6.466 331 HD21 LEU 41 HD21 LEU 41 9.752 -0.257 4.701 332 HD22 LEU 41 HD22 LEU 41 9.187 1.118 3.747 333 HD23 LEU 41 HD23 LEU 41 8.155 0.416 4.994 334 H SER 42 H SER 42 13.654 3.519 8.224 335 HA SER 42 HA SER 42 15.913 2.247 7.315 336 HB2 SER 42 HB3 SER 42 16.477 2.908 9.948 337 HB3 SER 42 HB2 SER 42 16.700 3.943 8.545 338 HG SER 42 HG SER 42 15.205 5.132 9.454 339 H GLY 43 H GLY 43 13.753 1.337 9.964 340 HA2 GLY 43 HA3 GLY 43 15.349 -0.746 10.981 341 HA3 GLY 43 HA2 GLY 43 13.611 -0.561 11.238 342 H PHE 44 H PHE 44 12.714 -0.679 8.643 343 HA PHE 44 HA PHE 44 12.738 -3.518 8.135 344 HB2 PHE 44 HB3 PHE 44 11.532 -1.184 6.676 345 HB3 PHE 44 HB2 PHE 44 11.632 -2.764 5.906 346 HD1 PHE 44 HD1 PHE 44 10.329 -0.978 8.880 347 HD2 PHE 44 HD2 PHE 44 10.182 -4.529 6.490 348 HE1 PHE 44 HE1 PHE 44 8.297 -1.753 10.133 349 HE2 PHE 44 HE2 PHE 44 8.180 -5.289 7.725 350 HZ PHE 44 HZ PHE 44 7.236 -3.909 9.534 351 H LEU 45 H LEU 45 14.136 -0.686 6.661 352 HA LEU 45 HA LEU 45 15.474 -1.981 4.549 353 HB2 LEU 45 HB3 LEU 45 15.208 0.343 4.433 354 HB3 LEU 45 HB2 LEU 45 15.906 0.610 6.019 355 HG LEU 45 HG LEU 45 18.031 -0.162 5.268 356 HD11 LEU 45 HD11 LEU 45 17.348 -1.783 3.515 357 HD12 LEU 45 HD12 LEU 45 18.436 -0.611 2.808 358 HD13 LEU 45 HD13 LEU 45 16.699 -0.474 2.521 359 HD21 LEU 45 HD21 LEU 45 16.972 2.234 4.735 360 HD22 LEU 45 HD22 LEU 45 17.380 1.771 3.081 361 HD23 LEU 45 HD23 LEU 45 18.632 1.847 4.319 362 H ASP 46 H ASP 46 16.553 -1.092 7.822 363 HA ASP 46 HA ASP 46 19.083 -2.279 7.487 364 HB2 ASP 46 HB3 ASP 46 17.563 -1.194 9.768 365 HB3 ASP 46 HB2 ASP 46 18.838 -2.310 10.152 366 H ALA 47 H ALA 47 16.048 -3.512 8.758 367 HA ALA 47 HA ALA 47 17.001 -5.797 9.963 368 HB1 ALA 47 HB1 ALA 47 14.382 -5.005 8.820 369 HB2 ALA 47 HB2 ALA 47 14.796 -5.596 10.424 370 HB3 ALA 47 HB3 ALA 47 14.642 -6.731 9.092 371 H GLN 48 H GLN 48 16.040 -5.340 6.604 372 HA GLN 48 HA GLN 48 17.455 -7.847 5.931 373 HB2 GLN 48 HB3 GLN 48 15.901 -7.635 3.779 374 HB3 GLN 48 HB2 GLN 48 15.286 -8.394 5.247 375 HG2 GLN 48 HG3 GLN 48 13.586 -6.938 4.695 376 HG3 GLN 48 HG2 GLN 48 14.476 -5.894 5.789 377 HE21 GLN 48 HE21 GLN 48 15.458 -4.013 4.850 378 HE22 GLN 48 HE22 GLN 48 15.317 -3.643 3.191 379 H LYS 49 H LYS 49 18.769 -5.485 6.282 380 HA LYS 49 HA LYS 49 19.038 -3.788 4.066 381 HB2 LYS 49 HB3 LYS 49 20.064 -3.827 6.585 382 HB3 LYS 49 HB2 LYS 49 21.430 -4.452 5.709 383 HG2 LYS 49 HG3 LYS 49 21.500 -2.484 4.233 384 HG3 LYS 49 HG2 LYS 49 20.037 -1.862 4.986 385 HD2 LYS 49 HD3 LYS 49 21.181 -1.710 7.187 386 HD3 LYS 49 HD2 LYS 49 22.650 -2.332 6.460 387 HE2 LYS 49 HE2 LYS 49 23.057 -0.049 6.420 388 HE3 LYS 49 HE1 LYS 49 22.400 -0.291 4.810 389 HZ1 LYS 49 HZ1 LYS 49 20.412 0.267 6.909 390 HZ2 LYS 49 HZ2 LYS 49 20.546 0.918 5.329 391 HZ3 LYS 49 HZ3 LYS 49 21.493 1.500 6.571 392 H ASP 50 H ASP 50 20.686 -6.687 5.062 393 HA ASP 50 HA ASP 50 22.360 -6.764 2.691 394 HB2 ASP 50 HB3 ASP 50 22.343 -8.353 5.242 395 HB3 ASP 50 HB2 ASP 50 23.402 -8.735 3.894 396 H VAL 51 H VAL 51 19.304 -7.754 3.313 397 HA VAL 51 HA VAL 51 19.498 -10.407 2.160 398 HB VAL 51 HB VAL 51 17.049 -8.786 2.894 399 HG11 VAL 51 HG11 VAL 51 17.437 -11.496 1.746 400 HG12 VAL 51 HG12 VAL 51 16.086 -10.366 1.577 401 HG13 VAL 51 HG13 VAL 51 16.252 -11.332 3.035 402 HG21 VAL 51 HG21 VAL 51 18.393 -11.052 4.405 403 HG22 VAL 51 HG22 VAL 51 17.006 -10.130 4.951 404 HG23 VAL 51 HG23 VAL 51 18.592 -9.359 4.837 405 H ASP 52 H ASP 52 19.157 -10.905 0.114 406 HA ASP 52 HA ASP 52 19.449 -9.062 -1.935 407 HB2 ASP 52 HB3 ASP 52 19.812 -11.535 -2.065 408 HB3 ASP 52 HB2 ASP 52 18.076 -11.726 -2.210 409 H ALA 53 H ALA 53 16.495 -10.208 -0.505 410 HA ALA 53 HA ALA 53 14.658 -9.516 -2.458 411 HB1 ALA 53 HB1 ALA 53 14.222 -9.182 0.519 412 HB2 ALA 53 HB2 ALA 53 14.029 -10.689 -0.384 413 HB3 ALA 53 HB3 ALA 53 12.978 -9.325 -0.722 414 H VAL 54 H VAL 54 16.217 -7.374 -0.111 415 HA VAL 54 HA VAL 54 14.584 -5.133 -0.575 416 HB VAL 54 HB VAL 54 16.234 -5.394 1.318 417 HG11 VAL 54 HG11 VAL 54 18.096 -6.072 -0.422 418 HG12 VAL 54 HG12 VAL 54 18.494 -5.228 1.051 419 HG13 VAL 54 HG13 VAL 54 18.357 -4.335 -0.484 420 HG21 VAL 54 HG21 VAL 54 17.021 -2.953 1.193 421 HG22 VAL 54 HG22 VAL 54 15.293 -3.232 1.034 422 HG23 VAL 54 HG23 VAL 54 16.262 -2.888 -0.402 423 H ASP 55 H ASP 55 17.386 -6.392 -2.267 424 HA ASP 55 HA ASP 55 17.951 -4.219 -3.990 425 HB2 ASP 55 HB3 ASP 55 19.411 -6.190 -3.793 426 HB3 ASP 55 HB2 ASP 55 18.154 -7.197 -4.520 427 H LYS 56 H LYS 56 15.820 -6.973 -4.205 428 HA LYS 56 HA LYS 56 14.861 -6.580 -6.821 429 HB2 LYS 56 HB3 LYS 56 13.533 -7.844 -4.435 430 HB3 LYS 56 HB2 LYS 56 12.987 -7.944 -6.102 431 HG2 LYS 56 HG3 LYS 56 15.036 -9.039 -6.816 432 HG3 LYS 56 HG2 LYS 56 15.754 -8.792 -5.225 433 HD2 LYS 56 HD3 LYS 56 15.144 -10.897 -5.171 434 HD3 LYS 56 HD2 LYS 56 13.793 -10.182 -4.320 435 HE2 LYS 56 HE2 LYS 56 13.720 -10.801 -7.322 436 HE3 LYS 56 HE1 LYS 56 13.089 -11.890 -6.094 437 HZ1 LYS 56 HZ1 LYS 56 11.235 -10.741 -6.534 438 HZ2 LYS 56 HZ2 LYS 56 11.932 -9.313 -7.001 439 HZ3 LYS 56 HZ3 LYS 56 11.774 -9.708 -5.359 440 H VAL 57 H VAL 57 13.615 -5.562 -3.668 441 HA VAL 57 HA VAL 57 11.309 -4.345 -4.708 442 HB VAL 57 HB VAL 57 12.869 -3.686 -2.191 443 HG11 VAL 57 HG11 VAL 57 11.466 -1.948 -2.035 444 HG12 VAL 57 HG12 VAL 57 10.154 -3.107 -1.825 445 HG13 VAL 57 HG13 VAL 57 10.523 -2.487 -3.422 446 HG21 VAL 57 HG21 VAL 57 10.655 -5.011 -1.347 447 HG22 VAL 57 HG22 VAL 57 12.151 -5.828 -1.733 448 HG23 VAL 57 HG23 VAL 57 10.852 -5.785 -2.915 449 H MET 58 H MET 58 14.532 -3.156 -3.993 450 HA MET 58 HA MET 58 14.178 -0.431 -4.744 451 HB2 MET 58 HB3 MET 58 16.625 -2.225 -4.846 452 HB3 MET 58 HB2 MET 58 16.646 -0.469 -4.932 453 HG2 MET 58 HG3 MET 58 15.158 -1.627 -2.693 454 HG3 MET 58 HG2 MET 58 16.886 -1.903 -2.654 455 HE1 MET 58 HE1 MET 58 18.688 0.617 -1.784 456 HE2 MET 58 HE2 MET 58 18.456 1.202 -3.427 457 HE3 MET 58 HE3 MET 58 18.483 -0.525 -3.129 458 H LYS 59 H LYS 59 15.264 -3.322 -6.454 459 HA LYS 59 HA LYS 59 15.834 -2.069 -8.925 460 HB2 LYS 59 HB3 LYS 59 16.778 -4.191 -8.213 461 HB3 LYS 59 HB2 LYS 59 15.201 -4.941 -8.306 462 HG2 LYS 59 HG3 LYS 59 16.221 -5.489 -10.374 463 HG3 LYS 59 HG2 LYS 59 15.074 -4.232 -10.771 464 HD2 LYS 59 HD3 LYS 59 17.851 -3.331 -10.052 465 HD3 LYS 59 HD2 LYS 59 17.691 -4.173 -11.575 466 HE2 LYS 59 HE2 LYS 59 16.682 -1.483 -10.779 467 HE3 LYS 59 HE1 LYS 59 17.322 -2.059 -12.308 468 HZ1 LYS 59 HZ1 LYS 59 15.122 -1.677 -12.702 469 HZ2 LYS 59 HZ2 LYS 59 14.548 -2.265 -11.266 470 HZ3 LYS 59 HZ3 LYS 59 15.041 -3.332 -12.499 471 H GLU 60 H GLU 60 13.109 -3.999 -7.786 472 HA GLU 60 HA GLU 60 11.743 -3.958 -10.213 473 HB2 GLU 60 HB3 GLU 60 10.807 -4.573 -7.397 474 HB3 GLU 60 HB2 GLU 60 9.822 -4.820 -8.837 475 HG2 GLU 60 HG3 GLU 60 11.499 -6.328 -9.814 476 HG3 GLU 60 HG2 GLU 60 12.585 -5.998 -8.475 477 H LEU 61 H LEU 61 11.440 -1.885 -7.351 478 HA LEU 61 HA LEU 61 9.404 -0.245 -8.530 479 HB2 LEU 61 HB3 LEU 61 11.259 0.119 -6.198 480 HB3 LEU 61 HB2 LEU 61 10.459 1.523 -6.890 481 HG LEU 61 HG LEU 61 9.139 0.508 -5.027 482 HD11 LEU 61 HD11 LEU 61 7.522 0.079 -7.498 483 HD12 LEU 61 HD12 LEU 61 8.170 1.686 -7.176 484 HD13 LEU 61 HD13 LEU 61 7.105 0.913 -6.009 485 HD21 LEU 61 HD21 LEU 61 9.782 -1.886 -5.558 486 HD22 LEU 61 HD22 LEU 61 8.696 -1.801 -6.948 487 HD23 LEU 61 HD23 LEU 61 8.054 -1.649 -5.321 488 H ASP 62 H ASP 62 12.926 -0.222 -8.567 489 HA ASP 62 HA ASP 62 13.154 2.225 -9.932 490 HB2 ASP 62 HB3 ASP 62 15.031 -0.088 -9.572 491 HB3 ASP 62 HB2 ASP 62 15.431 1.140 -10.752 492 H GLU 63 H GLU 63 12.021 -0.785 -11.037 493 HA GLU 63 HA GLU 63 12.549 -0.507 -13.872 494 HB2 GLU 63 HB3 GLU 63 10.059 -1.663 -12.522 495 HB3 GLU 63 HB2 GLU 63 10.607 -1.903 -14.161 496 HG2 GLU 63 HG3 GLU 63 12.210 -2.757 -11.755 497 HG3 GLU 63 HG2 GLU 63 11.107 -3.818 -12.613 498 H ASN 64 H ASN 64 10.274 0.804 -11.608 499 HA ASN 64 HA ASN 64 9.279 2.615 -13.713 500 HB2 ASN 64 HB3 ASN 64 7.594 1.128 -12.358 501 HB3 ASN 64 HB2 ASN 64 8.010 2.230 -11.037 502 HD21 ASN 64 HD21 ASN 64 5.370 2.057 -12.333 503 HD22 ASN 64 HD22 ASN 64 5.061 3.586 -12.968 504 H GLY 65 H GLY 65 11.819 2.834 -12.424 505 HA2 GLY 65 HA3 GLY 65 11.493 5.013 -10.486 506 HA3 GLY 65 HA2 GLY 65 13.006 4.178 -10.882 507 H ASP 66 H ASP 66 10.963 5.059 -13.439 508 HA ASP 66 HA ASP 66 12.944 6.519 -14.751 509 HB2 ASP 66 HB3 ASP 66 11.179 5.275 -15.852 510 HB3 ASP 66 HB2 ASP 66 9.993 6.429 -15.291 511 H GLY 67 H GLY 67 10.165 7.687 -12.877 512 HA2 GLY 67 HA3 GLY 67 11.470 10.263 -12.629 513 HA3 GLY 67 HA2 GLY 67 10.046 10.328 -13.643 514 H GLU 68 H GLU 68 8.016 9.328 -12.528 515 HA GLU 68 HA GLU 68 7.968 10.457 -9.785 516 HB2 GLU 68 HB3 GLU 68 5.711 10.283 -11.785 517 HB3 GLU 68 HB2 GLU 68 5.613 10.993 -10.182 518 HG2 GLU 68 HG3 GLU 68 6.336 12.956 -11.033 519 HG3 GLU 68 HG2 GLU 68 7.869 12.197 -11.408 520 H VAL 69 H VAL 69 6.603 9.602 -8.219 521 HA VAL 69 HA VAL 69 5.485 6.975 -8.696 522 HB VAL 69 HB VAL 69 7.260 6.106 -7.523 523 HG11 VAL 69 HG11 VAL 69 8.773 7.260 -6.199 524 HG12 VAL 69 HG12 VAL 69 7.554 8.343 -5.564 525 HG13 VAL 69 HG13 VAL 69 8.184 8.602 -7.175 526 HG21 VAL 69 HG21 VAL 69 6.430 5.385 -5.531 527 HG22 VAL 69 HG22 VAL 69 4.995 6.318 -5.933 528 HG23 VAL 69 HG23 VAL 69 6.226 7.003 -4.905 529 H ASP 70 H ASP 70 3.516 6.720 -7.928 530 HA ASP 70 HA ASP 70 2.317 9.028 -6.585 531 HB2 ASP 70 HB3 ASP 70 0.334 8.436 -7.555 532 HB3 ASP 70 HB2 ASP 70 1.425 7.692 -8.712 533 H PHE 71 H PHE 71 0.323 7.976 -5.271 534 HA PHE 71 HA PHE 71 1.542 7.061 -2.904 535 HB2 PHE 71 HB3 PHE 71 -0.674 8.293 -3.057 536 HB3 PHE 71 HB2 PHE 71 -1.357 6.749 -3.590 537 HD1 PHE 71 HD1 PHE 71 1.039 7.896 -0.959 538 HD2 PHE 71 HD2 PHE 71 -2.440 5.527 -1.863 539 HE1 PHE 71 HE1 PHE 71 0.890 7.204 1.407 540 HE2 PHE 71 HE2 PHE 71 -2.577 4.846 0.499 541 HZ PHE 71 HZ PHE 71 -0.920 5.666 2.135 542 H GLN 72 H GLN 72 -0.227 5.386 -5.490 543 HA GLN 72 HA GLN 72 -0.301 2.824 -4.310 544 HB2 GLN 72 HB3 GLN 72 -0.361 3.744 -7.171 545 HB3 GLN 72 HB2 GLN 72 -0.447 2.025 -6.745 546 HG2 GLN 72 HG3 GLN 72 -2.453 2.492 -5.412 547 HG3 GLN 72 HG2 GLN 72 -2.326 4.217 -5.787 548 HE21 GLN 72 HE21 GLN 72 -2.750 4.870 -8.028 549 HE22 GLN 72 HE22 GLN 72 -3.580 3.838 -9.077 550 H GLU 73 H GLU 73 2.166 4.302 -6.462 551 HA GLU 73 HA GLU 73 3.870 1.994 -6.393 552 HB2 GLU 73 HB3 GLU 73 4.496 4.891 -6.980 553 HB3 GLU 73 HB2 GLU 73 5.726 3.623 -7.055 554 HG2 GLU 73 HG3 GLU 73 4.332 2.483 -8.775 555 HG3 GLU 73 HG2 GLU 73 3.175 3.814 -8.692 556 H TYR 74 H TYR 74 3.571 4.882 -4.438 557 HA TYR 74 HA TYR 74 5.864 4.515 -2.865 558 HB2 TYR 74 HB3 TYR 74 4.710 6.652 -2.838 559 HB3 TYR 74 HB2 TYR 74 3.262 5.876 -2.209 560 HD1 TYR 74 HD1 TYR 74 6.905 5.631 -1.221 561 HD2 TYR 74 HD2 TYR 74 2.881 6.567 -0.025 562 HE1 TYR 74 HE1 TYR 74 7.675 6.000 1.085 563 HE2 TYR 74 HE2 TYR 74 3.675 6.937 2.298 564 HH TYR 74 HH TYR 74 6.789 7.416 3.139 565 H VAL 75 H VAL 75 2.515 3.456 -2.243 566 HA VAL 75 HA VAL 75 3.193 2.263 0.220 567 HB VAL 75 HB VAL 75 1.020 1.163 0.165 568 HG11 VAL 75 HG11 VAL 75 -0.015 3.125 0.697 569 HG12 VAL 75 HG12 VAL 75 0.337 3.860 -0.865 570 HG13 VAL 75 HG13 VAL 75 1.556 3.848 0.393 571 HG21 VAL 75 HG21 VAL 75 0.163 2.527 -2.297 572 HG22 VAL 75 HG22 VAL 75 -0.214 0.887 -1.740 573 HG23 VAL 75 HG23 VAL 75 1.251 1.186 -2.614 574 H VAL 76 H VAL 76 3.060 0.881 -3.046 575 HA VAL 76 HA VAL 76 3.308 -1.780 -2.172 576 HB VAL 76 HB VAL 76 2.536 -1.158 -4.451 577 HG11 VAL 76 HG11 VAL 76 4.033 0.667 -4.889 578 HG12 VAL 76 HG12 VAL 76 4.156 -0.537 -6.161 579 HG13 VAL 76 HG13 VAL 76 5.427 -0.414 -4.949 580 HG21 VAL 76 HG21 VAL 76 3.404 -3.454 -4.039 581 HG22 VAL 76 HG22 VAL 76 5.032 -2.906 -4.473 582 HG23 VAL 76 HG23 VAL 76 3.745 -2.898 -5.673 583 H LEU 77 H LEU 77 5.694 0.697 -2.935 584 HA LEU 77 HA LEU 77 7.975 -0.933 -2.893 585 HB2 LEU 77 HB3 LEU 77 8.023 1.378 -3.659 586 HB3 LEU 77 HB2 LEU 77 7.625 1.932 -2.045 587 HG LEU 77 HG LEU 77 9.774 0.828 -1.190 588 HD11 LEU 77 HD11 LEU 77 11.323 -0.057 -2.518 589 HD12 LEU 77 HD12 LEU 77 10.845 0.831 -3.945 590 HD13 LEU 77 HD13 LEU 77 9.921 -0.584 -3.446 591 HD21 LEU 77 HD21 LEU 77 9.878 3.152 -1.418 592 HD22 LEU 77 HD22 LEU 77 9.761 3.067 -3.178 593 HD23 LEU 77 HD23 LEU 77 11.260 2.585 -2.370 594 H VAL 78 H VAL 78 6.451 0.956 -0.286 595 HA VAL 78 HA VAL 78 8.266 -0.005 1.664 596 HB VAL 78 HB VAL 78 6.759 0.954 3.341 597 HG11 VAL 78 HG11 VAL 78 7.894 2.806 2.763 598 HG12 VAL 78 HG12 VAL 78 6.532 3.268 1.753 599 HG13 VAL 78 HG13 VAL 78 7.882 2.390 1.053 600 HG21 VAL 78 HG21 VAL 78 4.559 0.397 2.307 601 HG22 VAL 78 HG22 VAL 78 4.937 1.496 0.975 602 HG23 VAL 78 HG23 VAL 78 4.713 2.125 2.593 603 H ALA 79 H ALA 79 5.040 -0.952 0.640 604 HA ALA 79 HA ALA 79 4.662 -2.973 2.570 605 HB1 ALA 79 HB1 ALA 79 2.858 -1.980 1.096 606 HB2 ALA 79 HB2 ALA 79 2.879 -3.734 1.272 607 HB3 ALA 79 HB3 ALA 79 3.512 -2.997 -0.201 608 H ALA 80 H ALA 80 6.120 -2.989 -0.645 609 HA ALA 80 HA ALA 80 6.331 -5.721 -0.970 610 HB1 ALA 80 HB1 ALA 80 6.899 -4.490 -2.859 611 HB2 ALA 80 HB2 ALA 80 8.469 -5.077 -2.327 612 HB3 ALA 80 HB3 ALA 80 7.976 -3.409 -1.976 613 H LEU 81 H LEU 81 8.542 -3.411 0.539 614 HA LEU 81 HA LEU 81 10.471 -5.306 1.493 615 HB2 LEU 81 HB3 LEU 81 9.725 -2.524 2.459 616 HB3 LEU 81 HB2 LEU 81 11.066 -3.453 3.105 617 HG LEU 81 HG LEU 81 10.772 -2.765 0.164 618 HD11 LEU 81 HD11 LEU 81 11.100 -0.688 1.344 619 HD12 LEU 81 HD12 LEU 81 12.635 -1.156 0.634 620 HD13 LEU 81 HD13 LEU 81 12.360 -1.406 2.353 621 HD21 LEU 81 HD21 LEU 81 13.224 -3.350 0.184 622 HD22 LEU 81 HD22 LEU 81 12.183 -4.715 0.499 623 HD23 LEU 81 HD23 LEU 81 13.028 -3.930 1.830 624 H THR 82 H THR 82 7.533 -3.901 2.787 625 HA THR 82 HA THR 82 7.693 -4.941 5.386 626 HB THR 82 HB THR 82 5.162 -4.528 3.806 627 HG1 THR 82 HG2 THR 82 6.718 -2.672 3.772 628 HG21 THR 82 HG21 THR 82 5.755 -4.238 6.771 629 HG22 THR 82 HG22 THR 82 4.929 -5.582 6.003 630 HG23 THR 82 HG23 THR 82 4.194 -3.990 5.988 631 H VAL 83 H VAL 83 5.993 -6.281 2.509 632 HA VAL 83 HA VAL 83 5.256 -8.640 3.895 633 HB VAL 83 HB VAL 83 4.019 -8.004 1.901 634 HG11 VAL 83 HG11 VAL 83 5.697 -6.991 0.526 635 HG12 VAL 83 HG12 VAL 83 5.027 -8.341 -0.373 636 HG13 VAL 83 HG13 VAL 83 6.600 -8.499 0.383 637 HG21 VAL 83 HG21 VAL 83 4.527 -10.536 2.558 638 HG22 VAL 83 HG22 VAL 83 5.382 -10.527 1.028 639 HG23 VAL 83 HG23 VAL 83 3.663 -10.142 1.066 640 H ALA 84 H ALA 84 7.990 -7.846 1.835 641 HA ALA 84 HA ALA 84 9.106 -10.418 1.797 642 HB1 ALA 84 HB1 ALA 84 9.900 -8.728 0.273 643 HB2 ALA 84 HB2 ALA 84 11.249 -9.268 1.269 644 HB3 ALA 84 HB3 ALA 84 10.475 -7.716 1.596 645 H MET 85 H MET 85 9.710 -7.667 4.010 646 HA MET 85 HA MET 85 11.535 -9.207 5.564 647 HB2 MET 85 HB3 MET 85 11.520 -6.674 5.437 648 HB3 MET 85 HB2 MET 85 10.126 -6.710 6.514 649 HG2 MET 85 HG3 MET 85 11.502 -8.067 8.158 650 HG3 MET 85 HG2 MET 85 12.872 -7.853 7.086 651 HE1 MET 85 HE1 MET 85 10.647 -4.847 9.626 652 HE2 MET 85 HE2 MET 85 11.421 -6.247 10.338 653 HE3 MET 85 HE3 MET 85 10.192 -6.482 9.102 654 H ASN 86 H ASN 86 8.128 -8.274 5.997 655 HA ASN 86 HA ASN 86 7.895 -9.323 8.572 656 HB2 ASN 86 HB3 ASN 86 5.836 -8.640 6.482 657 HB3 ASN 86 HB2 ASN 86 5.380 -9.482 7.949 658 HD21 ASN 86 HD21 ASN 86 6.146 -8.452 10.084 659 HD22 ASN 86 HD22 ASN 86 6.191 -6.762 10.136 660 H ASN 87 H ASN 87 7.622 -10.830 5.456 661 HA ASN 87 HA ASN 87 6.488 -13.275 6.143 662 HB2 ASN 87 HB3 ASN 87 7.064 -12.779 3.846 663 HB3 ASN 87 HB2 ASN 87 8.780 -12.747 4.230 664 HD21 ASN 87 HD21 ASN 87 9.832 -14.707 3.857 665 HD22 ASN 87 HD22 ASN 87 9.095 -16.223 3.848 666 H PHE 88 H PHE 88 9.726 -12.026 6.796 667 HA PHE 88 HA PHE 88 10.857 -14.449 7.758 668 HB2 PHE 88 HB3 PHE 88 11.467 -11.575 8.555 669 HB3 PHE 88 HB2 PHE 88 12.408 -12.959 9.040 670 HD1 PHE 88 HD1 PHE 88 12.671 -14.665 6.732 671 HD2 PHE 88 HD2 PHE 88 12.639 -10.368 6.921 672 HE1 PHE 88 HE1 PHE 88 13.957 -14.576 4.645 673 HE2 PHE 88 HE2 PHE 88 13.929 -10.282 4.794 674 HZ PHE 88 HZ PHE 88 14.591 -12.394 3.659 675 H PHE 89 H PHE 89 9.039 -11.850 9.284 676 HA PHE 89 HA PHE 89 9.057 -12.963 11.921 677 HB2 PHE 89 HB3 PHE 89 7.235 -10.924 10.619 678 HB3 PHE 89 HB2 PHE 89 6.964 -11.497 12.241 679 HD1 PHE 89 HD1 PHE 89 9.581 -11.723 13.495 680 HD2 PHE 89 HD2 PHE 89 8.180 -8.763 10.681 681 HE1 PHE 89 HE1 PHE 89 11.213 -10.100 14.370 682 HE2 PHE 89 HE2 PHE 89 9.825 -7.165 11.572 683 HZ PHE 89 HZ PHE 89 11.342 -7.823 13.414 684 H TRP 90 H TRP 90 6.875 -13.262 9.187 685 HA TRP 90 HA TRP 90 4.820 -14.682 10.523 686 HB2 TRP 90 HB3 TRP 90 5.708 -15.126 7.639 687 HB3 TRP 90 HB2 TRP 90 4.136 -15.442 8.383 688 HD1 TRP 90 HD TRP 90 4.631 -12.554 10.103 689 HE1 TRP 90 HE1 TRP 90 3.905 -10.488 8.989 690 HE3 TRP 90 HE3 TRP 90 4.372 -14.277 5.312 691 HZ2 TRP 90 HZ2 TRP 90 3.225 -9.557 6.312 692 HZ3 TRP 90 HZ3 TRP 90 3.669 -12.762 3.478 693 HH2 TRP 90 HH TRP 90 3.089 -10.383 3.982 694 H GLU 91 H GLU 91 7.629 -15.717 8.850 695 HA GLU 91 HA GLU 91 7.338 -18.489 9.642 696 HB2 GLU 91 HB3 GLU 91 9.586 -16.986 8.456 697 HB3 GLU 91 HB2 GLU 91 9.730 -18.715 8.802 698 HG2 GLU 91 HG3 GLU 91 7.647 -19.090 7.427 699 HG3 GLU 91 HG2 GLU 91 7.641 -17.386 7.022 700 H ASN 92 H ASN 92 9.343 -15.790 10.797 701 HA ASN 92 HA ASN 92 10.450 -17.401 12.969 702 HB2 ASN 92 HB3 ASN 92 11.865 -15.674 12.004 703 HB3 ASN 92 HB2 ASN 92 10.634 -14.456 12.261 704 HD21 ASN 92 HD21 ASN 92 11.719 -13.133 13.768 705 HD22 ASN 92 HD22 ASN 92 12.251 -13.668 15.285 706 H SER 93 H SER 93 8.745 -18.003 14.213 707 HA SER 93 HA SER 93 7.551 -16.135 15.996 708 HB2 SER 93 HB3 SER 93 6.067 -17.047 13.552 709 HB3 SER 93 HB2 SER 93 5.183 -16.766 15.056 710 HG SER 93 HG SER 93 6.815 -14.972 13.521 711 H1 GLY 1 H GLY 1 12.314 6.152 12.631 712 HA2 GLY 1 HA3 GLY 1 11.410 3.547 12.273 713 HA3 GLY 1 HA2 GLY 1 11.467 3.831 14.011 714 H SER 2 H SER 2 10.490 5.583 11.084 715 HA SER 2 HA SER 2 8.623 7.232 12.397 716 HB2 SER 2 HB3 SER 2 8.510 6.473 9.475 717 HB3 SER 2 HB2 SER 2 7.970 7.948 10.252 718 HG SER 2 HG SER 2 9.931 8.029 9.155 719 H GLU 3 H GLU 3 6.314 7.256 12.193 720 HA GLU 3 HA GLU 3 5.064 5.012 13.138 721 HB2 GLU 3 HB3 GLU 3 3.893 7.297 11.528 722 HB3 GLU 3 HB2 GLU 3 2.952 6.133 12.444 723 HG2 GLU 3 HG3 GLU 3 3.160 7.879 13.980 724 HG3 GLU 3 HG2 GLU 3 4.474 6.838 14.468 725 H LEU 4 H LEU 4 6.055 5.708 9.971 726 HA LEU 4 HA LEU 4 4.180 4.347 8.411 727 HB2 LEU 4 HB3 LEU 4 7.145 4.667 7.952 728 HB3 LEU 4 HB2 LEU 4 5.967 4.182 6.749 729 HG LEU 4 HG LEU 4 5.933 6.836 8.244 730 HD11 LEU 4 HD11 LEU 4 7.416 7.472 6.758 731 HD12 LEU 4 HD12 LEU 4 6.148 7.265 5.535 732 HD13 LEU 4 HD13 LEU 4 7.283 5.958 5.849 733 HD21 LEU 4 HD21 LEU 4 4.377 6.828 5.879 734 HD22 LEU 4 HD22 LEU 4 3.832 7.099 7.515 735 HD23 LEU 4 HD23 LEU 4 3.796 5.465 6.843 736 H GLU 5 H GLU 5 7.153 3.215 10.055 737 HA GLU 5 HA GLU 5 7.050 0.569 9.051 738 HB2 GLU 5 HB3 GLU 5 8.271 1.715 11.579 739 HB3 GLU 5 HB2 GLU 5 8.460 0.030 11.112 740 HG2 GLU 5 HG3 GLU 5 9.494 0.772 8.960 741 HG3 GLU 5 HG2 GLU 5 9.315 2.438 9.455 742 H THR 6 H THR 6 5.747 2.033 12.017 743 HA THR 6 HA THR 6 4.510 -0.330 12.979 744 HB THR 6 HB THR 6 3.502 2.484 13.462 745 HG1 THR 6 HG2 THR 6 5.736 1.081 14.544 746 HG21 THR 6 HG21 THR 6 3.582 -0.051 15.108 747 HG22 THR 6 HG22 THR 6 2.148 0.663 14.382 748 HG23 THR 6 HG23 THR 6 2.981 1.500 15.686 749 H ALA 7 H ALA 7 3.339 2.365 10.950 750 HA ALA 7 HA ALA 7 0.690 1.549 10.631 751 HB1 ALA 7 HB1 ALA 7 2.472 2.865 8.575 752 HB2 ALA 7 HB2 ALA 7 1.602 3.722 9.856 753 HB3 ALA 7 HB3 ALA 7 0.712 2.879 8.587 754 H MET 8 H MET 8 3.583 0.729 8.744 755 HA MET 8 HA MET 8 2.222 -0.928 6.914 756 HB2 MET 8 HB3 MET 8 5.105 -0.875 7.764 757 HB3 MET 8 HB2 MET 8 4.511 -1.895 6.452 758 HG2 MET 8 HG3 MET 8 4.434 1.162 6.585 759 HG3 MET 8 HG2 MET 8 5.354 0.150 5.484 760 HE1 MET 8 HE1 MET 8 3.165 -2.170 4.645 761 HE2 MET 8 HE2 MET 8 4.554 -1.367 3.919 762 HE3 MET 8 HE3 MET 8 3.000 -1.343 3.081 763 H GLU 9 H GLU 9 3.782 -1.657 10.029 764 HA GLU 9 HA GLU 9 3.240 -4.416 9.751 765 HB2 GLU 9 HB3 GLU 9 3.774 -2.814 12.269 766 HB3 GLU 9 HB2 GLU 9 3.466 -4.541 12.270 767 HG2 GLU 9 HG3 GLU 9 5.356 -4.823 10.625 768 HG3 GLU 9 HG2 GLU 9 5.750 -3.125 10.873 769 H THR 10 H THR 10 1.436 -1.692 10.967 770 HA THR 10 HA THR 10 -0.700 -3.071 12.174 771 HB THR 10 HB THR 10 -1.005 -0.494 10.576 772 HG1 THR 10 HG2 THR 10 0.848 -0.443 12.043 773 HG21 THR 10 HG21 THR 10 -3.045 -1.556 11.472 774 HG22 THR 10 HG22 THR 10 -2.693 -0.009 12.231 775 HG23 THR 10 HG23 THR 10 -2.352 -1.511 13.095 776 H LEU 11 H LEU 11 -0.060 -2.119 8.842 777 HA LEU 11 HA LEU 11 -2.423 -3.188 7.695 778 HB2 LEU 11 HB3 LEU 11 0.338 -2.776 6.547 779 HB3 LEU 11 HB2 LEU 11 -1.048 -3.258 5.572 780 HG LEU 11 HG LEU 11 -0.839 -0.713 7.220 781 HD11 LEU 11 HD11 LEU 11 -0.670 -1.143 4.229 782 HD12 LEU 11 HD12 LEU 11 0.643 -0.606 5.281 783 HD13 LEU 11 HD13 LEU 11 -0.764 0.415 5.030 784 HD21 LEU 11 HD21 LEU 11 -3.109 -1.042 7.099 785 HD22 LEU 11 HD22 LEU 11 -3.022 -1.986 5.601 786 HD23 LEU 11 HD23 LEU 11 -2.861 -0.235 5.557 787 H ILE 12 H ILE 12 0.788 -4.598 8.332 788 HA ILE 12 HA ILE 12 0.349 -7.081 7.048 789 HB ILE 12 HB ILE 12 2.115 -6.363 9.408 790 HG12 ILE 12 HG13 ILE 12 2.575 -5.253 7.147 791 HG13 ILE 12 HG12 ILE 12 3.894 -6.212 7.795 792 HG21 ILE 12 HG21 ILE 12 3.365 -8.468 8.570 793 HG22 ILE 12 HG22 ILE 12 1.787 -8.958 7.936 794 HG23 ILE 12 HG23 ILE 12 1.996 -8.642 9.649 795 HD11 ILE 12 HD11 ILE 12 2.018 -7.736 6.052 796 HD12 ILE 12 HD12 ILE 12 3.782 -7.721 6.159 797 HD13 ILE 12 HD13 ILE 12 2.964 -6.467 5.272 798 H ASN 13 H ASN 13 -0.100 -6.067 10.368 799 HA ASN 13 HA ASN 13 -1.004 -8.575 11.367 800 HB2 ASN 13 HB3 ASN 13 -1.427 -5.760 12.412 801 HB3 ASN 13 HB2 ASN 13 -1.925 -7.216 13.255 802 HD21 ASN 13 HD21 ASN 13 0.917 -5.366 12.273 803 HD22 ASN 13 HD22 ASN 13 2.028 -6.267 13.185 804 H VAL 14 H VAL 14 -2.720 -5.782 10.045 805 HA VAL 14 HA VAL 14 -5.317 -6.878 10.424 806 HB VAL 14 HB VAL 14 -4.345 -4.773 8.458 807 HG11 VAL 14 HG11 VAL 14 -7.183 -5.315 9.373 808 HG12 VAL 14 HG12 VAL 14 -6.557 -5.908 7.843 809 HG13 VAL 14 HG13 VAL 14 -6.688 -4.182 8.128 810 HG21 VAL 14 HG21 VAL 14 -4.735 -4.755 11.302 811 HG22 VAL 14 HG22 VAL 14 -6.007 -3.779 10.581 812 HG23 VAL 14 HG23 VAL 14 -4.323 -3.397 10.263 813 H PHE 15 H PHE 15 -3.007 -6.893 7.735 814 HA PHE 15 HA PHE 15 -4.597 -8.203 5.838 815 HB2 PHE 15 HB3 PHE 15 -2.472 -7.170 5.227 816 HB3 PHE 15 HB2 PHE 15 -1.594 -8.313 6.231 817 HD1 PHE 15 HD1 PHE 15 -3.770 -8.027 3.202 818 HD2 PHE 15 HD2 PHE 15 -1.091 -10.515 5.456 819 HE1 PHE 15 HE1 PHE 15 -3.701 -9.651 1.336 820 HE2 PHE 15 HE2 PHE 15 -1.027 -12.142 3.583 821 HZ PHE 15 HZ PHE 15 -2.338 -11.707 1.527 822 H HIS 16 H HIS 16 -2.366 -9.568 8.269 823 HA HIS 16 HA HIS 16 -3.118 -12.203 7.445 824 HB2 HIS 16 HB3 HIS 16 -1.289 -11.288 9.648 825 HB3 HIS 16 HB2 HIS 16 -1.764 -12.978 9.437 826 HD1 HIS 16 HD1 HIS 16 -1.857 -13.092 6.319 827 HD2 HIS 16 HD2 HIS 16 1.285 -11.448 8.547 828 HE1 HIS 16 HE1 HIS 16 0.230 -13.184 4.863 829 HE2 HIS 16 HE2 HIS 16 2.120 -12.197 6.194 830 H ALA 17 H ALA 17 -4.517 -10.037 9.550 831 HA ALA 17 HA ALA 17 -5.714 -11.782 11.441 832 HB1 ALA 17 HB1 ALA 17 -7.066 -9.368 10.179 833 HB2 ALA 17 HB2 ALA 17 -5.864 -9.242 11.461 834 HB3 ALA 17 HB3 ALA 17 -7.376 -10.082 11.755 835 H HIS 18 H HIS 18 -6.373 -10.984 8.125 836 HA HIS 18 HA HIS 18 -8.689 -12.716 8.048 837 HB2 HIS 18 HB3 HIS 18 -7.458 -10.907 5.977 838 HB3 HIS 18 HB2 HIS 18 -8.824 -12.017 5.683 839 HD1 HIS 18 HD1 HIS 18 -11.101 -11.495 6.820 840 HD2 HIS 18 HD2 HIS 18 -8.110 -8.692 7.692 841 HE1 HIS 18 HE1 HIS 18 -12.222 -9.554 7.994 842 HE2 HIS 18 HE2 HIS 18 -10.407 -7.865 8.555 843 H SER 19 H SER 19 -5.286 -12.862 7.279 844 HA SER 19 HA SER 19 -5.276 -14.880 5.343 845 HB2 SER 19 HB3 SER 19 -3.320 -14.442 7.624 846 HB3 SER 19 HB2 SER 19 -3.064 -15.540 6.284 847 HG SER 19 HG SER 19 -3.482 -13.624 4.926 848 H GLY 20 H GLY 20 -5.685 -15.074 8.817 849 HA2 GLY 20 HA3 GLY 20 -5.580 -17.895 9.091 850 HA3 GLY 20 HA2 GLY 20 -6.411 -16.779 10.177 851 H LYS 21 H LYS 21 -8.017 -15.697 7.948 852 HA LYS 21 HA LYS 21 -10.260 -17.248 8.498 853 HB2 LYS 21 HB3 LYS 21 -9.860 -15.096 6.440 854 HB3 LYS 21 HB2 LYS 21 -11.424 -15.698 6.957 855 HG2 LYS 21 HG3 LYS 21 -9.376 -14.493 8.869 856 HG3 LYS 21 HG2 LYS 21 -10.739 -13.613 8.159 857 HD2 LYS 21 HD3 LYS 21 -12.326 -14.913 9.329 858 HD3 LYS 21 HD2 LYS 21 -11.189 -16.171 9.746 859 HE2 LYS 21 HE2 LYS 21 -11.890 -14.373 11.488 860 HE3 LYS 21 HE1 LYS 21 -10.239 -14.948 11.456 861 HZ1 LYS 21 HZ1 LYS 21 -10.741 -12.424 11.483 862 HZ2 LYS 21 HZ2 LYS 21 -11.043 -12.573 9.852 863 HZ3 LYS 21 HZ3 LYS 21 -9.490 -12.950 10.492 864 H GLU 22 H GLU 22 -8.334 -17.034 5.473 865 HA GLU 22 HA GLU 22 -9.609 -19.549 4.644 866 HB2 GLU 22 HB3 GLU 22 -9.464 -18.074 2.254 867 HB3 GLU 22 HB2 GLU 22 -10.899 -18.597 3.110 868 HG2 GLU 22 HG3 GLU 22 -11.327 -16.337 3.077 869 HG3 GLU 22 HG2 GLU 22 -10.374 -16.318 4.549 870 H GLY 23 H GLY 23 -7.420 -17.160 3.273 871 HA2 GLY 23 HA3 GLY 23 -6.053 -18.888 1.615 872 HA3 GLY 23 HA2 GLY 23 -5.434 -17.336 2.165 873 H ASP 24 H ASP 24 -3.390 -18.520 1.881 874 HA ASP 24 HA ASP 24 -2.544 -20.683 3.499 875 HB2 ASP 24 HB3 ASP 24 -1.360 -20.004 1.448 876 HB3 ASP 24 HB2 ASP 24 -0.914 -18.485 2.210 877 H LYS 25 H LYS 25 -0.551 -20.346 4.989 878 HA LYS 25 HA LYS 25 -1.367 -19.011 7.300 879 HB2 LYS 25 HB3 LYS 25 1.284 -18.986 7.754 880 HB3 LYS 25 HB2 LYS 25 0.326 -20.458 7.882 881 HG2 LYS 25 HG3 LYS 25 1.012 -21.117 5.603 882 HG3 LYS 25 HG2 LYS 25 1.875 -19.591 5.411 883 HD2 LYS 25 HD3 LYS 25 3.301 -20.129 7.298 884 HD3 LYS 25 HD2 LYS 25 2.505 -21.675 7.506 885 HE2 LYS 25 HE2 LYS 25 3.806 -20.816 4.920 886 HE3 LYS 25 HE1 LYS 25 4.656 -21.702 6.185 887 HZ1 LYS 25 HZ1 LYS 25 3.125 -22.796 4.168 888 HZ2 LYS 25 HZ2 LYS 25 2.158 -22.977 5.573 889 HZ3 LYS 25 HZ3 LYS 25 3.710 -23.587 5.519 890 H TYR 26 H TYR 26 0.629 -17.918 4.593 891 HA TYR 26 HA TYR 26 -0.128 -15.219 5.437 892 HB2 TYR 26 HB3 TYR 26 2.242 -14.841 3.961 893 HB3 TYR 26 HB2 TYR 26 1.977 -14.537 5.667 894 HD1 TYR 26 HD1 TYR 26 2.583 -16.200 7.355 895 HD2 TYR 26 HD2 TYR 26 3.473 -16.786 3.205 896 HE1 TYR 26 HE1 TYR 26 4.256 -17.974 7.951 897 HE2 TYR 26 HE2 TYR 26 5.098 -18.526 3.779 898 HH TYR 26 HH TYR 26 6.560 -19.019 5.919 899 H LYS 27 H LYS 27 -1.794 -15.254 4.157 900 HA LYS 27 HA LYS 27 -1.372 -14.145 1.666 901 HB2 LYS 27 HB3 LYS 27 -2.198 -17.018 1.616 902 HB3 LYS 27 HB2 LYS 27 -3.127 -15.948 0.613 903 HG2 LYS 27 HG3 LYS 27 -0.102 -16.320 0.452 904 HG3 LYS 27 HG2 LYS 27 -1.287 -16.837 -0.727 905 HD2 LYS 27 HD3 LYS 27 -1.769 -14.054 -0.375 906 HD3 LYS 27 HD2 LYS 27 -0.019 -14.245 -0.438 907 HE2 LYS 27 HE2 LYS 27 -0.719 -15.881 -2.528 908 HE3 LYS 27 HE1 LYS 27 -2.042 -14.710 -2.547 909 HZ1 LYS 27 HZ1 LYS 27 -0.588 -12.966 -3.088 910 HZ2 LYS 27 HZ2 LYS 27 0.041 -14.229 -3.913 911 HZ3 LYS 27 HZ3 LYS 27 0.777 -13.764 -2.488 912 H LEU 28 H LEU 28 -3.733 -13.979 0.595 913 HA LEU 28 HA LEU 28 -5.810 -13.992 2.600 914 HB2 LEU 28 HB3 LEU 28 -4.860 -11.771 2.880 915 HB3 LEU 28 HB2 LEU 28 -4.944 -11.463 1.152 916 HG LEU 28 HG LEU 28 -7.473 -11.840 1.338 917 HD11 LEU 28 HD11 LEU 28 -6.631 -12.051 4.203 918 HD12 LEU 28 HD12 LEU 28 -7.829 -12.989 3.309 919 HD13 LEU 28 HD13 LEU 28 -8.184 -11.324 3.788 920 HD21 LEU 28 HD21 LEU 28 -7.833 -9.629 2.477 921 HD22 LEU 28 HD22 LEU 28 -6.644 -9.574 1.172 922 HD23 LEU 28 HD23 LEU 28 -6.113 -9.584 2.854 923 H SER 29 H SER 29 -7.723 -14.635 1.582 924 HA SER 29 HA SER 29 -7.546 -14.992 -1.291 925 HB2 SER 29 HB3 SER 29 -10.028 -15.680 0.330 926 HB3 SER 29 HB2 SER 29 -9.417 -16.340 -1.150 927 HG SER 29 HG SER 29 -8.227 -16.571 1.409 928 H LYS 30 H LYS 30 -9.308 -14.149 -2.725 929 HA LYS 30 HA LYS 30 -9.724 -11.363 -2.227 930 HB2 LYS 30 HB3 LYS 30 -11.243 -13.019 -4.216 931 HB3 LYS 30 HB2 LYS 30 -10.915 -11.303 -4.319 932 HG2 LYS 30 HG3 LYS 30 -8.974 -13.611 -4.738 933 HG3 LYS 30 HG2 LYS 30 -9.430 -12.335 -5.854 934 HD2 LYS 30 HD3 LYS 30 -8.118 -11.517 -3.286 935 HD3 LYS 30 HD2 LYS 30 -7.094 -12.219 -4.527 936 HE2 LYS 30 HE2 LYS 30 -8.923 -10.175 -5.584 937 HE3 LYS 30 HE1 LYS 30 -7.924 -9.560 -4.303 938 HZ1 LYS 30 HZ1 LYS 30 -6.403 -11.144 -6.304 939 HZ2 LYS 30 HZ2 LYS 30 -5.969 -9.745 -5.567 940 HZ3 LYS 30 HZ3 LYS 30 -7.122 -9.736 -6.831 941 H LYS 31 H LYS 31 -11.149 -14.020 -0.972 942 HA LYS 31 HA LYS 31 -13.920 -13.389 -0.838 943 HB2 LYS 31 HB3 LYS 31 -12.407 -14.911 1.334 944 HB3 LYS 31 HB2 LYS 31 -14.057 -15.071 0.794 945 HG2 LYS 31 HG3 LYS 31 -13.323 -15.964 -1.360 946 HG3 LYS 31 HG2 LYS 31 -11.651 -15.707 -0.897 947 HD2 LYS 31 HD3 LYS 31 -11.987 -17.202 1.081 948 HD3 LYS 31 HD2 LYS 31 -13.578 -17.607 0.451 949 HE2 LYS 31 HE2 LYS 31 -11.051 -17.880 -1.132 950 HE3 LYS 31 HE1 LYS 31 -11.718 -19.228 -0.218 951 HZ1 LYS 31 HZ1 LYS 31 -13.567 -17.824 -2.033 952 HZ2 LYS 31 HZ2 LYS 31 -13.478 -19.433 -1.661 953 HZ3 LYS 31 HZ3 LYS 31 -12.388 -18.761 -2.775 954 H GLU 32 H GLU 32 -11.486 -13.291 1.748 955 HA GLU 32 HA GLU 32 -12.944 -11.632 3.453 956 HB2 GLU 32 HB3 GLU 32 -10.043 -12.413 3.284 957 HB3 GLU 32 HB2 GLU 32 -10.739 -11.500 4.625 958 HG2 GLU 32 HG3 GLU 32 -11.777 -14.158 3.685 959 HG3 GLU 32 HG2 GLU 32 -10.571 -14.018 4.929 960 H LEU 33 H LEU 33 -10.479 -11.094 1.044 961 HA LEU 33 HA LEU 33 -9.505 -8.670 1.834 962 HB2 LEU 33 HB3 LEU 33 -8.438 -9.930 0.127 963 HB3 LEU 33 HB2 LEU 33 -9.808 -9.774 -0.958 964 HG LEU 33 HG LEU 33 -7.768 -8.256 -1.392 965 HD11 LEU 33 HD11 LEU 33 -9.122 -6.992 -2.622 966 HD12 LEU 33 HD12 LEU 33 -10.082 -6.440 -1.258 967 HD13 LEU 33 HD13 LEU 33 -10.422 -7.992 -2.006 968 HD21 LEU 33 HD21 LEU 33 -8.978 -6.310 0.545 969 HD22 LEU 33 HD22 LEU 33 -7.336 -6.460 -0.030 970 HD23 LEU 33 HD23 LEU 33 -7.914 -7.555 1.210 971 H LYS 34 H LYS 34 -12.224 -9.072 -0.474 972 HA LYS 34 HA LYS 34 -12.551 -6.283 -0.845 973 HB2 LYS 34 HB3 LYS 34 -14.602 -8.488 -1.001 974 HB3 LYS 34 HB2 LYS 34 -14.854 -6.860 -1.599 975 HG2 LYS 34 HG3 LYS 34 -12.861 -7.128 -3.109 976 HG3 LYS 34 HG2 LYS 34 -12.736 -8.808 -2.601 977 HD2 LYS 34 HD3 LYS 34 -15.173 -7.567 -3.924 978 HD3 LYS 34 HD2 LYS 34 -14.008 -8.574 -4.748 979 HE2 LYS 34 HE2 LYS 34 -15.727 -9.441 -2.399 980 HE3 LYS 34 HE1 LYS 34 -16.011 -9.830 -4.077 981 HZ1 LYS 34 HZ1 LYS 34 -13.537 -10.707 -2.573 982 HZ2 LYS 34 HZ2 LYS 34 -13.950 -11.010 -4.199 983 HZ3 LYS 34 HZ3 LYS 34 -14.914 -11.599 -2.966 984 H GLU 35 H GLU 35 -14.006 -8.597 1.326 985 HA GLU 35 HA GLU 35 -15.789 -6.861 2.636 986 HB2 GLU 35 HB3 GLU 35 -14.632 -9.580 3.348 987 HB3 GLU 35 HB2 GLU 35 -15.966 -8.777 4.197 988 HG2 GLU 35 HG3 GLU 35 -17.323 -8.699 2.236 989 HG3 GLU 35 HG2 GLU 35 -16.007 -9.223 1.205 990 H LEU 36 H LEU 36 -12.544 -8.000 3.278 991 HA LEU 36 HA LEU 36 -12.037 -6.670 5.741 992 HB2 LEU 36 HB3 LEU 36 -10.479 -8.350 5.261 993 HB3 LEU 36 HB2 LEU 36 -10.440 -7.927 3.562 994 HG LEU 36 HG LEU 36 -9.120 -5.984 3.957 995 HD11 LEU 36 HD11 LEU 36 -8.611 -6.645 6.836 996 HD12 LEU 36 HD12 LEU 36 -10.141 -5.822 6.492 997 HD13 LEU 36 HD13 LEU 36 -8.605 -5.095 6.020 998 HD21 LEU 36 HD21 LEU 36 -7.580 -7.587 3.648 999 HD22 LEU 36 HD22 LEU 36 -8.237 -8.639 4.910 1000 HD23 LEU 36 HD23 LEU 36 -7.177 -7.307 5.338 1001 H LEU 37 H LEU 37 -11.493 -5.819 2.334 1002 HA LEU 37 HA LEU 37 -10.225 -3.369 2.835 1003 HB2 LEU 37 HB3 LEU 37 -10.053 -4.467 0.693 1004 HB3 LEU 37 HB2 LEU 37 -11.779 -4.356 0.411 1005 HG LEU 37 HG LEU 37 -10.285 -2.671 -0.797 1006 HD11 LEU 37 HD11 LEU 37 -12.887 -2.334 0.332 1007 HD12 LEU 37 HD12 LEU 37 -12.194 -1.535 -1.052 1008 HD13 LEU 37 HD13 LEU 37 -12.033 -0.808 0.536 1009 HD21 LEU 37 HD21 LEU 37 -10.289 -1.097 1.764 1010 HD22 LEU 37 HD22 LEU 37 -9.288 -0.909 0.327 1011 HD23 LEU 37 HD23 LEU 37 -8.999 -2.256 1.434 1012 H GLN 38 H GLN 38 -13.642 -4.101 2.200 1013 HA GLN 38 HA GLN 38 -14.399 -1.408 2.218 1014 HB2 GLN 38 HB3 GLN 38 -16.719 -2.163 2.479 1015 HB3 GLN 38 HB2 GLN 38 -15.890 -3.070 1.218 1016 HG2 GLN 38 HG3 GLN 38 -15.434 -4.858 2.911 1017 HG3 GLN 38 HG2 GLN 38 -16.436 -3.976 4.066 1018 HE21 GLN 38 HE21 GLN 38 -18.692 -4.179 3.859 1019 HE22 GLN 38 HE22 GLN 38 -19.454 -5.110 2.660 1020 H THR 39 H THR 39 -14.460 -3.729 4.888 1021 HA THR 39 HA THR 39 -15.699 -1.964 6.695 1022 HB THR 39 HB THR 39 -15.666 -4.176 7.477 1023 HG1 THR 39 HG2 THR 39 -13.500 -3.357 9.060 1024 HG21 THR 39 HG21 THR 39 -13.189 -4.456 6.124 1025 HG22 THR 39 HG22 THR 39 -14.034 -5.685 7.030 1026 HG23 THR 39 HG23 THR 39 -12.827 -4.719 7.815 1027 H GLU 40 H GLU 40 -12.225 -2.596 6.281 1028 HA GLU 40 HA GLU 40 -11.560 -0.732 8.250 1029 HB2 GLU 40 HB3 GLU 40 -9.712 -1.844 6.127 1030 HB3 GLU 40 HB2 GLU 40 -9.303 -1.101 7.684 1031 HG2 GLU 40 HG3 GLU 40 -10.850 -3.686 7.329 1032 HG3 GLU 40 HG2 GLU 40 -9.239 -3.513 7.982 1033 H LEU 41 H LEU 41 -11.851 -0.406 4.788 1034 HA LEU 41 HA LEU 41 -11.062 2.433 5.041 1035 HB2 LEU 41 HB3 LEU 41 -11.120 0.521 2.738 1036 HB3 LEU 41 HB2 LEU 41 -11.250 2.237 2.431 1037 HG LEU 41 HG LEU 41 -9.181 2.568 3.893 1038 HD11 LEU 41 HD11 LEU 41 -7.726 0.417 3.880 1039 HD12 LEU 41 HD12 LEU 41 -9.259 -0.443 3.788 1040 HD13 LEU 41 HD13 LEU 41 -8.928 0.637 5.140 1041 HD21 LEU 41 HD21 LEU 41 -7.633 1.896 2.084 1042 HD22 LEU 41 HD22 LEU 41 -9.070 2.680 1.438 1043 HD23 LEU 41 HD23 LEU 41 -8.910 0.922 1.352 1044 H SER 42 H SER 42 -13.651 1.360 5.942 1045 HA SER 42 HA SER 42 -15.766 1.840 4.227 1046 HB2 SER 42 HB3 SER 42 -15.652 2.555 7.168 1047 HB3 SER 42 HB2 SER 42 -17.099 2.303 6.211 1048 HG SER 42 HG SER 42 -15.118 0.428 7.049 1049 H GLY 43 H GLY 43 -13.928 4.176 6.178 1050 HA2 GLY 43 HA3 GLY 43 -15.475 6.460 5.667 1051 HA3 GLY 43 HA2 GLY 43 -13.780 6.418 6.119 1052 H PHE 44 H PHE 44 -12.680 5.054 4.006 1053 HA PHE 44 HA PHE 44 -12.634 7.118 1.959 1054 HB2 PHE 44 HB3 PHE 44 -11.204 4.475 2.231 1055 HB3 PHE 44 HB2 PHE 44 -11.132 5.397 0.747 1056 HD1 PHE 44 HD2 PHE 44 -10.951 8.209 1.663 1057 HD2 PHE 44 HD1 PHE 44 -9.131 4.663 3.273 1058 HE1 PHE 44 HE2 PHE 44 -9.157 9.572 2.603 1059 HE2 PHE 44 HE1 PHE 44 -7.311 6.049 4.221 1060 HZ PHE 44 HZ PHE 44 -7.311 8.493 3.896 1061 H LEU 45 H LEU 45 -13.668 3.791 2.222 1062 HA LEU 45 HA LEU 45 -14.292 3.398 -0.417 1063 HB2 LEU 45 HB3 LEU 45 -14.044 1.504 0.915 1064 HB3 LEU 45 HB2 LEU 45 -15.212 2.066 2.098 1065 HG LEU 45 HG LEU 45 -16.995 1.813 0.617 1066 HD11 LEU 45 HD11 LEU 45 -14.886 1.689 -1.445 1067 HD12 LEU 45 HD12 LEU 45 -16.621 2.050 -1.562 1068 HD13 LEU 45 HD13 LEU 45 -16.084 0.383 -1.630 1069 HD21 LEU 45 HD21 LEU 45 -17.041 -0.593 0.367 1070 HD22 LEU 45 HD22 LEU 45 -16.192 -0.167 1.845 1071 HD23 LEU 45 HD23 LEU 45 -15.284 -0.659 0.390 1072 H ASP 46 H ASP 46 -16.555 4.304 2.163 1073 HA ASP 46 HA ASP 46 -18.787 4.274 0.443 1074 HB2 ASP 46 HB3 ASP 46 -18.808 4.116 2.846 1075 HB3 ASP 46 HB2 ASP 46 -18.528 5.863 2.996 1076 H ALA 47 H ALA 47 -16.536 6.768 1.320 1077 HA ALA 47 HA ALA 47 -17.834 8.992 0.158 1078 HB1 ALA 47 HB1 ALA 47 -15.451 9.903 0.028 1079 HB2 ALA 47 HB2 ALA 47 -14.942 8.408 0.791 1080 HB3 ALA 47 HB3 ALA 47 -16.052 9.497 1.629 1081 H GLN 48 H GLN 48 -15.745 6.517 -1.172 1082 HA GLN 48 HA GLN 48 -15.701 7.926 -3.732 1083 HB2 GLN 48 HB3 GLN 48 -13.808 6.464 -4.329 1084 HB3 GLN 48 HB2 GLN 48 -13.520 7.361 -2.843 1085 HG2 GLN 48 HG3 GLN 48 -12.881 5.205 -2.159 1086 HG3 GLN 48 HG2 GLN 48 -14.577 5.219 -1.712 1087 HE21 GLN 48 HE21 GLN 48 -15.807 3.574 -2.480 1088 HE22 GLN 48 HE22 GLN 48 -15.406 2.595 -3.807 1089 H LYS 49 H LYS 49 -17.934 6.018 -2.671 1090 HA LYS 49 HA LYS 49 -18.011 3.743 -4.337 1091 HB2 LYS 49 HB3 LYS 49 -20.262 5.361 -3.135 1092 HB3 LYS 49 HB2 LYS 49 -20.538 3.936 -4.104 1093 HG2 LYS 49 HG3 LYS 49 -19.237 2.569 -2.567 1094 HG3 LYS 49 HG2 LYS 49 -18.865 3.985 -1.583 1095 HD2 LYS 49 HD3 LYS 49 -21.200 4.367 -1.094 1096 HD3 LYS 49 HD2 LYS 49 -21.707 3.082 -2.183 1097 HE2 LYS 49 HE2 LYS 49 -20.819 1.412 -0.820 1098 HE3 LYS 49 HE1 LYS 49 -19.917 2.528 0.211 1099 HZ1 LYS 49 HZ1 LYS 49 -21.862 3.343 1.091 1100 HZ2 LYS 49 HZ2 LYS 49 -22.132 1.691 1.149 1101 HZ3 LYS 49 HZ3 LYS 49 -22.902 2.662 -0.019 1102 H ASP 50 H ASP 50 -19.103 7.024 -4.895 1103 HA ASP 50 HA ASP 50 -19.985 6.245 -7.579 1104 HB2 ASP 50 HB3 ASP 50 -21.271 7.810 -5.796 1105 HB3 ASP 50 HB2 ASP 50 -20.388 9.047 -6.683 1106 H VAL 51 H VAL 51 -17.129 6.570 -6.772 1107 HA VAL 51 HA VAL 51 -16.390 8.724 -8.618 1108 HB VAL 51 HB VAL 51 -14.690 7.313 -6.531 1109 HG11 VAL 51 HG11 VAL 51 -13.314 9.495 -7.043 1110 HG12 VAL 51 HG12 VAL 51 -14.172 9.466 -8.575 1111 HG13 VAL 51 HG13 VAL 51 -13.143 8.109 -8.113 1112 HG21 VAL 51 HG21 VAL 51 -14.937 9.374 -5.245 1113 HG22 VAL 51 HG22 VAL 51 -16.567 8.844 -5.682 1114 HG23 VAL 51 HG23 VAL 51 -15.793 10.138 -6.574 1115 H ASP 52 H ASP 52 -17.214 5.767 -9.124 1116 HA ASP 52 HA ASP 52 -16.754 4.171 -10.692 1117 HB2 ASP 52 HB3 ASP 52 -16.694 6.065 -12.222 1118 HB3 ASP 52 HB2 ASP 52 -15.007 6.350 -11.868 1119 H ALA 53 H ALA 53 -13.770 5.783 -9.736 1120 HA ALA 53 HA ALA 53 -11.894 3.995 -10.506 1121 HB1 ALA 53 HB1 ALA 53 -10.978 5.872 -9.548 1122 HB2 ALA 53 HB2 ALA 53 -10.682 4.664 -8.298 1123 HB3 ALA 53 HB3 ALA 53 -12.013 5.798 -8.118 1124 H VAL 54 H VAL 54 -13.985 3.672 -7.701 1125 HA VAL 54 HA VAL 54 -12.719 1.602 -6.357 1126 HB VAL 54 HB VAL 54 -14.790 2.793 -5.588 1127 HG11 VAL 54 HG11 VAL 54 -16.281 1.004 -7.504 1128 HG12 VAL 54 HG12 VAL 54 -15.974 2.727 -7.756 1129 HG13 VAL 54 HG13 VAL 54 -16.960 2.202 -6.408 1130 HG21 VAL 54 HG21 VAL 54 -15.982 0.661 -4.761 1131 HG22 VAL 54 HG22 VAL 54 -14.282 0.823 -4.345 1132 HG23 VAL 54 HG23 VAL 54 -14.765 -0.244 -5.660 1133 H ASP 55 H ASP 55 -14.721 1.581 -9.243 1134 HA ASP 55 HA ASP 55 -14.970 -1.219 -9.604 1135 HB2 ASP 55 HB3 ASP 55 -16.297 0.398 -10.894 1136 HB3 ASP 55 HB2 ASP 55 -14.807 0.968 -11.665 1137 H LYS 56 H LYS 56 -12.688 1.149 -10.792 1138 HA LYS 56 HA LYS 56 -11.045 -0.587 -12.331 1139 HB2 LYS 56 HB3 LYS 56 -10.474 2.105 -11.054 1140 HB3 LYS 56 HB2 LYS 56 -9.407 1.255 -12.156 1141 HG2 LYS 56 HG3 LYS 56 -11.052 1.290 -13.941 1142 HG3 LYS 56 HG2 LYS 56 -12.255 1.999 -12.840 1143 HD2 LYS 56 HD3 LYS 56 -11.093 3.953 -12.607 1144 HD3 LYS 56 HD2 LYS 56 -9.616 3.375 -13.420 1145 HE2 LYS 56 HE2 LYS 56 -11.191 4.926 -14.781 1146 HE3 LYS 56 HE1 LYS 56 -10.725 3.438 -15.580 1147 HZ1 LYS 56 HZ1 LYS 56 -12.815 2.454 -14.845 1148 HZ2 LYS 56 HZ2 LYS 56 -13.122 3.848 -15.725 1149 HZ3 LYS 56 HZ3 LYS 56 -13.278 3.866 -14.058 1150 H VAL 57 H VAL 57 -10.871 0.624 -9.060 1151 HA VAL 57 HA VAL 57 -8.362 -0.518 -8.360 1152 HB VAL 57 HB VAL 57 -10.707 0.387 -6.646 1153 HG11 VAL 57 HG11 VAL 57 -8.136 -0.884 -5.912 1154 HG12 VAL 57 HG12 VAL 57 -9.700 -0.814 -5.086 1155 HG13 VAL 57 HG13 VAL 57 -8.613 0.562 -5.007 1156 HG21 VAL 57 HG21 VAL 57 -8.948 2.265 -6.202 1157 HG22 VAL 57 HG22 VAL 57 -9.811 2.302 -7.737 1158 HG23 VAL 57 HG23 VAL 57 -8.172 1.681 -7.670 1159 H MET 58 H MET 58 -11.699 -1.437 -7.976 1160 HA MET 58 HA MET 58 -11.361 -3.955 -6.767 1161 HB2 MET 58 HB3 MET 58 -13.526 -2.850 -6.858 1162 HB3 MET 58 HB2 MET 58 -13.502 -2.870 -8.621 1163 HG2 MET 58 HG3 MET 58 -13.441 -5.226 -8.616 1164 HG3 MET 58 HG2 MET 58 -13.474 -5.307 -6.835 1165 HE1 MET 58 HE1 MET 58 -14.799 -4.116 -9.963 1166 HE2 MET 58 HE2 MET 58 -16.079 -3.014 -9.478 1167 HE3 MET 58 HE3 MET 58 -16.490 -4.640 -9.976 1168 H LYS 59 H LYS 59 -11.316 -2.796 -10.090 1169 HA LYS 59 HA LYS 59 -11.526 -5.216 -11.462 1170 HB2 LYS 59 HB3 LYS 59 -11.498 -2.709 -12.336 1171 HB3 LYS 59 HB2 LYS 59 -9.792 -2.998 -12.474 1172 HG2 LYS 59 HG3 LYS 59 -10.623 -3.596 -14.603 1173 HG3 LYS 59 HG2 LYS 59 -10.322 -5.110 -13.775 1174 HD2 LYS 59 HD3 LYS 59 -12.531 -5.032 -14.962 1175 HD3 LYS 59 HD2 LYS 59 -12.680 -5.411 -13.250 1176 HE2 LYS 59 HE2 LYS 59 -12.823 -2.495 -13.959 1177 HE3 LYS 59 HE1 LYS 59 -14.156 -3.483 -14.501 1178 HZ1 LYS 59 HZ1 LYS 59 -14.081 -4.379 -12.025 1179 HZ2 LYS 59 HZ2 LYS 59 -14.870 -2.953 -12.422 1180 HZ3 LYS 59 HZ3 LYS 59 -13.355 -2.880 -11.730 1181 H GLU 60 H GLU 60 -8.639 -3.390 -10.499 1182 HA GLU 60 HA GLU 60 -6.797 -5.195 -11.574 1183 HB2 GLU 60 HB3 GLU 60 -6.603 -3.157 -9.394 1184 HB3 GLU 60 HB2 GLU 60 -5.215 -4.101 -9.931 1185 HG2 GLU 60 HG3 GLU 60 -5.574 -3.279 -12.239 1186 HG3 GLU 60 HG2 GLU 60 -6.951 -2.340 -11.698 1187 H LEU 61 H LEU 61 -8.230 -4.979 -8.373 1188 HA LEU 61 HA LEU 61 -6.722 -7.135 -7.280 1189 HB2 LEU 61 HB3 LEU 61 -9.267 -5.762 -6.472 1190 HB3 LEU 61 HB2 LEU 61 -8.827 -7.279 -5.709 1191 HG LEU 61 HG LEU 61 -8.008 -5.111 -4.565 1192 HD11 LEU 61 HD11 LEU 61 -7.216 -7.338 -3.962 1193 HD12 LEU 61 HD12 LEU 61 -5.921 -6.148 -3.867 1194 HD13 LEU 61 HD13 LEU 61 -5.991 -7.257 -5.234 1195 HD21 LEU 61 HD21 LEU 61 -5.991 -4.084 -5.436 1196 HD22 LEU 61 HD22 LEU 61 -7.149 -4.091 -6.740 1197 HD23 LEU 61 HD23 LEU 61 -5.846 -5.275 -6.717 1198 H ASP 62 H ASP 62 -9.751 -6.925 -9.052 1199 HA ASP 62 HA ASP 62 -10.416 -9.686 -8.861 1200 HB2 ASP 62 HB3 ASP 62 -11.995 -7.878 -9.607 1201 HB3 ASP 62 HB2 ASP 62 -11.149 -7.844 -11.150 1202 H GLU 63 H GLU 63 -8.494 -7.796 -11.150 1203 HA GLU 63 HA GLU 63 -7.998 -9.838 -13.053 1204 HB2 GLU 63 HB3 GLU 63 -6.279 -7.500 -12.163 1205 HB3 GLU 63 HB2 GLU 63 -5.875 -8.536 -13.527 1206 HG2 GLU 63 HG3 GLU 63 -7.938 -7.891 -14.675 1207 HG3 GLU 63 HG2 GLU 63 -8.423 -6.965 -13.236 1208 H ASN 64 H ASN 64 -6.454 -8.862 -10.096 1209 HA ASN 64 HA ASN 64 -4.585 -11.118 -10.085 1210 HB2 ASN 64 HB3 ASN 64 -5.051 -8.721 -8.331 1211 HB3 ASN 64 HB2 ASN 64 -3.963 -10.054 -7.868 1212 HD21 ASN 64 HD21 ASN 64 -2.183 -10.511 -9.555 1213 HD22 ASN 64 HD22 ASN 64 -1.558 -9.190 -10.417 1214 H GLY 65 H GLY 65 -7.685 -11.138 -9.795 1215 HA2 GLY 65 HA3 GLY 65 -7.912 -12.277 -7.106 1216 HA3 GLY 65 HA2 GLY 65 -9.233 -11.673 -8.104 1217 H ASP 66 H ASP 66 -6.789 -13.748 -9.473 1218 HA ASP 66 HA ASP 66 -8.669 -15.656 -10.369 1219 HB2 ASP 66 HB3 ASP 66 -6.391 -15.304 -11.344 1220 HB3 ASP 66 HB2 ASP 66 -5.725 -16.131 -9.940 1221 H GLY 67 H GLY 67 -6.520 -15.579 -7.586 1222 HA2 GLY 67 HA3 GLY 67 -8.068 -17.796 -6.413 1223 HA3 GLY 67 HA2 GLY 67 -6.308 -17.858 -6.432 1224 H GLU 68 H GLU 68 -5.220 -15.893 -5.422 1225 HA GLU 68 HA GLU 68 -6.804 -14.878 -3.175 1226 HB2 GLU 68 HB3 GLU 68 -4.097 -16.211 -2.935 1227 HB3 GLU 68 HB2 GLU 68 -4.835 -15.294 -1.647 1228 HG2 GLU 68 HG3 GLU 68 -5.730 -17.320 -1.053 1229 HG3 GLU 68 HG2 GLU 68 -6.915 -16.878 -2.244 1230 H VAL 69 H VAL 69 -5.377 -13.309 -1.873 1231 HA VAL 69 HA VAL 69 -3.988 -11.468 -3.685 1232 HB VAL 69 HB VAL 69 -6.072 -10.473 -3.425 1233 HG11 VAL 69 HG11 VAL 69 -6.001 -11.174 -0.465 1234 HG12 VAL 69 HG12 VAL 69 -6.999 -11.985 -1.654 1235 HG13 VAL 69 HG13 VAL 69 -7.257 -10.282 -1.285 1236 HG21 VAL 69 HG21 VAL 69 -5.550 -8.841 -1.261 1237 HG22 VAL 69 HG22 VAL 69 -4.987 -8.559 -2.889 1238 HG23 VAL 69 HG23 VAL 69 -3.934 -9.345 -1.715 1239 H ASP 70 H ASP 70 -2.141 -10.636 -2.862 1240 HA ASP 70 HA ASP 70 -1.354 -11.577 -0.187 1241 HB2 ASP 70 HB3 ASP 70 0.966 -10.830 -0.976 1242 HB3 ASP 70 HB2 ASP 70 0.318 -12.311 -1.611 1243 H PHE 71 H PHE 71 0.477 -10.061 0.592 1244 HA PHE 71 HA PHE 71 -0.831 -7.839 1.687 1245 HB2 PHE 71 HB3 PHE 71 1.175 -8.981 2.686 1246 HB3 PHE 71 HB2 PHE 71 2.162 -8.174 1.456 1247 HD1 PHE 71 HD1 PHE 71 -0.524 -7.372 3.927 1248 HD2 PHE 71 HD2 PHE 71 3.153 -6.083 2.086 1249 HE1 PHE 71 HE1 PHE 71 -0.491 -5.390 5.367 1250 HE2 PHE 71 HE2 PHE 71 3.157 -4.085 3.565 1251 HZ PHE 71 HZ PHE 71 1.374 -3.734 5.176 1252 H GLN 72 H GLN 72 1.493 -8.107 -0.976 1253 HA GLN 72 HA GLN 72 1.722 -5.364 -1.499 1254 HB2 GLN 72 HB3 GLN 72 2.267 -7.814 -3.109 1255 HB3 GLN 72 HB2 GLN 72 2.399 -6.207 -3.874 1256 HG2 GLN 72 HG3 GLN 72 3.994 -5.569 -2.113 1257 HG3 GLN 72 HG2 GLN 72 3.810 -7.144 -1.348 1258 HE21 GLN 72 HE21 GLN 72 3.630 -7.799 -4.620 1259 HE22 GLN 72 HE22 GLN 72 5.273 -8.072 -4.912 1260 H GLU 73 H GLU 73 -0.629 -7.762 -2.731 1261 HA GLU 73 HA GLU 73 -1.956 -5.870 -4.451 1262 HB2 GLU 73 HB3 GLU 73 -2.993 -8.363 -3.112 1263 HB3 GLU 73 HB2 GLU 73 -3.933 -7.382 -4.249 1264 HG2 GLU 73 HG3 GLU 73 -2.202 -7.816 -5.967 1265 HG3 GLU 73 HG2 GLU 73 -1.347 -8.849 -4.810 1266 H TYR 74 H TYR 74 -2.343 -6.967 -1.135 1267 HA TYR 74 HA TYR 74 -4.716 -5.650 -0.484 1268 HB2 TYR 74 HB3 TYR 74 -3.845 -7.393 0.918 1269 HB3 TYR 74 HB2 TYR 74 -2.379 -6.476 1.217 1270 HD1 TYR 74 HD1 TYR 74 -6.140 -5.881 1.541 1271 HD2 TYR 74 HD2 TYR 74 -2.217 -5.489 3.325 1272 HE1 TYR 74 HE1 TYR 74 -7.138 -4.922 3.542 1273 HE2 TYR 74 HE2 TYR 74 -3.257 -4.515 5.326 1274 HH TYR 74 HH TYR 74 -6.311 -4.842 6.138 1275 H VAL 75 H VAL 75 -1.377 -4.601 0.052 1276 HA VAL 75 HA VAL 75 -2.109 -2.146 1.214 1277 HB VAL 75 HB VAL 75 0.236 -1.423 0.780 1278 HG11 VAL 75 HG11 VAL 75 1.099 -2.802 2.460 1279 HG12 VAL 75 HG12 VAL 75 0.266 -4.236 1.879 1280 HG13 VAL 75 HG13 VAL 75 -0.629 -2.979 2.718 1281 HG21 VAL 75 HG21 VAL 75 0.091 -3.627 -1.121 1282 HG22 VAL 75 HG22 VAL 75 1.356 -3.925 0.019 1283 HG23 VAL 75 HG23 VAL 75 1.365 -2.431 -0.933 1284 H VAL 76 H VAL 76 -1.392 -2.934 -2.195 1285 HA VAL 76 HA VAL 76 -1.619 -0.234 -3.036 1286 HB VAL 76 HB VAL 76 -0.469 -2.007 -4.395 1287 HG11 VAL 76 HG11 VAL 76 -3.280 -2.984 -4.955 1288 HG12 VAL 76 HG12 VAL 76 -2.035 -3.833 -4.031 1289 HG13 VAL 76 HG13 VAL 76 -1.801 -3.520 -5.741 1290 HG21 VAL 76 HG21 VAL 76 -1.336 -1.211 -6.574 1291 HG22 VAL 76 HG22 VAL 76 -1.241 0.119 -5.427 1292 HG23 VAL 76 HG23 VAL 76 -2.796 -0.624 -5.775 1293 H LEU 77 H LEU 77 -3.904 -2.888 -2.669 1294 HA LEU 77 HA LEU 77 -6.105 -1.696 -3.948 1295 HB2 LEU 77 HB3 LEU 77 -6.081 -4.054 -3.280 1296 HB3 LEU 77 HB2 LEU 77 -6.033 -3.578 -1.589 1297 HG LEU 77 HG LEU 77 -8.256 -2.467 -1.821 1298 HD11 LEU 77 HD11 LEU 77 -8.466 -1.681 -3.843 1299 HD12 LEU 77 HD12 LEU 77 -9.469 -3.123 -4.037 1300 HD13 LEU 77 HD13 LEU 77 -7.823 -3.083 -4.692 1301 HD21 LEU 77 HD21 LEU 77 -9.509 -4.685 -2.579 1302 HD22 LEU 77 HD22 LEU 77 -8.575 -4.650 -1.085 1303 HD23 LEU 77 HD23 LEU 77 -7.877 -5.360 -2.533 1304 H VAL 78 H VAL 78 -5.148 -1.669 -0.524 1305 HA VAL 78 HA VAL 78 -7.260 0.086 0.160 1306 HB VAL 78 HB VAL 78 -6.211 0.309 2.353 1307 HG11 VAL 78 HG11 VAL 78 -5.701 -2.477 2.318 1308 HG12 VAL 78 HG12 VAL 78 -6.861 -2.199 1.033 1309 HG13 VAL 78 HG13 VAL 78 -7.225 -1.681 2.687 1310 HG21 VAL 78 HG21 VAL 78 -3.868 -1.003 0.956 1311 HG22 VAL 78 HG22 VAL 78 -4.101 -1.154 2.690 1312 HG23 VAL 78 HG23 VAL 78 -3.866 0.439 1.980 1313 H ALA 79 H ALA 79 -3.884 0.558 -0.647 1314 HA ALA 79 HA ALA 79 -3.791 3.365 -0.237 1315 HB1 ALA 79 HB1 ALA 79 -1.791 3.342 -1.483 1316 HB2 ALA 79 HB2 ALA 79 -2.265 1.881 -2.350 1317 HB3 ALA 79 HB3 ALA 79 -1.831 1.792 -0.642 1318 H ALA 80 H ALA 80 -4.614 1.364 -3.036 1319 HA ALA 80 HA ALA 80 -4.837 3.343 -4.942 1320 HB1 ALA 80 HB1 ALA 80 -6.520 1.792 -6.042 1321 HB2 ALA 80 HB2 ALA 80 -6.380 0.766 -4.617 1322 HB3 ALA 80 HB3 ALA 80 -4.979 1.042 -5.636 1323 H LEU 81 H LEU 81 -7.313 2.050 -2.743 1324 HA LEU 81 HA LEU 81 -9.350 3.878 -3.496 1325 HB2 LEU 81 HB3 LEU 81 -8.891 2.276 -0.997 1326 HB3 LEU 81 HB2 LEU 81 -10.316 3.287 -1.209 1327 HG LEU 81 HG LEU 81 -9.493 1.049 -3.122 1328 HD11 LEU 81 HD11 LEU 81 -10.871 0.933 -0.577 1329 HD12 LEU 81 HD12 LEU 81 -10.403 -0.367 -1.671 1330 HD13 LEU 81 HD13 LEU 81 -11.942 0.441 -1.891 1331 HD21 LEU 81 HD21 LEU 81 -12.142 1.529 -3.533 1332 HD22 LEU 81 HD22 LEU 81 -10.868 2.283 -4.470 1333 HD23 LEU 81 HD23 LEU 81 -11.593 3.150 -3.122 1334 H THR 82 H THR 82 -6.856 3.884 -1.007 1335 HA THR 82 HA THR 82 -7.688 6.215 0.328 1336 HB THR 82 HB THR 82 -4.821 5.265 0.094 1337 HG1 THR 82 HG2 THR 82 -6.368 3.543 0.682 1338 HG21 THR 82 HG21 THR 82 -4.545 7.020 1.492 1339 HG22 THR 82 HG22 THR 82 -5.323 6.028 2.707 1340 HG23 THR 82 HG23 THR 82 -6.269 7.178 1.789 1341 H VAL 83 H VAL 83 -5.276 5.799 -2.266 1342 HA VAL 83 HA VAL 83 -4.594 8.531 -2.431 1343 HB VAL 83 HB VAL 83 -3.224 6.744 -3.401 1344 HG11 VAL 83 HG11 VAL 83 -5.286 6.586 -5.597 1345 HG12 VAL 83 HG12 VAL 83 -5.038 5.375 -4.323 1346 HG13 VAL 83 HG13 VAL 83 -3.766 5.709 -5.489 1347 HG21 VAL 83 HG21 VAL 83 -4.066 8.579 -5.646 1348 HG22 VAL 83 HG22 VAL 83 -2.483 7.896 -5.344 1349 HG23 VAL 83 HG23 VAL 83 -3.107 9.171 -4.284 1350 H ALA 84 H ALA 84 -7.005 6.653 -4.227 1351 HA ALA 84 HA ALA 84 -7.819 8.709 -5.959 1352 HB1 ALA 84 HB1 ALA 84 -8.532 6.375 -6.283 1353 HB2 ALA 84 HB2 ALA 84 -9.921 7.440 -6.204 1354 HB3 ALA 84 HB3 ALA 84 -9.493 6.454 -4.811 1355 H MET 85 H MET 85 -9.123 7.711 -2.817 1356 HA MET 85 HA MET 85 -11.011 9.820 -2.628 1357 HB2 MET 85 HB3 MET 85 -10.443 7.528 -1.161 1358 HB3 MET 85 HB2 MET 85 -10.026 8.840 -0.070 1359 HG2 MET 85 HG3 MET 85 -12.621 9.181 -1.518 1360 HG3 MET 85 HG2 MET 85 -12.541 7.873 -0.364 1361 HE1 MET 85 HE1 MET 85 -13.433 11.081 -1.055 1362 HE2 MET 85 HE2 MET 85 -12.010 11.991 -0.565 1363 HE3 MET 85 HE3 MET 85 -13.449 12.033 0.431 1364 H ASN 86 H ASN 86 -7.728 9.396 -1.340 1365 HA ASN 86 HA ASN 86 -7.681 11.848 0.053 1366 HB2 ASN 86 HB3 ASN 86 -5.474 10.022 -0.894 1367 HB3 ASN 86 HB2 ASN 86 -5.120 11.569 -0.166 1368 HD21 ASN 86 HD21 ASN 86 -7.261 11.627 1.898 1369 HD22 ASN 86 HD22 ASN 86 -6.889 10.386 2.950 1370 H ASN 87 H ASN 87 -6.807 11.042 -3.232 1371 HA ASN 87 HA ASN 87 -5.599 13.422 -3.987 1372 HB2 ASN 87 HB3 ASN 87 -5.703 11.662 -5.570 1373 HB3 ASN 87 HB2 ASN 87 -7.454 11.588 -5.506 1374 HD21 ASN 87 HD21 ASN 87 -4.822 13.934 -6.375 1375 HD22 ASN 87 HD22 ASN 87 -5.737 14.693 -7.585 1376 H PHE 88 H PHE 88 -9.013 12.725 -3.534 1377 HA PHE 88 HA PHE 88 -9.982 15.260 -4.422 1378 HB2 PHE 88 HB3 PHE 88 -11.171 13.265 -2.471 1379 HB3 PHE 88 HB2 PHE 88 -11.965 14.748 -2.951 1380 HD1 PHE 88 HD1 PHE 88 -12.439 15.196 -5.400 1381 HD2 PHE 88 HD2 PHE 88 -11.155 11.386 -3.918 1382 HE1 PHE 88 HE1 PHE 88 -13.241 14.121 -7.479 1383 HE2 PHE 88 HE2 PHE 88 -11.941 10.300 -5.961 1384 HZ PHE 88 HZ PHE 88 -13.003 11.659 -7.772 1385 H PHE 89 H PHE 89 -8.889 14.040 -1.300 1386 HA PHE 89 HA PHE 89 -9.425 16.399 0.175 1387 HB2 PHE 89 HB3 PHE 89 -7.457 14.134 0.598 1388 HB3 PHE 89 HB2 PHE 89 -7.440 15.545 1.615 1389 HD1 PHE 89 HD1 PHE 89 -9.342 16.156 3.028 1390 HD2 PHE 89 HD2 PHE 89 -9.373 12.509 0.732 1391 HE1 PHE 89 HE1 PHE 89 -11.228 15.294 4.392 1392 HE2 PHE 89 HE2 PHE 89 -11.247 11.671 2.108 1393 HZ PHE 89 HZ PHE 89 -12.172 13.041 3.921 1394 H TRP 90 H TRP 90 -6.645 15.369 -1.745 1395 HA TRP 90 HA TRP 90 -5.004 17.624 -1.066 1396 HB2 TRP 90 HB3 TRP 90 -4.849 16.157 -3.694 1397 HB3 TRP 90 HB2 TRP 90 -3.550 16.935 -2.796 1398 HD1 TRP 90 HD TRP 90 -4.953 15.428 -0.026 1399 HE1 TRP 90 HE1 TRP 90 -4.185 13.099 0.423 1400 HE3 TRP 90 HE3 TRP 90 -3.023 14.290 -4.606 1401 HZ2 TRP 90 HZ2 TRP 90 -2.858 10.908 -0.982 1402 HZ3 TRP 90 HZ3 TRP 90 -1.998 12.049 -5.015 1403 HH2 TRP 90 HH TRP 90 -1.923 10.376 -3.201 1404 H GLU 91 H GLU 91 -6.946 16.858 -3.850 1405 HA GLU 91 HA GLU 91 -6.565 19.422 -5.097 1406 HB2 GLU 91 HB3 GLU 91 -8.500 17.223 -5.623 1407 HB3 GLU 91 HB2 GLU 91 -8.370 18.660 -6.646 1408 HG2 GLU 91 HG3 GLU 91 -5.983 18.199 -7.027 1409 HG3 GLU 91 HG2 GLU 91 -6.072 16.764 -6.021 1410 H ASN 92 H ASN 92 -9.318 17.971 -3.362 1411 HA ASN 92 HA ASN 92 -10.675 20.566 -3.387 1412 HB2 ASN 92 HB3 ASN 92 -11.999 18.609 -4.082 1413 HB3 ASN 92 HB2 ASN 92 -11.671 17.851 -2.520 1414 HD21 ASN 92 HD21 ASN 92 -14.240 18.018 -2.667 1415 HD22 ASN 92 HD22 ASN 92 -14.913 19.393 -1.946 1416 H SER 93 H SER 93 -9.751 21.710 -1.822 1417 HA SER 93 HA SER 93 -10.152 20.919 0.931 1418 HB2 SER 93 HB3 SER 93 -7.624 20.581 -0.444 1419 HB3 SER 93 HB2 SER 93 -7.450 21.574 1.015 1420 HG SER 93 HG SER 93 -7.877 18.948 0.609 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -12.750 5.339 10.038 2 HA2 GLY 1 HA3 GLY 1 -13.255 2.715 8.818 3 HA3 GLY 1 HA2 GLY 1 -11.919 3.696 8.257 4 H SER 2 H SER 2 -11.219 1.342 9.153 5 HA SER 2 HA SER 2 -10.581 1.294 11.974 6 HB2 SER 2 HB3 SER 2 -9.402 -0.334 9.755 7 HB3 SER 2 HB2 SER 2 -9.449 -0.756 11.462 8 HG SER 2 HG SER 2 -11.013 -1.769 10.114 9 H GLU 3 H GLU 3 -8.095 0.751 12.421 10 HA GLU 3 HA GLU 3 -6.604 3.083 12.216 11 HB2 GLU 3 HB3 GLU 3 -5.428 0.294 12.208 12 HB3 GLU 3 HB2 GLU 3 -4.669 1.774 12.775 13 HG2 GLU 3 HG3 GLU 3 -5.345 0.901 14.730 14 HG3 GLU 3 HG2 GLU 3 -6.778 1.878 14.399 15 H LEU 4 H LEU 4 -7.351 0.753 9.894 16 HA LEU 4 HA LEU 4 -5.210 0.604 8.205 17 HB2 LEU 4 HB3 LEU 4 -7.643 -0.474 8.221 18 HB3 LEU 4 HB2 LEU 4 -7.972 0.812 7.074 19 HG LEU 4 HG LEU 4 -7.311 -1.039 5.759 20 HD11 LEU 4 HD11 LEU 4 -6.141 1.052 5.159 21 HD12 LEU 4 HD12 LEU 4 -5.257 -0.399 4.712 22 HD13 LEU 4 HD13 LEU 4 -4.754 0.532 6.119 23 HD21 LEU 4 HD21 LEU 4 -5.215 -1.431 7.891 24 HD22 LEU 4 HD22 LEU 4 -5.140 -2.293 6.341 25 HD23 LEU 4 HD23 LEU 4 -6.523 -2.495 7.415 26 H GLU 5 H GLU 5 -7.902 2.937 8.241 27 HA GLU 5 HA GLU 5 -6.977 4.414 6.015 28 HB2 GLU 5 HB3 GLU 5 -8.904 5.115 8.233 29 HB3 GLU 5 HB2 GLU 5 -8.603 6.192 6.878 30 HG2 GLU 5 HG3 GLU 5 -9.229 4.330 5.312 31 HG3 GLU 5 HG2 GLU 5 -9.620 3.342 6.693 32 H THR 6 H THR 6 -6.501 4.806 9.495 33 HA THR 6 HA THR 6 -4.990 7.201 9.334 34 HB THR 6 HB THR 6 -4.590 5.031 11.408 35 HG1 THR 6 HG2 THR 6 -6.428 5.695 12.346 36 HG21 THR 6 HG21 THR 6 -3.035 6.757 11.732 37 HG22 THR 6 HG22 THR 6 -4.368 7.199 12.803 38 HG23 THR 6 HG23 THR 6 -4.178 8.013 11.261 39 H ALA 7 H ALA 7 -4.078 3.774 9.329 40 HA ALA 7 HA ALA 7 -1.302 4.109 9.215 41 HB1 ALA 7 HB1 ALA 7 -2.294 1.927 9.597 42 HB2 ALA 7 HB2 ALA 7 -1.278 1.850 8.157 43 HB3 ALA 7 HB3 ALA 7 -3.033 1.940 7.997 44 H MET 8 H MET 8 -3.685 3.793 6.588 45 HA MET 8 HA MET 8 -1.786 4.153 4.506 46 HB2 MET 8 HB3 MET 8 -4.788 4.598 4.474 47 HB3 MET 8 HB2 MET 8 -3.761 4.571 3.056 48 HG2 MET 8 HG3 MET 8 -4.149 2.276 5.017 49 HG3 MET 8 HG2 MET 8 -4.753 2.347 3.382 50 HE1 MET 8 HE1 MET 8 -3.526 2.887 1.549 51 HE2 MET 8 HE2 MET 8 -2.395 1.612 1.097 52 HE3 MET 8 HE3 MET 8 -1.771 3.201 1.510 53 H GLU 9 H GLU 9 -3.881 6.465 6.248 54 HA GLU 9 HA GLU 9 -3.096 8.640 4.648 55 HB2 GLU 9 HB3 GLU 9 -4.270 8.564 7.430 56 HB3 GLU 9 HB2 GLU 9 -3.833 10.069 6.637 57 HG2 GLU 9 HG3 GLU 9 -5.300 9.513 4.735 58 HG3 GLU 9 HG2 GLU 9 -5.753 8.002 5.514 59 H THR 10 H THR 10 -1.697 7.175 7.487 60 HA THR 10 HA THR 10 0.218 9.184 8.053 61 HB THR 10 HB THR 10 0.699 6.195 8.314 62 HG1 THR 10 HG2 THR 10 -1.363 6.913 9.250 63 HG21 THR 10 HG21 THR 10 1.620 8.451 10.112 64 HG22 THR 10 HG22 THR 10 2.563 7.907 8.737 65 HG23 THR 10 HG23 THR 10 2.208 6.794 10.053 66 H LEU 11 H LEU 11 0.212 6.441 5.812 67 HA LEU 11 HA LEU 11 2.766 6.960 4.682 68 HB2 LEU 11 HB3 LEU 11 0.330 5.520 3.597 69 HB3 LEU 11 HB2 LEU 11 1.854 5.592 2.729 70 HG LEU 11 HG LEU 11 1.632 4.507 5.560 71 HD11 LEU 11 HD11 LEU 11 0.591 3.295 3.235 72 HD12 LEU 11 HD12 LEU 11 0.921 2.528 4.773 73 HD13 LEU 11 HD13 LEU 11 2.142 2.507 3.510 74 HD21 LEU 11 HD21 LEU 11 3.830 3.567 5.094 75 HD22 LEU 11 HD22 LEU 11 3.939 5.277 4.690 76 HD23 LEU 11 HD23 LEU 11 3.757 4.077 3.426 77 H ILE 12 H ILE 12 -0.499 8.087 3.915 78 HA ILE 12 HA ILE 12 0.146 9.454 1.520 79 HB ILE 12 HB ILE 12 -2.000 10.055 3.591 80 HG12 ILE 12 HG13 ILE 12 -2.140 7.830 2.300 81 HG13 ILE 12 HG12 ILE 12 -3.519 8.906 2.123 82 HG21 ILE 12 HG21 ILE 12 -1.366 11.378 1.003 83 HG22 ILE 12 HG22 ILE 12 -1.910 12.075 2.519 84 HG23 ILE 12 HG23 ILE 12 -3.052 11.211 1.487 85 HD11 ILE 12 HD11 ILE 12 -3.107 9.320 -0.059 86 HD12 ILE 12 HD12 ILE 12 -2.293 7.777 0.037 87 HD13 ILE 12 HD13 ILE 12 -1.346 9.254 0.086 88 H ASN 13 H ASN 13 0.094 10.513 4.882 89 HA ASN 13 HA ASN 13 0.695 13.230 4.407 90 HB2 ASN 13 HB3 ASN 13 1.101 11.446 6.799 91 HB3 ASN 13 HB2 ASN 13 1.608 13.125 6.807 92 HD21 ASN 13 HD21 ASN 13 -1.224 11.049 6.748 93 HD22 ASN 13 HD22 ASN 13 -2.355 12.294 6.968 94 H VAL 14 H VAL 14 2.792 10.459 4.973 95 HA VAL 14 HA VAL 14 5.233 11.911 4.847 96 HB VAL 14 HB VAL 14 4.613 9.002 4.263 97 HG11 VAL 14 HG11 VAL 14 7.159 8.803 4.720 98 HG12 VAL 14 HG12 VAL 14 7.208 10.534 4.425 99 HG13 VAL 14 HG13 VAL 14 6.680 9.445 3.143 100 HG21 VAL 14 HG21 VAL 14 5.173 8.583 6.483 101 HG22 VAL 14 HG22 VAL 14 4.352 10.130 6.654 102 HG23 VAL 14 HG23 VAL 14 6.112 10.056 6.654 103 H PHE 15 H PHE 15 3.211 10.270 2.463 104 HA PHE 15 HA PHE 15 4.855 10.634 0.210 105 HB2 PHE 15 HB3 PHE 15 2.801 9.205 0.251 106 HB3 PHE 15 HB2 PHE 15 1.822 10.659 0.330 107 HD1 PHE 15 HD1 PHE 15 4.331 8.863 -1.760 108 HD2 PHE 15 HD2 PHE 15 1.303 11.910 -1.638 109 HE1 PHE 15 HE1 PHE 15 4.435 9.068 -4.222 110 HE2 PHE 15 HE2 PHE 15 1.418 12.120 -4.092 111 HZ PHE 15 HZ PHE 15 2.981 10.705 -5.389 112 H HIS 16 H HIS 16 2.298 12.668 1.554 113 HA HIS 16 HA HIS 16 2.631 14.838 -0.263 114 HB2 HIS 16 HB3 HIS 16 1.288 14.526 2.367 115 HB3 HIS 16 HB2 HIS 16 1.774 16.152 1.933 116 HD1 HIS 16 HD1 HIS 16 0.934 17.023 -0.486 117 HD2 HIS 16 HD2 HIS 16 -1.015 13.666 1.035 118 HE1 HIS 16 HE1 HIS 16 -1.232 16.813 -1.772 119 HE2 HIS 16 HE2 HIS 16 -2.429 14.764 -0.860 120 H ALA 17 H ALA 17 4.057 14.132 2.885 121 HA ALA 17 HA ALA 17 5.381 16.504 3.322 122 HB1 ALA 17 HB1 ALA 17 6.646 13.835 3.968 123 HB2 ALA 17 HB2 ALA 17 5.269 14.474 4.862 124 HB3 ALA 17 HB3 ALA 17 6.796 15.362 4.842 125 H HIS 18 H HIS 18 6.581 13.705 1.530 126 HA HIS 18 HA HIS 18 8.911 15.180 0.655 127 HB2 HIS 18 HB3 HIS 18 7.897 12.455 -0.173 128 HB3 HIS 18 HB2 HIS 18 9.317 13.267 -0.850 129 HD1 HIS 18 HD1 HIS 18 11.474 13.560 0.656 130 HD2 HIS 18 HD2 HIS 18 8.275 11.591 2.552 131 HE1 HIS 18 HE1 HIS 18 12.366 12.624 2.779 132 HE2 HIS 18 HE2 HIS 18 10.470 11.407 3.956 133 H SER 19 H SER 19 5.721 14.550 -0.634 134 HA SER 19 HA SER 19 6.133 15.042 -3.308 135 HB2 SER 19 HB3 SER 19 3.783 15.976 -1.635 136 HB3 SER 19 HB2 SER 19 3.803 15.944 -3.375 137 HG SER 19 HG SER 19 4.294 13.643 -1.710 138 H GLY 20 H GLY 20 5.737 17.405 -0.721 139 HA2 GLY 20 HA3 GLY 20 5.687 19.747 -2.287 140 HA3 GLY 20 HA2 GLY 20 6.179 19.656 -0.615 141 H LYS 21 H LYS 21 8.317 17.698 -1.243 142 HA LYS 21 HA LYS 21 10.388 19.564 -1.371 143 HB2 LYS 21 HB3 LYS 21 10.437 16.560 -1.591 144 HB3 LYS 21 HB2 LYS 21 11.868 17.560 -1.466 145 HG2 LYS 21 HG3 LYS 21 11.104 18.522 0.642 146 HG3 LYS 21 HG2 LYS 21 9.608 17.589 0.563 147 HD2 LYS 21 HD3 LYS 21 10.959 15.492 0.582 148 HD3 LYS 21 HD2 LYS 21 12.413 16.462 0.768 149 HE2 LYS 21 HE2 LYS 21 10.084 16.611 2.709 150 HE3 LYS 21 HE1 LYS 21 11.463 15.547 2.941 151 HZ1 LYS 21 HZ1 LYS 21 11.536 18.517 2.754 152 HZ2 LYS 21 HZ2 LYS 21 12.912 17.523 2.787 153 HZ3 LYS 21 HZ3 LYS 21 11.859 17.552 4.099 154 H GLU 22 H GLU 22 9.181 17.380 -3.932 155 HA GLU 22 HA GLU 22 10.619 19.064 -5.854 156 HB2 GLU 22 HB3 GLU 22 11.072 16.484 -6.886 157 HB3 GLU 22 HB2 GLU 22 12.259 17.600 -6.223 158 HG2 GLU 22 HG3 GLU 22 12.655 15.793 -4.871 159 HG3 GLU 22 HG2 GLU 22 11.413 16.501 -3.876 160 H GLY 23 H GLY 23 8.587 16.184 -5.649 161 HA2 GLY 23 HA3 GLY 23 7.626 16.217 -8.245 162 HA3 GLY 23 HA2 GLY 23 6.778 15.511 -6.877 163 H ASP 24 H ASP 24 5.104 16.295 -8.592 164 HA ASP 24 HA ASP 24 4.306 19.001 -8.724 165 HB2 ASP 24 HB3 ASP 24 3.454 17.358 -10.293 166 HB3 ASP 24 HB2 ASP 24 2.658 16.466 -9.005 167 H LYS 25 H LYS 25 2.289 19.886 -7.708 168 HA LYS 25 HA LYS 25 2.522 20.221 -5.040 169 HB2 LYS 25 HB3 LYS 25 -0.123 20.342 -5.023 170 HB3 LYS 25 HB2 LYS 25 0.850 21.615 -5.739 171 HG2 LYS 25 HG3 LYS 25 0.458 19.620 -7.796 172 HG3 LYS 25 HG2 LYS 25 -1.075 19.871 -7.005 173 HD2 LYS 25 HD3 LYS 25 -0.969 22.262 -7.349 174 HD3 LYS 25 HD2 LYS 25 0.641 22.111 -8.065 175 HE2 LYS 25 HE2 LYS 25 -0.296 20.704 -9.874 176 HE3 LYS 25 HE1 LYS 25 -1.907 20.876 -9.170 177 HZ1 LYS 25 HZ1 LYS 25 -0.293 23.247 -9.896 178 HZ2 LYS 25 HZ2 LYS 25 -1.958 23.132 -9.666 179 HZ3 LYS 25 HZ3 LYS 25 -1.247 22.468 -11.047 180 H TYR 26 H TYR 26 0.821 17.557 -6.562 181 HA TYR 26 HA TYR 26 1.356 16.050 -4.116 182 HB2 TYR 26 HB3 TYR 26 -0.801 14.788 -4.534 183 HB3 TYR 26 HB2 TYR 26 -0.955 16.373 -3.786 184 HD1 TYR 26 HD1 TYR 26 -1.758 18.342 -5.112 185 HD2 TYR 26 HD2 TYR 26 -1.628 14.392 -6.806 186 HE1 TYR 26 HE1 TYR 26 -3.209 19.091 -6.973 187 HE2 TYR 26 HE2 TYR 26 -3.063 15.149 -8.659 188 HH TYR 26 HH TYR 26 -4.746 16.926 -9.008 189 H LYS 27 H LYS 27 3.097 15.280 -5.112 190 HA LYS 27 HA LYS 27 2.754 12.819 -6.366 191 HB2 LYS 27 HB3 LYS 27 3.811 15.057 -8.084 192 HB3 LYS 27 HB2 LYS 27 4.516 13.454 -8.214 193 HG2 LYS 27 HG3 LYS 27 1.502 13.860 -8.480 194 HG3 LYS 27 HG2 LYS 27 2.590 13.977 -9.837 195 HD2 LYS 27 HD3 LYS 27 2.644 11.568 -8.032 196 HD3 LYS 27 HD2 LYS 27 1.508 11.682 -9.362 197 HE2 LYS 27 HE2 LYS 27 4.437 12.234 -9.914 198 HE3 LYS 27 HE1 LYS 27 3.886 10.578 -9.749 199 HZ1 LYS 27 HZ1 LYS 27 3.910 11.574 -12.019 200 HZ2 LYS 27 HZ2 LYS 27 2.570 12.500 -11.615 201 HZ3 LYS 27 HZ3 LYS 27 2.500 10.780 -11.589 202 H LEU 28 H LEU 28 4.936 11.722 -6.477 203 HA LEU 28 HA LEU 28 6.929 13.158 -4.853 204 HB2 LEU 28 HB3 LEU 28 5.887 11.500 -3.439 205 HB3 LEU 28 HB2 LEU 28 6.079 10.269 -4.677 206 HG LEU 28 HG LEU 28 8.576 10.541 -4.512 207 HD11 LEU 28 HD11 LEU 28 7.702 12.559 -2.464 208 HD12 LEU 28 HD12 LEU 28 8.967 12.674 -3.701 209 HD13 LEU 28 HD13 LEU 28 9.210 11.659 -2.273 210 HD21 LEU 28 HD21 LEU 28 8.770 9.492 -2.265 211 HD22 LEU 28 HD22 LEU 28 7.477 8.757 -3.221 212 HD23 LEU 28 HD23 LEU 28 7.093 9.912 -1.942 213 H SER 29 H SER 29 8.937 13.229 -5.752 214 HA SER 29 HA SER 29 9.322 11.798 -8.267 215 HB2 SER 29 HB3 SER 29 11.496 13.531 -7.113 216 HB3 SER 29 HB2 SER 29 10.984 13.220 -8.742 217 HG SER 29 HG SER 29 9.677 14.797 -6.794 218 H LYS 30 H LYS 30 11.301 10.532 -8.568 219 HA LYS 30 HA LYS 30 11.534 8.665 -6.426 220 HB2 LYS 30 HB3 LYS 30 13.380 8.916 -8.797 221 HB3 LYS 30 HB2 LYS 30 13.103 7.474 -7.823 222 HG2 LYS 30 HG3 LYS 30 11.122 8.845 -9.682 223 HG3 LYS 30 HG2 LYS 30 11.906 7.296 -9.913 224 HD2 LYS 30 HD3 LYS 30 10.155 7.810 -7.486 225 HD3 LYS 30 HD2 LYS 30 9.475 7.273 -9.009 226 HE2 LYS 30 HE2 LYS 30 11.472 5.804 -7.268 227 HE3 LYS 30 HE1 LYS 30 9.849 5.306 -7.735 228 HZ1 LYS 30 HZ1 LYS 30 11.267 5.745 -10.116 229 HZ2 LYS 30 HZ2 LYS 30 10.719 4.312 -9.493 230 HZ3 LYS 30 HZ3 LYS 30 12.294 4.866 -9.094 231 H LYS 31 H LYS 31 12.848 11.637 -6.861 232 HA LYS 31 HA LYS 31 15.545 11.431 -6.010 233 HB2 LYS 31 HB3 LYS 31 13.650 13.712 -5.404 234 HB3 LYS 31 HB2 LYS 31 15.389 13.777 -5.605 235 HG2 LYS 31 HG3 LYS 31 15.098 13.018 -8.015 236 HG3 LYS 31 HG2 LYS 31 13.380 13.053 -7.678 237 HD2 LYS 31 HD3 LYS 31 13.609 15.501 -7.046 238 HD3 LYS 31 HD2 LYS 31 15.205 15.471 -7.779 239 HE2 LYS 31 HE2 LYS 31 12.670 14.599 -9.126 240 HE3 LYS 31 HE1 LYS 31 13.375 16.182 -9.378 241 HZ1 LYS 31 HZ1 LYS 31 15.331 14.094 -9.774 242 HZ2 LYS 31 HZ2 LYS 31 14.826 15.319 -10.835 243 HZ3 LYS 31 HZ3 LYS 31 13.977 13.879 -10.766 244 H GLU 32 H GLU 32 12.553 12.167 -4.312 245 HA GLU 32 HA GLU 32 13.797 12.016 -1.704 246 HB2 GLU 32 HB3 GLU 32 11.048 12.641 -2.716 247 HB3 GLU 32 HB2 GLU 32 11.433 12.554 -0.983 248 HG2 GLU 32 HG3 GLU 32 12.887 14.251 -2.995 249 HG3 GLU 32 HG2 GLU 32 11.589 14.880 -2.026 250 H LEU 33 H LEU 33 11.771 10.101 -3.738 251 HA LEU 33 HA LEU 33 10.673 8.374 -1.868 252 HB2 LEU 33 HB3 LEU 33 10.073 8.467 -4.273 253 HB3 LEU 33 HB2 LEU 33 11.631 7.721 -4.604 254 HG LEU 33 HG LEU 33 9.548 6.140 -4.529 255 HD11 LEU 33 HD11 LEU 33 11.566 4.957 -2.759 256 HD12 LEU 33 HD12 LEU 33 12.228 5.701 -4.219 257 HD13 LEU 33 HD13 LEU 33 10.999 4.457 -4.343 258 HD21 LEU 33 HD21 LEU 33 9.002 5.277 -2.341 259 HD22 LEU 33 HD22 LEU 33 8.697 6.999 -2.346 260 HD23 LEU 33 HD23 LEU 33 10.142 6.353 -1.541 261 H LYS 34 H LYS 34 13.771 8.183 -3.615 262 HA LYS 34 HA LYS 34 14.557 5.729 -2.469 263 HB2 LYS 34 HB3 LYS 34 16.193 7.967 -3.689 264 HB3 LYS 34 HB2 LYS 34 16.904 6.471 -3.119 265 HG2 LYS 34 HG3 LYS 34 15.478 5.160 -4.648 266 HG3 LYS 34 HG2 LYS 34 14.743 6.674 -5.237 267 HD2 LYS 34 HD3 LYS 34 16.908 7.422 -6.104 268 HD3 LYS 34 HD2 LYS 34 17.717 6.038 -5.408 269 HE2 LYS 34 HE2 LYS 34 17.419 5.456 -7.689 270 HE3 LYS 34 HE1 LYS 34 16.148 4.580 -6.843 271 HZ1 LYS 34 HZ1 LYS 34 15.963 6.645 -8.788 272 HZ2 LYS 34 HZ2 LYS 34 15.043 7.041 -7.473 273 HZ3 LYS 34 HZ3 LYS 34 14.805 5.535 -8.315 274 H GLU 35 H GLU 35 15.076 9.083 -1.492 275 HA GLU 35 HA GLU 35 16.657 8.522 0.842 276 HB2 GLU 35 HB3 GLU 35 14.824 10.872 0.208 277 HB3 GLU 35 HB2 GLU 35 16.000 10.811 1.501 278 HG2 GLU 35 HG3 GLU 35 16.821 10.418 -1.392 279 HG3 GLU 35 HG2 GLU 35 16.727 12.000 -0.649 280 H LEU 36 H LEU 36 13.290 9.043 0.159 281 HA LEU 36 HA LEU 36 12.207 8.980 2.703 282 HB2 LEU 36 HB3 LEU 36 10.953 9.835 0.905 283 HB3 LEU 36 HB2 LEU 36 11.176 8.362 -0.023 284 HG LEU 36 HG LEU 36 9.755 7.131 1.404 285 HD11 LEU 36 HD11 LEU 36 8.891 9.575 2.963 286 HD12 LEU 36 HD12 LEU 36 10.373 8.756 3.495 287 HD13 LEU 36 HD13 LEU 36 8.857 7.885 3.411 288 HD21 LEU 36 HD21 LEU 36 8.485 8.073 -0.248 289 HD22 LEU 36 HD22 LEU 36 8.754 9.719 0.318 290 HD23 LEU 36 HD23 LEU 36 7.615 8.662 1.173 291 H LEU 37 H LEU 37 12.526 6.326 0.354 292 HA LEU 37 HA LEU 37 11.220 4.474 1.988 293 HB2 LEU 37 HB3 LEU 37 11.479 4.152 -0.419 294 HB3 LEU 37 HB2 LEU 37 13.211 3.968 -0.251 295 HG LEU 37 HG LEU 37 11.745 1.836 -0.467 296 HD11 LEU 37 HD11 LEU 37 13.385 1.348 1.908 297 HD12 LEU 37 HD12 LEU 37 14.222 2.287 0.669 298 HD13 LEU 37 HD13 LEU 37 13.538 0.730 0.271 299 HD21 LEU 37 HD21 LEU 37 11.477 2.048 2.517 300 HD22 LEU 37 HD22 LEU 37 10.607 1.024 1.391 301 HD23 LEU 37 HD23 LEU 37 10.221 2.744 1.486 302 H GLN 38 H GLN 38 14.654 5.113 1.629 303 HA GLN 38 HA GLN 38 15.450 3.039 3.380 304 HB2 GLN 38 HB3 GLN 38 17.667 4.138 3.470 305 HB3 GLN 38 HB2 GLN 38 17.084 3.897 1.832 306 HG2 GLN 38 HG3 GLN 38 16.182 6.330 1.986 307 HG3 GLN 38 HG2 GLN 38 17.213 6.468 3.409 308 HE21 GLN 38 HE21 GLN 38 17.187 6.219 -0.065 309 HE22 GLN 38 HE22 GLN 38 18.857 6.449 -0.277 310 H THR 39 H THR 39 14.928 6.477 4.022 311 HA THR 39 HA THR 39 15.764 6.313 6.724 312 HB THR 39 HB THR 39 15.728 8.525 5.900 313 HG1 THR 39 HG2 THR 39 13.293 8.595 7.333 314 HG21 THR 39 HG21 THR 39 14.291 9.294 4.379 315 HG22 THR 39 HG22 THR 39 12.908 8.999 5.405 316 HG23 THR 39 HG23 THR 39 13.476 7.743 4.343 317 H GLU 40 H GLU 40 12.453 6.322 5.387 318 HA GLU 40 HA GLU 40 11.336 6.074 7.950 319 HB2 GLU 40 HB3 GLU 40 9.999 5.659 5.286 320 HB3 GLU 40 HB2 GLU 40 9.187 5.961 6.834 321 HG2 GLU 40 HG3 GLU 40 11.042 7.850 5.345 322 HG3 GLU 40 HG2 GLU 40 9.340 8.066 5.668 323 H LEU 41 H LEU 41 12.153 3.694 5.555 324 HA LEU 41 HA LEU 41 11.039 1.602 7.298 325 HB2 LEU 41 HB3 LEU 41 11.921 1.668 4.450 326 HB3 LEU 41 HB2 LEU 41 11.808 0.157 5.276 327 HG LEU 41 HG LEU 41 9.444 0.656 5.976 328 HD11 LEU 41 HD11 LEU 41 8.287 2.449 4.576 329 HD12 LEU 41 HD12 LEU 41 9.903 3.082 4.232 330 HD13 LEU 41 HD13 LEU 41 9.310 3.015 5.885 331 HD21 LEU 41 HD21 LEU 41 8.683 -0.378 4.107 332 HD22 LEU 41 HD22 LEU 41 10.358 -0.348 3.559 333 HD23 LEU 41 HD23 LEU 41 9.239 0.923 3.065 334 H SER 42 H SER 42 13.298 3.109 8.088 335 HA SER 42 HA SER 42 15.724 1.992 7.423 336 HB2 SER 42 HB3 SER 42 16.084 2.784 10.044 337 HB3 SER 42 HB2 SER 42 16.198 3.820 8.641 338 HG SER 42 HG SER 42 14.338 4.670 9.072 339 H GLY 43 H GLY 43 13.318 0.928 9.766 340 HA2 GLY 43 HA3 GLY 43 14.945 -1.068 11.005 341 HA3 GLY 43 HA2 GLY 43 13.184 -0.951 11.054 342 H PHE 44 H PHE 44 12.657 -1.033 8.317 343 HA PHE 44 HA PHE 44 12.798 -3.859 7.844 344 HB2 PHE 44 HB3 PHE 44 11.693 -1.565 6.246 345 HB3 PHE 44 HB2 PHE 44 11.800 -3.178 5.550 346 HD1 PHE 44 HD1 PHE 44 10.339 -1.180 8.320 347 HD2 PHE 44 HD2 PHE 44 10.313 -4.903 6.214 348 HE1 PHE 44 HE1 PHE 44 8.239 -1.826 9.489 349 HE2 PHE 44 HE2 PHE 44 8.222 -5.565 7.389 350 HZ PHE 44 HZ PHE 44 7.187 -4.003 9.034 351 H LEU 45 H LEU 45 14.256 -0.989 6.582 352 HA LEU 45 HA LEU 45 15.862 -2.190 4.611 353 HB2 LEU 45 HB3 LEU 45 15.447 0.143 4.558 354 HB3 LEU 45 HB2 LEU 45 16.106 0.404 6.158 355 HG LEU 45 HG LEU 45 18.273 -0.329 5.409 356 HD11 LEU 45 HD11 LEU 45 18.092 -1.797 3.593 357 HD12 LEU 45 HD12 LEU 45 18.388 -0.322 2.686 358 HD13 LEU 45 HD13 LEU 45 16.744 -0.914 2.877 359 HD21 LEU 45 HD21 LEU 45 17.220 2.100 4.992 360 HD22 LEU 45 HD22 LEU 45 17.557 1.684 3.316 361 HD23 LEU 45 HD23 LEU 45 18.872 1.722 4.497 362 H ASP 46 H ASP 46 16.377 -1.438 8.021 363 HA ASP 46 HA ASP 46 19.055 -2.293 8.298 364 HB2 ASP 46 HB3 ASP 46 18.001 -1.064 10.061 365 HB3 ASP 46 HB2 ASP 46 16.748 -2.284 10.224 366 H ALA 47 H ALA 47 16.040 -4.054 8.690 367 HA ALA 47 HA ALA 47 17.174 -6.446 9.596 368 HB1 ALA 47 HB1 ALA 47 15.065 -7.163 9.730 369 HB2 ALA 47 HB2 ALA 47 14.769 -6.892 8.027 370 HB3 ALA 47 HB3 ALA 47 14.599 -5.560 9.175 371 H GLN 48 H GLN 48 16.588 -5.337 6.287 372 HA GLN 48 HA GLN 48 18.065 -7.731 5.374 373 HB2 GLN 48 HB3 GLN 48 16.448 -7.513 3.264 374 HB3 GLN 48 HB2 GLN 48 16.032 -8.471 4.666 375 HG2 GLN 48 HG3 GLN 48 14.101 -7.242 4.405 376 HG3 GLN 48 HG2 GLN 48 14.929 -6.172 5.520 377 HE21 GLN 48 HE21 GLN 48 15.702 -4.151 4.653 378 HE22 GLN 48 HE22 GLN 48 15.319 -3.631 3.074 379 H LYS 49 H LYS 49 19.479 -5.455 5.728 380 HA LYS 49 HA LYS 49 19.750 -3.920 3.313 381 HB2 LYS 49 HB3 LYS 49 21.743 -4.544 5.507 382 HB3 LYS 49 HB2 LYS 49 22.134 -3.514 4.161 383 HG2 LYS 49 HG3 LYS 49 20.164 -2.063 4.801 384 HG3 LYS 49 HG2 LYS 49 20.007 -3.062 6.242 385 HD2 LYS 49 HD3 LYS 49 22.285 -2.572 6.944 386 HD3 LYS 49 HD2 LYS 49 22.558 -1.604 5.504 387 HE2 LYS 49 HE2 LYS 49 20.408 -0.975 7.570 388 HE3 LYS 49 HE1 LYS 49 22.033 -0.314 7.526 389 HZ1 LYS 49 HZ1 LYS 49 21.613 0.947 5.708 390 HZ2 LYS 49 HZ2 LYS 49 20.061 0.886 6.318 391 HZ3 LYS 49 HZ3 LYS 49 20.512 -0.139 5.034 392 H ASP 50 H ASP 50 21.078 -6.875 4.541 393 HA ASP 50 HA ASP 50 22.958 -7.263 2.412 394 HB2 ASP 50 HB3 ASP 50 22.080 -9.078 4.655 395 HB3 ASP 50 HB2 ASP 50 23.341 -9.478 3.501 396 H VAL 51 H VAL 51 19.665 -7.674 2.427 397 HA VAL 51 HA VAL 51 19.702 -10.128 0.853 398 HB VAL 51 HB VAL 51 17.320 -8.375 1.398 399 HG11 VAL 51 HG11 VAL 51 16.143 -9.994 0.365 400 HG12 VAL 51 HG12 VAL 51 16.897 -11.248 1.327 401 HG13 VAL 51 HG13 VAL 51 17.682 -10.679 -0.142 402 HG21 VAL 51 HG21 VAL 51 16.902 -10.005 3.324 403 HG22 VAL 51 HG22 VAL 51 18.257 -8.921 3.605 404 HG23 VAL 51 HG23 VAL 51 18.542 -10.584 3.103 405 H ASP 52 H ASP 52 19.611 -10.188 -1.264 406 HA ASP 52 HA ASP 52 20.241 -7.975 -2.858 407 HB2 ASP 52 HB3 ASP 52 19.667 -10.772 -3.261 408 HB3 ASP 52 HB2 ASP 52 18.985 -9.801 -4.536 409 H ALA 53 H ALA 53 17.195 -9.271 -1.898 410 HA ALA 53 HA ALA 53 15.551 -8.280 -3.917 411 HB1 ALA 53 HB1 ALA 53 14.888 -8.879 -1.034 412 HB2 ALA 53 HB2 ALA 53 14.682 -9.938 -2.441 413 HB3 ALA 53 HB3 ALA 53 13.692 -8.505 -2.270 414 H VAL 54 H VAL 54 16.576 -6.664 -0.921 415 HA VAL 54 HA VAL 54 14.718 -4.635 -0.965 416 HB VAL 54 HB VAL 54 16.169 -5.048 0.945 417 HG11 VAL 54 HG11 VAL 54 18.438 -4.803 0.993 418 HG12 VAL 54 HG12 VAL 54 18.479 -3.582 -0.263 419 HG13 VAL 54 HG13 VAL 54 18.257 -5.280 -0.682 420 HG21 VAL 54 HG21 VAL 54 15.271 -2.911 1.203 421 HG22 VAL 54 HG22 VAL 54 16.050 -2.278 -0.242 422 HG23 VAL 54 HG23 VAL 54 16.990 -2.544 1.228 423 H ASP 55 H ASP 55 17.842 -4.762 -2.567 424 HA ASP 55 HA ASP 55 17.903 -2.170 -3.722 425 HB2 ASP 55 HB3 ASP 55 19.824 -3.716 -3.706 426 HB3 ASP 55 HB2 ASP 55 18.953 -4.808 -4.766 427 H LYS 56 H LYS 56 16.824 -5.267 -4.876 428 HA LYS 56 HA LYS 56 15.913 -4.494 -7.413 429 HB2 LYS 56 HB3 LYS 56 15.190 -6.854 -5.686 430 HB3 LYS 56 HB2 LYS 56 14.870 -6.712 -7.418 431 HG2 LYS 56 HG3 LYS 56 17.176 -6.447 -7.959 432 HG3 LYS 56 HG2 LYS 56 17.650 -6.351 -6.265 433 HD2 LYS 56 HD3 LYS 56 16.787 -8.706 -6.022 434 HD3 LYS 56 HD2 LYS 56 16.591 -8.766 -7.782 435 HE2 LYS 56 HE2 LYS 56 18.813 -9.675 -6.912 436 HE3 LYS 56 HE1 LYS 56 18.953 -8.423 -8.132 437 HZ1 LYS 56 HZ1 LYS 56 20.238 -8.263 -5.792 438 HZ2 LYS 56 HZ2 LYS 56 18.803 -7.525 -5.341 439 HZ3 LYS 56 HZ3 LYS 56 19.716 -6.882 -6.608 440 H VAL 57 H VAL 57 14.246 -4.839 -4.322 441 HA VAL 57 HA VAL 57 11.594 -4.424 -5.239 442 HB VAL 57 HB VAL 57 12.944 -3.893 -2.576 443 HG11 VAL 57 HG11 VAL 57 10.179 -3.304 -3.501 444 HG12 VAL 57 HG12 VAL 57 11.180 -2.498 -2.286 445 HG13 VAL 57 HG13 VAL 57 10.375 -4.017 -1.894 446 HG21 VAL 57 HG21 VAL 57 12.392 -6.310 -3.661 447 HG22 VAL 57 HG22 VAL 57 10.807 -5.932 -2.982 448 HG23 VAL 57 HG23 VAL 57 12.212 -5.975 -1.939 449 H MET 58 H MET 58 14.092 -2.354 -3.986 450 HA MET 58 HA MET 58 12.780 0.142 -4.317 451 HB2 MET 58 HB3 MET 58 14.705 -0.000 -2.899 452 HB3 MET 58 HB2 MET 58 15.686 -0.669 -4.191 453 HG2 MET 58 HG3 MET 58 15.542 1.285 -5.433 454 HG3 MET 58 HG2 MET 58 14.456 2.103 -4.277 455 HE1 MET 58 HE1 MET 58 18.881 1.243 -4.256 456 HE2 MET 58 HE2 MET 58 17.587 0.380 -5.092 457 HE3 MET 58 HE3 MET 58 18.022 -0.076 -3.461 458 H LYS 59 H LYS 59 14.862 -1.803 -6.373 459 HA LYS 59 HA LYS 59 15.096 0.097 -8.410 460 HB2 LYS 59 HB3 LYS 59 16.530 -2.028 -7.948 461 HB3 LYS 59 HB2 LYS 59 15.317 -2.845 -8.927 462 HG2 LYS 59 HG3 LYS 59 17.181 -2.128 -10.289 463 HG3 LYS 59 HG2 LYS 59 15.681 -1.280 -10.731 464 HD2 LYS 59 HD3 LYS 59 16.721 0.764 -10.343 465 HD3 LYS 59 HD2 LYS 59 16.934 0.303 -8.679 466 HE2 LYS 59 HE2 LYS 59 19.002 0.934 -10.016 467 HE3 LYS 59 HE1 LYS 59 19.070 -0.474 -8.973 468 HZ1 LYS 59 HZ1 LYS 59 18.170 -1.049 -11.680 469 HZ2 LYS 59 HZ2 LYS 59 19.305 -1.836 -10.695 470 HZ3 LYS 59 HZ3 LYS 59 19.769 -0.501 -11.580 471 H GLU 60 H GLU 60 12.748 -2.437 -7.889 472 HA GLU 60 HA GLU 60 11.467 -2.371 -10.401 473 HB2 GLU 60 HB3 GLU 60 10.514 -2.931 -7.635 474 HB3 GLU 60 HB2 GLU 60 9.428 -3.119 -9.014 475 HG2 GLU 60 HG3 GLU 60 11.038 -4.758 -9.995 476 HG3 GLU 60 HG2 GLU 60 12.078 -4.566 -8.583 477 H LEU 61 H LEU 61 11.208 -0.316 -7.604 478 HA LEU 61 HA LEU 61 8.961 1.184 -8.501 479 HB2 LEU 61 HB3 LEU 61 11.121 1.693 -6.479 480 HB3 LEU 61 HB2 LEU 61 10.097 3.019 -6.976 481 HG LEU 61 HG LEU 61 9.347 1.655 -4.962 482 HD11 LEU 61 HD11 LEU 61 6.904 1.525 -6.222 483 HD12 LEU 61 HD12 LEU 61 7.750 2.661 -7.254 484 HD13 LEU 61 HD13 LEU 61 7.586 2.979 -5.528 485 HD21 LEU 61 HD21 LEU 61 8.296 -0.270 -7.084 486 HD22 LEU 61 HD22 LEU 61 8.170 -0.404 -5.343 487 HD23 LEU 61 HD23 LEU 61 9.731 -0.592 -6.108 488 H ASP 62 H ASP 62 12.387 1.399 -9.127 489 HA ASP 62 HA ASP 62 12.161 3.887 -10.610 490 HB2 ASP 62 HB3 ASP 62 14.377 1.863 -10.380 491 HB3 ASP 62 HB2 ASP 62 14.454 3.241 -11.461 492 H GLU 63 H GLU 63 11.419 0.677 -11.380 493 HA GLU 63 HA GLU 63 11.654 0.914 -14.204 494 HB2 GLU 63 HB3 GLU 63 9.658 -0.709 -12.570 495 HB3 GLU 63 HB2 GLU 63 9.930 -0.818 -14.286 496 HG2 GLU 63 HG3 GLU 63 12.218 -1.546 -13.983 497 HG3 GLU 63 HG2 GLU 63 12.081 -1.305 -12.231 498 H ASN 64 H ASN 64 8.676 0.975 -12.264 499 HA ASN 64 HA ASN 64 7.118 2.355 -14.221 500 HB2 ASN 64 HB3 ASN 64 6.434 0.922 -12.044 501 HB3 ASN 64 HB2 ASN 64 6.502 2.568 -11.378 502 HD21 ASN 64 HD21 ASN 64 4.008 1.278 -11.497 503 HD22 ASN 64 HD22 ASN 64 3.029 2.072 -12.638 504 H GLY 65 H GLY 65 8.610 3.268 -11.141 505 HA2 GLY 65 HA3 GLY 65 7.925 5.993 -11.406 506 HA3 GLY 65 HA2 GLY 65 8.994 5.325 -10.177 507 H ASP 66 H ASP 66 8.931 5.492 -13.673 508 HA ASP 66 HA ASP 66 11.716 5.603 -14.073 509 HB2 ASP 66 HB3 ASP 66 9.949 5.012 -15.767 510 HB3 ASP 66 HB2 ASP 66 9.584 6.740 -15.848 511 H GLY 67 H GLY 67 9.233 7.937 -13.578 512 HA2 GLY 67 HA3 GLY 67 11.246 10.146 -13.525 513 HA3 GLY 67 HA2 GLY 67 9.612 10.368 -14.124 514 H GLU 68 H GLU 68 7.893 9.524 -12.485 515 HA GLU 68 HA GLU 68 8.583 10.633 -9.832 516 HB2 GLU 68 HB3 GLU 68 5.789 10.557 -10.826 517 HB3 GLU 68 HB2 GLU 68 6.542 11.676 -9.698 518 HG2 GLU 68 HG3 GLU 68 6.620 13.127 -11.456 519 HG3 GLU 68 HG2 GLU 68 7.984 12.176 -12.013 520 H VAL 69 H VAL 69 7.083 9.834 -8.096 521 HA VAL 69 HA VAL 69 6.126 7.111 -8.586 522 HB VAL 69 HB VAL 69 8.150 6.756 -7.414 523 HG11 VAL 69 HG11 VAL 69 8.534 7.941 -5.190 524 HG12 VAL 69 HG12 VAL 69 7.229 9.010 -5.625 525 HG13 VAL 69 HG13 VAL 69 8.697 8.994 -6.600 526 HG21 VAL 69 HG21 VAL 69 5.699 6.642 -5.630 527 HG22 VAL 69 HG22 VAL 69 7.273 6.140 -5.027 528 HG23 VAL 69 HG23 VAL 69 6.585 5.342 -6.423 529 H ASP 70 H ASP 70 4.091 6.794 -7.842 530 HA ASP 70 HA ASP 70 2.888 9.089 -6.477 531 HB2 ASP 70 HB3 ASP 70 0.921 8.658 -7.506 532 HB3 ASP 70 HB2 ASP 70 1.976 7.886 -8.679 533 H PHE 71 H PHE 71 0.840 8.158 -5.223 534 HA PHE 71 HA PHE 71 1.907 7.103 -2.832 535 HB2 PHE 71 HB3 PHE 71 -0.154 8.478 -2.961 536 HB3 PHE 71 HB2 PHE 71 -0.989 7.104 -3.695 537 HD1 PHE 71 HD1 PHE 71 1.160 7.918 -0.730 538 HD2 PHE 71 HD2 PHE 71 -2.132 5.582 -2.246 539 HE1 PHE 71 HE1 PHE 71 0.753 7.000 1.524 540 HE2 PHE 71 HE2 PHE 71 -2.524 4.693 0.031 541 HZ PHE 71 HZ PHE 71 -1.091 5.390 1.904 542 H GLN 72 H GLN 72 0.059 5.648 -5.475 543 HA GLN 72 HA GLN 72 -0.208 3.108 -4.335 544 HB2 GLN 72 HB3 GLN 72 -0.336 4.140 -7.145 545 HB3 GLN 72 HB2 GLN 72 -0.573 2.408 -6.802 546 HG2 GLN 72 HG3 GLN 72 -2.399 3.002 -5.272 547 HG3 GLN 72 HG2 GLN 72 -2.104 4.714 -5.559 548 HE21 GLN 72 HE21 GLN 72 -2.914 5.640 -7.507 549 HE22 GLN 72 HE22 GLN 72 -3.860 4.776 -8.604 550 H GLU 73 H GLU 73 2.351 4.491 -6.362 551 HA GLU 73 HA GLU 73 3.878 2.048 -6.385 552 HB2 GLU 73 HB3 GLU 73 4.665 4.909 -6.935 553 HB3 GLU 73 HB2 GLU 73 5.802 3.566 -7.036 554 HG2 GLU 73 HG3 GLU 73 4.374 2.481 -8.728 555 HG3 GLU 73 HG2 GLU 73 3.229 3.815 -8.602 556 H TYR 74 H TYR 74 3.827 4.923 -4.362 557 HA TYR 74 HA TYR 74 6.077 4.354 -2.796 558 HB2 TYR 74 HB3 TYR 74 5.160 6.560 -2.723 559 HB3 TYR 74 HB2 TYR 74 3.591 5.953 -2.230 560 HD1 TYR 74 HD1 TYR 74 7.187 5.581 -0.944 561 HD2 TYR 74 HD2 TYR 74 3.049 6.431 -0.022 562 HE1 TYR 74 HE1 TYR 74 7.766 5.900 1.402 563 HE2 TYR 74 HE2 TYR 74 3.665 6.764 2.335 564 HH TYR 74 HH TYR 74 6.289 7.468 3.482 565 H VAL 75 H VAL 75 2.677 3.559 -2.161 566 HA VAL 75 HA VAL 75 3.147 2.279 0.301 567 HB VAL 75 HB VAL 75 0.916 1.208 -0.015 568 HG11 VAL 75 HG11 VAL 75 0.995 4.155 -0.766 569 HG12 VAL 75 HG12 VAL 75 1.217 3.536 0.878 570 HG13 VAL 75 HG13 VAL 75 -0.304 3.289 0.043 571 HG21 VAL 75 HG21 VAL 75 0.346 0.828 -2.218 572 HG22 VAL 75 HG22 VAL 75 1.449 2.074 -2.799 573 HG23 VAL 75 HG23 VAL 75 -0.116 2.521 -2.227 574 H VAL 76 H VAL 76 3.001 0.885 -2.981 575 HA VAL 76 HA VAL 76 3.202 -1.780 -2.096 576 HB VAL 76 HB VAL 76 2.361 -1.220 -4.345 577 HG11 VAL 76 HG11 VAL 76 3.939 -0.588 -6.128 578 HG12 VAL 76 HG12 VAL 76 5.245 -0.474 -4.964 579 HG13 VAL 76 HG13 VAL 76 3.863 0.631 -4.867 580 HG21 VAL 76 HG21 VAL 76 4.896 -2.873 -4.601 581 HG22 VAL 76 HG22 VAL 76 3.402 -3.041 -5.512 582 HG23 VAL 76 HG23 VAL 76 3.436 -3.475 -3.817 583 H LEU 77 H LEU 77 5.612 0.620 -2.989 584 HA LEU 77 HA LEU 77 7.855 -1.037 -3.043 585 HB2 LEU 77 HB3 LEU 77 7.911 1.261 -3.813 586 HB3 LEU 77 HB2 LEU 77 7.560 1.841 -2.208 587 HG LEU 77 HG LEU 77 9.686 0.953 -1.329 588 HD11 LEU 77 HD11 LEU 77 11.341 -0.041 -2.717 589 HD12 LEU 77 HD12 LEU 77 10.379 0.104 -4.170 590 HD13 LEU 77 HD13 LEU 77 9.894 -1.001 -2.882 591 HD21 LEU 77 HD21 LEU 77 9.473 3.033 -3.343 592 HD22 LEU 77 HD22 LEU 77 11.069 2.295 -3.405 593 HD23 LEU 77 HD23 LEU 77 10.466 2.977 -1.894 594 H VAL 78 H VAL 78 6.478 0.856 -0.395 595 HA VAL 78 HA VAL 78 8.327 -0.133 1.485 596 HB VAL 78 HB VAL 78 6.953 0.954 3.196 597 HG11 VAL 78 HG11 VAL 78 6.701 2.991 1.096 598 HG12 VAL 78 HG12 VAL 78 8.235 2.170 1.031 599 HG13 VAL 78 HG13 VAL 78 7.729 2.989 2.522 600 HG21 VAL 78 HG21 VAL 78 4.849 2.055 2.583 601 HG22 VAL 78 HG22 VAL 78 4.700 0.340 2.233 602 HG23 VAL 78 HG23 VAL 78 5.004 1.495 0.929 603 H ALA 79 H ALA 79 5.074 -1.071 0.574 604 HA ALA 79 HA ALA 79 4.748 -3.105 2.523 605 HB1 ALA 79 HB1 ALA 79 3.005 -3.987 1.090 606 HB2 ALA 79 HB2 ALA 79 3.593 -3.031 -0.259 607 HB3 ALA 79 HB3 ALA 79 2.875 -2.228 1.144 608 H ALA 80 H ALA 80 6.150 -3.086 -0.714 609 HA ALA 80 HA ALA 80 6.486 -5.809 -1.007 610 HB1 ALA 80 HB1 ALA 80 8.468 -5.125 -2.495 611 HB2 ALA 80 HB2 ALA 80 8.069 -3.469 -2.080 612 HB3 ALA 80 HB3 ALA 80 6.895 -4.473 -2.916 613 H LEU 81 H LEU 81 8.681 -3.420 0.392 614 HA LEU 81 HA LEU 81 10.653 -5.311 1.265 615 HB2 LEU 81 HB3 LEU 81 9.955 -2.545 2.298 616 HB3 LEU 81 HB2 LEU 81 11.335 -3.481 2.843 617 HG LEU 81 HG LEU 81 10.836 -2.692 -0.047 618 HD11 LEU 81 HD11 LEU 81 11.484 -0.853 1.704 619 HD12 LEU 81 HD12 LEU 81 12.381 -0.971 0.187 620 HD13 LEU 81 HD13 LEU 81 13.070 -1.624 1.656 621 HD21 LEU 81 HD21 LEU 81 13.380 -3.326 -0.077 622 HD22 LEU 81 HD22 LEU 81 12.169 -4.594 -0.194 623 HD23 LEU 81 HD23 LEU 81 12.983 -4.293 1.346 624 H THR 82 H THR 82 7.738 -3.925 2.681 625 HA THR 82 HA THR 82 8.053 -4.966 5.248 626 HB THR 82 HB THR 82 5.407 -4.542 3.874 627 HG1 THR 82 HG2 THR 82 6.894 -2.680 3.726 628 HG21 THR 82 HG21 THR 82 4.495 -4.271 6.022 629 HG22 THR 82 HG22 THR 82 6.075 -4.045 6.766 630 HG23 THR 82 HG23 THR 82 5.584 -5.642 6.210 631 H VAL 83 H VAL 83 6.240 -6.326 2.476 632 HA VAL 83 HA VAL 83 5.454 -8.661 3.866 633 HB VAL 83 HB VAL 83 4.315 -7.976 1.790 634 HG11 VAL 83 HG11 VAL 83 6.171 -7.139 0.511 635 HG12 VAL 83 HG12 VAL 83 5.346 -8.399 -0.390 636 HG13 VAL 83 HG13 VAL 83 6.890 -8.749 0.390 637 HG21 VAL 83 HG21 VAL 83 4.616 -10.283 0.543 638 HG22 VAL 83 HG22 VAL 83 3.832 -10.212 2.098 639 HG23 VAL 83 HG23 VAL 83 5.513 -10.735 1.988 640 H ALA 84 H ALA 84 8.261 -7.985 1.840 641 HA ALA 84 HA ALA 84 9.343 -10.559 1.886 642 HB1 ALA 84 HB1 ALA 84 10.085 -8.332 0.612 643 HB2 ALA 84 HB2 ALA 84 11.213 -9.656 0.921 644 HB3 ALA 84 HB3 ALA 84 11.221 -8.243 1.959 645 H MET 85 H MET 85 9.985 -7.815 4.045 646 HA MET 85 HA MET 85 11.694 -9.401 5.724 647 HB2 MET 85 HB3 MET 85 11.873 -6.885 5.565 648 HB3 MET 85 HB2 MET 85 10.358 -6.824 6.479 649 HG2 MET 85 HG3 MET 85 11.407 -8.147 8.314 650 HG3 MET 85 HG2 MET 85 12.911 -8.139 7.418 651 HE1 MET 85 HE1 MET 85 11.276 -5.996 10.399 652 HE2 MET 85 HE2 MET 85 10.183 -6.453 9.099 653 HE3 MET 85 HE3 MET 85 10.619 -4.765 9.324 654 H ASN 86 H ASN 86 8.323 -8.300 5.949 655 HA ASN 86 HA ASN 86 8.020 -9.165 8.577 656 HB2 ASN 86 HB3 ASN 86 6.423 -7.647 7.113 657 HB3 ASN 86 HB2 ASN 86 5.581 -9.176 6.833 658 HD21 ASN 86 HD21 ASN 86 6.638 -6.883 9.380 659 HD22 ASN 86 HD22 ASN 86 5.558 -7.454 10.539 660 H ASN 87 H ASN 87 7.729 -10.904 5.569 661 HA ASN 87 HA ASN 87 6.518 -13.288 6.391 662 HB2 ASN 87 HB3 ASN 87 7.524 -12.610 4.045 663 HB3 ASN 87 HB2 ASN 87 8.964 -13.407 4.669 664 HD21 ASN 87 HD21 ASN 87 8.133 -15.596 5.980 665 HD22 ASN 87 HD22 ASN 87 7.174 -16.603 5.010 666 H PHE 88 H PHE 88 9.664 -12.030 7.086 667 HA PHE 88 HA PHE 88 10.889 -14.333 8.134 668 HB2 PHE 88 HB3 PHE 88 12.190 -12.284 7.685 669 HB3 PHE 88 HB2 PHE 88 11.236 -11.422 8.889 670 HD1 PHE 88 HD1 PHE 88 13.201 -14.641 8.739 671 HD2 PHE 88 HD2 PHE 88 12.261 -11.023 10.894 672 HE1 PHE 88 HE1 PHE 88 14.815 -15.264 10.510 673 HE2 PHE 88 HE2 PHE 88 13.869 -11.654 12.656 674 HZ PHE 88 HZ PHE 88 15.155 -13.776 12.468 675 H PHE 89 H PHE 89 8.832 -11.880 9.613 676 HA PHE 89 HA PHE 89 8.898 -12.899 12.262 677 HB2 PHE 89 HB3 PHE 89 6.890 -11.166 10.807 678 HB3 PHE 89 HB2 PHE 89 6.695 -11.645 12.479 679 HD1 PHE 89 HD2 PHE 89 8.913 -9.800 10.137 680 HD2 PHE 89 HD1 PHE 89 8.002 -10.679 14.243 681 HE1 PHE 89 HE2 PHE 89 10.451 -8.008 10.867 682 HE2 PHE 89 HE1 PHE 89 9.543 -8.873 14.972 683 HZ PHE 89 HZ PHE 89 10.769 -7.539 13.281 684 H TRP 90 H TRP 90 6.707 -13.453 9.542 685 HA TRP 90 HA TRP 90 4.799 -15.005 10.945 686 HB2 TRP 90 HB3 TRP 90 5.416 -15.563 8.049 687 HB3 TRP 90 HB2 TRP 90 3.865 -15.579 8.900 688 HD1 TRP 90 HD TRP 90 4.750 -12.602 10.267 689 HE1 TRP 90 HE1 TRP 90 4.335 -10.566 8.849 690 HE3 TRP 90 HE3 TRP 90 4.286 -14.835 5.711 691 HZ2 TRP 90 HZ2 TRP 90 3.827 -9.911 6.061 692 HZ3 TRP 90 HZ3 TRP 90 3.839 -13.483 3.687 693 HH2 TRP 90 HH TRP 90 3.609 -11.014 3.864 694 H GLU 91 H GLU 91 7.659 -15.851 9.167 695 HA GLU 91 HA GLU 91 7.320 -18.709 9.816 696 HB2 GLU 91 HB3 GLU 91 9.284 -17.314 7.991 697 HB3 GLU 91 HB2 GLU 91 9.180 -19.052 8.248 698 HG2 GLU 91 HG3 GLU 91 6.894 -19.113 7.479 699 HG3 GLU 91 HG2 GLU 91 6.867 -17.365 7.278 700 H ASN 92 H ASN 92 8.749 -16.115 11.223 701 HA ASN 92 HA ASN 92 11.323 -16.641 11.792 702 HB2 ASN 92 HB3 ASN 92 9.772 -14.758 12.747 703 HB3 ASN 92 HB2 ASN 92 9.540 -15.922 14.056 704 HD21 ASN 92 HD21 ASN 92 11.951 -13.849 12.515 705 HD22 ASN 92 HD22 ASN 92 13.114 -14.022 13.732 706 H SER 93 H SER 93 12.316 -18.395 12.416 707 HA SER 93 HA SER 93 11.182 -20.083 14.525 708 HB2 SER 93 HB3 SER 93 12.187 -20.964 11.835 709 HB3 SER 93 HB2 SER 93 11.813 -22.078 13.160 710 HG SER 93 HG SER 93 10.121 -20.254 11.746 711 H1 GLY 1 H GLY 1 9.867 2.177 14.819 712 HA2 GLY 1 HA3 GLY 1 11.890 3.342 13.187 713 HA3 GLY 1 HA2 GLY 1 10.856 2.294 12.233 714 H SER 2 H SER 2 10.419 4.396 11.152 715 HA SER 2 HA SER 2 8.865 6.397 12.401 716 HB2 SER 2 HB3 SER 2 8.868 5.602 9.477 717 HB3 SER 2 HB2 SER 2 8.364 7.146 10.153 718 HG SER 2 HG SER 2 10.366 7.361 9.433 719 H GLU 3 H GLU 3 6.568 6.763 12.159 720 HA GLU 3 HA GLU 3 4.941 4.730 12.931 721 HB2 GLU 3 HB3 GLU 3 4.161 7.140 11.267 722 HB3 GLU 3 HB2 GLU 3 3.028 6.069 12.079 723 HG2 GLU 3 HG3 GLU 3 4.092 6.596 14.258 724 HG3 GLU 3 HG2 GLU 3 5.195 7.687 13.443 725 H LEU 4 H LEU 4 6.034 5.435 9.748 726 HA LEU 4 HA LEU 4 4.104 4.038 8.229 727 HB2 LEU 4 HB3 LEU 4 7.071 4.425 7.630 728 HB3 LEU 4 HB2 LEU 4 5.870 3.846 6.516 729 HG LEU 4 HG LEU 4 5.806 6.048 5.902 730 HD11 LEU 4 HD11 LEU 4 4.012 6.326 8.338 731 HD12 LEU 4 HD12 LEU 4 3.522 5.485 6.852 732 HD13 LEU 4 HD13 LEU 4 3.892 7.182 6.813 733 HD21 LEU 4 HD21 LEU 4 7.031 7.585 7.003 734 HD22 LEU 4 HD22 LEU 4 7.305 6.444 8.288 735 HD23 LEU 4 HD23 LEU 4 5.948 7.563 8.379 736 H GLU 5 H GLU 5 7.070 2.909 9.847 737 HA GLU 5 HA GLU 5 6.797 0.252 8.866 738 HB2 GLU 5 HB3 GLU 5 8.180 1.309 11.359 739 HB3 GLU 5 HB2 GLU 5 8.240 -0.369 10.856 740 HG2 GLU 5 HG3 GLU 5 9.194 0.393 8.634 741 HG3 GLU 5 HG2 GLU 5 9.234 2.016 9.267 742 H THR 6 H THR 6 5.554 1.953 11.699 743 HA THR 6 HA THR 6 4.239 -0.284 12.871 744 HB THR 6 HB THR 6 3.305 2.592 13.003 745 HG1 THR 6 HG2 THR 6 4.932 3.022 14.275 746 HG21 THR 6 HG21 THR 6 1.912 0.738 13.966 747 HG22 THR 6 HG22 THR 6 2.468 1.916 15.157 748 HG23 THR 6 HG23 THR 6 3.249 0.350 15.042 749 H ALA 7 H ALA 7 3.210 2.272 10.631 750 HA ALA 7 HA ALA 7 0.567 1.478 10.301 751 HB1 ALA 7 HB1 ALA 7 2.362 2.788 8.251 752 HB2 ALA 7 HB2 ALA 7 1.437 3.639 9.501 753 HB3 ALA 7 HB3 ALA 7 0.604 2.779 8.222 754 H MET 8 H MET 8 3.455 0.605 8.432 755 HA MET 8 HA MET 8 2.074 -1.070 6.615 756 HB2 MET 8 HB3 MET 8 4.986 -1.161 7.463 757 HB3 MET 8 HB2 MET 8 4.311 -2.047 6.104 758 HG2 MET 8 HG3 MET 8 4.383 0.988 6.398 759 HG3 MET 8 HG2 MET 8 5.284 0.024 5.261 760 HE1 MET 8 HE1 MET 8 3.308 -1.017 2.627 761 HE2 MET 8 HE2 MET 8 2.683 -2.063 3.898 762 HE3 MET 8 HE3 MET 8 4.391 -1.603 3.909 763 H GLU 9 H GLU 9 3.623 -1.735 9.747 764 HA GLU 9 HA GLU 9 3.006 -4.499 9.654 765 HB2 GLU 9 HB3 GLU 9 3.650 -2.689 11.995 766 HB3 GLU 9 HB2 GLU 9 3.257 -4.379 12.199 767 HG2 GLU 9 HG3 GLU 9 5.168 -5.033 10.734 768 HG3 GLU 9 HG2 GLU 9 5.538 -3.318 10.489 769 H THR 10 H THR 10 1.279 -1.638 10.723 770 HA THR 10 HA THR 10 -0.892 -2.953 11.973 771 HB THR 10 HB THR 10 -1.206 -0.403 10.325 772 HG1 THR 10 HG2 THR 10 0.675 -0.495 11.917 773 HG21 THR 10 HG21 THR 10 -2.805 0.107 12.192 774 HG22 THR 10 HG22 THR 10 -2.563 -1.537 12.780 775 HG23 THR 10 HG23 THR 10 -3.272 -1.269 11.199 776 H LEU 11 H LEU 11 -0.226 -2.092 8.610 777 HA LEU 11 HA LEU 11 -2.619 -3.117 7.478 778 HB2 LEU 11 HB3 LEU 11 0.159 -2.789 6.323 779 HB3 LEU 11 HB2 LEU 11 -1.256 -3.246 5.367 780 HG LEU 11 HG LEU 11 -1.048 -0.702 7.004 781 HD11 LEU 11 HD11 LEU 11 -0.763 0.457 4.901 782 HD12 LEU 11 HD12 LEU 11 -0.799 -1.063 4.013 783 HD13 LEU 11 HD13 LEU 11 0.538 -0.708 5.120 784 HD21 LEU 11 HD21 LEU 11 -3.331 -0.990 6.749 785 HD22 LEU 11 HD22 LEU 11 -3.163 -1.984 5.305 786 HD23 LEU 11 HD23 LEU 11 -2.965 -0.237 5.206 787 H ILE 12 H ILE 12 0.543 -4.576 8.193 788 HA ILE 12 HA ILE 12 0.039 -7.126 7.040 789 HB ILE 12 HB ILE 12 1.792 -6.370 9.415 790 HG12 ILE 12 HG13 ILE 12 2.417 -5.371 7.129 791 HG13 ILE 12 HG12 ILE 12 3.639 -6.420 7.843 792 HG21 ILE 12 HG21 ILE 12 1.904 -8.571 9.801 793 HG22 ILE 12 HG22 ILE 12 2.846 -8.675 8.325 794 HG23 ILE 12 HG23 ILE 12 1.118 -8.975 8.281 795 HD11 ILE 12 HD11 ILE 12 1.739 -7.912 6.148 796 HD12 ILE 12 HD12 ILE 12 3.494 -7.885 6.174 797 HD13 ILE 12 HD13 ILE 12 2.627 -6.643 5.306 798 H ASN 13 H ASN 13 -0.431 -5.804 10.250 799 HA ASN 13 HA ASN 13 -1.347 -8.131 11.506 800 HB2 ASN 13 HB3 ASN 13 -1.776 -5.204 12.090 801 HB3 ASN 13 HB2 ASN 13 -2.511 -6.447 13.064 802 HD21 ASN 13 HD21 ASN 13 0.545 -4.963 12.286 803 HD22 ASN 13 HD22 ASN 13 1.467 -5.782 13.452 804 H VAL 14 H VAL 14 -3.156 -5.563 9.827 805 HA VAL 14 HA VAL 14 -5.715 -6.750 10.235 806 HB VAL 14 HB VAL 14 -4.730 -4.841 8.085 807 HG11 VAL 14 HG11 VAL 14 -7.471 -4.513 8.402 808 HG12 VAL 14 HG12 VAL 14 -7.282 -6.253 8.391 809 HG13 VAL 14 HG13 VAL 14 -6.673 -5.282 7.045 810 HG21 VAL 14 HG21 VAL 14 -4.649 -3.928 10.400 811 HG22 VAL 14 HG22 VAL 14 -6.321 -4.401 10.637 812 HG23 VAL 14 HG23 VAL 14 -5.921 -3.149 9.460 813 H PHE 15 H PHE 15 -3.337 -6.817 7.621 814 HA PHE 15 HA PHE 15 -4.721 -8.413 5.793 815 HB2 PHE 15 HB3 PHE 15 -2.673 -7.168 5.277 816 HB3 PHE 15 HB2 PHE 15 -1.748 -8.256 6.300 817 HD1 PHE 15 HD1 PHE 15 -3.735 -8.032 3.176 818 HD2 PHE 15 HD2 PHE 15 -1.129 -10.471 5.566 819 HE1 PHE 15 HE1 PHE 15 -3.473 -9.609 1.288 820 HE2 PHE 15 HE2 PHE 15 -0.876 -12.051 3.666 821 HZ PHE 15 HZ PHE 15 -2.049 -11.615 1.536 822 H HIS 16 H HIS 16 -2.371 -9.378 8.280 823 HA HIS 16 HA HIS 16 -2.898 -12.147 7.670 824 HB2 HIS 16 HB3 HIS 16 -0.984 -10.869 9.582 825 HB3 HIS 16 HB2 HIS 16 -1.332 -12.592 9.673 826 HD1 HIS 16 HD1 HIS 16 -1.728 -12.974 6.469 827 HD2 HIS 16 HD2 HIS 16 1.564 -11.213 8.401 828 HE1 HIS 16 HE1 HIS 16 0.259 -13.248 4.946 829 HE2 HIS 16 HE2 HIS 16 2.248 -12.200 6.071 830 H ALA 17 H ALA 17 -4.362 -9.957 9.739 831 HA ALA 17 HA ALA 17 -5.250 -11.741 11.761 832 HB1 ALA 17 HB1 ALA 17 -5.727 -9.371 12.012 833 HB2 ALA 17 HB2 ALA 17 -7.259 -10.213 11.845 834 HB3 ALA 17 HB3 ALA 17 -6.594 -9.334 10.477 835 H HIS 18 H HIS 18 -6.341 -10.919 8.548 836 HA HIS 18 HA HIS 18 -8.503 -12.815 8.487 837 HB2 HIS 18 HB3 HIS 18 -7.179 -11.124 6.375 838 HB3 HIS 18 HB2 HIS 18 -8.478 -12.251 6.000 839 HD1 HIS 18 HD1 HIS 18 -10.915 -11.665 6.931 840 HD2 HIS 18 HD2 HIS 18 -7.977 -8.822 7.899 841 HE1 HIS 18 HE1 HIS 18 -12.107 -9.673 7.863 842 HE2 HIS 18 HE2 HIS 18 -10.354 -7.934 8.465 843 H SER 19 H SER 19 -5.114 -12.829 7.469 844 HA SER 19 HA SER 19 -5.095 -14.977 5.746 845 HB2 SER 19 HB3 SER 19 -2.993 -14.312 7.822 846 HB3 SER 19 HB2 SER 19 -2.770 -15.467 6.524 847 HG SER 19 HG SER 19 -3.630 -13.430 5.260 848 H GLY 20 H GLY 20 -5.257 -15.121 9.231 849 HA2 GLY 20 HA3 GLY 20 -4.772 -17.854 9.633 850 HA3 GLY 20 HA2 GLY 20 -5.791 -16.815 10.631 851 H LYS 21 H LYS 21 -7.495 -16.234 8.230 852 HA LYS 21 HA LYS 21 -9.489 -18.093 8.990 853 HB2 LYS 21 HB3 LYS 21 -9.493 -15.901 6.941 854 HB3 LYS 21 HB2 LYS 21 -10.896 -16.810 7.479 855 HG2 LYS 21 HG3 LYS 21 -10.554 -16.112 9.784 856 HG3 LYS 21 HG2 LYS 21 -9.102 -15.198 9.309 857 HD2 LYS 21 HD3 LYS 21 -10.479 -13.849 7.801 858 HD3 LYS 21 HD2 LYS 21 -11.917 -14.725 8.317 859 HE2 LYS 21 HE2 LYS 21 -11.393 -14.066 10.660 860 HE3 LYS 21 HE1 LYS 21 -10.095 -13.093 10.052 861 HZ1 LYS 21 HZ1 LYS 21 -12.206 -12.354 8.435 862 HZ2 LYS 21 HZ2 LYS 21 -11.516 -11.418 9.689 863 HZ3 LYS 21 HZ3 LYS 21 -12.871 -12.357 9.990 864 H GLU 22 H GLU 22 -8.720 -17.036 5.750 865 HA GLU 22 HA GLU 22 -10.335 -18.863 4.555 866 HB2 GLU 22 HB3 GLU 22 -8.181 -17.181 3.233 867 HB3 GLU 22 HB2 GLU 22 -9.505 -17.992 2.464 868 HG2 GLU 22 HG3 GLU 22 -11.179 -16.703 3.539 869 HG3 GLU 22 HG2 GLU 22 -10.078 -16.101 4.743 870 H GLY 23 H GLY 23 -6.743 -19.033 4.598 871 HA2 GLY 23 HA3 GLY 23 -6.773 -21.866 4.401 872 HA3 GLY 23 HA2 GLY 23 -6.590 -21.194 2.795 873 H ASP 24 H ASP 24 -4.721 -19.621 2.561 874 HA ASP 24 HA ASP 24 -2.378 -21.014 3.088 875 HB2 ASP 24 HB3 ASP 24 -2.720 -19.177 1.303 876 HB3 ASP 24 HB2 ASP 24 -2.403 -18.072 2.643 877 H LYS 25 H LYS 25 -0.508 -20.415 4.316 878 HA LYS 25 HA LYS 25 -1.002 -19.819 7.038 879 HB2 LYS 25 HB3 LYS 25 1.498 -19.696 5.395 880 HB3 LYS 25 HB2 LYS 25 1.459 -19.533 7.152 881 HG2 LYS 25 HG3 LYS 25 0.369 -21.673 7.342 882 HG3 LYS 25 HG2 LYS 25 0.402 -21.863 5.590 883 HD2 LYS 25 HD3 LYS 25 2.321 -23.106 6.218 884 HD3 LYS 25 HD2 LYS 25 2.979 -21.545 5.788 885 HE2 LYS 25 HE2 LYS 25 3.888 -22.330 7.987 886 HE3 LYS 25 HE1 LYS 25 2.976 -20.818 8.076 887 HZ1 LYS 25 HZ1 LYS 25 2.524 -22.824 9.704 888 HZ2 LYS 25 HZ2 LYS 25 1.496 -23.308 8.488 889 HZ3 LYS 25 HZ3 LYS 25 1.285 -21.781 9.239 890 H TYR 26 H TYR 26 0.213 -17.979 4.276 891 HA TYR 26 HA TYR 26 -0.559 -15.664 5.746 892 HB2 TYR 26 HB3 TYR 26 1.817 -14.866 4.329 893 HB3 TYR 26 HB2 TYR 26 1.492 -14.837 6.059 894 HD1 TYR 26 HD2 TYR 26 2.678 -17.022 3.284 895 HD2 TYR 26 HD1 TYR 26 2.474 -16.367 7.499 896 HE1 TYR 26 HE2 TYR 26 4.296 -18.835 3.615 897 HE2 TYR 26 HE1 TYR 26 4.132 -18.213 7.863 898 HH TYR 26 HH TYR 26 6.085 -19.231 5.617 899 H LYS 27 H LYS 27 -2.260 -15.358 4.348 900 HA LYS 27 HA LYS 27 -1.746 -13.935 1.977 901 HB2 LYS 27 HB3 LYS 27 -3.180 -16.604 1.601 902 HB3 LYS 27 HB2 LYS 27 -3.240 -15.280 0.500 903 HG2 LYS 27 HG3 LYS 27 -0.664 -16.662 1.283 904 HG3 LYS 27 HG2 LYS 27 -1.592 -16.917 -0.173 905 HD2 LYS 27 HD3 LYS 27 -1.347 -14.118 -0.097 906 HD3 LYS 27 HD2 LYS 27 0.229 -14.663 0.399 907 HE2 LYS 27 HE2 LYS 27 -1.164 -15.079 -2.205 908 HE3 LYS 27 HE1 LYS 27 0.526 -14.678 -1.887 909 HZ1 LYS 27 HZ1 LYS 27 -0.853 -17.259 -1.890 910 HZ2 LYS 27 HZ2 LYS 27 0.493 -17.091 -0.850 911 HZ3 LYS 27 HZ3 LYS 27 0.667 -16.894 -2.511 912 H LEU 28 H LEU 28 -3.803 -13.252 0.993 913 HA LEU 28 HA LEU 28 -6.061 -13.381 2.832 914 HB2 LEU 28 HB3 LEU 28 -5.094 -11.178 3.037 915 HB3 LEU 28 HB2 LEU 28 -5.027 -11.005 1.280 916 HG LEU 28 HG LEU 28 -7.552 -11.261 1.249 917 HD11 LEU 28 HD11 LEU 28 -8.681 -10.792 3.427 918 HD12 LEU 28 HD12 LEU 28 -7.146 -11.048 4.239 919 HD13 LEU 28 HD13 LEU 28 -7.915 -12.373 3.358 920 HD21 LEU 28 HD21 LEU 28 -7.940 -8.975 2.170 921 HD22 LEU 28 HD22 LEU 28 -6.581 -9.057 1.056 922 HD23 LEU 28 HD23 LEU 28 -6.293 -8.983 2.804 923 H SER 29 H SER 29 -7.897 -14.064 1.750 924 HA SER 29 HA SER 29 -7.525 -14.533 -1.108 925 HB2 SER 29 HB3 SER 29 -9.793 -15.763 0.400 926 HB3 SER 29 HB2 SER 29 -8.812 -16.397 -0.897 927 HG SER 29 HG SER 29 -8.130 -15.954 1.795 928 H LYS 30 H LYS 30 -9.922 -14.706 -2.125 929 HA LYS 30 HA LYS 30 -10.637 -11.908 -2.228 930 HB2 LYS 30 HB3 LYS 30 -11.849 -14.218 -3.765 931 HB3 LYS 30 HB2 LYS 30 -11.991 -12.499 -4.135 932 HG2 LYS 30 HG3 LYS 30 -9.397 -14.079 -4.113 933 HG3 LYS 30 HG2 LYS 30 -10.257 -13.596 -5.560 934 HD2 LYS 30 HD3 LYS 30 -9.381 -11.487 -3.545 935 HD3 LYS 30 HD2 LYS 30 -8.278 -12.128 -4.718 936 HE2 LYS 30 HE2 LYS 30 -10.860 -10.683 -5.230 937 HE3 LYS 30 HE1 LYS 30 -9.262 -10.181 -5.713 938 HZ1 LYS 30 HZ1 LYS 30 -9.479 -12.648 -6.941 939 HZ2 LYS 30 HZ2 LYS 30 -9.775 -11.207 -7.707 940 HZ3 LYS 30 HZ3 LYS 30 -11.042 -12.070 -7.028 941 H LYS 31 H LYS 31 -11.552 -14.171 -0.126 942 HA LYS 31 HA LYS 31 -14.409 -13.521 -0.060 943 HB2 LYS 31 HB3 LYS 31 -13.242 -14.929 2.253 944 HB3 LYS 31 HB2 LYS 31 -14.627 -15.354 1.258 945 HG2 LYS 31 HG3 LYS 31 -13.064 -16.187 -0.533 946 HG3 LYS 31 HG2 LYS 31 -11.728 -15.753 0.470 947 HD2 LYS 31 HD3 LYS 31 -12.474 -17.290 2.213 948 HD3 LYS 31 HD2 LYS 31 -13.815 -17.805 1.178 949 HE2 LYS 31 HE2 LYS 31 -11.879 -18.146 -0.576 950 HE3 LYS 31 HE1 LYS 31 -10.868 -18.236 0.843 951 HZ1 LYS 31 HZ1 LYS 31 -13.324 -19.864 0.753 952 HZ2 LYS 31 HZ2 LYS 31 -11.883 -20.164 1.598 953 HZ3 LYS 31 HZ3 LYS 31 -11.962 -20.361 -0.093 954 H GLU 32 H GLU 32 -11.745 -13.491 2.286 955 HA GLU 32 HA GLU 32 -12.972 -11.675 4.063 956 HB2 GLU 32 HB3 GLU 32 -10.137 -12.646 3.764 957 HB3 GLU 32 HB2 GLU 32 -10.668 -11.611 5.087 958 HG2 GLU 32 HG3 GLU 32 -11.880 -14.302 4.381 959 HG3 GLU 32 HG2 GLU 32 -10.706 -14.068 5.647 960 H LEU 33 H LEU 33 -10.744 -11.255 1.394 961 HA LEU 33 HA LEU 33 -9.872 -8.657 1.960 962 HB2 LEU 33 HB3 LEU 33 -8.835 -9.976 0.187 963 HB3 LEU 33 HB2 LEU 33 -10.320 -10.002 -0.744 964 HG LEU 33 HG LEU 33 -8.473 -8.340 -1.445 965 HD11 LEU 33 HD11 LEU 33 -10.936 -6.737 -1.095 966 HD12 LEU 33 HD12 LEU 33 -11.164 -8.319 -1.843 967 HD13 LEU 33 HD13 LEU 33 -10.033 -7.171 -2.536 968 HD21 LEU 33 HD21 LEU 33 -8.343 -6.246 -0.302 969 HD22 LEU 33 HD22 LEU 33 -8.109 -7.457 0.932 970 HD23 LEU 33 HD23 LEU 33 -9.654 -6.630 0.795 971 H LYS 34 H LYS 34 -12.717 -9.792 0.214 972 HA LYS 34 HA LYS 34 -13.753 -7.222 -0.446 973 HB2 LYS 34 HB3 LYS 34 -15.188 -9.850 0.047 974 HB3 LYS 34 HB2 LYS 34 -15.921 -8.401 -0.620 975 HG2 LYS 34 HG3 LYS 34 -14.376 -8.461 -2.524 976 HG3 LYS 34 HG2 LYS 34 -13.622 -9.930 -1.897 977 HD2 LYS 34 HD3 LYS 34 -15.835 -11.074 -1.981 978 HD3 LYS 34 HD2 LYS 34 -16.545 -9.626 -2.681 979 HE2 LYS 34 HE2 LYS 34 -16.101 -10.804 -4.589 980 HE3 LYS 34 HE1 LYS 34 -14.596 -9.902 -4.460 981 HZ1 LYS 34 HZ1 LYS 34 -13.991 -12.009 -2.949 982 HZ2 LYS 34 HZ2 LYS 34 -13.777 -12.069 -4.654 983 HZ3 LYS 34 HZ3 LYS 34 -15.112 -12.744 -3.942 984 H GLU 35 H GLU 35 -14.175 -9.415 2.291 985 HA GLU 35 HA GLU 35 -16.161 -7.909 3.639 986 HB2 GLU 35 HB3 GLU 35 -14.138 -9.847 4.774 987 HB3 GLU 35 HB2 GLU 35 -15.606 -9.259 5.562 988 HG2 GLU 35 HG3 GLU 35 -15.616 -10.742 2.928 989 HG3 GLU 35 HG2 GLU 35 -15.897 -11.545 4.466 990 H LEU 36 H LEU 36 -12.643 -8.052 3.910 991 HA LEU 36 HA LEU 36 -12.645 -6.233 6.120 992 HB2 LEU 36 HB3 LEU 36 -10.519 -6.876 6.522 993 HB3 LEU 36 HB2 LEU 36 -10.996 -8.231 5.501 994 HG LEU 36 HG LEU 36 -10.104 -6.717 3.540 995 HD11 LEU 36 HD11 LEU 36 -8.949 -4.836 4.074 996 HD12 LEU 36 HD12 LEU 36 -8.111 -5.637 5.404 997 HD13 LEU 36 HD13 LEU 36 -9.715 -4.975 5.644 998 HD21 LEU 36 HD21 LEU 36 -7.865 -7.607 3.874 999 HD22 LEU 36 HD22 LEU 36 -9.092 -8.829 4.293 1000 HD23 LEU 36 HD23 LEU 36 -8.228 -7.955 5.566 1001 H LEU 37 H LEU 37 -11.798 -5.892 2.702 1002 HA LEU 37 HA LEU 37 -10.589 -3.389 2.943 1003 HB2 LEU 37 HB3 LEU 37 -10.330 -4.632 0.899 1004 HB3 LEU 37 HB2 LEU 37 -12.055 -4.638 0.566 1005 HG LEU 37 HG LEU 37 -10.615 -2.999 -0.759 1006 HD11 LEU 37 HD11 LEU 37 -12.369 -1.519 -1.000 1007 HD12 LEU 37 HD12 LEU 37 -12.713 -1.429 0.705 1008 HD13 LEU 37 HD13 LEU 37 -13.200 -2.853 -0.218 1009 HD21 LEU 37 HD21 LEU 37 -9.434 -2.281 1.520 1010 HD22 LEU 37 HD22 LEU 37 -10.801 -1.171 1.599 1011 HD23 LEU 37 HD23 LEU 37 -9.708 -1.114 0.224 1012 H GLN 38 H GLN 38 -13.921 -4.287 2.457 1013 HA GLN 38 HA GLN 38 -15.007 -1.720 2.123 1014 HB2 GLN 38 HB3 GLN 38 -17.156 -2.710 2.808 1015 HB3 GLN 38 HB2 GLN 38 -16.335 -3.708 1.618 1016 HG2 GLN 38 HG3 GLN 38 -15.418 -5.110 3.490 1017 HG3 GLN 38 HG2 GLN 38 -16.394 -4.168 4.619 1018 HE21 GLN 38 HE21 GLN 38 -17.342 -6.402 5.036 1019 HE22 GLN 38 HE22 GLN 38 -18.603 -6.919 4.028 1020 H THR 39 H THR 39 -14.396 -3.505 5.168 1021 HA THR 39 HA THR 39 -15.596 -1.372 6.719 1022 HB THR 39 HB THR 39 -15.268 -2.643 8.619 1023 HG1 THR 39 HG2 THR 39 -13.595 -4.574 8.126 1024 HG21 THR 39 HG21 THR 39 -15.156 -4.814 6.594 1025 HG22 THR 39 HG22 THR 39 -16.622 -3.819 6.822 1026 HG23 THR 39 HG23 THR 39 -15.982 -4.814 8.145 1027 H GLU 40 H GLU 40 -12.315 -2.654 6.290 1028 HA GLU 40 HA GLU 40 -11.168 -1.032 8.069 1029 HB2 GLU 40 HB3 GLU 40 -9.949 -2.209 5.563 1030 HB3 GLU 40 HB2 GLU 40 -9.002 -1.384 6.807 1031 HG2 GLU 40 HG3 GLU 40 -10.796 -3.778 7.337 1032 HG3 GLU 40 HG2 GLU 40 -9.039 -3.819 7.133 1033 H LEU 41 H LEU 41 -11.801 -0.423 4.676 1034 HA LEU 41 HA LEU 41 -10.938 2.387 4.973 1035 HB2 LEU 41 HB3 LEU 41 -11.090 0.566 2.597 1036 HB3 LEU 41 HB2 LEU 41 -11.216 2.280 2.359 1037 HG LEU 41 HG LEU 41 -9.087 2.527 3.793 1038 HD11 LEU 41 HD11 LEU 41 -7.631 0.412 3.572 1039 HD12 LEU 41 HD12 LEU 41 -9.168 -0.449 3.383 1040 HD13 LEU 41 HD13 LEU 41 -8.842 0.473 4.846 1041 HD21 LEU 41 HD21 LEU 41 -7.664 2.250 1.877 1042 HD22 LEU 41 HD22 LEU 41 -9.233 2.702 1.246 1043 HD23 LEU 41 HD23 LEU 41 -8.713 1.014 1.185 1044 H SER 42 H SER 42 -13.405 1.296 5.982 1045 HA SER 42 HA SER 42 -15.571 1.640 4.304 1046 HB2 SER 42 HB3 SER 42 -16.769 2.302 6.527 1047 HB3 SER 42 HB2 SER 42 -16.143 0.686 6.304 1048 HG SER 42 HG SER 42 -14.471 1.124 7.642 1049 H GLY 43 H GLY 43 -13.750 4.057 6.114 1050 HA2 GLY 43 HA3 GLY 43 -15.461 6.277 5.616 1051 HA3 GLY 43 HA2 GLY 43 -13.743 6.323 6.035 1052 H PHE 44 H PHE 44 -12.561 5.007 3.993 1053 HA PHE 44 HA PHE 44 -12.609 6.975 1.908 1054 HB2 PHE 44 HB3 PHE 44 -11.202 4.322 2.134 1055 HB3 PHE 44 HB2 PHE 44 -11.121 5.271 0.650 1056 HD1 PHE 44 HD2 PHE 44 -10.826 7.947 1.324 1057 HD2 PHE 44 HD1 PHE 44 -9.315 4.566 3.438 1058 HE1 PHE 44 HE2 PHE 44 -9.067 9.377 2.292 1059 HE2 PHE 44 HE1 PHE 44 -7.530 5.986 4.440 1060 HZ PHE 44 HZ PHE 44 -7.396 8.386 3.872 1061 H LEU 45 H LEU 45 -13.826 3.743 2.226 1062 HA LEU 45 HA LEU 45 -14.795 3.382 -0.395 1063 HB2 LEU 45 HB3 LEU 45 -14.762 1.420 0.794 1064 HB3 LEU 45 HB2 LEU 45 -15.302 2.173 2.280 1065 HG LEU 45 HG LEU 45 -17.562 2.394 1.383 1066 HD11 LEU 45 HD11 LEU 45 -17.380 0.639 -0.919 1067 HD12 LEU 45 HD12 LEU 45 -16.287 2.005 -1.147 1068 HD13 LEU 45 HD13 LEU 45 -17.985 2.282 -0.797 1069 HD21 LEU 45 HD21 LEU 45 -16.828 -0.466 0.810 1070 HD22 LEU 45 HD22 LEU 45 -18.188 0.160 1.720 1071 HD23 LEU 45 HD23 LEU 45 -16.576 0.176 2.432 1072 H ASP 46 H ASP 46 -16.404 4.672 2.495 1073 HA ASP 46 HA ASP 46 -18.796 5.239 1.052 1074 HB2 ASP 46 HB3 ASP 46 -18.840 4.988 3.438 1075 HB3 ASP 46 HB2 ASP 46 -17.818 6.417 3.659 1076 H ALA 47 H ALA 47 -15.966 7.141 1.932 1077 HA ALA 47 HA ALA 47 -16.885 9.635 1.054 1078 HB1 ALA 47 HB1 ALA 47 -14.190 8.484 1.579 1079 HB2 ALA 47 HB2 ALA 47 -14.959 9.948 2.211 1080 HB3 ALA 47 HB3 ALA 47 -14.277 9.946 0.597 1081 H GLN 48 H GLN 48 -14.998 7.204 -0.795 1082 HA GLN 48 HA GLN 48 -15.659 8.736 -3.232 1083 HB2 GLN 48 HB3 GLN 48 -13.879 7.425 -4.326 1084 HB3 GLN 48 HB2 GLN 48 -13.239 8.378 -2.989 1085 HG2 GLN 48 HG3 GLN 48 -12.542 6.495 -1.918 1086 HG3 GLN 48 HG2 GLN 48 -14.122 5.757 -2.076 1087 HE21 GLN 48 HE21 GLN 48 -14.621 4.905 -4.312 1088 HE22 GLN 48 HE22 GLN 48 -13.356 4.131 -5.149 1089 H LYS 49 H LYS 49 -17.571 7.224 -1.944 1090 HA LYS 49 HA LYS 49 -17.938 4.643 -2.987 1091 HB2 LYS 49 HB3 LYS 49 -19.212 5.647 -1.100 1092 HB3 LYS 49 HB2 LYS 49 -20.084 6.660 -2.239 1093 HG2 LYS 49 HG3 LYS 49 -20.187 3.947 -3.167 1094 HG3 LYS 49 HG2 LYS 49 -20.622 3.970 -1.465 1095 HD2 LYS 49 HD3 LYS 49 -22.112 6.103 -2.239 1096 HD3 LYS 49 HD2 LYS 49 -22.018 5.239 -3.765 1097 HE2 LYS 49 HE2 LYS 49 -23.966 4.412 -2.682 1098 HE3 LYS 49 HE1 LYS 49 -22.748 3.150 -2.547 1099 HZ1 LYS 49 HZ1 LYS 49 -24.084 4.515 -0.500 1100 HZ2 LYS 49 HZ2 LYS 49 -22.459 4.883 -0.349 1101 HZ3 LYS 49 HZ3 LYS 49 -22.977 3.257 -0.317 1102 H ASP 50 H ASP 50 -18.894 7.838 -4.167 1103 HA ASP 50 HA ASP 50 -20.122 6.725 -6.559 1104 HB2 ASP 50 HB3 ASP 50 -21.016 8.766 -5.320 1105 HB3 ASP 50 HB2 ASP 50 -19.641 9.644 -5.994 1106 H VAL 51 H VAL 51 -17.392 6.099 -6.312 1107 HA VAL 51 HA VAL 51 -16.254 7.698 -8.533 1108 HB VAL 51 HB VAL 51 -14.862 6.409 -6.188 1109 HG11 VAL 51 HG11 VAL 51 -13.790 7.329 -8.831 1110 HG12 VAL 51 HG12 VAL 51 -13.330 5.919 -7.840 1111 HG13 VAL 51 HG13 VAL 51 -12.807 7.517 -7.381 1112 HG21 VAL 51 HG21 VAL 51 -13.987 8.766 -5.930 1113 HG22 VAL 51 HG22 VAL 51 -15.723 8.624 -5.688 1114 HG23 VAL 51 HG23 VAL 51 -15.091 9.266 -7.207 1115 H ASP 52 H ASP 52 -15.764 6.691 -10.306 1116 HA ASP 52 HA ASP 52 -16.535 4.065 -10.890 1117 HB2 ASP 52 HB3 ASP 52 -16.296 5.662 -12.653 1118 HB3 ASP 52 HB2 ASP 52 -14.610 5.932 -12.250 1119 H ALA 53 H ALA 53 -13.442 5.425 -10.020 1120 HA ALA 53 HA ALA 53 -11.804 3.201 -10.426 1121 HB1 ALA 53 HB1 ALA 53 -10.223 4.522 -9.585 1122 HB2 ALA 53 HB2 ALA 53 -11.002 4.589 -8.017 1123 HB3 ALA 53 HB3 ALA 53 -11.452 5.743 -9.273 1124 H VAL 54 H VAL 54 -14.158 3.797 -7.898 1125 HA VAL 54 HA VAL 54 -13.116 1.968 -6.044 1126 HB VAL 54 HB VAL 54 -15.145 3.691 -5.799 1127 HG11 VAL 54 HG11 VAL 54 -17.289 2.811 -5.957 1128 HG12 VAL 54 HG12 VAL 54 -16.726 1.179 -6.264 1129 HG13 VAL 54 HG13 VAL 54 -16.544 2.432 -7.502 1130 HG21 VAL 54 HG21 VAL 54 -15.853 2.511 -3.802 1131 HG22 VAL 54 HG22 VAL 54 -14.119 2.265 -3.969 1132 HG23 VAL 54 HG23 VAL 54 -15.240 0.987 -4.419 1133 H ASP 55 H ASP 55 -15.228 1.538 -8.803 1134 HA ASP 55 HA ASP 55 -15.673 -1.298 -8.447 1135 HB2 ASP 55 HB3 ASP 55 -17.171 0.049 -9.877 1136 HB3 ASP 55 HB2 ASP 55 -15.804 0.462 -10.905 1137 H LYS 56 H LYS 56 -13.733 0.597 -10.645 1138 HA LYS 56 HA LYS 56 -12.405 -1.621 -11.725 1139 HB2 LYS 56 HB3 LYS 56 -11.792 1.311 -11.885 1140 HB3 LYS 56 HB2 LYS 56 -10.942 0.071 -12.826 1141 HG2 LYS 56 HG3 LYS 56 -13.057 -0.734 -13.769 1142 HG3 LYS 56 HG2 LYS 56 -13.964 0.452 -12.834 1143 HD2 LYS 56 HD3 LYS 56 -12.830 2.232 -14.006 1144 HD3 LYS 56 HD2 LYS 56 -11.899 1.069 -14.959 1145 HE2 LYS 56 HE2 LYS 56 -13.991 1.965 -16.128 1146 HE3 LYS 56 HE1 LYS 56 -13.886 0.212 -16.025 1147 HZ1 LYS 56 HZ1 LYS 56 -16.077 1.128 -15.402 1148 HZ2 LYS 56 HZ2 LYS 56 -15.404 1.934 -14.100 1149 HZ3 LYS 56 HZ3 LYS 56 -15.401 0.213 -14.171 1150 H VAL 57 H VAL 57 -11.405 0.450 -9.071 1151 HA VAL 57 HA VAL 57 -8.732 -0.548 -8.959 1152 HB VAL 57 HB VAL 57 -10.539 0.620 -6.818 1153 HG11 VAL 57 HG11 VAL 57 -8.890 -0.713 -5.696 1154 HG12 VAL 57 HG12 VAL 57 -8.373 0.968 -5.599 1155 HG13 VAL 57 HG13 VAL 57 -7.610 -0.117 -6.754 1156 HG21 VAL 57 HG21 VAL 57 -8.114 1.958 -8.002 1157 HG22 VAL 57 HG22 VAL 57 -9.537 2.675 -7.252 1158 HG23 VAL 57 HG23 VAL 57 -9.645 2.016 -8.885 1159 H MET 58 H MET 58 -11.764 -1.340 -7.393 1160 HA MET 58 HA MET 58 -10.823 -3.566 -5.942 1161 HB2 MET 58 HB3 MET 58 -12.932 -2.428 -5.380 1162 HB3 MET 58 HB2 MET 58 -13.593 -2.902 -6.937 1163 HG2 MET 58 HG3 MET 58 -13.461 -5.117 -6.475 1164 HG3 MET 58 HG2 MET 58 -12.607 -4.943 -4.920 1165 HE1 MET 58 HE1 MET 58 -15.508 -3.682 -7.019 1166 HE2 MET 58 HE2 MET 58 -16.931 -3.772 -6.004 1167 HE3 MET 58 HE3 MET 58 -16.199 -5.258 -6.596 1168 H LYS 59 H LYS 59 -12.408 -3.272 -9.113 1169 HA LYS 59 HA LYS 59 -12.460 -6.064 -9.526 1170 HB2 LYS 59 HB3 LYS 59 -13.728 -5.647 -11.296 1171 HB3 LYS 59 HB2 LYS 59 -13.874 -4.042 -10.618 1172 HG2 LYS 59 HG3 LYS 59 -11.696 -3.542 -12.051 1173 HG3 LYS 59 HG2 LYS 59 -12.204 -4.963 -12.969 1174 HD2 LYS 59 HD3 LYS 59 -13.985 -2.597 -12.368 1175 HD3 LYS 59 HD2 LYS 59 -13.040 -2.801 -13.854 1176 HE2 LYS 59 HE2 LYS 59 -14.312 -4.653 -14.546 1177 HE3 LYS 59 HE1 LYS 59 -14.958 -4.952 -12.937 1178 HZ1 LYS 59 HZ1 LYS 59 -15.656 -2.804 -14.833 1179 HZ2 LYS 59 HZ2 LYS 59 -16.010 -2.656 -13.170 1180 HZ3 LYS 59 HZ3 LYS 59 -16.672 -3.935 -14.087 1181 H GLU 60 H GLU 60 -10.250 -3.517 -10.687 1182 HA GLU 60 HA GLU 60 -8.857 -5.295 -12.397 1183 HB2 GLU 60 HB3 GLU 60 -8.006 -2.677 -11.122 1184 HB3 GLU 60 HB2 GLU 60 -7.029 -3.578 -12.268 1185 HG2 GLU 60 HG3 GLU 60 -8.899 -3.434 -13.946 1186 HG3 GLU 60 HG2 GLU 60 -9.822 -2.505 -12.789 1187 H LEU 61 H LEU 61 -8.389 -4.324 -9.057 1188 HA LEU 61 HA LEU 61 -6.090 -5.956 -8.608 1189 HB2 LEU 61 HB3 LEU 61 -8.088 -4.614 -6.816 1190 HB3 LEU 61 HB2 LEU 61 -7.003 -5.816 -6.146 1191 HG LEU 61 HG LEU 61 -6.165 -3.374 -6.081 1192 HD11 LEU 61 HD11 LEU 61 -4.583 -5.695 -7.099 1193 HD12 LEU 61 HD12 LEU 61 -4.589 -4.956 -5.503 1194 HD13 LEU 61 HD13 LEU 61 -3.834 -4.120 -6.857 1195 HD21 LEU 61 HD21 LEU 61 -6.827 -2.959 -8.534 1196 HD22 LEU 61 HD22 LEU 61 -5.429 -3.959 -8.969 1197 HD23 LEU 61 HD23 LEU 61 -5.197 -2.464 -8.075 1198 H ASP 62 H ASP 62 -9.540 -6.446 -8.536 1199 HA ASP 62 HA ASP 62 -9.708 -8.851 -7.199 1200 HB2 ASP 62 HB3 ASP 62 -11.651 -7.444 -8.104 1201 HB3 ASP 62 HB2 ASP 62 -11.333 -8.246 -9.648 1202 H GLU 63 H GLU 63 -8.938 -8.193 -10.555 1203 HA GLU 63 HA GLU 63 -8.930 -10.888 -11.489 1204 HB2 GLU 63 HB3 GLU 63 -7.363 -8.497 -12.464 1205 HB3 GLU 63 HB2 GLU 63 -7.556 -10.015 -13.323 1206 HG2 GLU 63 HG3 GLU 63 -10.011 -9.776 -13.328 1207 HG3 GLU 63 HG2 GLU 63 -9.841 -8.285 -12.429 1208 H ASN 64 H ASN 64 -6.468 -8.787 -10.117 1209 HA ASN 64 HA ASN 64 -4.246 -10.520 -10.376 1210 HB2 ASN 64 HB3 ASN 64 -4.492 -7.997 -9.432 1211 HB3 ASN 64 HB2 ASN 64 -4.551 -8.980 -7.933 1212 HD21 ASN 64 HD21 ASN 64 -2.842 -11.102 -9.097 1213 HD22 ASN 64 HD22 ASN 64 -1.253 -10.495 -9.017 1214 H GLY 65 H GLY 65 -6.752 -10.026 -8.013 1215 HA2 GLY 65 HA3 GLY 65 -5.927 -11.991 -6.107 1216 HA3 GLY 65 HA2 GLY 65 -7.543 -11.299 -6.291 1217 H ASP 66 H ASP 66 -5.439 -13.260 -8.287 1218 HA ASP 66 HA ASP 66 -7.319 -14.646 -9.743 1219 HB2 ASP 66 HB3 ASP 66 -4.773 -14.674 -9.995 1220 HB3 ASP 66 HB2 ASP 66 -4.758 -15.880 -8.727 1221 H GLY 67 H GLY 67 -6.299 -15.062 -6.552 1222 HA2 GLY 67 HA3 GLY 67 -8.576 -16.632 -5.821 1223 HA3 GLY 67 HA2 GLY 67 -7.129 -17.651 -5.857 1224 H GLU 68 H GLU 68 -5.232 -15.932 -5.079 1225 HA GLU 68 HA GLU 68 -5.955 -15.177 -2.324 1226 HB2 GLU 68 HB3 GLU 68 -3.320 -16.072 -3.542 1227 HB3 GLU 68 HB2 GLU 68 -3.476 -15.421 -1.916 1228 HG2 GLU 68 HG3 GLU 68 -4.947 -17.219 -1.251 1229 HG3 GLU 68 HG2 GLU 68 -5.032 -17.850 -2.885 1230 H VAL 69 H VAL 69 -5.069 -13.182 -1.586 1231 HA VAL 69 HA VAL 69 -3.910 -11.509 -3.644 1232 HB VAL 69 HB VAL 69 -6.126 -10.657 -3.487 1233 HG11 VAL 69 HG11 VAL 69 -7.047 -9.953 -1.192 1234 HG12 VAL 69 HG12 VAL 69 -5.791 -11.001 -0.522 1235 HG13 VAL 69 HG13 VAL 69 -7.036 -11.679 -1.566 1236 HG21 VAL 69 HG21 VAL 69 -4.278 -8.968 -3.314 1237 HG22 VAL 69 HG22 VAL 69 -4.501 -8.941 -1.568 1238 HG23 VAL 69 HG23 VAL 69 -5.799 -8.414 -2.632 1239 H ASP 70 H ASP 70 -2.046 -10.581 -2.988 1240 HA ASP 70 HA ASP 70 -1.177 -11.415 -0.326 1241 HB2 ASP 70 HB3 ASP 70 0.843 -11.786 -1.245 1242 HB3 ASP 70 HB2 ASP 70 0.129 -11.437 -2.794 1243 H PHE 71 H PHE 71 0.575 -9.903 0.596 1244 HA PHE 71 HA PHE 71 -0.775 -7.693 1.657 1245 HB2 PHE 71 HB3 PHE 71 1.055 -8.896 2.787 1246 HB3 PHE 71 HB2 PHE 71 2.204 -8.219 1.642 1247 HD1 PHE 71 HD1 PHE 71 -0.521 -7.162 3.980 1248 HD2 PHE 71 HD2 PHE 71 3.251 -6.153 2.177 1249 HE1 PHE 71 HE1 PHE 71 -0.401 -5.143 5.358 1250 HE2 PHE 71 HE2 PHE 71 3.362 -4.115 3.583 1251 HZ PHE 71 HZ PHE 71 1.554 -3.601 5.162 1252 H GLN 72 H GLN 72 1.751 -7.925 -0.836 1253 HA GLN 72 HA GLN 72 2.034 -5.133 -1.301 1254 HB2 GLN 72 HB3 GLN 72 2.582 -7.571 -3.000 1255 HB3 GLN 72 HB2 GLN 72 2.916 -5.922 -3.594 1256 HG2 GLN 72 HG3 GLN 72 4.422 -5.614 -1.715 1257 HG3 GLN 72 HG2 GLN 72 3.998 -7.207 -1.087 1258 HE21 GLN 72 HE21 GLN 72 3.980 -7.510 -4.431 1259 HE22 GLN 72 HE22 GLN 72 5.570 -8.041 -4.652 1260 H GLU 73 H GLU 73 -0.027 -7.603 -2.721 1261 HA GLU 73 HA GLU 73 -1.398 -5.928 -4.574 1262 HB2 GLU 73 HB3 GLU 73 -2.114 -8.553 -3.249 1263 HB3 GLU 73 HB2 GLU 73 -3.077 -7.797 -4.521 1264 HG2 GLU 73 HG3 GLU 73 -1.270 -7.919 -6.092 1265 HG3 GLU 73 HG2 GLU 73 -0.130 -8.414 -4.845 1266 H TYR 74 H TYR 74 -2.018 -6.974 -1.271 1267 HA TYR 74 HA TYR 74 -4.555 -5.796 -0.880 1268 HB2 TYR 74 HB3 TYR 74 -3.742 -7.454 0.639 1269 HB3 TYR 74 HB2 TYR 74 -2.341 -6.464 1.046 1270 HD1 TYR 74 HD1 TYR 74 -6.067 -5.911 0.876 1271 HD2 TYR 74 HD2 TYR 74 -2.446 -5.505 3.157 1272 HE1 TYR 74 HE1 TYR 74 -7.337 -4.850 2.691 1273 HE2 TYR 74 HE2 TYR 74 -3.723 -4.441 4.990 1274 HH TYR 74 HH TYR 74 -6.505 -3.068 4.770 1275 H VAL 75 H VAL 75 -1.310 -4.480 -0.124 1276 HA VAL 75 HA VAL 75 -2.348 -2.122 0.985 1277 HB VAL 75 HB VAL 75 -0.132 -1.155 0.830 1278 HG11 VAL 75 HG11 VAL 75 0.804 -3.815 1.512 1279 HG12 VAL 75 HG12 VAL 75 -0.811 -3.553 2.138 1280 HG13 VAL 75 HG13 VAL 75 0.486 -2.439 2.564 1281 HG21 VAL 75 HG21 VAL 75 0.802 -3.621 -0.640 1282 HG22 VAL 75 HG22 VAL 75 1.629 -2.069 -0.428 1283 HG23 VAL 75 HG23 VAL 75 0.329 -2.185 -1.551 1284 H VAL 76 H VAL 76 -1.368 -2.823 -2.350 1285 HA VAL 76 HA VAL 76 -1.678 -0.164 -3.225 1286 HB VAL 76 HB VAL 76 -0.358 -1.838 -4.486 1287 HG11 VAL 76 HG11 VAL 76 -1.626 -3.427 -5.959 1288 HG12 VAL 76 HG12 VAL 76 -3.060 -3.119 -5.000 1289 HG13 VAL 76 HG13 VAL 76 -1.620 -3.822 -4.253 1290 HG21 VAL 76 HG21 VAL 76 -2.682 -0.774 -6.145 1291 HG22 VAL 76 HG22 VAL 76 -1.067 -1.168 -6.712 1292 HG23 VAL 76 HG23 VAL 76 -1.301 0.196 -5.632 1293 H LEU 77 H LEU 77 -3.886 -2.884 -2.984 1294 HA LEU 77 HA LEU 77 -6.038 -1.754 -4.406 1295 HB2 LEU 77 HB3 LEU 77 -6.041 -4.110 -3.796 1296 HB3 LEU 77 HB2 LEU 77 -6.032 -3.712 -2.087 1297 HG LEU 77 HG LEU 77 -8.257 -2.617 -2.331 1298 HD11 LEU 77 HD11 LEU 77 -9.328 -2.297 -4.260 1299 HD12 LEU 77 HD12 LEU 77 -8.854 -3.852 -4.914 1300 HD13 LEU 77 HD13 LEU 77 -7.768 -2.488 -5.062 1301 HD21 LEU 77 HD21 LEU 77 -9.050 -4.630 -1.725 1302 HD22 LEU 77 HD22 LEU 77 -7.695 -5.442 -2.485 1303 HD23 LEU 77 HD23 LEU 77 -9.157 -5.094 -3.414 1304 H VAL 78 H VAL 78 -5.270 -1.683 -0.919 1305 HA VAL 78 HA VAL 78 -7.442 0.082 -0.340 1306 HB VAL 78 HB VAL 78 -6.470 0.342 1.873 1307 HG11 VAL 78 HG11 VAL 78 -5.915 -2.514 1.675 1308 HG12 VAL 78 HG12 VAL 78 -7.323 -2.090 0.715 1309 HG13 VAL 78 HG13 VAL 78 -7.278 -1.705 2.436 1310 HG21 VAL 78 HG21 VAL 78 -4.352 -0.773 2.468 1311 HG22 VAL 78 HG22 VAL 78 -4.061 0.423 1.211 1312 HG23 VAL 78 HG23 VAL 78 -4.176 -1.299 0.804 1313 H ALA 79 H ALA 79 -4.011 0.515 -0.966 1314 HA ALA 79 HA ALA 79 -3.885 3.269 -0.430 1315 HB1 ALA 79 HB1 ALA 79 -1.875 1.818 -0.778 1316 HB2 ALA 79 HB2 ALA 79 -1.892 3.299 -1.750 1317 HB3 ALA 79 HB3 ALA 79 -2.305 1.763 -2.493 1318 H ALA 80 H ALA 80 -4.592 1.496 -3.409 1319 HA ALA 80 HA ALA 80 -4.677 3.634 -5.139 1320 HB1 ALA 80 HB1 ALA 80 -6.393 2.192 -6.410 1321 HB2 ALA 80 HB2 ALA 80 -6.135 1.012 -5.098 1322 HB3 ALA 80 HB3 ALA 80 -4.800 1.496 -6.109 1323 H LEU 81 H LEU 81 -7.272 2.207 -3.202 1324 HA LEU 81 HA LEU 81 -9.297 4.119 -3.871 1325 HB2 LEU 81 HB3 LEU 81 -8.953 2.318 -1.454 1326 HB3 LEU 81 HB2 LEU 81 -10.379 3.303 -1.770 1327 HG LEU 81 HG LEU 81 -9.319 1.220 -3.708 1328 HD11 LEU 81 HD11 LEU 81 -11.443 -0.022 -2.931 1329 HD12 LEU 81 HD12 LEU 81 -11.405 1.045 -1.526 1330 HD13 LEU 81 HD13 LEU 81 -10.049 -0.043 -1.854 1331 HD21 LEU 81 HD21 LEU 81 -10.694 2.906 -4.820 1332 HD22 LEU 81 HD22 LEU 81 -11.906 2.812 -3.555 1333 HD23 LEU 81 HD23 LEU 81 -11.643 1.437 -4.639 1334 H THR 82 H THR 82 -6.873 3.905 -1.302 1335 HA THR 82 HA THR 82 -7.743 6.138 0.162 1336 HB THR 82 HB THR 82 -4.871 5.217 -0.090 1337 HG1 THR 82 HG2 THR 82 -6.401 3.471 0.396 1338 HG21 THR 82 HG21 THR 82 -6.263 7.159 1.554 1339 HG22 THR 82 HG22 THR 82 -4.534 6.816 1.478 1340 HG23 THR 82 HG23 THR 82 -5.569 5.892 2.547 1341 H VAL 83 H VAL 83 -5.225 5.913 -2.378 1342 HA VAL 83 HA VAL 83 -4.688 8.705 -2.356 1343 HB VAL 83 HB VAL 83 -3.098 7.068 -3.304 1344 HG11 VAL 83 HG11 VAL 83 -4.695 5.567 -4.396 1345 HG12 VAL 83 HG12 VAL 83 -3.469 6.166 -5.538 1346 HG13 VAL 83 HG13 VAL 83 -5.072 6.828 -5.579 1347 HG21 VAL 83 HG21 VAL 83 -2.482 8.308 -5.327 1348 HG22 VAL 83 HG22 VAL 83 -2.939 9.431 -4.032 1349 HG23 VAL 83 HG23 VAL 83 -4.056 9.095 -5.351 1350 H ALA 84 H ALA 84 -6.870 6.704 -4.300 1351 HA ALA 84 HA ALA 84 -7.771 8.702 -6.041 1352 HB1 ALA 84 HB1 ALA 84 -9.047 6.200 -4.964 1353 HB2 ALA 84 HB2 ALA 84 -8.497 6.548 -6.610 1354 HB3 ALA 84 HB3 ALA 84 -9.958 7.321 -5.975 1355 H MET 85 H MET 85 -9.104 7.657 -2.921 1356 HA MET 85 HA MET 85 -11.077 9.686 -2.838 1357 HB2 MET 85 HB3 MET 85 -10.863 7.455 -1.450 1358 HB3 MET 85 HB2 MET 85 -9.951 8.494 -0.359 1359 HG2 MET 85 HG3 MET 85 -12.540 9.638 -1.303 1360 HG3 MET 85 HG2 MET 85 -12.656 8.255 -0.239 1361 HE1 MET 85 HE1 MET 85 -12.852 12.154 1.002 1362 HE2 MET 85 HE2 MET 85 -12.915 11.519 -0.621 1363 HE3 MET 85 HE3 MET 85 -11.450 12.308 -0.052 1364 H ASN 86 H ASN 86 -7.892 9.370 -1.293 1365 HA ASN 86 HA ASN 86 -8.045 11.802 0.112 1366 HB2 ASN 86 HB3 ASN 86 -6.307 9.773 0.312 1367 HB3 ASN 86 HB2 ASN 86 -5.355 10.820 -0.742 1368 HD21 ASN 86 HD21 ASN 86 -6.990 10.686 2.437 1369 HD22 ASN 86 HD22 ASN 86 -6.069 11.941 3.119 1370 H ASN 87 H ASN 87 -6.831 11.017 -3.101 1371 HA ASN 87 HA ASN 87 -5.583 13.364 -3.821 1372 HB2 ASN 87 HB3 ASN 87 -5.575 11.543 -5.350 1373 HB3 ASN 87 HB2 ASN 87 -7.332 11.519 -5.445 1374 HD21 ASN 87 HD21 ASN 87 -4.453 13.437 -6.382 1375 HD22 ASN 87 HD22 ASN 87 -5.257 14.325 -7.584 1376 H PHE 88 H PHE 88 -9.019 12.729 -3.472 1377 HA PHE 88 HA PHE 88 -9.976 15.042 -4.752 1378 HB2 PHE 88 HB3 PHE 88 -11.544 13.298 -4.089 1379 HB3 PHE 88 HB2 PHE 88 -11.167 13.553 -2.387 1380 HD1 PHE 88 HD1 PHE 88 -12.425 15.371 -5.417 1381 HD2 PHE 88 HD2 PHE 88 -12.367 15.133 -1.115 1382 HE1 PHE 88 HE1 PHE 88 -14.106 17.191 -5.281 1383 HE2 PHE 88 HE2 PHE 88 -14.044 16.956 -0.995 1384 HZ PHE 88 HZ PHE 88 -14.909 17.984 -3.081 1385 H PHE 89 H PHE 89 -8.922 14.478 -1.421 1386 HA PHE 89 HA PHE 89 -9.444 17.123 -0.505 1387 HB2 PHE 89 HB3 PHE 89 -7.512 15.011 0.483 1388 HB3 PHE 89 HB2 PHE 89 -7.674 16.586 1.224 1389 HD1 PHE 89 HD1 PHE 89 -10.072 17.382 1.876 1390 HD2 PHE 89 HD2 PHE 89 -9.026 13.278 1.132 1391 HE1 PHE 89 HE1 PHE 89 -12.080 16.641 3.124 1392 HE2 PHE 89 HE2 PHE 89 -11.045 12.551 2.381 1393 HZ PHE 89 HZ PHE 89 -12.565 14.232 3.371 1394 H TRP 90 H TRP 90 -6.663 15.609 -2.063 1395 HA TRP 90 HA TRP 90 -4.857 17.788 -1.802 1396 HB2 TRP 90 HB3 TRP 90 -4.974 15.938 -4.181 1397 HB3 TRP 90 HB2 TRP 90 -3.565 16.791 -3.555 1398 HD1 TRP 90 HD TRP 90 -5.184 15.605 -0.559 1399 HE1 TRP 90 HE1 TRP 90 -4.301 13.396 0.210 1400 HE3 TRP 90 HE3 TRP 90 -2.738 14.152 -4.795 1401 HZ2 TRP 90 HZ2 TRP 90 -2.691 11.212 -0.801 1402 HZ3 TRP 90 HZ3 TRP 90 -1.529 12.001 -4.861 1403 HH2 TRP 90 HH TRP 90 -1.501 10.522 -2.862 1404 H GLU 91 H GLU 91 -7.107 16.854 -4.276 1405 HA GLU 91 HA GLU 91 -6.634 19.325 -5.759 1406 HB2 GLU 91 HB3 GLU 91 -8.433 16.985 -6.363 1407 HB3 GLU 91 HB2 GLU 91 -8.300 18.407 -7.382 1408 HG2 GLU 91 HG3 GLU 91 -5.881 18.067 -7.634 1409 HG3 GLU 91 HG2 GLU 91 -5.947 16.648 -6.596 1410 H ASN 92 H ASN 92 -8.669 18.406 -3.275 1411 HA ASN 92 HA ASN 92 -11.099 19.536 -3.734 1412 HB2 ASN 92 HB3 ASN 92 -10.454 18.492 -1.585 1413 HB3 ASN 92 HB2 ASN 92 -9.496 19.956 -1.238 1414 HD21 ASN 92 HD21 ASN 92 -11.557 19.343 0.582 1415 HD22 ASN 92 HD22 ASN 92 -12.824 20.434 0.363 1416 H SER 93 H SER 93 -11.366 21.301 -4.850 1417 HA SER 93 HA SER 93 -10.361 23.842 -3.842 1418 HB2 SER 93 HB3 SER 93 -9.958 22.865 -6.644 1419 HB3 SER 93 HB2 SER 93 -9.399 24.429 -6.015 1420 HG SER 93 HG SER 93 -8.696 21.768 -5.310 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -10.441 6.258 8.575 2 HA2 GLY 1 HA3 GLY 1 -9.074 8.316 10.140 3 HA3 GLY 1 HA2 GLY 1 -10.783 8.049 10.493 4 H SER 2 H SER 2 -10.263 5.135 9.723 5 HA SER 2 HA SER 2 -9.861 4.114 12.355 6 HB2 SER 2 HB3 SER 2 -9.703 2.481 9.814 7 HB3 SER 2 HB2 SER 2 -10.320 2.037 11.395 8 HG SER 2 HG SER 2 -11.399 3.757 9.438 9 H GLU 3 H GLU 3 -8.162 2.161 12.536 10 HA GLU 3 HA GLU 3 -5.579 3.310 12.553 11 HB2 GLU 3 HB3 GLU 3 -6.477 0.427 12.683 12 HB3 GLU 3 HB2 GLU 3 -4.796 0.898 12.816 13 HG2 GLU 3 HG3 GLU 3 -5.156 2.193 14.670 14 HG3 GLU 3 HG2 GLU 3 -6.941 2.055 14.633 15 H LEU 4 H LEU 4 -7.058 0.985 10.372 16 HA LEU 4 HA LEU 4 -4.818 0.645 8.687 17 HB2 LEU 4 HB3 LEU 4 -7.784 0.238 8.334 18 HB3 LEU 4 HB2 LEU 4 -6.695 0.029 6.974 19 HG LEU 4 HG LEU 4 -7.238 -2.066 8.347 20 HD11 LEU 4 HD11 LEU 4 -4.291 -1.482 8.173 21 HD12 LEU 4 HD12 LEU 4 -5.311 -1.759 6.748 22 HD13 LEU 4 HD13 LEU 4 -5.139 -3.014 7.964 23 HD21 LEU 4 HD21 LEU 4 -5.649 -2.333 10.331 24 HD22 LEU 4 HD22 LEU 4 -7.046 -1.331 10.607 25 HD23 LEU 4 HD23 LEU 4 -5.456 -0.597 10.349 26 H GLU 5 H GLU 5 -7.565 2.828 8.603 27 HA GLU 5 HA GLU 5 -6.883 4.182 6.209 28 HB2 GLU 5 HB3 GLU 5 -8.520 4.947 8.615 29 HB3 GLU 5 HB2 GLU 5 -8.427 5.956 7.192 30 HG2 GLU 5 HG3 GLU 5 -9.296 4.122 5.795 31 HG3 GLU 5 HG2 GLU 5 -9.327 3.043 7.175 32 H THR 6 H THR 6 -6.305 4.896 9.629 33 HA THR 6 HA THR 6 -4.831 7.238 9.197 34 HB THR 6 HB THR 6 -4.438 5.340 11.516 35 HG1 THR 6 HG2 THR 6 -6.666 5.787 11.134 36 HG21 THR 6 HG21 THR 6 -2.863 7.179 11.467 37 HG22 THR 6 HG22 THR 6 -4.056 7.531 12.709 38 HG23 THR 6 HG23 THR 6 -4.144 8.336 11.149 39 H ALA 7 H ALA 7 -3.862 3.829 9.478 40 HA ALA 7 HA ALA 7 -1.102 4.182 9.307 41 HB1 ALA 7 HB1 ALA 7 -2.223 2.010 9.767 42 HB2 ALA 7 HB2 ALA 7 -1.022 1.881 8.482 43 HB3 ALA 7 HB3 ALA 7 -2.732 1.932 8.081 44 H MET 8 H MET 8 -3.541 3.784 6.737 45 HA MET 8 HA MET 8 -1.720 4.123 4.572 46 HB2 MET 8 HB3 MET 8 -4.701 4.632 4.680 47 HB3 MET 8 HB2 MET 8 -3.741 4.572 3.212 48 HG2 MET 8 HG3 MET 8 -4.142 2.276 5.174 49 HG3 MET 8 HG2 MET 8 -4.796 2.394 3.551 50 HE1 MET 8 HE1 MET 8 -2.250 1.776 1.175 51 HE2 MET 8 HE2 MET 8 -1.931 3.411 1.753 52 HE3 MET 8 HE3 MET 8 -3.594 2.846 1.638 53 H GLU 9 H GLU 9 -3.764 6.378 6.386 54 HA GLU 9 HA GLU 9 -3.156 8.672 4.872 55 HB2 GLU 9 HB3 GLU 9 -3.958 8.380 7.780 56 HB3 GLU 9 HB2 GLU 9 -3.813 9.914 6.946 57 HG2 GLU 9 HG3 GLU 9 -5.513 9.341 5.338 58 HG3 GLU 9 HG2 GLU 9 -5.631 7.694 5.914 59 H THR 10 H THR 10 -1.572 7.075 7.555 60 HA THR 10 HA THR 10 0.393 9.017 8.158 61 HB THR 10 HB THR 10 0.856 6.006 8.259 62 HG1 THR 10 HG2 THR 10 -1.183 6.663 9.219 63 HG21 THR 10 HG21 THR 10 2.622 7.924 8.819 64 HG22 THR 10 HG22 THR 10 2.510 6.473 9.796 65 HG23 THR 10 HG23 THR 10 1.738 7.955 10.339 66 H LEU 11 H LEU 11 0.307 6.316 5.866 67 HA LEU 11 HA LEU 11 2.863 6.784 4.702 68 HB2 LEU 11 HB3 LEU 11 0.378 5.435 3.611 69 HB3 LEU 11 HB2 LEU 11 1.925 5.446 2.774 70 HG LEU 11 HG LEU 11 1.566 4.367 5.589 71 HD11 LEU 11 HD11 LEU 11 1.514 2.175 4.686 72 HD12 LEU 11 HD12 LEU 11 1.809 2.744 3.048 73 HD13 LEU 11 HD13 LEU 11 0.266 3.089 3.847 74 HD21 LEU 11 HD21 LEU 11 3.933 5.045 4.913 75 HD22 LEU 11 HD22 LEU 11 3.780 3.960 3.543 76 HD23 LEU 11 HD23 LEU 11 3.731 3.318 5.173 77 H ILE 12 H ILE 12 -0.386 7.948 3.976 78 HA ILE 12 HA ILE 12 0.279 9.397 1.628 79 HB ILE 12 HB ILE 12 -1.887 9.885 3.689 80 HG12 ILE 12 HG13 ILE 12 -2.003 7.741 2.307 81 HG13 ILE 12 HG12 ILE 12 -3.370 8.831 2.095 82 HG21 ILE 12 HG21 ILE 12 -2.933 11.210 1.745 83 HG22 ILE 12 HG22 ILE 12 -1.294 11.303 1.096 84 HG23 ILE 12 HG23 ILE 12 -1.656 11.986 2.673 85 HD11 ILE 12 HD11 ILE 12 -2.553 7.957 -0.048 86 HD12 ILE 12 HD12 ILE 12 -0.980 8.695 0.200 87 HD13 ILE 12 HD13 ILE 12 -2.417 9.695 0.015 88 H ASN 13 H ASN 13 0.222 10.326 5.025 89 HA ASN 13 HA ASN 13 0.809 13.044 4.639 90 HB2 ASN 13 HB3 ASN 13 1.330 11.158 6.928 91 HB3 ASN 13 HB2 ASN 13 1.936 12.806 6.963 92 HD21 ASN 13 HD21 ASN 13 -1.126 10.989 6.487 93 HD22 ASN 13 HD22 ASN 13 -2.120 12.218 7.098 94 H VAL 14 H VAL 14 2.989 10.278 5.058 95 HA VAL 14 HA VAL 14 5.379 11.801 4.808 96 HB VAL 14 HB VAL 14 4.813 8.873 4.292 97 HG11 VAL 14 HG11 VAL 14 7.305 8.631 4.501 98 HG12 VAL 14 HG12 VAL 14 7.438 10.379 4.422 99 HG13 VAL 14 HG13 VAL 14 6.799 9.481 3.040 100 HG21 VAL 14 HG21 VAL 14 6.173 8.757 6.498 101 HG22 VAL 14 HG22 VAL 14 4.511 9.308 6.613 102 HG23 VAL 14 HG23 VAL 14 5.833 10.474 6.655 103 H PHE 15 H PHE 15 3.491 9.899 2.474 104 HA PHE 15 HA PHE 15 5.066 10.408 0.187 105 HB2 PHE 15 HB3 PHE 15 3.286 8.697 0.293 106 HB3 PHE 15 HB2 PHE 15 2.071 9.965 0.373 107 HD1 PHE 15 HD1 PHE 15 4.625 8.343 -1.765 108 HD2 PHE 15 HD2 PHE 15 1.456 11.259 -1.608 109 HE1 PHE 15 HE1 PHE 15 4.601 8.471 -4.237 110 HE2 PHE 15 HE2 PHE 15 1.452 11.377 -4.075 111 HZ PHE 15 HZ PHE 15 3.022 9.984 -5.389 112 H HIS 16 H HIS 16 2.240 12.039 1.484 113 HA HIS 16 HA HIS 16 1.982 14.051 -0.456 114 HB2 HIS 16 HB3 HIS 16 0.261 13.328 1.208 115 HB3 HIS 16 HB2 HIS 16 1.206 14.127 2.461 116 HD1 HIS 16 HD1 HIS 16 1.235 16.005 -0.737 117 HD2 HIS 16 HD2 HIS 16 -1.195 15.751 2.647 118 HE1 HIS 16 HE1 HIS 16 -0.291 17.992 -0.822 119 HE2 HIS 16 HE2 HIS 16 -1.803 17.868 1.229 120 H ALA 17 H ALA 17 3.617 13.990 2.721 121 HA ALA 17 HA ALA 17 4.476 16.644 2.762 122 HB1 ALA 17 HB1 ALA 17 6.118 15.957 4.406 123 HB2 ALA 17 HB2 ALA 17 5.992 14.279 3.900 124 HB3 ALA 17 HB3 ALA 17 4.638 15.053 4.714 125 H HIS 18 H HIS 18 6.157 13.754 1.557 126 HA HIS 18 HA HIS 18 8.348 15.295 0.558 127 HB2 HIS 18 HB3 HIS 18 7.537 12.427 0.034 128 HB3 HIS 18 HB2 HIS 18 8.936 13.206 -0.710 129 HD1 HIS 18 HD1 HIS 18 11.038 13.734 0.780 130 HD2 HIS 18 HD2 HIS 18 7.800 12.131 2.931 131 HE1 HIS 18 HE1 HIS 18 11.853 13.260 3.107 132 HE2 HIS 18 HE2 HIS 18 9.912 12.281 4.421 133 H SER 19 H SER 19 5.323 14.206 -0.852 134 HA SER 19 HA SER 19 5.807 14.957 -3.534 135 HB2 SER 19 HB3 SER 19 3.262 15.348 -1.928 136 HB3 SER 19 HB2 SER 19 3.387 15.384 -3.660 137 HG SER 19 HG SER 19 4.126 13.134 -2.026 138 H GLY 20 H GLY 20 4.842 16.768 -0.681 139 HA2 GLY 20 HA3 GLY 20 4.487 19.309 -1.816 140 HA3 GLY 20 HA2 GLY 20 4.946 18.953 -0.152 141 H LYS 21 H LYS 21 7.353 17.599 -0.659 142 HA LYS 21 HA LYS 21 9.105 19.791 -0.599 143 HB2 LYS 21 HB3 LYS 21 9.721 16.854 -0.956 144 HB3 LYS 21 HB2 LYS 21 10.925 18.098 -0.663 145 HG2 LYS 21 HG3 LYS 21 9.781 18.744 1.438 146 HG3 LYS 21 HG2 LYS 21 8.591 17.472 1.153 147 HD2 LYS 21 HD3 LYS 21 10.445 15.787 1.189 148 HD3 LYS 21 HD2 LYS 21 11.555 17.084 1.605 149 HE2 LYS 21 HE2 LYS 21 9.160 16.191 3.236 150 HE3 LYS 21 HE1 LYS 21 10.873 15.988 3.642 151 HZ1 LYS 21 HZ1 LYS 21 10.460 17.882 4.778 152 HZ2 LYS 21 HZ2 LYS 21 9.186 18.349 3.827 153 HZ3 LYS 21 HZ3 LYS 21 10.785 18.635 3.311 154 H GLU 22 H GLU 22 8.432 17.496 -3.237 155 HA GLU 22 HA GLU 22 10.401 18.918 -4.873 156 HB2 GLU 22 HB3 GLU 22 9.523 16.944 -6.524 157 HB3 GLU 22 HB2 GLU 22 10.806 16.766 -5.348 158 HG2 GLU 22 HG3 GLU 22 9.361 15.781 -3.731 159 HG3 GLU 22 HG2 GLU 22 7.914 16.194 -4.645 160 H GLY 23 H GLY 23 7.160 17.634 -5.692 161 HA2 GLY 23 HA3 GLY 23 6.169 20.167 -6.516 162 HA3 GLY 23 HA2 GLY 23 6.750 19.256 -7.902 163 H ASP 24 H ASP 24 4.204 19.806 -8.039 164 HA ASP 24 HA ASP 24 2.115 18.958 -8.326 165 HB2 ASP 24 HB3 ASP 24 3.399 16.895 -9.117 166 HB3 ASP 24 HB2 ASP 24 3.158 16.261 -7.493 167 H LYS 25 H LYS 25 0.295 18.547 -7.115 168 HA LYS 25 HA LYS 25 0.508 19.189 -4.377 169 HB2 LYS 25 HB3 LYS 25 -1.932 18.397 -4.306 170 HB3 LYS 25 HB2 LYS 25 -1.548 19.794 -5.329 171 HG2 LYS 25 HG3 LYS 25 -1.444 18.251 -7.291 172 HG3 LYS 25 HG2 LYS 25 -1.885 16.908 -6.234 173 HD2 LYS 25 HD3 LYS 25 -3.972 18.126 -5.615 174 HD3 LYS 25 HD2 LYS 25 -3.568 19.369 -6.781 175 HE2 LYS 25 HE2 LYS 25 -3.833 16.443 -7.470 176 HE3 LYS 25 HE1 LYS 25 -5.132 17.613 -7.606 177 HZ1 LYS 25 HZ1 LYS 25 -2.713 18.550 -8.860 178 HZ2 LYS 25 HZ2 LYS 25 -4.288 18.395 -9.493 179 HZ3 LYS 25 HZ3 LYS 25 -3.247 17.078 -9.499 180 H TYR 26 H TYR 26 0.131 16.114 -6.039 181 HA TYR 26 HA TYR 26 1.456 14.897 -3.836 182 HB2 TYR 26 HB3 TYR 26 -0.481 12.984 -3.917 183 HB3 TYR 26 HB2 TYR 26 -0.364 14.242 -2.697 184 HD1 TYR 26 HD1 TYR 26 -1.744 16.278 -2.837 185 HD2 TYR 26 HD2 TYR 26 -2.205 13.064 -5.645 186 HE1 TYR 26 HE1 TYR 26 -3.896 17.224 -3.558 187 HE2 TYR 26 HE2 TYR 26 -4.365 14.001 -6.371 188 HH TYR 26 HH TYR 26 -5.975 15.587 -5.951 189 H LYS 27 H LYS 27 2.996 14.461 -5.194 190 HA LYS 27 HA LYS 27 2.816 11.925 -6.399 191 HB2 LYS 27 HB3 LYS 27 3.634 14.307 -8.100 192 HB3 LYS 27 HB2 LYS 27 4.091 12.650 -8.469 193 HG2 LYS 27 HG3 LYS 27 1.208 13.506 -8.115 194 HG3 LYS 27 HG2 LYS 27 1.972 13.540 -9.669 195 HD2 LYS 27 HD3 LYS 27 1.764 11.019 -7.943 196 HD3 LYS 27 HD2 LYS 27 0.708 11.423 -9.269 197 HE2 LYS 27 HE2 LYS 27 3.651 10.728 -9.424 198 HE3 LYS 27 HE1 LYS 27 2.298 9.984 -10.256 199 HZ1 LYS 27 HZ1 LYS 27 3.056 12.824 -10.777 200 HZ2 LYS 27 HZ2 LYS 27 2.085 11.793 -11.699 201 HZ3 LYS 27 HZ3 LYS 27 3.744 11.538 -11.609 202 H LEU 28 H LEU 28 4.958 11.018 -6.492 203 HA LEU 28 HA LEU 28 6.935 12.634 -5.014 204 HB2 LEU 28 HB3 LEU 28 5.831 11.049 -3.558 205 HB3 LEU 28 HB2 LEU 28 6.175 9.734 -4.670 206 HG LEU 28 HG LEU 28 8.653 10.241 -4.334 207 HD11 LEU 28 HD11 LEU 28 7.443 12.085 -2.263 208 HD12 LEU 28 HD12 LEU 28 8.596 12.496 -3.529 209 HD13 LEU 28 HD13 LEU 28 9.092 11.478 -2.171 210 HD21 LEU 28 HD21 LEU 28 8.757 9.067 -2.257 211 HD22 LEU 28 HD22 LEU 28 7.327 8.459 -3.114 212 HD23 LEU 28 HD23 LEU 28 7.147 9.616 -1.792 213 H SER 29 H SER 29 8.936 12.657 -5.863 214 HA SER 29 HA SER 29 9.360 11.240 -8.344 215 HB2 SER 29 HB3 SER 29 11.118 13.206 -6.860 216 HB3 SER 29 HB2 SER 29 11.447 12.531 -8.462 217 HG SER 29 HG SER 29 9.261 14.072 -7.554 218 H LYS 30 H LYS 30 11.421 10.082 -8.668 219 HA LYS 30 HA LYS 30 11.587 8.051 -6.689 220 HB2 LYS 30 HB3 LYS 30 13.586 8.373 -8.923 221 HB3 LYS 30 HB2 LYS 30 13.031 6.901 -8.158 222 HG2 LYS 30 HG3 LYS 30 11.525 8.681 -10.086 223 HG3 LYS 30 HG2 LYS 30 11.972 7.003 -10.288 224 HD2 LYS 30 HD3 LYS 30 10.053 7.835 -8.057 225 HD3 LYS 30 HD2 LYS 30 9.507 7.525 -9.688 226 HE2 LYS 30 HE2 LYS 30 11.222 5.343 -8.858 227 HE3 LYS 30 HE1 LYS 30 10.010 5.609 -7.650 228 HZ1 LYS 30 HZ1 LYS 30 9.000 5.566 -10.461 229 HZ2 LYS 30 HZ2 LYS 30 8.274 5.014 -9.068 230 HZ3 LYS 30 HZ3 LYS 30 9.492 4.124 -9.772 231 H LYS 31 H LYS 31 12.937 11.049 -6.822 232 HA LYS 31 HA LYS 31 15.556 10.488 -5.694 233 HB2 LYS 31 HB3 LYS 31 15.054 13.122 -4.993 234 HB3 LYS 31 HB2 LYS 31 15.857 12.607 -6.462 235 HG2 LYS 31 HG3 LYS 31 13.670 12.640 -7.672 236 HG3 LYS 31 HG2 LYS 31 12.901 13.104 -6.117 237 HD2 LYS 31 HD3 LYS 31 14.096 15.156 -6.123 238 HD3 LYS 31 HD2 LYS 31 15.018 14.701 -7.576 239 HE2 LYS 31 HE2 LYS 31 12.834 14.561 -8.812 240 HE3 LYS 31 HE1 LYS 31 12.013 15.140 -7.370 241 HZ1 LYS 31 HZ1 LYS 31 14.154 16.640 -8.791 242 HZ2 LYS 31 HZ2 LYS 31 13.238 17.230 -7.497 243 HZ3 LYS 31 HZ3 LYS 31 12.518 16.915 -8.986 244 H GLU 32 H GLU 32 12.763 12.211 -4.291 245 HA GLU 32 HA GLU 32 13.564 11.892 -1.606 246 HB2 GLU 32 HB3 GLU 32 10.905 12.489 -2.916 247 HB3 GLU 32 HB2 GLU 32 11.094 12.432 -1.158 248 HG2 GLU 32 HG3 GLU 32 12.697 14.188 -3.029 249 HG3 GLU 32 HG2 GLU 32 11.296 14.721 -2.110 250 H LEU 33 H LEU 33 11.779 9.898 -3.828 251 HA LEU 33 HA LEU 33 10.522 8.195 -2.022 252 HB2 LEU 33 HB3 LEU 33 10.062 8.209 -4.453 253 HB3 LEU 33 HB2 LEU 33 11.649 7.523 -4.762 254 HG LEU 33 HG LEU 33 9.718 5.885 -4.776 255 HD11 LEU 33 HD11 LEU 33 11.086 4.173 -4.111 256 HD12 LEU 33 HD12 LEU 33 11.624 4.992 -2.659 257 HD13 LEU 33 HD13 LEU 33 12.287 5.451 -4.221 258 HD21 LEU 33 HD21 LEU 33 8.553 5.349 -2.855 259 HD22 LEU 33 HD22 LEU 33 8.825 7.042 -2.523 260 HD23 LEU 33 HD23 LEU 33 9.858 5.820 -1.775 261 H LYS 34 H LYS 34 13.750 7.864 -3.538 262 HA LYS 34 HA LYS 34 14.397 5.462 -2.139 263 HB2 LYS 34 HB3 LYS 34 16.191 7.567 -3.337 264 HB3 LYS 34 HB2 LYS 34 16.765 6.053 -2.665 265 HG2 LYS 34 HG3 LYS 34 15.362 4.807 -4.284 266 HG3 LYS 34 HG2 LYS 34 14.863 6.320 -5.037 267 HD2 LYS 34 HD3 LYS 34 17.726 6.398 -4.833 268 HD3 LYS 34 HD2 LYS 34 17.289 4.819 -5.451 269 HE2 LYS 34 HE2 LYS 34 17.617 6.394 -7.254 270 HE3 LYS 34 HE1 LYS 34 15.921 5.881 -7.215 271 HZ1 LYS 34 HZ1 LYS 34 17.023 8.403 -6.073 272 HZ2 LYS 34 HZ2 LYS 34 15.381 7.979 -6.085 273 HZ3 LYS 34 HZ3 LYS 34 16.223 8.257 -7.525 274 H GLU 35 H GLU 35 15.076 8.880 -1.550 275 HA GLU 35 HA GLU 35 16.719 8.449 0.688 276 HB2 GLU 35 HB3 GLU 35 15.125 10.893 -0.116 277 HB3 GLU 35 HB2 GLU 35 16.402 10.862 1.099 278 HG2 GLU 35 HG3 GLU 35 16.762 10.111 -1.825 279 HG3 GLU 35 HG2 GLU 35 17.222 11.640 -1.108 280 H LEU 36 H LEU 36 13.278 9.347 0.456 281 HA LEU 36 HA LEU 36 12.968 9.331 3.271 282 HB2 LEU 36 HB3 LEU 36 10.830 10.045 2.943 283 HB3 LEU 36 HB2 LEU 36 11.511 10.488 1.391 284 HG LEU 36 HG LEU 36 10.728 8.077 0.639 285 HD11 LEU 36 HD11 LEU 36 9.830 8.086 3.342 286 HD12 LEU 36 HD12 LEU 36 9.519 6.885 2.099 287 HD13 LEU 36 HD13 LEU 36 8.399 8.218 2.323 288 HD21 LEU 36 HD21 LEU 36 9.780 10.130 -0.267 289 HD22 LEU 36 HD22 LEU 36 8.814 10.356 1.195 290 HD23 LEU 36 HD23 LEU 36 8.480 8.998 0.119 291 H LEU 37 H LEU 37 12.372 6.892 0.790 292 HA LEU 37 HA LEU 37 10.943 5.155 2.453 293 HB2 LEU 37 HB3 LEU 37 10.944 4.842 0.034 294 HB3 LEU 37 HB2 LEU 37 12.665 4.512 0.030 295 HG LEU 37 HG LEU 37 11.080 2.483 -0.108 296 HD11 LEU 37 HD11 LEU 37 12.836 1.977 2.209 297 HD12 LEU 37 HD12 LEU 37 13.609 2.674 0.783 298 HD13 LEU 37 HD13 LEU 37 12.711 1.176 0.650 299 HD21 LEU 37 HD21 LEU 37 9.938 1.746 1.758 300 HD22 LEU 37 HD22 LEU 37 9.695 3.484 1.907 301 HD23 LEU 37 HD23 LEU 37 10.924 2.667 2.882 302 H GLN 38 H GLN 38 14.423 5.238 1.747 303 HA GLN 38 HA GLN 38 15.004 3.085 3.505 304 HB2 GLN 38 HB3 GLN 38 17.351 3.773 3.334 305 HB3 GLN 38 HB2 GLN 38 16.614 3.786 1.738 306 HG2 GLN 38 HG3 GLN 38 16.183 6.304 2.140 307 HG3 GLN 38 HG2 GLN 38 17.261 6.147 3.518 308 HE21 GLN 38 HE21 GLN 38 17.209 5.236 0.044 309 HE22 GLN 38 HE22 GLN 38 18.833 5.606 -0.238 310 H THR 39 H THR 39 14.974 6.572 3.851 311 HA THR 39 HA THR 39 15.900 6.709 6.506 312 HB THR 39 HB THR 39 14.063 8.561 4.972 313 HG1 THR 39 HG2 THR 39 15.906 8.579 3.892 314 HG21 THR 39 HG21 THR 39 13.942 8.962 7.350 315 HG22 THR 39 HG22 THR 39 14.829 10.260 6.572 316 HG23 THR 39 HG23 THR 39 15.701 9.013 7.482 317 H GLU 40 H GLU 40 12.527 6.670 5.249 318 HA GLU 40 HA GLU 40 11.464 6.756 7.861 319 HB2 GLU 40 HB3 GLU 40 10.117 6.009 5.255 320 HB3 GLU 40 HB2 GLU 40 9.305 6.306 6.796 321 HG2 GLU 40 HG3 GLU 40 11.045 8.349 5.346 322 HG3 GLU 40 HG2 GLU 40 9.289 8.326 5.384 323 H LEU 41 H LEU 41 12.118 4.074 5.660 324 HA LEU 41 HA LEU 41 11.160 2.179 7.733 325 HB2 LEU 41 HB3 LEU 41 11.370 2.004 4.753 326 HB3 LEU 41 HB2 LEU 41 11.406 0.552 5.705 327 HG LEU 41 HG LEU 41 9.294 1.388 6.908 328 HD11 LEU 41 HD11 LEU 41 7.910 2.913 5.368 329 HD12 LEU 41 HD12 LEU 41 9.444 3.360 4.627 330 HD13 LEU 41 HD13 LEU 41 9.167 3.661 6.339 331 HD21 LEU 41 HD21 LEU 41 7.885 0.345 5.309 332 HD22 LEU 41 HD22 LEU 41 9.457 -0.385 5.022 333 HD23 LEU 41 HD23 LEU 41 8.870 0.893 3.955 334 H SER 42 H SER 42 13.753 3.458 7.909 335 HA SER 42 HA SER 42 15.829 1.937 6.895 336 HB2 SER 42 HB3 SER 42 15.708 3.320 9.582 337 HB3 SER 42 HB2 SER 42 17.175 2.714 8.836 338 HG SER 42 HG SER 42 15.721 4.213 7.092 339 H GLY 43 H GLY 43 13.860 1.293 9.767 340 HA2 GLY 43 HA3 GLY 43 15.347 -0.935 10.718 341 HA3 GLY 43 HA2 GLY 43 13.670 -0.564 11.088 342 H PHE 44 H PHE 44 12.472 -0.684 8.653 343 HA PHE 44 HA PHE 44 12.202 -3.515 8.261 344 HB2 PHE 44 HB3 PHE 44 10.833 -1.119 7.253 345 HB3 PHE 44 HB2 PHE 44 11.026 -2.330 6.003 346 HD1 PHE 44 HD2 PHE 44 10.795 -4.879 7.392 347 HD2 PHE 44 HD1 PHE 44 8.593 -1.248 8.065 348 HE1 PHE 44 HE2 PHE 44 8.897 -6.180 8.350 349 HE2 PHE 44 HE1 PHE 44 6.731 -2.543 9.012 350 HZ PHE 44 HZ PHE 44 6.883 -5.023 9.155 351 H LEU 45 H LEU 45 13.655 -0.881 6.517 352 HA LEU 45 HA LEU 45 14.592 -2.323 4.302 353 HB2 LEU 45 HB3 LEU 45 14.440 0.066 4.214 354 HB3 LEU 45 HB2 LEU 45 15.510 0.261 5.587 355 HG LEU 45 HG LEU 45 17.299 -0.725 4.408 356 HD11 LEU 45 HD11 LEU 45 16.604 -0.727 1.676 357 HD12 LEU 45 HD12 LEU 45 15.170 -1.400 2.437 358 HD13 LEU 45 HD13 LEU 45 16.756 -2.153 2.688 359 HD21 LEU 45 HD21 LEU 45 16.717 1.752 4.191 360 HD22 LEU 45 HD22 LEU 45 16.152 1.374 2.550 361 HD23 LEU 45 HD23 LEU 45 17.830 1.117 2.986 362 H ASP 46 H ASP 46 16.081 -1.517 7.416 363 HA ASP 46 HA ASP 46 18.652 -2.517 6.973 364 HB2 ASP 46 HB3 ASP 46 18.184 -1.141 8.887 365 HB3 ASP 46 HB2 ASP 46 17.041 -2.325 9.503 366 H ALA 47 H ALA 47 15.800 -4.110 8.236 367 HA ALA 47 HA ALA 47 16.995 -6.482 9.076 368 HB1 ALA 47 HB1 ALA 47 14.809 -6.042 9.838 369 HB2 ALA 47 HB2 ALA 47 14.682 -7.480 8.833 370 HB3 ALA 47 HB3 ALA 47 14.191 -5.907 8.194 371 H GLN 48 H GLN 48 16.194 -5.505 5.861 372 HA GLN 48 HA GLN 48 16.940 -8.205 4.899 373 HB2 GLN 48 HB3 GLN 48 15.284 -7.757 2.998 374 HB3 GLN 48 HB2 GLN 48 14.598 -8.159 4.570 375 HG2 GLN 48 HG3 GLN 48 13.328 -6.312 3.926 376 HG3 GLN 48 HG2 GLN 48 14.555 -5.531 4.903 377 HE21 GLN 48 HE21 GLN 48 15.948 -4.017 3.841 378 HE22 GLN 48 HE22 GLN 48 15.870 -3.752 2.171 379 H LYS 49 H LYS 49 18.743 -6.052 5.173 380 HA LYS 49 HA LYS 49 19.206 -4.641 2.753 381 HB2 LYS 49 HB3 LYS 49 21.157 -5.633 4.844 382 HB3 LYS 49 HB2 LYS 49 21.579 -4.521 3.550 383 HG2 LYS 49 HG3 LYS 49 19.876 -2.915 4.373 384 HG3 LYS 49 HG2 LYS 49 19.497 -3.988 5.710 385 HD2 LYS 49 HD3 LYS 49 22.217 -2.721 5.175 386 HD3 LYS 49 HD2 LYS 49 21.094 -2.214 6.421 387 HE2 LYS 49 HE2 LYS 49 22.460 -4.932 6.264 388 HE3 LYS 49 HE1 LYS 49 22.835 -3.632 7.372 389 HZ1 LYS 49 HZ1 LYS 49 21.384 -5.325 8.381 390 HZ2 LYS 49 HZ2 LYS 49 20.119 -4.942 7.326 391 HZ3 LYS 49 HZ3 LYS 49 20.718 -3.798 8.402 392 H ASP 50 H ASP 50 20.065 -7.805 3.938 393 HA ASP 50 HA ASP 50 21.796 -8.511 1.755 394 HB2 ASP 50 HB3 ASP 50 21.890 -10.684 2.928 395 HB3 ASP 50 HB2 ASP 50 22.318 -9.340 3.963 396 H VAL 51 H VAL 51 18.604 -8.116 1.677 397 HA VAL 51 HA VAL 51 17.999 -10.723 0.458 398 HB VAL 51 HB VAL 51 16.148 -8.598 1.520 399 HG11 VAL 51 HG11 VAL 51 14.594 -10.729 1.490 400 HG12 VAL 51 HG12 VAL 51 15.714 -11.297 0.263 401 HG13 VAL 51 HG13 VAL 51 14.827 -9.787 0.026 402 HG21 VAL 51 HG21 VAL 51 15.822 -10.110 3.445 403 HG22 VAL 51 HG22 VAL 51 17.530 -9.710 3.295 404 HG23 VAL 51 HG23 VAL 51 16.942 -11.270 2.741 405 H ASP 52 H ASP 52 17.505 -10.845 -1.642 406 HA ASP 52 HA ASP 52 18.083 -8.773 -3.447 407 HB2 ASP 52 HB3 ASP 52 18.153 -11.074 -4.147 408 HB3 ASP 52 HB2 ASP 52 16.431 -11.272 -3.836 409 H ALA 53 H ALA 53 15.102 -9.798 -2.020 410 HA ALA 53 HA ALA 53 13.245 -8.492 -3.560 411 HB1 ALA 53 HB1 ALA 53 12.849 -9.903 -1.426 412 HB2 ALA 53 HB2 ALA 53 11.757 -8.566 -1.759 413 HB3 ALA 53 HB3 ALA 53 13.028 -8.372 -0.559 414 H VAL 54 H VAL 54 15.618 -7.120 -1.384 415 HA VAL 54 HA VAL 54 14.476 -4.598 -1.015 416 HB VAL 54 HB VAL 54 16.610 -5.641 0.078 417 HG11 VAL 54 HG11 VAL 54 18.719 -4.902 -0.850 418 HG12 VAL 54 HG12 VAL 54 17.933 -4.137 -2.205 419 HG13 VAL 54 HG13 VAL 54 17.915 -5.897 -2.052 420 HG21 VAL 54 HG21 VAL 54 16.832 -2.719 -0.675 421 HG22 VAL 54 HG22 VAL 54 17.288 -3.490 0.831 422 HG23 VAL 54 HG23 VAL 54 15.580 -3.300 0.424 423 H ASP 55 H ASP 55 16.536 -5.873 -3.586 424 HA ASP 55 HA ASP 55 16.695 -3.474 -5.156 425 HB2 ASP 55 HB3 ASP 55 18.214 -5.395 -5.612 426 HB3 ASP 55 HB2 ASP 55 16.778 -6.359 -6.007 427 H LYS 56 H LYS 56 14.652 -6.313 -5.118 428 HA LYS 56 HA LYS 56 13.133 -5.667 -7.382 429 HB2 LYS 56 HB3 LYS 56 12.234 -7.305 -4.995 430 HB3 LYS 56 HB2 LYS 56 11.525 -7.323 -6.598 431 HG2 LYS 56 HG3 LYS 56 14.359 -8.181 -5.899 432 HG3 LYS 56 HG2 LYS 56 13.006 -9.204 -6.379 433 HD2 LYS 56 HD3 LYS 56 12.939 -7.659 -8.519 434 HD3 LYS 56 HD2 LYS 56 14.555 -7.240 -8.046 435 HE2 LYS 56 HE2 LYS 56 13.898 -9.463 -9.587 436 HE3 LYS 56 HE1 LYS 56 15.443 -9.173 -8.808 437 HZ1 LYS 56 HZ1 LYS 56 14.408 -11.351 -8.261 438 HZ2 LYS 56 HZ2 LYS 56 13.158 -10.574 -7.459 439 HZ3 LYS 56 HZ3 LYS 56 14.791 -10.410 -6.925 440 H VAL 57 H VAL 57 12.689 -4.907 -4.006 441 HA VAL 57 HA VAL 57 10.169 -3.647 -4.172 442 HB VAL 57 HB VAL 57 12.562 -3.078 -2.429 443 HG11 VAL 57 HG11 VAL 57 10.098 -1.648 -2.654 444 HG12 VAL 57 HG12 VAL 57 11.424 -1.393 -1.520 445 HG13 VAL 57 HG13 VAL 57 10.111 -2.473 -1.100 446 HG21 VAL 57 HG21 VAL 57 12.053 -4.956 -1.307 447 HG22 VAL 57 HG22 VAL 57 10.813 -5.339 -2.477 448 HG23 VAL 57 HG23 VAL 57 10.419 -4.400 -1.029 449 H MET 58 H MET 58 13.488 -2.478 -4.480 450 HA MET 58 HA MET 58 12.939 0.246 -5.094 451 HB2 MET 58 HB3 MET 58 15.296 -1.500 -5.847 452 HB3 MET 58 HB2 MET 58 15.231 0.249 -5.941 453 HG2 MET 58 HG3 MET 58 14.410 -0.849 -3.357 454 HG3 MET 58 HG2 MET 58 16.105 -1.134 -3.721 455 HE1 MET 58 HE1 MET 58 17.648 0.218 -4.340 456 HE2 MET 58 HE2 MET 58 17.959 1.781 -3.585 457 HE3 MET 58 HE3 MET 58 17.274 1.721 -5.201 458 H LYS 59 H LYS 59 13.542 -2.636 -7.007 459 HA LYS 59 HA LYS 59 13.652 -1.399 -9.491 460 HB2 LYS 59 HB3 LYS 59 14.520 -3.697 -8.771 461 HB3 LYS 59 HB2 LYS 59 12.887 -4.273 -9.083 462 HG2 LYS 59 HG3 LYS 59 14.069 -4.625 -11.133 463 HG3 LYS 59 HG2 LYS 59 13.050 -3.197 -11.366 464 HD2 LYS 59 HD3 LYS 59 15.188 -2.672 -12.271 465 HD3 LYS 59 HD2 LYS 59 15.095 -1.756 -10.775 466 HE2 LYS 59 HE2 LYS 59 16.206 -4.398 -10.241 467 HE3 LYS 59 HE1 LYS 59 17.080 -3.640 -11.563 468 HZ1 LYS 59 HZ1 LYS 59 18.137 -2.474 -10.078 469 HZ2 LYS 59 HZ2 LYS 59 17.252 -3.096 -8.822 470 HZ3 LYS 59 HZ3 LYS 59 16.749 -1.661 -9.586 471 H GLU 60 H GLU 60 10.972 -3.015 -7.838 472 HA GLU 60 HA GLU 60 9.091 -2.882 -9.922 473 HB2 GLU 60 HB3 GLU 60 8.849 -2.728 -6.944 474 HB3 GLU 60 HB2 GLU 60 7.426 -2.793 -7.987 475 HG2 GLU 60 HG3 GLU 60 9.658 -4.866 -7.911 476 HG3 GLU 60 HG2 GLU 60 8.096 -5.018 -7.129 477 H LEU 61 H LEU 61 10.019 -0.602 -7.433 478 HA LEU 61 HA LEU 61 8.335 1.556 -8.280 479 HB2 LEU 61 HB3 LEU 61 10.761 1.297 -6.526 480 HB3 LEU 61 HB2 LEU 61 10.219 2.889 -7.012 481 HG LEU 61 HG LEU 61 9.317 1.883 -4.794 482 HD11 LEU 61 HD11 LEU 61 8.455 3.918 -5.478 483 HD12 LEU 61 HD12 LEU 61 7.042 2.892 -5.267 484 HD13 LEU 61 HD13 LEU 61 7.644 3.232 -6.892 485 HD21 LEU 61 HD21 LEU 61 8.606 -0.314 -5.830 486 HD22 LEU 61 HD22 LEU 61 7.354 0.558 -6.727 487 HD23 LEU 61 HD23 LEU 61 7.311 0.511 -4.985 488 H ASP 62 H ASP 62 11.595 0.475 -9.017 489 HA ASP 62 HA ASP 62 12.353 2.719 -10.515 490 HB2 ASP 62 HB3 ASP 62 13.904 0.915 -9.567 491 HB3 ASP 62 HB2 ASP 62 13.446 -0.025 -10.998 492 H GLU 63 H GLU 63 10.648 -0.205 -11.488 493 HA GLU 63 HA GLU 63 10.893 0.066 -14.285 494 HB2 GLU 63 HB3 GLU 63 8.430 -0.788 -12.722 495 HB3 GLU 63 HB2 GLU 63 8.639 -0.993 -14.447 496 HG2 GLU 63 HG3 GLU 63 10.707 -2.360 -14.002 497 HG3 GLU 63 HG2 GLU 63 10.329 -2.231 -12.283 498 H ASN 64 H ASN 64 8.876 1.665 -11.972 499 HA ASN 64 HA ASN 64 8.045 3.559 -14.069 500 HB2 ASN 64 HB3 ASN 64 6.360 2.389 -12.400 501 HB3 ASN 64 HB2 ASN 64 6.879 3.681 -11.322 502 HD21 ASN 64 HD21 ASN 64 4.244 3.616 -12.394 503 HD22 ASN 64 HD22 ASN 64 4.025 4.948 -13.425 504 H GLY 65 H GLY 65 10.676 3.422 -13.055 505 HA2 GLY 65 HA3 GLY 65 11.014 5.644 -11.233 506 HA3 GLY 65 HA2 GLY 65 12.287 4.701 -12.015 507 H ASP 66 H ASP 66 9.958 5.433 -14.194 508 HA ASP 66 HA ASP 66 11.536 6.871 -15.949 509 HB2 ASP 66 HB3 ASP 66 9.410 5.572 -16.388 510 HB3 ASP 66 HB2 ASP 66 8.525 6.968 -15.798 511 H GLY 67 H GLY 67 9.064 8.014 -13.682 512 HA2 GLY 67 HA3 GLY 67 10.249 10.717 -13.812 513 HA3 GLY 67 HA2 GLY 67 8.529 10.505 -14.053 514 H GLU 68 H GLU 68 7.315 9.412 -12.303 515 HA GLU 68 HA GLU 68 8.415 10.143 -9.661 516 HB2 GLU 68 HB3 GLU 68 5.512 10.229 -10.390 517 HB3 GLU 68 HB2 GLU 68 6.291 10.989 -9.016 518 HG2 GLU 68 HG3 GLU 68 6.099 12.823 -10.389 519 HG3 GLU 68 HG2 GLU 68 7.662 12.229 -10.942 520 H VAL 69 H VAL 69 6.812 9.242 -7.978 521 HA VAL 69 HA VAL 69 6.008 6.505 -8.575 522 HB VAL 69 HB VAL 69 7.980 6.127 -7.322 523 HG11 VAL 69 HG11 VAL 69 7.120 8.563 -5.803 524 HG12 VAL 69 HG12 VAL 69 8.694 8.234 -6.502 525 HG13 VAL 69 HG13 VAL 69 8.185 7.412 -5.022 526 HG21 VAL 69 HG21 VAL 69 6.255 4.828 -6.374 527 HG22 VAL 69 HG22 VAL 69 5.573 6.178 -5.462 528 HG23 VAL 69 HG23 VAL 69 7.110 5.484 -4.991 529 H ASP 70 H ASP 70 3.940 6.150 -7.934 530 HA ASP 70 HA ASP 70 2.599 8.418 -6.659 531 HB2 ASP 70 HB3 ASP 70 0.663 7.801 -7.649 532 HB3 ASP 70 HB2 ASP 70 1.754 7.043 -8.793 533 H PHE 71 H PHE 71 0.619 7.568 -5.356 534 HA PHE 71 HA PHE 71 1.723 6.669 -2.942 535 HB2 PHE 71 HB3 PHE 71 -0.298 8.103 -3.076 536 HB3 PHE 71 HB2 PHE 71 -1.206 6.704 -3.662 537 HD1 PHE 71 HD1 PHE 71 1.257 7.458 -0.915 538 HD2 PHE 71 HD2 PHE 71 -2.459 5.584 -2.023 539 HE1 PHE 71 HE1 PHE 71 0.920 6.750 1.415 540 HE2 PHE 71 HE2 PHE 71 -2.782 4.878 0.335 541 HZ PHE 71 HZ PHE 71 -1.105 5.455 2.047 542 H GLN 72 H GLN 72 -0.191 4.972 -5.433 543 HA GLN 72 HA GLN 72 -0.446 2.556 -4.054 544 HB2 GLN 72 HB3 GLN 72 -0.422 3.238 -6.952 545 HB3 GLN 72 HB2 GLN 72 -0.515 1.533 -6.461 546 HG2 GLN 72 HG3 GLN 72 -2.524 2.144 -5.102 547 HG3 GLN 72 HG2 GLN 72 -2.390 3.794 -5.722 548 HE21 GLN 72 HE21 GLN 72 -3.735 0.724 -6.384 549 HE22 GLN 72 HE22 GLN 72 -4.170 1.013 -7.988 550 H GLU 73 H GLU 73 2.107 3.765 -6.241 551 HA GLU 73 HA GLU 73 3.741 1.445 -6.054 552 HB2 GLU 73 HB3 GLU 73 4.408 4.304 -6.747 553 HB3 GLU 73 HB2 GLU 73 5.607 2.995 -6.745 554 HG2 GLU 73 HG3 GLU 73 4.306 1.795 -8.411 555 HG3 GLU 73 HG2 GLU 73 3.070 3.050 -8.401 556 H TYR 74 H TYR 74 3.530 4.458 -4.239 557 HA TYR 74 HA TYR 74 5.785 4.064 -2.633 558 HB2 TYR 74 HB3 TYR 74 4.714 6.240 -2.707 559 HB3 TYR 74 HB2 TYR 74 3.246 5.573 -2.001 560 HD1 TYR 74 HD1 TYR 74 6.933 5.442 -1.217 561 HD2 TYR 74 HD2 TYR 74 2.940 6.056 0.269 562 HE1 TYR 74 HE1 TYR 74 7.825 5.796 1.057 563 HE2 TYR 74 HE2 TYR 74 3.852 6.417 2.538 564 HH TYR 74 HH TYR 74 7.058 7.012 3.190 565 H VAL 75 H VAL 75 2.391 3.150 -2.010 566 HA VAL 75 HA VAL 75 2.967 2.051 0.508 567 HB VAL 75 HB VAL 75 0.806 0.952 0.422 568 HG11 VAL 75 HG11 VAL 75 1.293 3.662 0.375 569 HG12 VAL 75 HG12 VAL 75 -0.246 2.935 0.743 570 HG13 VAL 75 HG13 VAL 75 0.087 3.497 -0.894 571 HG21 VAL 75 HG21 VAL 75 -0.566 0.983 -1.602 572 HG22 VAL 75 HG22 VAL 75 0.948 0.246 -2.023 573 HG23 VAL 75 HG23 VAL 75 0.644 1.947 -2.429 574 H VAL 76 H VAL 76 2.879 0.550 -2.719 575 HA VAL 76 HA VAL 76 3.354 -2.045 -1.706 576 HB VAL 76 HB VAL 76 2.435 -1.651 -3.988 577 HG11 VAL 76 HG11 VAL 76 3.942 -1.053 -5.821 578 HG12 VAL 76 HG12 VAL 76 5.266 -0.826 -4.686 579 HG13 VAL 76 HG13 VAL 76 3.828 0.208 -4.604 580 HG21 VAL 76 HG21 VAL 76 3.489 -3.531 -4.990 581 HG22 VAL 76 HG22 VAL 76 3.669 -3.797 -3.261 582 HG23 VAL 76 HG23 VAL 76 5.032 -3.194 -4.211 583 H LEU 77 H LEU 77 5.428 0.619 -2.591 584 HA LEU 77 HA LEU 77 7.918 -0.698 -2.595 585 HB2 LEU 77 HB3 LEU 77 7.610 1.641 -3.331 586 HB3 LEU 77 HB2 LEU 77 7.190 2.094 -1.697 587 HG LEU 77 HG LEU 77 9.456 1.327 -0.926 588 HD11 LEU 77 HD11 LEU 77 9.626 0.174 -3.505 589 HD12 LEU 77 HD12 LEU 77 10.900 0.304 -2.282 590 HD13 LEU 77 HD13 LEU 77 10.762 1.524 -3.502 591 HD21 LEU 77 HD21 LEU 77 9.019 3.676 -1.340 592 HD22 LEU 77 HD22 LEU 77 9.346 3.451 -3.067 593 HD23 LEU 77 HD23 LEU 77 10.652 3.286 -1.893 594 H VAL 78 H VAL 78 6.149 0.934 0.042 595 HA VAL 78 HA VAL 78 8.043 0.029 1.985 596 HB VAL 78 HB VAL 78 6.496 0.948 3.681 597 HG11 VAL 78 HG11 VAL 78 6.305 3.308 2.268 598 HG12 VAL 78 HG12 VAL 78 7.533 2.459 1.352 599 HG13 VAL 78 HG13 VAL 78 7.758 2.745 3.076 600 HG21 VAL 78 HG21 VAL 78 4.767 1.810 1.379 601 HG22 VAL 78 HG22 VAL 78 4.421 1.946 3.093 602 HG23 VAL 78 HG23 VAL 78 4.343 0.372 2.322 603 H ALA 79 H ALA 79 4.875 -1.075 0.911 604 HA ALA 79 HA ALA 79 4.600 -3.124 2.841 605 HB1 ALA 79 HB1 ALA 79 3.519 -3.245 0.037 606 HB2 ALA 79 HB2 ALA 79 2.785 -2.264 1.314 607 HB3 ALA 79 HB3 ALA 79 2.858 -4.009 1.480 608 H ALA 80 H ALA 80 6.160 -3.014 -0.317 609 HA ALA 80 HA ALA 80 6.596 -5.718 -0.601 610 HB1 ALA 80 HB1 ALA 80 8.447 -5.115 -2.131 611 HB2 ALA 80 HB2 ALA 80 8.369 -3.451 -1.529 612 HB3 ALA 80 HB3 ALA 80 7.033 -4.110 -2.418 613 H LEU 81 H LEU 81 8.620 -3.242 0.967 614 HA LEU 81 HA LEU 81 10.655 -5.015 1.928 615 HB2 LEU 81 HB3 LEU 81 9.676 -2.344 2.963 616 HB3 LEU 81 HB2 LEU 81 11.026 -3.215 3.671 617 HG LEU 81 HG LEU 81 10.893 -2.406 0.749 618 HD11 LEU 81 HD11 LEU 81 12.792 -0.817 1.645 619 HD12 LEU 81 HD12 LEU 81 11.942 -0.990 3.176 620 HD13 LEU 81 HD13 LEU 81 11.102 -0.339 1.766 621 HD21 LEU 81 HD21 LEU 81 12.560 -3.968 0.675 622 HD22 LEU 81 HD22 LEU 81 12.749 -3.983 2.423 623 HD23 LEU 81 HD23 LEU 81 13.537 -2.738 1.469 624 H THR 82 H THR 82 7.622 -3.805 3.216 625 HA THR 82 HA THR 82 7.824 -4.907 5.779 626 HB THR 82 HB THR 82 5.229 -4.506 4.292 627 HG1 THR 82 HG2 THR 82 6.670 -2.608 4.127 628 HG21 THR 82 HG21 THR 82 5.688 -3.764 7.129 629 HG22 THR 82 HG22 THR 82 5.568 -5.481 6.762 630 HG23 THR 82 HG23 THR 82 4.239 -4.387 6.357 631 H VAL 83 H VAL 83 6.170 -6.225 2.867 632 HA VAL 83 HA VAL 83 5.452 -8.644 4.171 633 HB VAL 83 HB VAL 83 4.346 -7.867 2.049 634 HG11 VAL 83 HG11 VAL 83 6.313 -7.122 0.848 635 HG12 VAL 83 HG12 VAL 83 5.398 -8.317 -0.084 636 HG13 VAL 83 HG13 VAL 83 6.892 -8.784 0.688 637 HG21 VAL 83 HG21 VAL 83 4.105 -10.224 2.755 638 HG22 VAL 83 HG22 VAL 83 5.589 -10.637 1.889 639 HG23 VAL 83 HG23 VAL 83 4.178 -10.081 1.004 640 H ALA 84 H ALA 84 8.214 -7.724 2.170 641 HA ALA 84 HA ALA 84 9.433 -10.219 2.012 642 HB1 ALA 84 HB1 ALA 84 11.506 -9.017 1.562 643 HB2 ALA 84 HB2 ALA 84 10.801 -7.527 2.181 644 HB3 ALA 84 HB3 ALA 84 10.165 -8.258 0.707 645 H MET 85 H MET 85 10.041 -7.618 4.413 646 HA MET 85 HA MET 85 11.812 -9.248 5.892 647 HB2 MET 85 HB3 MET 85 11.701 -6.732 6.088 648 HB3 MET 85 HB2 MET 85 10.220 -6.958 7.029 649 HG2 MET 85 HG3 MET 85 11.557 -8.526 8.553 650 HG3 MET 85 HG2 MET 85 12.988 -7.964 7.710 651 HE1 MET 85 HE1 MET 85 10.052 -7.422 9.709 652 HE2 MET 85 HE2 MET 85 10.230 -5.922 10.620 653 HE3 MET 85 HE3 MET 85 11.217 -7.312 11.036 654 H ASN 86 H ASN 86 8.366 -8.483 6.230 655 HA ASN 86 HA ASN 86 8.032 -9.910 8.611 656 HB2 ASN 86 HB3 ASN 86 6.037 -8.957 6.566 657 HB3 ASN 86 HB2 ASN 86 5.490 -9.930 7.903 658 HD21 ASN 86 HD21 ASN 86 4.530 -7.394 7.891 659 HD22 ASN 86 HD22 ASN 86 5.296 -6.479 9.102 660 H ASN 87 H ASN 87 7.936 -10.933 5.303 661 HA ASN 87 HA ASN 87 6.809 -13.434 5.484 662 HB2 ASN 87 HB3 ASN 87 7.647 -13.631 3.403 663 HB3 ASN 87 HB2 ASN 87 8.448 -12.096 3.616 664 HD21 ASN 87 HD21 ASN 87 10.744 -12.141 4.327 665 HD22 ASN 87 HD22 ASN 87 11.677 -13.535 4.109 666 H PHE 88 H PHE 88 10.003 -12.369 6.573 667 HA PHE 88 HA PHE 88 11.014 -14.916 7.284 668 HB2 PHE 88 HB3 PHE 88 11.715 -12.219 8.478 669 HB3 PHE 88 HB2 PHE 88 12.611 -13.708 8.698 670 HD1 PHE 88 HD1 PHE 88 13.101 -15.014 6.335 671 HD2 PHE 88 HD2 PHE 88 12.519 -10.799 6.852 672 HE1 PHE 88 HE1 PHE 88 14.314 -14.599 4.229 673 HE2 PHE 88 HE2 PHE 88 13.740 -10.370 4.721 674 HZ PHE 88 HZ PHE 88 14.639 -12.275 3.411 675 H PHE 89 H PHE 89 9.100 -12.530 9.061 676 HA PHE 89 HA PHE 89 9.298 -13.631 11.626 677 HB2 PHE 89 HB3 PHE 89 7.122 -12.098 10.231 678 HB3 PHE 89 HB2 PHE 89 6.799 -12.705 11.808 679 HD1 PHE 89 HD1 PHE 89 9.479 -12.323 13.178 680 HD2 PHE 89 HD2 PHE 89 7.340 -9.746 10.456 681 HE1 PHE 89 HE1 PHE 89 10.614 -10.336 14.121 682 HE2 PHE 89 HE2 PHE 89 8.496 -7.799 11.409 683 HZ PHE 89 HZ PHE 89 10.131 -8.093 13.241 684 H TRP 90 H TRP 90 7.031 -14.288 9.058 685 HA TRP 90 HA TRP 90 5.685 -16.337 10.586 686 HB2 TRP 90 HB3 TRP 90 5.141 -15.666 7.723 687 HB3 TRP 90 HB2 TRP 90 4.022 -16.256 8.958 688 HD1 TRP 90 HD TRP 90 5.034 -13.128 7.409 689 HE1 TRP 90 HE1 TRP 90 4.402 -11.113 8.848 690 HE3 TRP 90 HE3 TRP 90 3.943 -15.489 11.779 691 HZ2 TRP 90 HZ2 TRP 90 3.543 -10.547 11.535 692 HZ3 TRP 90 HZ3 TRP 90 3.241 -14.200 13.768 693 HH2 TRP 90 HH TRP 90 3.039 -11.725 13.645 694 H GLU 91 H GLU 91 7.913 -16.260 8.006 695 HA GLU 91 HA GLU 91 7.639 -19.137 7.521 696 HB2 GLU 91 HB3 GLU 91 9.582 -17.127 6.423 697 HB3 GLU 91 HB2 GLU 91 9.342 -18.785 5.842 698 HG2 GLU 91 HG3 GLU 91 7.089 -16.793 6.025 699 HG3 GLU 91 HG2 GLU 91 8.018 -16.908 4.579 700 H ASN 92 H ASN 92 10.342 -17.032 8.527 701 HA ASN 92 HA ASN 92 11.432 -19.307 10.070 702 HB2 ASN 92 HB3 ASN 92 12.654 -19.132 7.956 703 HB3 ASN 92 HB2 ASN 92 13.013 -17.438 8.299 704 HD21 ASN 92 HD21 ASN 92 15.298 -17.662 8.545 705 HD22 ASN 92 HD22 ASN 92 16.007 -18.577 9.773 706 H SER 93 H SER 93 10.973 -18.529 12.074 707 HA SER 93 HA SER 93 12.645 -16.715 13.311 708 HB2 SER 93 HB3 SER 93 10.133 -15.502 12.234 709 HB3 SER 93 HB2 SER 93 10.752 -14.941 13.782 710 HG SER 93 HG SER 93 12.150 -15.175 11.335 711 H1 GLY 1 H GLY 1 13.146 5.120 11.074 712 HA2 GLY 1 HA3 GLY 1 11.753 2.936 10.156 713 HA3 GLY 1 HA2 GLY 1 12.270 2.486 11.781 714 H SER 2 H SER 2 10.548 4.934 9.932 715 HA SER 2 HA SER 2 9.501 6.320 12.190 716 HB2 SER 2 HB3 SER 2 8.423 6.346 9.376 717 HB3 SER 2 HB2 SER 2 8.270 7.600 10.576 718 HG SER 2 HG SER 2 9.869 7.893 9.007 719 H GLU 3 H GLU 3 7.002 6.686 12.245 720 HA GLU 3 HA GLU 3 5.669 4.463 13.251 721 HB2 GLU 3 HB3 GLU 3 4.478 6.893 11.861 722 HB3 GLU 3 HB2 GLU 3 3.575 5.699 12.785 723 HG2 GLU 3 HG3 GLU 3 4.799 6.229 14.803 724 HG3 GLU 3 HG2 GLU 3 5.851 7.338 13.920 725 H LEU 4 H LEU 4 6.419 5.269 10.039 726 HA LEU 4 HA LEU 4 4.324 4.107 8.621 727 HB2 LEU 4 HB3 LEU 4 7.248 4.199 7.876 728 HB3 LEU 4 HB2 LEU 4 5.927 3.835 6.789 729 HG LEU 4 HG LEU 4 6.317 6.444 8.279 730 HD11 LEU 4 HD11 LEU 4 7.452 7.093 6.507 731 HD12 LEU 4 HD12 LEU 4 6.039 6.753 5.496 732 HD13 LEU 4 HD13 LEU 4 7.242 5.503 5.759 733 HD21 LEU 4 HD21 LEU 4 4.327 6.955 6.521 734 HD22 LEU 4 HD22 LEU 4 4.067 6.464 8.185 735 HD23 LEU 4 HD23 LEU 4 3.941 5.265 6.899 736 H GLU 5 H GLU 5 7.304 2.692 9.981 737 HA GLU 5 HA GLU 5 6.887 0.100 8.900 738 HB2 GLU 5 HB3 GLU 5 8.310 0.937 11.446 739 HB3 GLU 5 HB2 GLU 5 8.349 -0.685 10.770 740 HG2 GLU 5 HG3 GLU 5 9.357 0.292 8.626 741 HG3 GLU 5 HG2 GLU 5 9.371 1.838 9.438 742 H THR 6 H THR 6 5.883 1.663 11.924 743 HA THR 6 HA THR 6 4.514 -0.557 13.005 744 HB THR 6 HB THR 6 3.745 2.343 13.410 745 HG1 THR 6 HG2 THR 6 5.942 0.854 14.519 746 HG21 THR 6 HG21 THR 6 3.041 1.586 15.575 747 HG22 THR 6 HG22 THR 6 3.832 0.036 15.371 748 HG23 THR 6 HG23 THR 6 2.404 0.419 14.426 749 H ALA 7 H ALA 7 3.510 2.173 10.923 750 HA ALA 7 HA ALA 7 0.792 1.501 10.715 751 HB1 ALA 7 HB1 ALA 7 0.706 2.983 8.872 752 HB2 ALA 7 HB2 ALA 7 2.395 2.729 8.472 753 HB3 ALA 7 HB3 ALA 7 1.961 3.652 9.914 754 H MET 8 H MET 8 3.586 0.568 8.734 755 HA MET 8 HA MET 8 2.082 -1.031 6.925 756 HB2 MET 8 HB3 MET 8 5.016 -1.252 7.697 757 HB3 MET 8 HB2 MET 8 4.268 -2.084 6.343 758 HG2 MET 8 HG3 MET 8 4.520 0.934 6.660 759 HG3 MET 8 HG2 MET 8 5.307 -0.088 5.478 760 HE1 MET 8 HE1 MET 8 4.266 -1.553 4.031 761 HE2 MET 8 HE2 MET 8 2.874 -1.145 3.024 762 HE3 MET 8 HE3 MET 8 2.633 -2.072 4.502 763 H GLU 9 H GLU 9 3.734 -1.756 9.968 764 HA GLU 9 HA GLU 9 3.097 -4.510 9.981 765 HB2 GLU 9 HB3 GLU 9 3.850 -2.535 12.131 766 HB3 GLU 9 HB2 GLU 9 3.273 -4.143 12.560 767 HG2 GLU 9 HG3 GLU 9 5.374 -3.988 10.438 768 HG3 GLU 9 HG2 GLU 9 5.876 -3.689 12.095 769 H THR 10 H THR 10 1.372 -1.624 10.970 770 HA THR 10 HA THR 10 -0.806 -2.914 12.231 771 HB THR 10 HB THR 10 -1.046 -0.272 10.705 772 HG1 THR 10 HG2 THR 10 0.851 -0.518 12.222 773 HG21 THR 10 HG21 THR 10 -3.126 -1.188 11.619 774 HG22 THR 10 HG22 THR 10 -2.627 0.219 12.548 775 HG23 THR 10 HG23 THR 10 -2.360 -1.393 13.188 776 H LEU 11 H LEU 11 -0.158 -1.980 8.887 777 HA LEU 11 HA LEU 11 -2.571 -3.006 7.746 778 HB2 LEU 11 HB3 LEU 11 0.195 -2.587 6.582 779 HB3 LEU 11 HB2 LEU 11 -1.175 -3.131 5.617 780 HG LEU 11 HG LEU 11 -1.178 -0.552 7.227 781 HD11 LEU 11 HD11 LEU 11 -0.842 0.558 5.046 782 HD12 LEU 11 HD12 LEU 11 -0.499 -1.007 4.312 783 HD13 LEU 11 HD13 LEU 11 0.562 -0.361 5.567 784 HD21 LEU 11 HD21 LEU 11 -2.836 -0.872 4.802 785 HD22 LEU 11 HD22 LEU 11 -3.279 -0.195 6.349 786 HD23 LEU 11 HD23 LEU 11 -3.316 -1.941 6.111 787 H ILE 12 H ILE 12 0.608 -4.413 8.405 788 HA ILE 12 HA ILE 12 0.193 -6.933 7.180 789 HB ILE 12 HB ILE 12 1.965 -6.191 9.534 790 HG12 ILE 12 HG13 ILE 12 2.285 -5.189 7.174 791 HG13 ILE 12 HG12 ILE 12 3.698 -5.915 7.894 792 HG21 ILE 12 HG21 ILE 12 3.155 -8.291 8.985 793 HG22 ILE 12 HG22 ILE 12 1.761 -8.794 8.013 794 HG23 ILE 12 HG23 ILE 12 1.589 -8.517 9.733 795 HD11 ILE 12 HD11 ILE 12 1.804 -7.226 5.890 796 HD12 ILE 12 HD12 ILE 12 3.217 -8.027 6.573 797 HD13 ILE 12 HD13 ILE 12 3.411 -6.628 5.539 798 H ASN 13 H ASN 13 -0.400 -5.849 10.493 799 HA ASN 13 HA ASN 13 -1.086 -8.353 11.530 800 HB2 ASN 13 HB3 ASN 13 -1.882 -5.561 12.311 801 HB3 ASN 13 HB2 ASN 13 -2.523 -6.963 13.155 802 HD21 ASN 13 HD21 ASN 13 0.402 -5.103 12.583 803 HD22 ASN 13 HD22 ASN 13 1.347 -5.899 13.746 804 H VAL 14 H VAL 14 -3.168 -5.889 10.054 805 HA VAL 14 HA VAL 14 -5.565 -7.410 10.304 806 HB VAL 14 HB VAL 14 -4.835 -5.153 8.416 807 HG11 VAL 14 HG11 VAL 14 -7.280 -4.946 8.100 808 HG12 VAL 14 HG12 VAL 14 -7.520 -6.428 9.005 809 HG13 VAL 14 HG13 VAL 14 -6.679 -6.469 7.444 810 HG21 VAL 14 HG21 VAL 14 -6.588 -4.090 10.067 811 HG22 VAL 14 HG22 VAL 14 -4.891 -4.248 10.573 812 HG23 VAL 14 HG23 VAL 14 -6.094 -5.403 11.128 813 H PHE 15 H PHE 15 -3.273 -6.977 7.666 814 HA PHE 15 HA PHE 15 -4.519 -8.705 5.804 815 HB2 PHE 15 HB3 PHE 15 -2.700 -7.141 5.217 816 HB3 PHE 15 HB2 PHE 15 -1.570 -8.123 6.145 817 HD1 PHE 15 HD1 PHE 15 -3.852 -8.132 3.214 818 HD2 PHE 15 HD2 PHE 15 -0.679 -10.182 5.271 819 HE1 PHE 15 HE1 PHE 15 -3.550 -9.633 1.276 820 HE2 PHE 15 HE2 PHE 15 -0.397 -11.674 3.321 821 HZ PHE 15 HZ PHE 15 -1.828 -11.402 1.339 822 H HIS 16 H HIS 16 -1.982 -9.248 8.172 823 HA HIS 16 HA HIS 16 -1.562 -11.989 7.706 824 HB2 HIS 16 HB3 HIS 16 0.012 -10.488 8.882 825 HB3 HIS 16 HB2 HIS 16 -1.137 -10.325 10.203 826 HD1 HIS 16 HD1 HIS 16 -0.394 -13.721 8.552 827 HD2 HIS 16 HD2 HIS 16 0.574 -11.549 11.992 828 HE1 HIS 16 HE1 HIS 16 0.749 -15.314 10.089 829 HE2 HIS 16 HE2 HIS 16 1.361 -14.049 12.196 830 H ALA 17 H ALA 17 -3.658 -10.218 9.977 831 HA ALA 17 HA ALA 17 -4.787 -12.464 11.264 832 HB1 ALA 17 HB1 ALA 17 -5.213 -10.389 12.302 833 HB2 ALA 17 HB2 ALA 17 -6.765 -10.861 11.623 834 HB3 ALA 17 HB3 ALA 17 -5.784 -9.651 10.807 835 H HIS 18 H HIS 18 -5.936 -10.558 8.459 836 HA HIS 18 HA HIS 18 -8.102 -12.322 7.956 837 HB2 HIS 18 HB3 HIS 18 -6.856 -10.178 6.244 838 HB3 HIS 18 HB2 HIS 18 -8.089 -11.287 5.633 839 HD1 HIS 18 HD1 HIS 18 -10.506 -11.239 6.741 840 HD2 HIS 18 HD2 HIS 18 -7.851 -8.292 8.109 841 HE1 HIS 18 HE1 HIS 18 -11.875 -9.574 8.023 842 HE2 HIS 18 HE2 HIS 18 -10.305 -7.761 8.855 843 H SER 19 H SER 19 -4.777 -12.298 6.867 844 HA SER 19 HA SER 19 -5.025 -14.332 4.928 845 HB2 SER 19 HB3 SER 19 -2.724 -13.928 6.890 846 HB3 SER 19 HB2 SER 19 -2.696 -14.856 5.411 847 HG SER 19 HG SER 19 -3.321 -12.066 5.542 848 H GLY 20 H GLY 20 -4.746 -14.327 8.423 849 HA2 GLY 20 HA3 GLY 20 -4.781 -17.136 8.805 850 HA3 GLY 20 HA2 GLY 20 -5.228 -15.911 9.994 851 H LYS 21 H LYS 21 -7.272 -14.625 8.582 852 HA LYS 21 HA LYS 21 -9.533 -16.263 9.172 853 HB2 LYS 21 HB3 LYS 21 -9.446 -13.842 7.331 854 HB3 LYS 21 HB2 LYS 21 -10.863 -14.540 8.074 855 HG2 LYS 21 HG3 LYS 21 -8.553 -13.347 9.658 856 HG3 LYS 21 HG2 LYS 21 -10.063 -12.520 9.295 857 HD2 LYS 21 HD3 LYS 21 -11.292 -14.206 10.555 858 HD3 LYS 21 HD2 LYS 21 -9.778 -15.077 10.900 859 HE2 LYS 21 HE2 LYS 21 -8.903 -13.043 12.043 860 HE3 LYS 21 HE1 LYS 21 -10.412 -12.217 11.713 861 HZ1 LYS 21 HZ1 LYS 21 -10.977 -12.976 13.691 862 HZ2 LYS 21 HZ2 LYS 21 -9.802 -14.177 13.732 863 HZ3 LYS 21 HZ3 LYS 21 -11.292 -14.455 12.940 864 H GLU 22 H GLU 22 -7.906 -15.381 6.182 865 HA GLU 22 HA GLU 22 -9.569 -16.935 4.464 866 HB2 GLU 22 HB3 GLU 22 -8.507 -15.510 3.079 867 HB3 GLU 22 HB2 GLU 22 -7.201 -15.224 4.177 868 HG2 GLU 22 HG3 GLU 22 -6.241 -16.214 2.219 869 HG3 GLU 22 HG2 GLU 22 -6.191 -17.466 3.431 870 H GLY 23 H GLY 23 -6.525 -17.510 6.123 871 HA2 GLY 23 HA3 GLY 23 -6.366 -19.794 7.116 872 HA3 GLY 23 HA2 GLY 23 -6.813 -20.414 5.540 873 H ASP 24 H ASP 24 -4.625 -17.683 5.881 874 HA ASP 24 HA ASP 24 -2.329 -19.451 5.287 875 HB2 ASP 24 HB3 ASP 24 -3.350 -18.167 3.223 876 HB3 ASP 24 HB2 ASP 24 -2.551 -16.797 3.923 877 H LYS 25 H LYS 25 -0.270 -18.497 5.716 878 HA LYS 25 HA LYS 25 -0.215 -17.009 8.148 879 HB2 LYS 25 HB3 LYS 25 2.317 -16.801 7.540 880 HB3 LYS 25 HB2 LYS 25 1.679 -18.391 7.923 881 HG2 LYS 25 HG3 LYS 25 1.606 -17.566 5.032 882 HG3 LYS 25 HG2 LYS 25 3.171 -17.894 5.745 883 HD2 LYS 25 HD3 LYS 25 2.223 -20.098 6.596 884 HD3 LYS 25 HD2 LYS 25 0.829 -19.799 5.577 885 HE2 LYS 25 HE2 LYS 25 2.230 -21.055 4.183 886 HE3 LYS 25 HE1 LYS 25 2.521 -19.381 3.689 887 HZ1 LYS 25 HZ1 LYS 25 4.472 -21.045 4.272 888 HZ2 LYS 25 HZ2 LYS 25 4.198 -20.497 5.820 889 HZ3 LYS 25 HZ3 LYS 25 4.648 -19.402 4.611 890 H TYR 26 H TYR 26 0.439 -16.231 4.751 891 HA TYR 26 HA TYR 26 -0.667 -13.689 5.221 892 HB2 TYR 26 HB3 TYR 26 1.282 -12.375 4.221 893 HB3 TYR 26 HB2 TYR 26 1.446 -12.905 5.890 894 HD1 TYR 26 HD1 TYR 26 2.637 -15.067 6.330 895 HD2 TYR 26 HD2 TYR 26 2.865 -13.048 2.577 896 HE1 TYR 26 HE1 TYR 26 4.710 -16.352 5.769 897 HE2 TYR 26 HE2 TYR 26 4.907 -14.304 1.996 898 HH TYR 26 HH TYR 26 5.943 -17.014 3.876 899 H LYS 27 H LYS 27 -2.114 -14.284 3.763 900 HA LYS 27 HA LYS 27 -1.631 -13.491 1.113 901 HB2 LYS 27 HB3 LYS 27 -2.622 -16.340 1.562 902 HB3 LYS 27 HB2 LYS 27 -2.754 -15.434 0.060 903 HG2 LYS 27 HG3 LYS 27 -0.091 -16.035 1.398 904 HG3 LYS 27 HG2 LYS 27 -0.772 -17.043 0.151 905 HD2 LYS 27 HD3 LYS 27 -0.144 -14.076 -0.205 906 HD3 LYS 27 HD2 LYS 27 0.840 -15.398 -0.780 907 HE2 LYS 27 HE2 LYS 27 -1.867 -14.522 -1.797 908 HE3 LYS 27 HE1 LYS 27 -0.394 -14.879 -2.683 909 HZ1 LYS 27 HZ1 LYS 27 -2.394 -16.791 -1.598 910 HZ2 LYS 27 HZ2 LYS 27 -0.777 -17.294 -1.848 911 HZ3 LYS 27 HZ3 LYS 27 -1.677 -16.661 -3.097 912 H LEU 28 H LEU 28 -3.754 -12.930 0.185 913 HA LEU 28 HA LEU 28 -5.917 -13.259 2.121 914 HB2 LEU 28 HB3 LEU 28 -4.967 -11.054 2.350 915 HB3 LEU 28 HB2 LEU 28 -5.199 -10.717 0.643 916 HG LEU 28 HG LEU 28 -7.680 -11.094 1.001 917 HD11 LEU 28 HD11 LEU 28 -7.771 -12.442 2.941 918 HD12 LEU 28 HD12 LEU 28 -8.325 -10.850 3.467 919 HD13 LEU 28 HD13 LEU 28 -6.680 -11.372 3.829 920 HD21 LEU 28 HD21 LEU 28 -6.193 -8.985 2.567 921 HD22 LEU 28 HD22 LEU 28 -7.945 -8.985 2.382 922 HD23 LEU 28 HD23 LEU 28 -6.899 -8.835 0.953 923 H SER 29 H SER 29 -7.736 -14.034 1.275 924 HA SER 29 HA SER 29 -7.821 -14.459 -1.559 925 HB2 SER 29 HB3 SER 29 -10.003 -15.648 -0.911 926 HB3 SER 29 HB2 SER 29 -8.468 -16.313 -0.376 927 HG SER 29 HG SER 29 -9.282 -16.161 1.500 928 H LYS 30 H LYS 30 -9.921 -14.064 -2.703 929 HA LYS 30 HA LYS 30 -10.427 -11.253 -2.575 930 HB2 LYS 30 HB3 LYS 30 -11.983 -13.222 -4.244 931 HB3 LYS 30 HB2 LYS 30 -11.681 -11.509 -4.548 932 HG2 LYS 30 HG3 LYS 30 -9.785 -13.834 -4.758 933 HG3 LYS 30 HG2 LYS 30 -10.180 -12.677 -6.019 934 HD2 LYS 30 HD3 LYS 30 -8.695 -11.881 -3.470 935 HD3 LYS 30 HD2 LYS 30 -7.876 -12.418 -4.909 936 HE2 LYS 30 HE2 LYS 30 -9.877 -10.296 -5.446 937 HE3 LYS 30 HE1 LYS 30 -8.573 -9.815 -4.385 938 HZ1 LYS 30 HZ1 LYS 30 -6.958 -10.206 -5.949 939 HZ2 LYS 30 HZ2 LYS 30 -8.204 -9.650 -6.974 940 HZ3 LYS 30 HZ3 LYS 30 -7.871 -11.298 -6.828 941 H LYS 31 H LYS 31 -11.631 -13.670 -0.809 942 HA LYS 31 HA LYS 31 -14.395 -12.739 -0.484 943 HB2 LYS 31 HB3 LYS 31 -13.923 -14.340 1.700 944 HB3 LYS 31 HB2 LYS 31 -14.541 -14.902 0.159 945 HG2 LYS 31 HG3 LYS 31 -12.517 -15.854 -0.480 946 HG3 LYS 31 HG2 LYS 31 -11.555 -14.681 0.399 947 HD2 LYS 31 HD3 LYS 31 -11.516 -15.870 2.286 948 HD3 LYS 31 HD2 LYS 31 -13.180 -16.473 2.128 949 HE2 LYS 31 HE2 LYS 31 -11.101 -17.407 0.175 950 HE3 LYS 31 HE1 LYS 31 -11.052 -18.043 1.825 951 HZ1 LYS 31 HZ1 LYS 31 -13.208 -18.874 1.641 952 HZ2 LYS 31 HZ2 LYS 31 -12.451 -19.344 0.208 953 HZ3 LYS 31 HZ3 LYS 31 -13.544 -18.043 0.215 954 H GLU 32 H GLU 32 -11.795 -13.225 1.857 955 HA GLU 32 HA GLU 32 -12.698 -11.555 3.897 956 HB2 GLU 32 HB3 GLU 32 -9.937 -12.382 3.045 957 HB3 GLU 32 HB2 GLU 32 -10.255 -11.526 4.565 958 HG2 GLU 32 HG3 GLU 32 -11.510 -14.178 3.766 959 HG3 GLU 32 HG2 GLU 32 -10.076 -14.036 4.761 960 H LEU 33 H LEU 33 -10.665 -10.893 1.112 961 HA LEU 33 HA LEU 33 -9.718 -8.390 1.848 962 HB2 LEU 33 HB3 LEU 33 -8.767 -9.634 -0.041 963 HB3 LEU 33 HB2 LEU 33 -10.271 -9.486 -0.917 964 HG LEU 33 HG LEU 33 -8.374 -7.867 -1.534 965 HD11 LEU 33 HD11 LEU 33 -11.138 -7.659 -1.699 966 HD12 LEU 33 HD12 LEU 33 -9.951 -6.694 -2.547 967 HD13 LEU 33 HD13 LEU 33 -10.628 -6.106 -1.035 968 HD21 LEU 33 HD21 LEU 33 -7.823 -6.114 -0.143 969 HD22 LEU 33 HD22 LEU 33 -8.197 -7.270 1.111 970 HD23 LEU 33 HD23 LEU 33 -9.388 -6.067 0.640 971 H LYS 34 H LYS 34 -12.664 -9.166 0.009 972 HA LYS 34 HA LYS 34 -13.345 -6.468 -0.484 973 HB2 LYS 34 HB3 LYS 34 -15.129 -8.900 -0.217 974 HB3 LYS 34 HB2 LYS 34 -15.655 -7.334 -0.813 975 HG2 LYS 34 HG3 LYS 34 -14.028 -7.436 -2.636 976 HG3 LYS 34 HG2 LYS 34 -13.463 -9.013 -2.062 977 HD2 LYS 34 HD3 LYS 34 -15.806 -9.886 -2.346 978 HD3 LYS 34 HD2 LYS 34 -16.253 -8.331 -3.022 979 HE2 LYS 34 HE2 LYS 34 -15.805 -9.548 -4.940 980 HE3 LYS 34 HE1 LYS 34 -14.260 -8.749 -4.692 981 HZ1 LYS 34 HZ1 LYS 34 -13.634 -10.965 -4.948 982 HZ2 LYS 34 HZ2 LYS 34 -15.027 -11.525 -4.235 983 HZ3 LYS 34 HZ3 LYS 34 -13.791 -10.925 -3.250 984 H GLU 35 H GLU 35 -14.200 -8.731 2.066 985 HA GLU 35 HA GLU 35 -15.932 -7.042 3.523 986 HB2 GLU 35 HB3 GLU 35 -14.218 -9.396 4.330 987 HB3 GLU 35 HB2 GLU 35 -15.436 -8.664 5.370 988 HG2 GLU 35 HG3 GLU 35 -17.198 -9.163 3.743 989 HG3 GLU 35 HG2 GLU 35 -15.996 -9.774 2.615 990 H LEU 36 H LEU 36 -12.511 -7.830 3.781 991 HA LEU 36 HA LEU 36 -11.844 -6.160 5.951 992 HB2 LEU 36 HB3 LEU 36 -10.219 -7.728 5.508 993 HB3 LEU 36 HB2 LEU 36 -10.433 -7.604 3.778 994 HG LEU 36 HG LEU 36 -9.248 -5.502 3.704 995 HD11 LEU 36 HD11 LEU 36 -9.357 -4.277 5.618 996 HD12 LEU 36 HD12 LEU 36 -7.917 -5.169 6.051 997 HD13 LEU 36 HD13 LEU 36 -9.493 -5.689 6.675 998 HD21 LEU 36 HD21 LEU 36 -8.085 -7.998 4.678 999 HD22 LEU 36 HD22 LEU 36 -7.071 -6.594 5.018 1000 HD23 LEU 36 HD23 LEU 36 -7.592 -6.932 3.365 1001 H LEU 37 H LEU 37 -11.595 -5.618 2.447 1002 HA LEU 37 HA LEU 37 -10.468 -3.085 2.706 1003 HB2 LEU 37 HB3 LEU 37 -10.273 -4.308 0.629 1004 HB3 LEU 37 HB2 LEU 37 -12.018 -4.270 0.389 1005 HG LEU 37 HG LEU 37 -10.521 -2.615 -0.935 1006 HD11 LEU 37 HD11 LEU 37 -13.154 -2.536 -0.268 1007 HD12 LEU 37 HD12 LEU 37 -12.372 -1.343 -1.286 1008 HD13 LEU 37 HD13 LEU 37 -12.613 -1.008 0.425 1009 HD21 LEU 37 HD21 LEU 37 -10.809 -0.749 1.364 1010 HD22 LEU 37 HD22 LEU 37 -9.620 -0.784 0.077 1011 HD23 LEU 37 HD23 LEU 37 -9.453 -1.886 1.431 1012 H GLN 38 H GLN 38 -13.868 -4.004 2.245 1013 HA GLN 38 HA GLN 38 -14.776 -1.308 2.271 1014 HB2 GLN 38 HB3 GLN 38 -17.017 -2.174 2.495 1015 HB3 GLN 38 HB2 GLN 38 -16.153 -3.240 1.393 1016 HG2 GLN 38 HG3 GLN 38 -15.730 -4.799 3.301 1017 HG3 GLN 38 HG2 GLN 38 -16.698 -3.748 4.338 1018 HE21 GLN 38 HE21 GLN 38 -18.645 -4.923 4.639 1019 HE22 GLN 38 HE22 GLN 38 -19.545 -5.548 3.350 1020 H THR 39 H THR 39 -14.325 -3.735 4.751 1021 HA THR 39 HA THR 39 -15.531 -2.332 6.867 1022 HB THR 39 HB THR 39 -13.387 -4.446 6.825 1023 HG1 THR 39 HG2 THR 39 -15.065 -5.342 6.072 1024 HG21 THR 39 HG21 THR 39 -14.968 -3.287 9.131 1025 HG22 THR 39 HG22 THR 39 -13.210 -3.475 8.935 1026 HG23 THR 39 HG23 THR 39 -14.214 -4.891 9.155 1027 H GLU 40 H GLU 40 -12.025 -2.612 6.091 1028 HA GLU 40 HA GLU 40 -11.306 -0.819 8.184 1029 HB2 GLU 40 HB3 GLU 40 -9.737 -1.828 5.813 1030 HB3 GLU 40 HB2 GLU 40 -9.071 -0.856 7.129 1031 HG2 GLU 40 HG3 GLU 40 -10.447 -3.541 7.495 1032 HG3 GLU 40 HG2 GLU 40 -8.708 -3.287 7.506 1033 H LEU 41 H LEU 41 -11.665 -0.374 4.723 1034 HA LEU 41 HA LEU 41 -11.150 2.503 5.074 1035 HB2 LEU 41 HB3 LEU 41 -10.945 0.586 2.837 1036 HB3 LEU 41 HB2 LEU 41 -11.275 2.241 2.402 1037 HG LEU 41 HG LEU 41 -9.285 2.885 3.928 1038 HD11 LEU 41 HD11 LEU 41 -8.980 0.937 5.223 1039 HD12 LEU 41 HD12 LEU 41 -7.610 0.962 4.125 1040 HD13 LEU 41 HD13 LEU 41 -8.970 -0.115 3.811 1041 HD21 LEU 41 HD21 LEU 41 -8.553 1.125 1.583 1042 HD22 LEU 41 HD22 LEU 41 -7.695 2.555 2.173 1043 HD23 LEU 41 HD23 LEU 41 -9.248 2.732 1.372 1044 H SER 42 H SER 42 -13.562 1.359 6.001 1045 HA SER 42 HA SER 42 -15.690 1.521 4.224 1046 HB2 SER 42 HB3 SER 42 -16.850 2.315 6.526 1047 HB3 SER 42 HB2 SER 42 -16.454 0.653 6.160 1048 HG SER 42 HG SER 42 -14.802 0.723 7.537 1049 H GLY 43 H GLY 43 -14.067 4.092 6.030 1050 HA2 GLY 43 HA3 GLY 43 -15.896 6.158 5.279 1051 HA3 GLY 43 HA2 GLY 43 -14.263 6.399 5.881 1052 H PHE 44 H PHE 44 -12.789 5.018 3.997 1053 HA PHE 44 HA PHE 44 -12.625 6.878 1.840 1054 HB2 PHE 44 HB3 PHE 44 -11.349 4.224 2.385 1055 HB3 PHE 44 HB2 PHE 44 -11.124 5.007 0.826 1056 HD1 PHE 44 HD2 PHE 44 -9.895 7.131 0.676 1057 HD2 PHE 44 HD1 PHE 44 -10.389 5.115 4.416 1058 HE1 PHE 44 HE2 PHE 44 -8.101 8.533 1.656 1059 HE2 PHE 44 HE1 PHE 44 -8.584 6.516 5.405 1060 HZ PHE 44 HZ PHE 44 -7.448 8.217 4.038 1061 H LEU 45 H LEU 45 -13.807 3.586 2.139 1062 HA LEU 45 HA LEU 45 -14.566 3.192 -0.539 1063 HB2 LEU 45 HB3 LEU 45 -14.521 1.224 0.635 1064 HB3 LEU 45 HB2 LEU 45 -15.201 1.938 2.086 1065 HG LEU 45 HG LEU 45 -17.385 2.100 1.013 1066 HD11 LEU 45 HD11 LEU 45 -17.854 1.461 -1.126 1067 HD12 LEU 45 HD12 LEU 45 -16.525 0.311 -1.242 1068 HD13 LEU 45 HD13 LEU 45 -16.219 2.043 -1.411 1069 HD21 LEU 45 HD21 LEU 45 -17.976 -0.198 1.170 1070 HD22 LEU 45 HD22 LEU 45 -16.635 0.050 2.281 1071 HD23 LEU 45 HD23 LEU 45 -16.359 -0.726 0.707 1072 H ASP 46 H ASP 46 -16.452 4.265 2.260 1073 HA ASP 46 HA ASP 46 -18.871 4.560 0.865 1074 HB2 ASP 46 HB3 ASP 46 -18.814 4.384 3.167 1075 HB3 ASP 46 HB2 ASP 46 -17.904 5.893 3.397 1076 H ALA 47 H ALA 47 -16.312 6.875 1.605 1077 HA ALA 47 HA ALA 47 -17.627 9.152 0.705 1078 HB1 ALA 47 HB1 ALA 47 -14.655 8.624 0.687 1079 HB2 ALA 47 HB2 ALA 47 -15.582 9.241 2.053 1080 HB3 ALA 47 HB3 ALA 47 -15.431 10.202 0.581 1081 H GLN 48 H GLN 48 -15.432 6.996 -1.082 1082 HA GLN 48 HA GLN 48 -16.156 8.477 -3.526 1083 HB2 GLN 48 HB3 GLN 48 -14.052 7.690 -4.490 1084 HB3 GLN 48 HB2 GLN 48 -13.780 8.588 -3.005 1085 HG2 GLN 48 HG3 GLN 48 -12.754 6.816 -2.067 1086 HG3 GLN 48 HG2 GLN 48 -14.145 5.793 -2.335 1087 HE21 GLN 48 HE21 GLN 48 -14.344 5.401 -4.962 1088 HE22 GLN 48 HE22 GLN 48 -12.921 4.779 -5.645 1089 H LYS 49 H LYS 49 -17.914 6.491 -2.622 1090 HA LYS 49 HA LYS 49 -17.660 4.002 -4.003 1091 HB2 LYS 49 HB3 LYS 49 -20.111 5.598 -3.269 1092 HB3 LYS 49 HB2 LYS 49 -20.146 3.963 -3.891 1093 HG2 LYS 49 HG3 LYS 49 -18.768 3.208 -1.937 1094 HG3 LYS 49 HG2 LYS 49 -18.846 4.858 -1.311 1095 HD2 LYS 49 HD3 LYS 49 -21.331 3.273 -1.966 1096 HD3 LYS 49 HD2 LYS 49 -20.570 3.258 -0.381 1097 HE2 LYS 49 HE2 LYS 49 -21.104 5.461 0.091 1098 HE3 LYS 49 HE1 LYS 49 -21.091 5.966 -1.581 1099 HZ1 LYS 49 HZ1 LYS 49 -23.195 4.388 -0.212 1100 HZ2 LYS 49 HZ2 LYS 49 -23.143 4.683 -1.906 1101 HZ3 LYS 49 HZ3 LYS 49 -23.268 5.968 -0.812 1102 H ASP 50 H ASP 50 -18.938 7.122 -4.726 1103 HA ASP 50 HA ASP 50 -20.180 6.421 -7.197 1104 HB2 ASP 50 HB3 ASP 50 -19.667 9.150 -5.985 1105 HB3 ASP 50 HB2 ASP 50 -20.793 8.776 -7.279 1106 H VAL 51 H VAL 51 -17.030 6.892 -6.469 1107 HA VAL 51 HA VAL 51 -16.274 8.362 -8.872 1108 HB VAL 51 HB VAL 51 -14.496 7.129 -6.753 1109 HG11 VAL 51 HG11 VAL 51 -13.975 9.465 -8.612 1110 HG12 VAL 51 HG12 VAL 51 -13.459 7.824 -8.981 1111 HG13 VAL 51 HG13 VAL 51 -12.820 8.656 -7.570 1112 HG21 VAL 51 HG21 VAL 51 -15.985 8.681 -5.636 1113 HG22 VAL 51 HG22 VAL 51 -15.796 9.869 -6.912 1114 HG23 VAL 51 HG23 VAL 51 -14.446 9.514 -5.840 1115 H ASP 52 H ASP 52 -15.508 7.393 -10.694 1116 HA ASP 52 HA ASP 52 -16.009 4.698 -11.230 1117 HB2 ASP 52 HB3 ASP 52 -15.795 6.323 -13.013 1118 HB3 ASP 52 HB2 ASP 52 -14.085 6.559 -12.640 1119 H ALA 53 H ALA 53 -13.060 6.261 -10.213 1120 HA ALA 53 HA ALA 53 -11.254 4.213 -10.599 1121 HB1 ALA 53 HB1 ALA 53 -10.236 6.175 -9.866 1122 HB2 ALA 53 HB2 ALA 53 -10.128 5.144 -8.447 1123 HB3 ALA 53 HB3 ALA 53 -11.371 6.390 -8.527 1124 H VAL 54 H VAL 54 -13.819 4.433 -8.228 1125 HA VAL 54 HA VAL 54 -12.816 2.569 -6.369 1126 HB VAL 54 HB VAL 54 -14.989 4.119 -6.302 1127 HG11 VAL 54 HG11 VAL 54 -16.234 3.085 -8.103 1128 HG12 VAL 54 HG12 VAL 54 -17.040 2.792 -6.577 1129 HG13 VAL 54 HG13 VAL 54 -16.130 1.499 -7.328 1130 HG21 VAL 54 HG21 VAL 54 -14.604 1.408 -5.011 1131 HG22 VAL 54 HG22 VAL 54 -15.958 2.457 -4.592 1132 HG23 VAL 54 HG23 VAL 54 -14.308 3.007 -4.318 1133 H ASP 55 H ASP 55 -14.714 2.137 -9.330 1134 HA ASP 55 HA ASP 55 -14.915 -0.725 -9.247 1135 HB2 ASP 55 HB3 ASP 55 -16.198 0.670 -10.907 1136 HB3 ASP 55 HB2 ASP 55 -14.643 1.049 -11.668 1137 H LYS 56 H LYS 56 -12.693 1.551 -10.666 1138 HA LYS 56 HA LYS 56 -11.025 -0.295 -11.926 1139 HB2 LYS 56 HB3 LYS 56 -10.219 2.397 -10.796 1140 HB3 LYS 56 HB2 LYS 56 -9.385 1.494 -12.044 1141 HG2 LYS 56 HG3 LYS 56 -12.207 2.636 -12.289 1142 HG3 LYS 56 HG2 LYS 56 -10.758 3.220 -13.094 1143 HD2 LYS 56 HD3 LYS 56 -10.567 0.802 -13.998 1144 HD3 LYS 56 HD2 LYS 56 -12.257 0.658 -13.580 1145 HE2 LYS 56 HE2 LYS 56 -11.359 3.060 -15.166 1146 HE3 LYS 56 HE1 LYS 56 -11.650 1.533 -15.998 1147 HZ1 LYS 56 HZ1 LYS 56 -13.491 3.377 -14.706 1148 HZ2 LYS 56 HZ2 LYS 56 -13.896 1.741 -14.558 1149 HZ3 LYS 56 HZ3 LYS 56 -13.688 2.453 -16.082 1150 H VAL 57 H VAL 57 -10.959 1.077 -8.681 1151 HA VAL 57 HA VAL 57 -8.517 -0.036 -7.840 1152 HB VAL 57 HB VAL 57 -11.015 0.642 -6.261 1153 HG11 VAL 57 HG11 VAL 57 -8.782 0.855 -4.626 1154 HG12 VAL 57 HG12 VAL 57 -8.599 -0.696 -5.444 1155 HG13 VAL 57 HG13 VAL 57 -10.085 -0.322 -4.555 1156 HG21 VAL 57 HG21 VAL 57 -10.371 2.767 -6.641 1157 HG22 VAL 57 HG22 VAL 57 -8.903 2.275 -7.470 1158 HG23 VAL 57 HG23 VAL 57 -8.927 2.448 -5.713 1159 H MET 58 H MET 58 -11.843 -1.261 -7.554 1160 HA MET 58 HA MET 58 -10.977 -3.785 -6.485 1161 HB2 MET 58 HB3 MET 58 -13.338 -4.586 -7.217 1162 HB3 MET 58 HB2 MET 58 -13.237 -3.385 -5.938 1163 HG2 MET 58 HG3 MET 58 -13.520 -1.626 -7.796 1164 HG3 MET 58 HG2 MET 58 -13.960 -2.959 -8.846 1165 HE1 MET 58 HE1 MET 58 -15.761 -4.499 -8.586 1166 HE2 MET 58 HE2 MET 58 -17.112 -4.428 -7.464 1167 HE3 MET 58 HE3 MET 58 -15.543 -4.969 -6.889 1168 H LYS 59 H LYS 59 -11.661 -2.541 -9.665 1169 HA LYS 59 HA LYS 59 -11.596 -4.913 -11.141 1170 HB2 LYS 59 HB3 LYS 59 -12.176 -2.468 -11.907 1171 HB3 LYS 59 HB2 LYS 59 -10.432 -2.342 -12.217 1172 HG2 LYS 59 HG3 LYS 59 -11.412 -2.984 -14.219 1173 HG3 LYS 59 HG2 LYS 59 -10.753 -4.484 -13.587 1174 HD2 LYS 59 HD3 LYS 59 -12.790 -5.432 -13.433 1175 HD3 LYS 59 HD2 LYS 59 -13.447 -4.085 -12.524 1176 HE2 LYS 59 HE2 LYS 59 -13.256 -4.341 -15.538 1177 HE3 LYS 59 HE1 LYS 59 -14.703 -4.301 -14.525 1178 HZ1 LYS 59 HZ1 LYS 59 -12.827 -2.050 -15.060 1179 HZ2 LYS 59 HZ2 LYS 59 -14.066 -1.951 -13.870 1180 HZ3 LYS 59 HZ3 LYS 59 -14.435 -2.178 -15.475 1181 H GLU 60 H GLU 60 -8.976 -2.746 -10.122 1182 HA GLU 60 HA GLU 60 -6.871 -4.157 -11.400 1183 HB2 GLU 60 HB3 GLU 60 -6.637 -1.853 -10.458 1184 HB3 GLU 60 HB2 GLU 60 -6.783 -2.524 -8.842 1185 HG2 GLU 60 HG3 GLU 60 -4.747 -3.821 -9.110 1186 HG3 GLU 60 HG2 GLU 60 -4.587 -3.346 -10.791 1187 H LEU 61 H LEU 61 -8.420 -4.415 -8.277 1188 HA LEU 61 HA LEU 61 -6.866 -6.616 -7.368 1189 HB2 LEU 61 HB3 LEU 61 -9.409 -5.341 -6.449 1190 HB3 LEU 61 HB2 LEU 61 -9.022 -6.941 -5.852 1191 HG LEU 61 HG LEU 61 -8.172 -4.932 -4.479 1192 HD11 LEU 61 HD11 LEU 61 -6.177 -6.116 -3.808 1193 HD12 LEU 61 HD12 LEU 61 -6.114 -7.000 -5.318 1194 HD13 LEU 61 HD13 LEU 61 -7.428 -7.292 -4.176 1195 HD21 LEU 61 HD21 LEU 61 -7.228 -3.720 -6.532 1196 HD22 LEU 61 HD22 LEU 61 -5.940 -4.926 -6.573 1197 HD23 LEU 61 HD23 LEU 61 -6.099 -3.875 -5.202 1198 H ASP 62 H ASP 62 -9.721 -6.251 -9.311 1199 HA ASP 62 HA ASP 62 -10.584 -8.930 -9.320 1200 HB2 ASP 62 HB3 ASP 62 -11.876 -6.973 -10.249 1201 HB3 ASP 62 HB2 ASP 62 -10.797 -6.998 -11.635 1202 H GLU 63 H GLU 63 -8.180 -7.191 -11.236 1203 HA GLU 63 HA GLU 63 -7.463 -9.344 -12.995 1204 HB2 GLU 63 HB3 GLU 63 -5.744 -7.129 -11.829 1205 HB3 GLU 63 HB2 GLU 63 -5.257 -8.195 -13.125 1206 HG2 GLU 63 HG3 GLU 63 -7.175 -7.386 -14.508 1207 HG3 GLU 63 HG2 GLU 63 -7.588 -6.336 -13.147 1208 H ASN 64 H ASN 64 -6.465 -8.208 -9.879 1209 HA ASN 64 HA ASN 64 -4.556 -10.228 -9.256 1210 HB2 ASN 64 HB3 ASN 64 -4.591 -8.141 -8.033 1211 HB3 ASN 64 HB2 ASN 64 -6.209 -8.409 -7.480 1212 HD21 ASN 64 HD21 ASN 64 -2.907 -9.572 -7.081 1213 HD22 ASN 64 HD22 ASN 64 -3.203 -10.401 -5.644 1214 H GLY 65 H GLY 65 -7.838 -10.436 -9.801 1215 HA2 GLY 65 HA3 GLY 65 -8.596 -12.489 -7.923 1216 HA3 GLY 65 HA2 GLY 65 -9.410 -12.058 -9.419 1217 H ASP 66 H ASP 66 -6.147 -12.521 -9.998 1218 HA ASP 66 HA ASP 66 -6.426 -14.776 -11.633 1219 HB2 ASP 66 HB3 ASP 66 -4.541 -13.078 -11.618 1220 HB3 ASP 66 HB2 ASP 66 -3.930 -13.910 -10.190 1221 H GLY 67 H GLY 67 -5.426 -14.358 -8.294 1222 HA2 GLY 67 HA3 GLY 67 -6.042 -17.159 -7.712 1223 HA3 GLY 67 HA2 GLY 67 -4.409 -16.608 -7.357 1224 H GLU 68 H GLU 68 -4.120 -14.859 -5.867 1225 HA GLU 68 HA GLU 68 -6.363 -14.260 -4.051 1226 HB2 GLU 68 HB3 GLU 68 -3.663 -15.375 -3.323 1227 HB3 GLU 68 HB2 GLU 68 -4.713 -14.634 -2.139 1228 HG2 GLU 68 HG3 GLU 68 -6.470 -16.283 -2.605 1229 HG3 GLU 68 HG2 GLU 68 -5.519 -17.000 -3.892 1230 H VAL 69 H VAL 69 -5.542 -12.575 -2.406 1231 HA VAL 69 HA VAL 69 -3.873 -10.698 -3.874 1232 HB VAL 69 HB VAL 69 -5.820 -9.467 -3.649 1233 HG11 VAL 69 HG11 VAL 69 -7.302 -9.495 -1.720 1234 HG12 VAL 69 HG12 VAL 69 -6.261 -10.646 -0.907 1235 HG13 VAL 69 HG13 VAL 69 -7.104 -11.109 -2.383 1236 HG21 VAL 69 HG21 VAL 69 -4.333 -8.905 -1.050 1237 HG22 VAL 69 HG22 VAL 69 -5.556 -7.859 -1.753 1238 HG23 VAL 69 HG23 VAL 69 -4.051 -8.134 -2.609 1239 H ASP 70 H ASP 70 -1.953 -10.325 -3.041 1240 HA ASP 70 HA ASP 70 -1.312 -11.435 -0.431 1241 HB2 ASP 70 HB3 ASP 70 0.354 -12.187 -1.702 1242 HB3 ASP 70 HB2 ASP 70 0.171 -10.940 -2.906 1243 H PHE 71 H PHE 71 0.607 -10.014 0.672 1244 HA PHE 71 HA PHE 71 -0.774 -7.852 1.771 1245 HB2 PHE 71 HB3 PHE 71 1.039 -9.036 2.946 1246 HB3 PHE 71 HB2 PHE 71 2.211 -8.292 1.857 1247 HD1 PHE 71 HD1 PHE 71 -0.651 -7.332 4.067 1248 HD2 PHE 71 HD2 PHE 71 3.197 -6.196 2.509 1249 HE1 PHE 71 HE1 PHE 71 -0.677 -5.310 5.462 1250 HE2 PHE 71 HE2 PHE 71 3.153 -4.171 3.931 1251 HZ PHE 71 HZ PHE 71 1.250 -3.721 5.389 1252 H GLN 72 H GLN 72 1.812 -7.921 -0.633 1253 HA GLN 72 HA GLN 72 2.113 -5.117 -0.947 1254 HB2 GLN 72 HB3 GLN 72 2.613 -7.479 -2.755 1255 HB3 GLN 72 HB2 GLN 72 2.990 -5.816 -3.263 1256 HG2 GLN 72 HG3 GLN 72 4.484 -5.646 -1.310 1257 HG3 GLN 72 HG2 GLN 72 3.992 -7.272 -0.832 1258 HE21 GLN 72 HE21 GLN 72 6.275 -5.583 -2.744 1259 HE22 GLN 72 HE22 GLN 72 6.859 -6.918 -3.611 1260 H GLU 73 H GLU 73 0.073 -7.527 -2.397 1261 HA GLU 73 HA GLU 73 -1.272 -5.865 -4.267 1262 HB2 GLU 73 HB3 GLU 73 -2.027 -8.530 -3.022 1263 HB3 GLU 73 HB2 GLU 73 -2.825 -7.801 -4.397 1264 HG2 GLU 73 HG3 GLU 73 -0.862 -7.844 -5.759 1265 HG3 GLU 73 HG2 GLU 73 0.168 -8.257 -4.405 1266 H TYR 74 H TYR 74 -1.907 -6.880 -0.958 1267 HA TYR 74 HA TYR 74 -4.476 -5.754 -0.605 1268 HB2 TYR 74 HB3 TYR 74 -3.719 -7.374 0.966 1269 HB3 TYR 74 HB2 TYR 74 -2.274 -6.448 1.330 1270 HD1 TYR 74 HD1 TYR 74 -6.014 -5.665 1.262 1271 HD2 TYR 74 HD2 TYR 74 -2.303 -5.532 3.469 1272 HE1 TYR 74 HE1 TYR 74 -7.157 -4.573 3.131 1273 HE2 TYR 74 HE2 TYR 74 -3.492 -4.429 5.355 1274 HH TYR 74 HH TYR 74 -6.724 -3.226 5.087 1275 H VAL 75 H VAL 75 -1.237 -4.344 0.008 1276 HA VAL 75 HA VAL 75 -2.302 -2.031 1.173 1277 HB VAL 75 HB VAL 75 -0.095 -1.013 0.954 1278 HG11 VAL 75 HG11 VAL 75 0.886 -2.350 2.532 1279 HG12 VAL 75 HG12 VAL 75 0.535 -3.846 1.674 1280 HG13 VAL 75 HG13 VAL 75 -0.731 -3.031 2.582 1281 HG21 VAL 75 HG21 VAL 75 0.298 -2.163 -1.394 1282 HG22 VAL 75 HG22 VAL 75 0.892 -3.509 -0.429 1283 HG23 VAL 75 HG23 VAL 75 1.657 -1.929 -0.314 1284 H VAL 76 H VAL 76 -1.461 -2.777 -2.169 1285 HA VAL 76 HA VAL 76 -1.831 -0.140 -3.091 1286 HB VAL 76 HB VAL 76 -2.019 -1.092 -5.321 1287 HG11 VAL 76 HG11 VAL 76 0.213 -0.711 -4.328 1288 HG12 VAL 76 HG12 VAL 76 0.235 -2.096 -5.404 1289 HG13 VAL 76 HG13 VAL 76 0.207 -2.346 -3.662 1290 HG21 VAL 76 HG21 VAL 76 -2.008 -3.417 -5.749 1291 HG22 VAL 76 HG22 VAL 76 -3.236 -3.210 -4.508 1292 HG23 VAL 76 HG23 VAL 76 -1.618 -3.805 -4.081 1293 H LEU 77 H LEU 77 -4.072 -2.827 -2.631 1294 HA LEU 77 HA LEU 77 -6.274 -1.692 -3.986 1295 HB2 LEU 77 HB3 LEU 77 -6.322 -4.026 -3.260 1296 HB3 LEU 77 HB2 LEU 77 -6.182 -3.510 -1.586 1297 HG LEU 77 HG LEU 77 -8.366 -2.365 -1.707 1298 HD11 LEU 77 HD11 LEU 77 -8.990 -1.639 -3.620 1299 HD12 LEU 77 HD12 LEU 77 -9.625 -3.240 -3.975 1300 HD13 LEU 77 HD13 LEU 77 -8.038 -2.759 -4.587 1301 HD21 LEU 77 HD21 LEU 77 -8.823 -4.434 -0.945 1302 HD22 LEU 77 HD22 LEU 77 -8.112 -5.279 -2.331 1303 HD23 LEU 77 HD23 LEU 77 -9.713 -4.536 -2.454 1304 H VAL 78 H VAL 78 -5.325 -1.533 -0.579 1305 HA VAL 78 HA VAL 78 -7.427 0.275 0.027 1306 HB VAL 78 HB VAL 78 -6.330 0.592 2.210 1307 HG11 VAL 78 HG11 VAL 78 -7.393 -1.322 2.744 1308 HG12 VAL 78 HG12 VAL 78 -6.015 -2.270 2.185 1309 HG13 VAL 78 HG13 VAL 78 -7.305 -1.852 1.068 1310 HG21 VAL 78 HG21 VAL 78 -4.214 -1.288 1.125 1311 HG22 VAL 78 HG22 VAL 78 -4.270 -0.602 2.739 1312 HG23 VAL 78 HG23 VAL 78 -3.928 0.439 1.366 1313 H ALA 79 H ALA 79 -4.028 0.673 -0.778 1314 HA ALA 79 HA ALA 79 -3.940 3.478 -0.446 1315 HB1 ALA 79 HB1 ALA 79 -2.415 1.762 -2.393 1316 HB2 ALA 79 HB2 ALA 79 -1.904 2.161 -0.739 1317 HB3 ALA 79 HB3 ALA 79 -2.013 3.421 -1.962 1318 H ALA 80 H ALA 80 -4.880 1.379 -3.129 1319 HA ALA 80 HA ALA 80 -5.012 3.233 -5.072 1320 HB1 ALA 80 HB1 ALA 80 -6.888 1.748 -6.047 1321 HB2 ALA 80 HB2 ALA 80 -6.638 0.758 -4.594 1322 HB3 ALA 80 HB3 ALA 80 -5.334 0.988 -5.719 1323 H LEU 81 H LEU 81 -7.592 2.242 -2.792 1324 HA LEU 81 HA LEU 81 -9.556 4.171 -3.587 1325 HB2 LEU 81 HB3 LEU 81 -9.119 2.724 -0.959 1326 HB3 LEU 81 HB2 LEU 81 -10.472 3.799 -1.252 1327 HG LEU 81 HG LEU 81 -9.874 1.369 -2.973 1328 HD11 LEU 81 HD11 LEU 81 -10.966 1.460 -0.328 1329 HD12 LEU 81 HD12 LEU 81 -10.809 0.086 -1.419 1330 HD13 LEU 81 HD13 LEU 81 -12.266 1.061 -1.453 1331 HD21 LEU 81 HD21 LEU 81 -12.322 1.733 -3.565 1332 HD22 LEU 81 HD22 LEU 81 -11.221 2.948 -4.198 1333 HD23 LEU 81 HD23 LEU 81 -12.209 3.300 -2.774 1334 H THR 82 H THR 82 -6.966 4.116 -1.211 1335 HA THR 82 HA THR 82 -7.555 6.550 0.029 1336 HB THR 82 HB THR 82 -4.761 5.465 -0.321 1337 HG1 THR 82 HG2 THR 82 -6.310 3.789 0.377 1338 HG21 THR 82 HG21 THR 82 -5.307 6.327 2.315 1339 HG22 THR 82 HG22 THR 82 -5.962 7.565 1.253 1340 HG23 THR 82 HG23 THR 82 -4.273 7.096 1.124 1341 H VAL 83 H VAL 83 -5.261 5.843 -2.628 1342 HA VAL 83 HA VAL 83 -4.485 8.532 -2.976 1343 HB VAL 83 HB VAL 83 -3.174 6.599 -3.824 1344 HG11 VAL 83 HG11 VAL 83 -5.232 6.443 -6.028 1345 HG12 VAL 83 HG12 VAL 83 -5.044 5.296 -4.698 1346 HG13 VAL 83 HG13 VAL 83 -3.751 5.499 -5.878 1347 HG21 VAL 83 HG21 VAL 83 -2.731 8.864 -4.737 1348 HG22 VAL 83 HG22 VAL 83 -3.935 8.582 -6.003 1349 HG23 VAL 83 HG23 VAL 83 -2.471 7.605 -5.944 1350 H ALA 84 H ALA 84 -6.980 6.575 -4.532 1351 HA ALA 84 HA ALA 84 -7.871 8.475 -6.399 1352 HB1 ALA 84 HB1 ALA 84 -9.524 6.393 -4.933 1353 HB2 ALA 84 HB2 ALA 84 -8.612 6.110 -6.410 1354 HB3 ALA 84 HB3 ALA 84 -9.979 7.219 -6.421 1355 H MET 85 H MET 85 -9.000 7.797 -3.090 1356 HA MET 85 HA MET 85 -10.819 9.976 -3.032 1357 HB2 MET 85 HB3 MET 85 -11.008 7.990 -1.544 1358 HB3 MET 85 HB2 MET 85 -9.566 8.543 -0.691 1359 HG2 MET 85 HG3 MET 85 -10.726 10.680 -0.133 1360 HG3 MET 85 HG2 MET 85 -12.161 10.089 -0.955 1361 HE1 MET 85 HE1 MET 85 -11.871 11.134 2.045 1362 HE2 MET 85 HE2 MET 85 -12.946 10.039 2.906 1363 HE3 MET 85 HE3 MET 85 -13.433 10.675 1.344 1364 H ASN 86 H ASN 86 -7.475 9.553 -1.967 1365 HA ASN 86 HA ASN 86 -7.186 11.915 -0.533 1366 HB2 ASN 86 HB3 ASN 86 -5.215 10.252 -2.061 1367 HB3 ASN 86 HB2 ASN 86 -4.714 11.773 -1.359 1368 HD21 ASN 86 HD21 ASN 86 -6.218 11.744 1.148 1369 HD22 ASN 86 HD22 ASN 86 -5.652 10.421 2.018 1370 H ASN 87 H ASN 87 -7.213 11.400 -3.936 1371 HA ASN 87 HA ASN 87 -6.188 13.934 -4.695 1372 HB2 ASN 87 HB3 ASN 87 -6.539 12.080 -6.320 1373 HB3 ASN 87 HB2 ASN 87 -8.279 12.253 -6.067 1374 HD21 ASN 87 HD21 ASN 87 -8.662 12.888 -8.291 1375 HD22 ASN 87 HD22 ASN 87 -8.187 14.407 -8.869 1376 H PHE 88 H PHE 88 -9.406 12.787 -3.814 1377 HA PHE 88 HA PHE 88 -10.727 15.322 -4.180 1378 HB2 PHE 88 HB3 PHE 88 -11.505 12.824 -2.659 1379 HB3 PHE 88 HB2 PHE 88 -12.526 14.243 -2.810 1380 HD1 PHE 88 HD1 PHE 88 -13.292 15.005 -5.107 1381 HD2 PHE 88 HD2 PHE 88 -11.258 11.268 -4.479 1382 HE1 PHE 88 HE1 PHE 88 -14.057 14.210 -7.310 1383 HE2 PHE 88 HE2 PHE 88 -12.027 10.476 -6.676 1384 HZ PHE 88 HZ PHE 88 -13.433 11.940 -8.107 1385 H PHE 89 H PHE 89 -9.350 13.560 -1.457 1386 HA PHE 89 HA PHE 89 -10.022 14.609 0.864 1387 HB2 PHE 89 HB3 PHE 89 -7.347 13.963 -0.154 1388 HB3 PHE 89 HB2 PHE 89 -7.351 15.079 1.176 1389 HD1 PHE 89 HD2 PHE 89 -9.260 11.974 0.234 1390 HD2 PHE 89 HD1 PHE 89 -7.173 14.180 3.235 1391 HE1 PHE 89 HE2 PHE 89 -9.625 10.118 1.835 1392 HE2 PHE 89 HE1 PHE 89 -7.524 12.320 4.860 1393 HZ PHE 89 HZ PHE 89 -8.742 10.298 4.161 1394 H TRP 90 H TRP 90 -7.642 16.383 -0.999 1395 HA TRP 90 HA TRP 90 -7.857 18.654 0.754 1396 HB2 TRP 90 HB3 TRP 90 -6.376 18.907 -1.823 1397 HB3 TRP 90 HB2 TRP 90 -5.918 19.378 -0.195 1398 HD1 TRP 90 HD TRP 90 -5.646 16.581 -2.646 1399 HE1 TRP 90 HE1 TRP 90 -4.306 14.654 -1.644 1400 HE3 TRP 90 HE3 TRP 90 -5.426 18.129 2.211 1401 HZ2 TRP 90 HZ2 TRP 90 -3.258 13.848 0.921 1402 HZ3 TRP 90 HZ3 TRP 90 -4.265 16.769 3.906 1403 HH2 TRP 90 HH TRP 90 -3.179 14.630 3.278 1404 H GLU 91 H GLU 91 -8.346 18.217 -2.707 1405 HA GLU 91 HA GLU 91 -9.321 20.821 -3.186 1406 HB2 GLU 91 HB3 GLU 91 -9.455 18.294 -4.733 1407 HB3 GLU 91 HB2 GLU 91 -9.949 19.851 -5.412 1408 HG2 GLU 91 HG3 GLU 91 -7.695 20.786 -4.913 1409 HG3 GLU 91 HG2 GLU 91 -7.210 19.235 -4.253 1410 H ASN 92 H ASN 92 -11.005 17.714 -2.821 1411 HA ASN 92 HA ASN 92 -13.545 19.219 -2.599 1412 HB2 ASN 92 HB3 ASN 92 -13.030 16.684 -4.132 1413 HB3 ASN 92 HB2 ASN 92 -14.631 17.336 -3.817 1414 HD21 ASN 92 HD21 ASN 92 -11.877 17.592 -5.936 1415 HD22 ASN 92 HD22 ASN 92 -12.425 18.927 -6.815 1416 H SER 93 H SER 93 -13.742 19.033 -0.460 1417 HA SER 93 HA SER 93 -14.832 16.767 0.700 1418 HB2 SER 93 HB3 SER 93 -11.879 16.896 0.752 1419 HB3 SER 93 HB2 SER 93 -12.655 16.385 2.249 1420 HG SER 93 HG SER 93 -13.108 15.408 -0.368 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -11.361 5.841 8.710 2 HA2 GLY 1 HA3 GLY 1 -12.982 4.887 10.752 3 HA3 GLY 1 HA2 GLY 1 -12.301 3.963 9.416 4 H SER 2 H SER 2 -11.162 2.278 9.997 5 HA SER 2 HA SER 2 -10.051 1.891 12.603 6 HB2 SER 2 HB3 SER 2 -9.302 0.391 10.099 7 HB3 SER 2 HB2 SER 2 -9.296 -0.143 11.763 8 HG SER 2 HG SER 2 -11.031 -0.843 10.442 9 H GLU 3 H GLU 3 -7.678 1.330 12.792 10 HA GLU 3 HA GLU 3 -6.039 3.531 12.274 11 HB2 GLU 3 HB3 GLU 3 -5.258 0.603 12.582 12 HB3 GLU 3 HB2 GLU 3 -4.212 1.994 12.760 13 HG2 GLU 3 HG3 GLU 3 -4.756 1.568 14.953 14 HG3 GLU 3 HG2 GLU 3 -5.924 2.812 14.513 15 H LEU 4 H LEU 4 -7.128 0.893 10.425 16 HA LEU 4 HA LEU 4 -5.202 0.626 8.499 17 HB2 LEU 4 HB3 LEU 4 -7.428 -0.720 8.977 18 HB3 LEU 4 HB2 LEU 4 -8.130 0.431 7.916 19 HG LEU 4 HG LEU 4 -7.177 -0.385 6.014 20 HD11 LEU 4 HD11 LEU 4 -4.815 0.018 6.500 21 HD12 LEU 4 HD12 LEU 4 -5.000 -1.654 6.018 22 HD13 LEU 4 HD13 LEU 4 -4.804 -1.278 7.717 23 HD21 LEU 4 HD21 LEU 4 -6.464 -2.935 7.156 24 HD22 LEU 4 HD22 LEU 4 -7.830 -2.560 6.115 25 HD23 LEU 4 HD23 LEU 4 -7.947 -2.350 7.873 26 H GLU 5 H GLU 5 -8.110 2.747 8.561 27 HA GLU 5 HA GLU 5 -7.542 3.902 6.023 28 HB2 GLU 5 HB3 GLU 5 -9.294 4.899 8.300 29 HB3 GLU 5 HB2 GLU 5 -9.159 5.705 6.740 30 HG2 GLU 5 HG3 GLU 5 -9.905 3.580 5.626 31 HG3 GLU 5 HG2 GLU 5 -10.115 2.861 7.203 32 H THR 6 H THR 6 -6.948 4.841 9.351 33 HA THR 6 HA THR 6 -5.725 7.302 8.803 34 HB THR 6 HB THR 6 -5.231 5.549 11.211 35 HG1 THR 6 HG2 THR 6 -7.214 6.040 11.843 36 HG21 THR 6 HG21 THR 6 -4.307 7.378 12.119 37 HG22 THR 6 HG22 THR 6 -5.598 8.428 11.568 38 HG23 THR 6 HG23 THR 6 -4.248 8.067 10.506 39 H ALA 7 H ALA 7 -4.313 4.052 9.287 40 HA ALA 7 HA ALA 7 -1.635 4.813 9.253 41 HB1 ALA 7 HB1 ALA 7 -3.075 2.277 8.574 42 HB2 ALA 7 HB2 ALA 7 -1.852 2.585 9.801 43 HB3 ALA 7 HB3 ALA 7 -1.383 2.436 8.108 44 H MET 8 H MET 8 -3.813 4.063 6.565 45 HA MET 8 HA MET 8 -1.861 4.308 4.531 46 HB2 MET 8 HB3 MET 8 -4.851 4.783 4.405 47 HB3 MET 8 HB2 MET 8 -3.801 4.635 3.000 48 HG2 MET 8 HG3 MET 8 -4.281 2.492 5.103 49 HG3 MET 8 HG2 MET 8 -4.865 2.471 3.446 50 HE1 MET 8 HE1 MET 8 -1.841 3.237 1.635 51 HE2 MET 8 HE2 MET 8 -3.561 2.868 1.596 52 HE3 MET 8 HE3 MET 8 -2.387 1.594 1.239 53 H GLU 9 H GLU 9 -4.071 6.631 6.032 54 HA GLU 9 HA GLU 9 -3.262 8.889 4.504 55 HB2 GLU 9 HB3 GLU 9 -4.487 8.668 7.270 56 HB3 GLU 9 HB2 GLU 9 -4.171 10.193 6.451 57 HG2 GLU 9 HG3 GLU 9 -5.841 7.965 5.258 58 HG3 GLU 9 HG2 GLU 9 -6.496 9.358 6.107 59 H THR 10 H THR 10 -2.090 7.368 7.424 60 HA THR 10 HA THR 10 -0.174 9.307 8.143 61 HB THR 10 HB THR 10 0.200 6.312 8.494 62 HG1 THR 10 HG2 THR 10 -1.993 7.236 9.107 63 HG21 THR 10 HG21 THR 10 2.050 7.819 9.195 64 HG22 THR 10 HG22 THR 10 1.297 7.009 10.558 65 HG23 THR 10 HG23 THR 10 0.923 8.695 10.228 66 H LEU 11 H LEU 11 -0.103 6.500 5.989 67 HA LEU 11 HA LEU 11 2.588 6.875 5.084 68 HB2 LEU 11 HB3 LEU 11 0.261 5.488 3.718 69 HB3 LEU 11 HB2 LEU 11 1.934 5.419 3.174 70 HG LEU 11 HG LEU 11 0.802 4.344 5.773 71 HD11 LEU 11 HD11 LEU 11 0.549 2.957 3.696 72 HD12 LEU 11 HD12 LEU 11 1.467 2.226 5.025 73 HD13 LEU 11 HD13 LEU 11 2.321 2.892 3.644 74 HD21 LEU 11 HD21 LEU 11 2.971 5.270 6.358 75 HD22 LEU 11 HD22 LEU 11 3.686 4.598 4.872 76 HD23 LEU 11 HD23 LEU 11 3.132 3.531 6.156 77 H ILE 12 H ILE 12 -0.536 8.101 4.005 78 HA ILE 12 HA ILE 12 0.458 9.381 1.680 79 HB ILE 12 HB ILE 12 -1.869 10.186 3.466 80 HG12 ILE 12 HG13 ILE 12 -2.028 7.956 2.170 81 HG13 ILE 12 HG12 ILE 12 -3.285 9.125 1.832 82 HG21 ILE 12 HG21 ILE 12 -2.200 11.244 0.865 83 HG22 ILE 12 HG22 ILE 12 -0.575 11.626 1.321 84 HG23 ILE 12 HG23 ILE 12 -1.902 12.128 2.353 85 HD11 ILE 12 HD11 ILE 12 -0.865 9.321 0.072 86 HD12 ILE 12 HD12 ILE 12 -2.574 9.493 -0.305 87 HD13 ILE 12 HD13 ILE 12 -1.893 7.899 -0.095 88 H ASN 13 H ASN 13 0.135 10.427 5.036 89 HA ASN 13 HA ASN 13 0.941 13.076 4.622 90 HB2 ASN 13 HB3 ASN 13 1.044 11.304 7.051 91 HB3 ASN 13 HB2 ASN 13 1.722 12.921 7.092 92 HD21 ASN 13 HD21 ASN 13 -1.311 11.146 6.851 93 HD22 ASN 13 HD22 ASN 13 -2.306 12.510 6.990 94 H VAL 14 H VAL 14 2.898 10.187 5.235 95 HA VAL 14 HA VAL 14 5.389 11.552 5.288 96 HB VAL 14 HB VAL 14 4.712 8.719 4.434 97 HG11 VAL 14 HG11 VAL 14 6.829 8.629 3.708 98 HG12 VAL 14 HG12 VAL 14 7.333 8.796 5.375 99 HG13 VAL 14 HG13 VAL 14 7.218 10.219 4.351 100 HG21 VAL 14 HG21 VAL 14 5.986 8.482 6.819 101 HG22 VAL 14 HG22 VAL 14 4.242 8.623 6.705 102 HG23 VAL 14 HG23 VAL 14 5.218 10.043 7.076 103 H PHE 15 H PHE 15 3.517 10.009 2.735 104 HA PHE 15 HA PHE 15 5.184 10.579 0.499 105 HB2 PHE 15 HB3 PHE 15 3.259 8.978 0.552 106 HB3 PHE 15 HB2 PHE 15 2.161 10.350 0.592 107 HD1 PHE 15 HD2 PHE 15 2.008 11.898 -1.344 108 HD2 PHE 15 HD1 PHE 15 4.402 8.333 -1.485 109 HE1 PHE 15 HE2 PHE 15 2.103 12.067 -3.806 110 HE2 PHE 15 HE1 PHE 15 4.500 8.498 -3.946 111 HZ PHE 15 HZ PHE 15 3.354 10.359 -5.119 112 H HIS 16 H HIS 16 2.448 12.277 1.895 113 HA HIS 16 HA HIS 16 2.194 14.401 0.100 114 HB2 HIS 16 HB3 HIS 16 0.640 13.645 2.010 115 HB3 HIS 16 HB2 HIS 16 1.634 14.662 3.050 116 HD1 HIS 16 HD1 HIS 16 1.928 16.702 0.328 117 HD2 HIS 16 HD2 HIS 16 -1.478 15.542 2.458 118 HE1 HIS 16 HE1 HIS 16 0.140 18.408 -0.172 119 HE2 HIS 16 HE2 HIS 16 -1.930 17.729 1.145 120 H ALA 17 H ALA 17 4.137 14.123 3.013 121 HA ALA 17 HA ALA 17 5.083 16.758 3.144 122 HB1 ALA 17 HB1 ALA 17 5.369 14.928 4.873 123 HB2 ALA 17 HB2 ALA 17 6.785 15.931 4.588 124 HB3 ALA 17 HB3 ALA 17 6.702 14.314 3.899 125 H HIS 18 H HIS 18 6.487 13.928 1.532 126 HA HIS 18 HA HIS 18 8.725 15.339 0.523 127 HB2 HIS 18 HB3 HIS 18 7.522 12.693 -0.253 128 HB3 HIS 18 HB2 HIS 18 8.990 13.328 -0.997 129 HD1 HIS 18 HD1 HIS 18 11.070 13.836 0.739 130 HD2 HIS 18 HD2 HIS 18 7.917 11.515 2.253 131 HE1 HIS 18 HE1 HIS 18 11.897 12.757 2.865 132 HE2 HIS 18 HE2 HIS 18 9.997 11.362 3.800 133 H SER 19 H SER 19 5.552 14.636 -0.956 134 HA SER 19 HA SER 19 6.139 15.551 -3.550 135 HB2 SER 19 HB3 SER 19 3.570 15.878 -1.988 136 HB3 SER 19 HB2 SER 19 3.715 16.073 -3.722 137 HG SER 19 HG SER 19 4.640 13.847 -3.620 138 H GLY 20 H GLY 20 5.258 17.302 -0.623 139 HA2 GLY 20 HA3 GLY 20 5.141 19.907 -1.771 140 HA3 GLY 20 HA2 GLY 20 5.460 19.543 -0.075 141 H LYS 21 H LYS 21 7.759 17.950 -0.425 142 HA LYS 21 HA LYS 21 9.762 19.966 -0.516 143 HB2 LYS 21 HB3 LYS 21 10.022 16.942 -0.629 144 HB3 LYS 21 HB2 LYS 21 11.343 18.063 -0.405 145 HG2 LYS 21 HG3 LYS 21 8.950 17.939 1.457 146 HG3 LYS 21 HG2 LYS 21 10.474 17.113 1.752 147 HD2 LYS 21 HD3 LYS 21 11.657 19.295 1.668 148 HD3 LYS 21 HD2 LYS 21 10.102 20.109 1.441 149 HE2 LYS 21 HE2 LYS 21 9.300 19.332 3.586 150 HE3 LYS 21 HE1 LYS 21 10.737 18.338 3.813 151 HZ1 LYS 21 HZ1 LYS 21 10.419 20.916 4.647 152 HZ2 LYS 21 HZ2 LYS 21 11.414 21.077 3.286 153 HZ3 LYS 21 HZ3 LYS 21 11.843 20.028 4.562 154 H GLU 22 H GLU 22 8.861 17.389 -2.803 155 HA GLU 22 HA GLU 22 10.823 18.231 -4.699 156 HB2 GLU 22 HB3 GLU 22 8.439 16.319 -5.127 157 HB3 GLU 22 HB2 GLU 22 9.693 16.691 -6.256 158 HG2 GLU 22 HG3 GLU 22 11.400 15.820 -4.850 159 HG3 GLU 22 HG2 GLU 22 10.258 15.694 -3.507 160 H GLY 23 H GLY 23 7.416 18.949 -4.251 161 HA2 GLY 23 HA3 GLY 23 6.844 21.265 -4.664 162 HA3 GLY 23 HA2 GLY 23 7.786 21.212 -6.135 163 H ASP 24 H ASP 24 6.312 18.340 -6.273 164 HA ASP 24 HA ASP 24 4.337 19.281 -8.142 165 HB2 ASP 24 HB3 ASP 24 5.485 16.997 -8.279 166 HB3 ASP 24 HB2 ASP 24 4.419 16.503 -6.979 167 H LYS 25 H LYS 25 2.039 18.955 -7.995 168 HA LYS 25 HA LYS 25 0.894 19.892 -5.548 169 HB2 LYS 25 HB3 LYS 25 -0.481 18.273 -7.642 170 HB3 LYS 25 HB2 LYS 25 -1.231 19.388 -6.495 171 HG2 LYS 25 HG3 LYS 25 0.488 21.040 -7.536 172 HG3 LYS 25 HG2 LYS 25 0.367 19.978 -8.947 173 HD2 LYS 25 HD3 LYS 25 -1.914 21.480 -7.566 174 HD3 LYS 25 HD2 LYS 25 -1.294 21.784 -9.172 175 HE2 LYS 25 HE2 LYS 25 -2.438 20.066 -10.120 176 HE3 LYS 25 HE1 LYS 25 -2.155 18.967 -8.776 177 HZ1 LYS 25 HZ1 LYS 25 -4.276 19.347 -8.245 178 HZ2 LYS 25 HZ2 LYS 25 -4.434 20.689 -9.258 179 HZ3 LYS 25 HZ3 LYS 25 -3.817 20.862 -7.722 180 H TYR 26 H TYR 26 1.129 16.754 -7.094 181 HA TYR 26 HA TYR 26 1.404 15.581 -4.618 182 HB2 TYR 26 HB3 TYR 26 -0.697 13.897 -5.481 183 HB3 TYR 26 HB2 TYR 26 -0.704 14.939 -4.079 184 HD1 TYR 26 HD2 TYR 26 -1.523 14.724 -7.674 185 HD2 TYR 26 HD1 TYR 26 -1.962 17.042 -4.082 186 HE1 TYR 26 HE2 TYR 26 -3.212 16.119 -8.784 187 HE2 TYR 26 HE1 TYR 26 -3.671 18.433 -5.200 188 HH TYR 26 HH TYR 26 -5.371 18.039 -7.255 189 H LYS 27 H LYS 27 3.229 14.721 -5.369 190 HA LYS 27 HA LYS 27 3.106 12.271 -6.739 191 HB2 LYS 27 HB3 LYS 27 4.362 14.610 -8.171 192 HB3 LYS 27 HB2 LYS 27 5.058 13.004 -8.345 193 HG2 LYS 27 HG3 LYS 27 2.253 13.865 -9.071 194 HG3 LYS 27 HG2 LYS 27 3.561 13.406 -10.148 195 HD2 LYS 27 HD3 LYS 27 3.376 11.195 -8.421 196 HD3 LYS 27 HD2 LYS 27 1.699 11.624 -8.699 197 HE2 LYS 27 HE2 LYS 27 3.716 10.533 -10.579 198 HE3 LYS 27 HE1 LYS 27 2.007 10.253 -10.521 199 HZ1 LYS 27 HZ1 LYS 27 2.107 11.549 -12.382 200 HZ2 LYS 27 HZ2 LYS 27 3.481 12.401 -11.885 201 HZ3 LYS 27 HZ3 LYS 27 1.955 12.788 -11.256 202 H LEU 28 H LEU 28 5.190 11.157 -6.596 203 HA LEU 28 HA LEU 28 7.073 12.477 -4.788 204 HB2 LEU 28 HB3 LEU 28 5.831 10.816 -3.492 205 HB3 LEU 28 HB2 LEU 28 6.190 9.575 -4.695 206 HG LEU 28 HG LEU 28 8.658 10.009 -4.248 207 HD11 LEU 28 HD11 LEU 28 7.390 11.876 -2.280 208 HD12 LEU 28 HD12 LEU 28 8.816 12.110 -3.306 209 HD13 LEU 28 HD13 LEU 28 8.921 11.102 -1.873 210 HD21 LEU 28 HD21 LEU 28 6.959 9.171 -1.867 211 HD22 LEU 28 HD22 LEU 28 8.668 8.846 -2.092 212 HD23 LEU 28 HD23 LEU 28 7.487 8.104 -3.179 213 H SER 29 H SER 29 9.122 12.372 -5.501 214 HA SER 29 HA SER 29 9.520 10.884 -7.975 215 HB2 SER 29 HB3 SER 29 11.236 13.093 -6.906 216 HB3 SER 29 HB2 SER 29 11.241 12.455 -8.534 217 HG SER 29 HG SER 29 9.298 13.871 -7.103 218 H LYS 30 H LYS 30 11.963 10.240 -8.200 219 HA LYS 30 HA LYS 30 12.402 8.415 -5.999 220 HB2 LYS 30 HB3 LYS 30 14.250 8.823 -8.319 221 HB3 LYS 30 HB2 LYS 30 14.020 7.388 -7.353 222 HG2 LYS 30 HG3 LYS 30 12.238 8.566 -9.438 223 HG3 LYS 30 HG2 LYS 30 12.850 6.903 -9.342 224 HD2 LYS 30 HD3 LYS 30 11.092 7.601 -7.026 225 HD3 LYS 30 HD2 LYS 30 10.288 7.792 -8.567 226 HE2 LYS 30 HE2 LYS 30 11.858 5.282 -8.162 227 HE3 LYS 30 HE1 LYS 30 10.377 5.472 -7.261 228 HZ1 LYS 30 HZ1 LYS 30 10.143 6.099 -10.162 229 HZ2 LYS 30 HZ2 LYS 30 9.089 5.255 -9.121 230 HZ3 LYS 30 HZ3 LYS 30 10.484 4.518 -9.691 231 H LYS 31 H LYS 31 13.219 11.520 -6.405 232 HA LYS 31 HA LYS 31 15.869 11.535 -5.279 233 HB2 LYS 31 HB3 LYS 31 14.657 13.926 -4.432 234 HB3 LYS 31 HB2 LYS 31 15.654 13.714 -5.862 235 HG2 LYS 31 HG3 LYS 31 13.553 13.215 -7.223 236 HG3 LYS 31 HG2 LYS 31 12.682 13.378 -5.675 237 HD2 LYS 31 HD3 LYS 31 13.187 15.662 -5.555 238 HD3 LYS 31 HD2 LYS 31 14.300 15.598 -6.908 239 HE2 LYS 31 HE2 LYS 31 12.267 14.682 -8.275 240 HE3 LYS 31 HE1 LYS 31 11.282 15.290 -6.961 241 HZ1 LYS 31 HZ1 LYS 31 12.355 17.506 -7.292 242 HZ2 LYS 31 HZ2 LYS 31 11.485 16.956 -8.663 243 HZ3 LYS 31 HZ3 LYS 31 13.141 16.881 -8.644 244 H GLU 32 H GLU 32 12.777 12.523 -3.834 245 HA GLU 32 HA GLU 32 13.627 12.290 -1.148 246 HB2 GLU 32 HB3 GLU 32 10.889 12.351 -2.413 247 HB3 GLU 32 HB2 GLU 32 11.187 12.482 -0.686 248 HG2 GLU 32 HG3 GLU 32 12.259 14.371 -2.801 249 HG3 GLU 32 HG2 GLU 32 10.874 14.694 -1.772 250 H LEU 33 H LEU 33 11.746 10.190 -3.317 251 HA LEU 33 HA LEU 33 10.862 8.393 -1.401 252 HB2 LEU 33 HB3 LEU 33 9.962 8.456 -3.684 253 HB3 LEU 33 HB2 LEU 33 11.455 7.825 -4.324 254 HG LEU 33 HG LEU 33 9.549 6.158 -3.980 255 HD11 LEU 33 HD11 LEU 33 12.277 5.821 -3.970 256 HD12 LEU 33 HD12 LEU 33 11.085 4.533 -4.033 257 HD13 LEU 33 HD13 LEU 33 11.782 4.993 -2.492 258 HD21 LEU 33 HD21 LEU 33 9.273 5.218 -1.760 259 HD22 LEU 33 HD22 LEU 33 8.949 6.944 -1.658 260 HD23 LEU 33 HD23 LEU 33 10.478 6.297 -1.076 261 H LYS 34 H LYS 34 13.803 8.223 -3.381 262 HA LYS 34 HA LYS 34 14.621 5.737 -2.316 263 HB2 LYS 34 HB3 LYS 34 16.209 7.950 -3.644 264 HB3 LYS 34 HB2 LYS 34 16.906 6.391 -3.198 265 HG2 LYS 34 HG3 LYS 34 15.225 5.212 -4.605 266 HG3 LYS 34 HG2 LYS 34 14.496 6.745 -5.027 267 HD2 LYS 34 HD3 LYS 34 15.857 6.380 -6.876 268 HD3 LYS 34 HD2 LYS 34 16.909 7.364 -5.868 269 HE2 LYS 34 HE2 LYS 34 18.223 5.523 -5.207 270 HE3 LYS 34 HE1 LYS 34 16.985 4.347 -5.629 271 HZ1 LYS 34 HZ1 LYS 34 18.631 5.936 -7.557 272 HZ2 LYS 34 HZ2 LYS 34 17.353 4.903 -8.014 273 HZ3 LYS 34 HZ3 LYS 34 18.700 4.295 -7.234 274 H GLU 35 H GLU 35 15.168 9.071 -1.276 275 HA GLU 35 HA GLU 35 16.883 8.377 0.936 276 HB2 GLU 35 HB3 GLU 35 15.144 10.793 0.422 277 HB3 GLU 35 HB2 GLU 35 16.182 10.622 1.823 278 HG2 GLU 35 HG3 GLU 35 18.155 10.410 0.367 279 HG3 GLU 35 HG2 GLU 35 17.087 10.536 -1.046 280 H LEU 36 H LEU 36 13.446 9.188 0.637 281 HA LEU 36 HA LEU 36 12.889 8.844 3.338 282 HB2 LEU 36 HB3 LEU 36 10.915 9.680 2.826 283 HB3 LEU 36 HB2 LEU 36 11.461 9.842 1.175 284 HG LEU 36 HG LEU 36 10.597 7.377 0.895 285 HD11 LEU 36 HD11 LEU 36 9.485 6.395 2.575 286 HD12 LEU 36 HD12 LEU 36 8.555 7.832 2.943 287 HD13 LEU 36 HD13 LEU 36 10.161 7.620 3.626 288 HD21 LEU 36 HD21 LEU 36 9.508 9.663 0.161 289 HD22 LEU 36 HD22 LEU 36 8.368 9.308 1.469 290 HD23 LEU 36 HD23 LEU 36 8.549 8.186 0.147 291 H LEU 37 H LEU 37 12.531 6.515 0.716 292 HA LEU 37 HA LEU 37 11.191 4.656 2.299 293 HB2 LEU 37 HB3 LEU 37 11.292 4.434 -0.163 294 HB3 LEU 37 HB2 LEU 37 13.010 4.111 -0.074 295 HG LEU 37 HG LEU 37 11.418 2.084 -0.308 296 HD11 LEU 37 HD11 LEU 37 13.040 1.527 2.087 297 HD12 LEU 37 HD12 LEU 37 13.928 2.318 0.775 298 HD13 LEU 37 HD13 LEU 37 13.091 0.807 0.486 299 HD21 LEU 37 HD21 LEU 37 11.173 2.343 2.682 300 HD22 LEU 37 HD22 LEU 37 10.290 1.298 1.597 301 HD23 LEU 37 HD23 LEU 37 9.929 3.024 1.629 302 H GLN 38 H GLN 38 14.651 4.956 1.652 303 HA GLN 38 HA GLN 38 15.390 2.840 3.411 304 HB2 GLN 38 HB3 GLN 38 17.669 3.690 3.251 305 HB3 GLN 38 HB2 GLN 38 16.942 3.631 1.652 306 HG2 GLN 38 HG3 GLN 38 16.329 6.086 1.974 307 HG3 GLN 38 HG2 GLN 38 17.378 6.094 3.383 308 HE21 GLN 38 HE21 GLN 38 17.282 5.978 -0.091 309 HE22 GLN 38 HE22 GLN 38 18.954 6.147 -0.352 310 H THR 39 H THR 39 15.107 6.334 3.785 311 HA THR 39 HA THR 39 16.078 6.481 6.406 312 HB THR 39 HB THR 39 14.230 8.294 4.865 313 HG1 THR 39 HG2 THR 39 16.049 8.289 3.879 314 HG21 THR 39 HG21 THR 39 15.334 8.441 7.618 315 HG22 THR 39 HG22 THR 39 13.888 9.144 6.897 316 HG23 THR 39 HG23 THR 39 15.438 9.914 6.644 317 H GLU 40 H GLU 40 12.707 6.271 5.202 318 HA GLU 40 HA GLU 40 11.703 6.347 7.887 319 HB2 GLU 40 HB3 GLU 40 10.276 5.811 5.279 320 HB3 GLU 40 HB2 GLU 40 9.481 6.080 6.835 321 HG2 GLU 40 HG3 GLU 40 11.285 8.077 5.391 322 HG3 GLU 40 HG2 GLU 40 9.539 8.159 5.556 323 H LEU 41 H LEU 41 12.234 3.763 5.519 324 HA LEU 41 HA LEU 41 11.170 1.789 7.459 325 HB2 LEU 41 HB3 LEU 41 11.769 1.607 4.500 326 HB3 LEU 41 HB2 LEU 41 11.550 0.199 5.495 327 HG LEU 41 HG LEU 41 9.352 1.067 6.298 328 HD11 LEU 41 HD11 LEU 41 9.302 3.334 6.012 329 HD12 LEU 41 HD12 LEU 41 8.414 2.849 4.574 330 HD13 LEU 41 HD13 LEU 41 10.131 3.282 4.458 331 HD21 LEU 41 HD21 LEU 41 8.249 0.073 4.554 332 HD22 LEU 41 HD22 LEU 41 9.855 -0.369 4.028 333 HD23 LEU 41 HD23 LEU 41 9.046 1.041 3.331 334 H SER 42 H SER 42 13.670 3.152 7.863 335 HA SER 42 HA SER 42 15.934 1.804 7.078 336 HB2 SER 42 HB3 SER 42 15.401 2.994 9.802 337 HB3 SER 42 HB2 SER 42 16.967 2.706 9.088 338 HG SER 42 HG SER 42 15.703 4.040 7.256 339 H GLY 43 H GLY 43 13.658 0.969 9.670 340 HA2 GLY 43 HA3 GLY 43 15.194 -1.169 10.729 341 HA3 GLY 43 HA2 GLY 43 13.474 -0.888 10.988 342 H PHE 44 H PHE 44 12.493 -1.021 8.454 343 HA PHE 44 HA PHE 44 12.424 -3.857 8.008 344 HB2 PHE 44 HB3 PHE 44 11.139 -1.525 6.680 345 HB3 PHE 44 HB2 PHE 44 11.294 -2.972 5.708 346 HD1 PHE 44 HD2 PHE 44 10.894 -5.181 7.556 347 HD2 PHE 44 HD1 PHE 44 8.943 -1.368 7.448 348 HE1 PHE 44 HE2 PHE 44 8.948 -6.154 8.716 349 HE2 PHE 44 HE1 PHE 44 6.985 -2.330 8.610 350 HZ PHE 44 HZ PHE 44 6.978 -4.723 9.250 351 H LEU 45 H LEU 45 13.887 -1.126 6.434 352 HA LEU 45 HA LEU 45 15.093 -2.482 4.261 353 HB2 LEU 45 HB3 LEU 45 14.926 -0.088 4.299 354 HB3 LEU 45 HB2 LEU 45 15.850 0.005 5.794 355 HG LEU 45 HG LEU 45 17.742 -0.923 4.753 356 HD11 LEU 45 HD11 LEU 45 17.045 -2.382 3.001 357 HD12 LEU 45 HD12 LEU 45 17.596 -1.014 2.061 358 HD13 LEU 45 HD13 LEU 45 15.866 -1.223 2.384 359 HD21 LEU 45 HD21 LEU 45 18.448 1.018 3.708 360 HD22 LEU 45 HD22 LEU 45 16.969 1.608 4.439 361 HD23 LEU 45 HD23 LEU 45 17.001 1.161 2.725 362 H ASP 46 H ASP 46 16.323 -1.806 7.519 363 HA ASP 46 HA ASP 46 18.746 -3.236 7.088 364 HB2 ASP 46 HB3 ASP 46 18.628 -1.682 8.865 365 HB3 ASP 46 HB2 ASP 46 17.290 -2.554 9.639 366 H ALA 47 H ALA 47 15.596 -4.139 8.406 367 HA ALA 47 HA ALA 47 16.250 -6.683 9.338 368 HB1 ALA 47 HB1 ALA 47 13.646 -6.913 8.378 369 HB2 ALA 47 HB2 ALA 47 13.809 -5.216 8.789 370 HB3 ALA 47 HB3 ALA 47 14.134 -6.455 10.006 371 H GLN 48 H GLN 48 14.981 -5.755 6.162 372 HA GLN 48 HA GLN 48 15.688 -8.458 5.209 373 HB2 GLN 48 HB3 GLN 48 14.132 -7.603 3.169 374 HB3 GLN 48 HB2 GLN 48 13.543 -8.436 4.596 375 HG2 GLN 48 HG3 GLN 48 12.110 -6.638 4.388 376 HG3 GLN 48 HG2 GLN 48 13.192 -6.052 5.640 377 HE21 GLN 48 HE21 GLN 48 15.348 -5.011 4.222 378 HE22 GLN 48 HE22 GLN 48 14.804 -3.883 3.083 379 H LYS 49 H LYS 49 17.384 -5.899 5.393 380 HA LYS 49 HA LYS 49 18.076 -5.026 2.826 381 HB2 LYS 49 HB3 LYS 49 19.040 -4.302 5.186 382 HB3 LYS 49 HB2 LYS 49 20.196 -5.584 4.882 383 HG2 LYS 49 HG3 LYS 49 20.804 -4.531 2.716 384 HG3 LYS 49 HG2 LYS 49 19.621 -3.290 3.038 385 HD2 LYS 49 HD3 LYS 49 20.777 -2.429 4.933 386 HD3 LYS 49 HD2 LYS 49 21.883 -3.793 4.980 387 HE2 LYS 49 HE2 LYS 49 22.865 -1.698 3.969 388 HE3 LYS 49 HE1 LYS 49 22.950 -3.119 2.943 389 HZ1 LYS 49 HZ1 LYS 49 21.216 -2.339 1.593 390 HZ2 LYS 49 HZ2 LYS 49 22.179 -0.996 1.900 391 HZ3 LYS 49 HZ3 LYS 49 20.715 -1.151 2.701 392 H ASP 50 H ASP 50 19.094 -7.772 4.698 393 HA ASP 50 HA ASP 50 21.055 -8.884 3.029 394 HB2 ASP 50 HB3 ASP 50 20.752 -9.549 5.367 395 HB3 ASP 50 HB2 ASP 50 19.183 -10.236 4.963 396 H VAL 51 H VAL 51 17.584 -8.905 2.788 397 HA VAL 51 HA VAL 51 17.306 -11.282 1.289 398 HB VAL 51 HB VAL 51 15.518 -8.833 1.344 399 HG11 VAL 51 HG11 VAL 51 13.760 -10.399 0.639 400 HG12 VAL 51 HG12 VAL 51 14.934 -11.699 0.550 401 HG13 VAL 51 HG13 VAL 51 15.033 -10.338 -0.579 402 HG21 VAL 51 HG21 VAL 51 16.007 -10.051 3.599 403 HG22 VAL 51 HG22 VAL 51 15.178 -11.424 2.876 404 HG23 VAL 51 HG23 VAL 51 14.319 -9.922 3.112 405 H ASP 52 H ASP 52 18.419 -8.134 0.546 406 HA ASP 52 HA ASP 52 19.241 -7.145 -1.328 407 HB2 ASP 52 HB3 ASP 52 20.653 -8.916 -1.830 408 HB3 ASP 52 HB2 ASP 52 19.339 -10.022 -2.193 409 H ALA 53 H ALA 53 16.630 -9.410 -2.048 410 HA ALA 53 HA ALA 53 15.755 -8.330 -4.419 411 HB1 ALA 53 HB1 ALA 53 13.915 -9.300 -2.203 412 HB2 ALA 53 HB2 ALA 53 14.770 -10.365 -3.324 413 HB3 ALA 53 HB3 ALA 53 13.566 -9.235 -3.924 414 H VAL 54 H VAL 54 15.590 -7.118 -1.239 415 HA VAL 54 HA VAL 54 13.587 -5.149 -1.490 416 HB VAL 54 HB VAL 54 14.625 -4.107 0.470 417 HG11 VAL 54 HG11 VAL 54 14.676 -6.163 1.924 418 HG12 VAL 54 HG12 VAL 54 14.495 -7.148 0.483 419 HG13 VAL 54 HG13 VAL 54 13.219 -6.015 0.949 420 HG21 VAL 54 HG21 VAL 54 16.648 -5.191 1.437 421 HG22 VAL 54 HG22 VAL 54 17.005 -4.312 -0.027 422 HG23 VAL 54 HG23 VAL 54 16.905 -6.081 -0.048 423 H ASP 55 H ASP 55 17.070 -5.023 -2.085 424 HA ASP 55 HA ASP 55 17.250 -2.271 -2.886 425 HB2 ASP 55 HB3 ASP 55 19.271 -3.588 -2.491 426 HB3 ASP 55 HB2 ASP 55 18.808 -4.698 -3.785 427 H LYS 56 H LYS 56 16.748 -5.260 -4.513 428 HA LYS 56 HA LYS 56 16.441 -4.255 -7.103 429 HB2 LYS 56 HB3 LYS 56 15.585 -6.856 -5.831 430 HB3 LYS 56 HB2 LYS 56 15.479 -6.526 -7.558 431 HG2 LYS 56 HG3 LYS 56 17.872 -6.027 -7.706 432 HG3 LYS 56 HG2 LYS 56 18.041 -6.220 -5.967 433 HD2 LYS 56 HD3 LYS 56 17.560 -8.539 -6.096 434 HD3 LYS 56 HD2 LYS 56 17.155 -8.465 -7.819 435 HE2 LYS 56 HE2 LYS 56 19.514 -9.304 -7.223 436 HE3 LYS 56 HE1 LYS 56 19.417 -8.019 -8.426 437 HZ1 LYS 56 HZ1 LYS 56 20.048 -6.404 -6.765 438 HZ2 LYS 56 HZ2 LYS 56 21.122 -7.677 -6.700 439 HZ3 LYS 56 HZ3 LYS 56 19.960 -7.543 -5.501 440 H VAL 57 H VAL 57 14.147 -4.728 -4.484 441 HA VAL 57 HA VAL 57 11.779 -4.121 -5.968 442 HB VAL 57 HB VAL 57 12.394 -3.631 -3.025 443 HG11 VAL 57 HG11 VAL 57 9.645 -3.870 -4.208 444 HG12 VAL 57 HG12 VAL 57 10.449 -2.311 -4.194 445 HG13 VAL 57 HG13 VAL 57 10.133 -3.157 -2.680 446 HG21 VAL 57 HG21 VAL 57 10.458 -5.699 -3.612 447 HG22 VAL 57 HG22 VAL 57 11.921 -5.807 -2.675 448 HG23 VAL 57 HG23 VAL 57 11.978 -6.079 -4.425 449 H MET 58 H MET 58 14.122 -2.179 -4.137 450 HA MET 58 HA MET 58 12.973 0.396 -4.597 451 HB2 MET 58 HB3 MET 58 15.901 -0.379 -4.293 452 HB3 MET 58 HB2 MET 58 15.260 1.246 -4.184 453 HG2 MET 58 HG3 MET 58 13.821 0.558 -2.433 454 HG3 MET 58 HG2 MET 58 14.488 -1.057 -2.393 455 HE1 MET 58 HE1 MET 58 15.712 0.433 0.797 456 HE2 MET 58 HE2 MET 58 16.281 -1.092 0.159 457 HE3 MET 58 HE3 MET 58 14.599 -0.622 -0.101 458 H LYS 59 H LYS 59 15.231 -1.596 -6.249 459 HA LYS 59 HA LYS 59 15.962 0.073 -8.371 460 HB2 LYS 59 HB3 LYS 59 16.935 -2.073 -7.463 461 HB3 LYS 59 HB2 LYS 59 15.770 -2.925 -8.490 462 HG2 LYS 59 HG3 LYS 59 17.796 -2.754 -9.749 463 HG3 LYS 59 HG2 LYS 59 16.703 -1.565 -10.451 464 HD2 LYS 59 HD3 LYS 59 17.872 0.255 -9.475 465 HD3 LYS 59 HD2 LYS 59 18.555 -0.741 -8.205 466 HE2 LYS 59 HE2 LYS 59 20.126 -0.011 -10.080 467 HE3 LYS 59 HE1 LYS 59 20.139 -1.703 -9.606 468 HZ1 LYS 59 HZ1 LYS 59 18.330 -0.870 -11.811 469 HZ2 LYS 59 HZ2 LYS 59 19.107 -2.352 -11.544 470 HZ3 LYS 59 HZ3 LYS 59 19.974 -1.039 -12.094 471 H GLU 60 H GLU 60 13.367 -2.267 -7.893 472 HA GLU 60 HA GLU 60 12.207 -2.272 -10.512 473 HB2 GLU 60 HB3 GLU 60 11.620 -3.875 -8.607 474 HB3 GLU 60 HB2 GLU 60 10.750 -2.557 -7.853 475 HG2 GLU 60 HG3 GLU 60 9.087 -3.737 -9.024 476 HG3 GLU 60 HG2 GLU 60 9.416 -2.358 -10.045 477 H LEU 61 H LEU 61 11.644 -0.364 -7.613 478 HA LEU 61 HA LEU 61 9.782 1.484 -8.767 479 HB2 LEU 61 HB3 LEU 61 11.465 1.481 -6.282 480 HB3 LEU 61 HB2 LEU 61 10.704 2.975 -6.794 481 HG LEU 61 HG LEU 61 9.393 1.477 -5.150 482 HD11 LEU 61 HD11 LEU 61 7.301 2.071 -6.084 483 HD12 LEU 61 HD12 LEU 61 7.962 2.231 -7.716 484 HD13 LEU 61 HD13 LEU 61 8.416 3.376 -6.454 485 HD21 LEU 61 HD21 LEU 61 8.819 -0.085 -7.717 486 HD22 LEU 61 HD22 LEU 61 8.092 -0.334 -6.155 487 HD23 LEU 61 HD23 LEU 61 9.802 -0.672 -6.376 488 H ASP 62 H ASP 62 13.254 1.354 -8.446 489 HA ASP 62 HA ASP 62 13.869 3.962 -9.244 490 HB2 ASP 62 HB3 ASP 62 15.485 2.275 -8.246 491 HB3 ASP 62 HB2 ASP 62 15.574 1.549 -9.847 492 H GLU 63 H GLU 63 13.185 1.100 -11.172 493 HA GLU 63 HA GLU 63 13.986 2.017 -13.738 494 HB2 GLU 63 HB3 GLU 63 11.482 0.452 -13.004 495 HB3 GLU 63 HB2 GLU 63 12.145 0.626 -14.609 496 HG2 GLU 63 HG3 GLU 63 14.247 -0.478 -13.921 497 HG3 GLU 63 HG2 GLU 63 13.593 -0.642 -12.293 498 H ASN 64 H ASN 64 11.040 2.543 -11.955 499 HA ASN 64 HA ASN 64 10.101 4.440 -13.927 500 HB2 ASN 64 HB3 ASN 64 8.656 2.905 -12.401 501 HB3 ASN 64 HB2 ASN 64 8.835 4.187 -11.210 502 HD21 ASN 64 HD21 ASN 64 6.299 3.753 -12.212 503 HD22 ASN 64 HD22 ASN 64 5.830 4.994 -13.255 504 H GLY 65 H GLY 65 12.650 5.023 -12.879 505 HA2 GLY 65 HA3 GLY 65 12.195 7.327 -11.138 506 HA3 GLY 65 HA2 GLY 65 13.785 6.665 -11.575 507 H ASP 66 H ASP 66 12.164 6.524 -14.303 508 HA ASP 66 HA ASP 66 13.282 8.813 -15.591 509 HB2 ASP 66 HB3 ASP 66 11.080 6.895 -16.258 510 HB3 ASP 66 HB2 ASP 66 11.528 8.206 -17.356 511 H GLY 67 H GLY 67 10.189 7.925 -14.271 512 HA2 GLY 67 HA3 GLY 67 9.262 10.718 -14.452 513 HA3 GLY 67 HA2 GLY 67 8.214 9.305 -14.486 514 H GLU 68 H GLU 68 7.105 10.193 -12.754 515 HA GLU 68 HA GLU 68 8.425 10.443 -10.136 516 HB2 GLU 68 HB3 GLU 68 5.528 10.721 -10.821 517 HB3 GLU 68 HB2 GLU 68 6.291 11.340 -9.360 518 HG2 GLU 68 HG3 GLU 68 6.528 13.287 -10.513 519 HG3 GLU 68 HG2 GLU 68 7.786 12.495 -11.432 520 H VAL 69 H VAL 69 7.182 9.487 -8.237 521 HA VAL 69 HA VAL 69 6.093 6.823 -8.836 522 HB VAL 69 HB VAL 69 8.224 6.389 -7.851 523 HG11 VAL 69 HG11 VAL 69 8.803 8.597 -7.019 524 HG12 VAL 69 HG12 VAL 69 8.932 7.450 -5.690 525 HG13 VAL 69 HG13 VAL 69 7.532 8.505 -5.806 526 HG21 VAL 69 HG21 VAL 69 5.917 6.170 -5.891 527 HG22 VAL 69 HG22 VAL 69 7.524 5.689 -5.407 528 HG23 VAL 69 HG23 VAL 69 6.763 4.917 -6.794 529 H ASP 70 H ASP 70 4.089 6.594 -8.069 530 HA ASP 70 HA ASP 70 3.003 8.829 -6.531 531 HB2 ASP 70 HB3 ASP 70 0.993 8.449 -7.513 532 HB3 ASP 70 HB2 ASP 70 2.013 7.757 -8.758 533 H PHE 71 H PHE 71 0.948 7.941 -5.281 534 HA PHE 71 HA PHE 71 1.987 6.805 -2.931 535 HB2 PHE 71 HB3 PHE 71 -0.063 8.272 -3.078 536 HB3 PHE 71 HB2 PHE 71 -0.932 6.892 -3.730 537 HD1 PHE 71 HD1 PHE 71 1.389 7.692 -0.898 538 HD2 PHE 71 HD2 PHE 71 -2.128 5.547 -2.171 539 HE1 PHE 71 HE1 PHE 71 1.023 6.908 1.415 540 HE2 PHE 71 HE2 PHE 71 -2.481 4.779 0.158 541 HZ PHE 71 HZ PHE 71 -0.916 5.448 1.941 542 H GLN 72 H GLN 72 0.082 5.494 -5.618 543 HA GLN 72 HA GLN 72 -0.340 2.926 -4.583 544 HB2 GLN 72 HB3 GLN 72 -0.296 4.021 -7.380 545 HB3 GLN 72 HB2 GLN 72 -0.621 2.304 -7.081 546 HG2 GLN 72 HG3 GLN 72 -2.524 2.994 -5.619 547 HG3 GLN 72 HG2 GLN 72 -2.116 4.674 -5.950 548 HE21 GLN 72 HE21 GLN 72 -3.953 1.997 -7.162 549 HE22 GLN 72 HE22 GLN 72 -4.330 2.699 -8.650 550 H GLU 73 H GLU 73 2.383 4.217 -6.527 551 HA GLU 73 HA GLU 73 3.781 1.683 -6.499 552 HB2 GLU 73 HB3 GLU 73 4.751 4.481 -7.073 553 HB3 GLU 73 HB2 GLU 73 5.841 3.104 -7.002 554 HG2 GLU 73 HG3 GLU 73 4.575 1.981 -8.734 555 HG3 GLU 73 HG2 GLU 73 3.447 3.340 -8.844 556 H TYR 74 H TYR 74 3.793 4.586 -4.549 557 HA TYR 74 HA TYR 74 5.974 3.986 -2.928 558 HB2 TYR 74 HB3 TYR 74 4.998 6.201 -2.977 559 HB3 TYR 74 HB2 TYR 74 3.498 5.567 -2.312 560 HD1 TYR 74 HD1 TYR 74 7.155 5.336 -1.439 561 HD2 TYR 74 HD2 TYR 74 3.153 6.073 -0.055 562 HE1 TYR 74 HE1 TYR 74 8.011 5.702 0.855 563 HE2 TYR 74 HE2 TYR 74 4.021 6.451 2.238 564 HH TYR 74 HH TYR 74 6.553 5.458 3.420 565 H VAL 75 H VAL 75 2.529 3.277 -2.347 566 HA VAL 75 HA VAL 75 2.994 2.053 0.136 567 HB VAL 75 HB VAL 75 0.735 0.992 -0.160 568 HG11 VAL 75 HG11 VAL 75 0.956 3.986 -0.657 569 HG12 VAL 75 HG12 VAL 75 1.024 3.195 0.918 570 HG13 VAL 75 HG13 VAL 75 -0.456 3.144 -0.035 571 HG21 VAL 75 HG21 VAL 75 1.235 1.680 -2.912 572 HG22 VAL 75 HG22 VAL 75 -0.100 2.639 -2.378 573 HG23 VAL 75 HG23 VAL 75 -0.164 0.872 -2.229 574 H VAL 76 H VAL 76 2.817 0.593 -3.126 575 HA VAL 76 HA VAL 76 3.079 -2.035 -2.141 576 HB VAL 76 HB VAL 76 2.190 -1.581 -4.392 577 HG11 VAL 76 HG11 VAL 76 5.041 -0.765 -5.033 578 HG12 VAL 76 HG12 VAL 76 3.602 0.264 -5.062 579 HG13 VAL 76 HG13 VAL 76 3.768 -1.040 -6.219 580 HG21 VAL 76 HG21 VAL 76 4.753 -3.186 -4.629 581 HG22 VAL 76 HG22 VAL 76 3.231 -3.465 -5.462 582 HG23 VAL 76 HG23 VAL 76 3.358 -3.776 -3.731 583 H LEU 77 H LEU 77 5.370 0.445 -3.108 584 HA LEU 77 HA LEU 77 7.716 -1.102 -3.098 585 HB2 LEU 77 HB3 LEU 77 7.717 1.155 -3.946 586 HB3 LEU 77 HB2 LEU 77 7.272 1.801 -2.375 587 HG LEU 77 HG LEU 77 9.393 0.996 -1.399 588 HD11 LEU 77 HD11 LEU 77 11.129 0.352 -3.327 589 HD12 LEU 77 HD12 LEU 77 9.669 -0.289 -4.070 590 HD13 LEU 77 HD13 LEU 77 10.164 -0.829 -2.455 591 HD21 LEU 77 HD21 LEU 77 9.143 3.056 -3.429 592 HD22 LEU 77 HD22 LEU 77 10.760 2.368 -3.482 593 HD23 LEU 77 HD23 LEU 77 10.135 3.034 -1.977 594 H VAL 78 H VAL 78 6.187 0.757 -0.486 595 HA VAL 78 HA VAL 78 8.067 -0.219 1.423 596 HB VAL 78 HB VAL 78 6.619 0.797 3.134 597 HG11 VAL 78 HG11 VAL 78 6.450 3.071 1.428 598 HG12 VAL 78 HG12 VAL 78 7.824 2.158 0.858 599 HG13 VAL 78 HG13 VAL 78 7.743 2.680 2.549 600 HG21 VAL 78 HG21 VAL 78 4.850 1.736 0.895 601 HG22 VAL 78 HG22 VAL 78 4.554 1.834 2.628 602 HG23 VAL 78 HG23 VAL 78 4.416 0.284 1.812 603 H ALA 79 H ALA 79 4.835 -1.215 0.422 604 HA ALA 79 HA ALA 79 4.498 -3.171 2.426 605 HB1 ALA 79 HB1 ALA 79 2.850 -4.189 0.839 606 HB2 ALA 79 HB2 ALA 79 3.384 -3.029 -0.360 607 HB3 ALA 79 HB3 ALA 79 2.605 -2.465 1.129 608 H ALA 80 H ALA 80 5.913 -3.308 -0.815 609 HA ALA 80 HA ALA 80 6.326 -6.061 -0.961 610 HB1 ALA 80 HB1 ALA 80 8.154 -5.505 -2.542 611 HB2 ALA 80 HB2 ALA 80 8.036 -3.816 -2.064 612 HB3 ALA 80 HB3 ALA 80 6.686 -4.594 -2.886 613 H LEU 81 H LEU 81 8.404 -3.486 0.231 614 HA LEU 81 HA LEU 81 10.531 -5.113 1.152 615 HB2 LEU 81 HB3 LEU 81 9.557 -2.370 1.979 616 HB3 LEU 81 HB2 LEU 81 11.077 -3.065 2.513 617 HG LEU 81 HG LEU 81 10.351 -2.716 -0.426 618 HD11 LEU 81 HD11 LEU 81 10.566 -0.514 0.245 619 HD12 LEU 81 HD12 LEU 81 12.235 -0.903 -0.159 620 HD13 LEU 81 HD13 LEU 81 11.717 -0.885 1.530 621 HD21 LEU 81 HD21 LEU 81 12.020 -4.389 -0.211 622 HD22 LEU 81 HD22 LEU 81 12.855 -3.494 1.071 623 HD23 LEU 81 HD23 LEU 81 12.905 -2.910 -0.586 624 H THR 82 H THR 82 7.628 -3.805 2.711 625 HA THR 82 HA THR 82 8.141 -4.817 5.284 626 HB THR 82 HB THR 82 5.456 -4.236 4.041 627 HG1 THR 82 HG2 THR 82 6.851 -2.463 3.794 628 HG21 THR 82 HG21 THR 82 5.932 -5.343 6.489 629 HG22 THR 82 HG22 THR 82 4.579 -4.270 6.125 630 HG23 THR 82 HG23 THR 82 6.024 -3.621 6.871 631 H VAL 83 H VAL 83 6.116 -6.174 2.641 632 HA VAL 83 HA VAL 83 5.175 -8.322 4.166 633 HB VAL 83 HB VAL 83 4.146 -7.579 2.026 634 HG11 VAL 83 HG11 VAL 83 6.395 -9.064 0.653 635 HG12 VAL 83 HG12 VAL 83 6.201 -7.312 0.708 636 HG13 VAL 83 HG13 VAL 83 5.003 -8.304 -0.110 637 HG21 VAL 83 HG21 VAL 83 4.860 -10.514 2.311 638 HG22 VAL 83 HG22 VAL 83 3.715 -9.918 1.107 639 HG23 VAL 83 HG23 VAL 83 3.379 -9.697 2.815 640 H ALA 84 H ALA 84 7.997 -8.112 2.089 641 HA ALA 84 HA ALA 84 8.805 -10.778 2.169 642 HB1 ALA 84 HB1 ALA 84 11.172 -9.768 1.993 643 HB2 ALA 84 HB2 ALA 84 10.367 -8.202 2.010 644 HB3 ALA 84 HB3 ALA 84 10.016 -9.354 0.728 645 H MET 85 H MET 85 9.690 -8.130 4.386 646 HA MET 85 HA MET 85 11.068 -9.840 6.227 647 HB2 MET 85 HB3 MET 85 11.548 -7.427 6.126 648 HB3 MET 85 HB2 MET 85 9.922 -7.085 6.727 649 HG2 MET 85 HG3 MET 85 11.506 -7.017 8.593 650 HG3 MET 85 HG2 MET 85 10.445 -8.385 8.811 651 HE1 MET 85 HE1 MET 85 12.419 -9.725 10.497 652 HE2 MET 85 HE2 MET 85 12.778 -8.009 10.368 653 HE3 MET 85 HE3 MET 85 14.063 -9.179 10.147 654 H ASN 86 H ASN 86 7.793 -8.500 6.140 655 HA ASN 86 HA ASN 86 7.147 -9.313 8.726 656 HB2 ASN 86 HB3 ASN 86 5.701 -8.055 6.631 657 HB3 ASN 86 HB2 ASN 86 4.741 -9.411 7.208 658 HD21 ASN 86 HD21 ASN 86 5.920 -6.240 8.076 659 HD22 ASN 86 HD22 ASN 86 5.203 -6.209 9.615 660 H ASN 87 H ASN 87 7.084 -11.116 5.775 661 HA ASN 87 HA ASN 87 5.603 -13.347 6.666 662 HB2 ASN 87 HB3 ASN 87 6.265 -13.231 4.337 663 HB3 ASN 87 HB2 ASN 87 7.969 -13.187 4.779 664 HD21 ASN 87 HD21 ASN 87 5.472 -15.374 6.201 665 HD22 ASN 87 HD22 ASN 87 6.243 -16.778 5.643 666 H PHE 88 H PHE 88 8.971 -12.398 7.105 667 HA PHE 88 HA PHE 88 9.786 -14.662 8.609 668 HB2 PHE 88 HB3 PHE 88 11.473 -13.126 7.729 669 HB3 PHE 88 HB2 PHE 88 10.840 -11.804 8.699 670 HD1 PHE 88 HD2 PHE 88 12.457 -15.152 8.898 671 HD2 PHE 88 HD1 PHE 88 11.382 -11.559 10.997 672 HE1 PHE 88 HE2 PHE 88 13.842 -15.855 10.822 673 HE2 PHE 88 HE1 PHE 88 12.768 -12.268 12.924 674 HZ PHE 88 HZ PHE 88 13.994 -14.422 12.837 675 H PHE 89 H PHE 89 8.367 -11.545 9.513 676 HA PHE 89 HA PHE 89 8.340 -11.974 12.337 677 HB2 PHE 89 HB3 PHE 89 6.443 -10.340 10.613 678 HB3 PHE 89 HB2 PHE 89 6.436 -10.359 12.352 679 HD1 PHE 89 HD1 PHE 89 9.739 -10.637 12.346 680 HD2 PHE 89 HD2 PHE 89 6.834 -7.857 10.730 681 HE1 PHE 89 HE1 PHE 89 11.401 -8.862 12.403 682 HE2 PHE 89 HE2 PHE 89 8.547 -6.091 10.792 683 HZ PHE 89 HZ PHE 89 10.830 -6.580 11.623 684 H TRP 90 H TRP 90 5.981 -12.785 9.847 685 HA TRP 90 HA TRP 90 4.110 -13.866 11.738 686 HB2 TRP 90 HB3 TRP 90 4.297 -14.724 8.848 687 HB3 TRP 90 HB2 TRP 90 2.884 -14.682 9.894 688 HD1 TRP 90 HD TRP 90 4.295 -11.587 10.824 689 HE1 TRP 90 HE1 TRP 90 3.574 -9.656 9.444 690 HE3 TRP 90 HE3 TRP 90 2.334 -14.103 6.860 691 HZ2 TRP 90 HZ2 TRP 90 2.231 -9.153 6.879 692 HZ3 TRP 90 HZ3 TRP 90 1.329 -12.851 4.948 693 HH2 TRP 90 HH TRP 90 1.283 -10.391 4.969 694 H GLU 91 H GLU 91 6.635 -15.241 9.791 695 HA GLU 91 HA GLU 91 6.154 -17.927 10.758 696 HB2 GLU 91 HB3 GLU 91 8.553 -16.739 9.441 697 HB3 GLU 91 HB2 GLU 91 8.403 -18.463 9.795 698 HG2 GLU 91 HG3 GLU 91 6.243 -18.476 8.421 699 HG3 GLU 91 HG2 GLU 91 6.570 -16.816 8.018 700 H ASN 92 H ASN 92 8.531 -15.423 11.602 701 HA ASN 92 HA ASN 92 9.414 -17.018 13.892 702 HB2 ASN 92 HB3 ASN 92 11.138 -15.751 12.616 703 HB3 ASN 92 HB2 ASN 92 10.270 -14.267 12.961 704 HD21 ASN 92 HD21 ASN 92 12.239 -16.817 14.489 705 HD22 ASN 92 HD22 ASN 92 12.524 -15.947 15.909 706 H SER 93 H SER 93 7.795 -17.047 15.293 707 HA SER 93 HA SER 93 6.974 -14.498 16.453 708 HB2 SER 93 HB3 SER 93 5.352 -15.983 14.727 709 HB3 SER 93 HB2 SER 93 4.749 -16.401 16.326 710 HG SER 93 HG SER 93 5.328 -13.705 15.637 711 H1 GLY 1 H GLY 1 11.858 2.975 9.389 712 HA2 GLY 1 HA3 GLY 1 11.959 1.695 11.639 713 HA3 GLY 1 HA2 GLY 1 13.143 2.892 12.051 714 H SER 2 H SER 2 10.963 4.325 10.007 715 HA SER 2 HA SER 2 9.887 6.017 12.078 716 HB2 SER 2 HB3 SER 2 9.414 5.834 9.122 717 HB3 SER 2 HB2 SER 2 8.735 7.078 10.138 718 HG SER 2 HG SER 2 10.567 7.802 9.282 719 H GLU 3 H GLU 3 7.576 6.678 11.892 720 HA GLU 3 HA GLU 3 5.837 4.709 12.869 721 HB2 GLU 3 HB3 GLU 3 4.845 7.073 11.287 722 HB3 GLU 3 HB2 GLU 3 4.168 6.346 12.731 723 HG2 GLU 3 HG3 GLU 3 5.130 8.211 13.647 724 HG3 GLU 3 HG2 GLU 3 6.488 7.098 13.803 725 H LEU 4 H LEU 4 7.005 5.443 9.808 726 HA LEU 4 HA LEU 4 5.018 4.663 7.999 727 HB2 LEU 4 HB3 LEU 4 7.401 5.707 7.719 728 HB3 LEU 4 HB2 LEU 4 7.948 4.042 7.571 729 HG LEU 4 HG LEU 4 7.557 4.846 5.377 730 HD11 LEU 4 HD11 LEU 4 6.601 2.621 5.690 731 HD12 LEU 4 HD12 LEU 4 5.624 3.549 4.554 732 HD13 LEU 4 HD13 LEU 4 5.062 3.322 6.190 733 HD21 LEU 4 HD21 LEU 4 5.153 6.136 6.629 734 HD22 LEU 4 HD22 LEU 4 5.192 5.878 4.874 735 HD23 LEU 4 HD23 LEU 4 6.444 6.817 5.671 736 H GLU 5 H GLU 5 7.551 2.860 9.738 737 HA GLU 5 HA GLU 5 6.906 0.314 8.645 738 HB2 GLU 5 HB3 GLU 5 8.336 1.148 11.159 739 HB3 GLU 5 HB2 GLU 5 8.214 -0.530 10.675 740 HG2 GLU 5 HG3 GLU 5 9.295 0.077 8.480 741 HG3 GLU 5 HG2 GLU 5 9.490 1.704 9.077 742 H THR 6 H THR 6 5.976 2.042 11.589 743 HA THR 6 HA THR 6 4.390 -0.000 12.695 744 HB THR 6 HB THR 6 3.860 2.965 13.008 745 HG1 THR 6 HG2 THR 6 5.545 3.051 14.348 746 HG21 THR 6 HG21 THR 6 3.630 0.605 14.904 747 HG22 THR 6 HG22 THR 6 2.285 1.366 14.064 748 HG23 THR 6 HG23 THR 6 3.188 2.270 15.268 749 H ALA 7 H ALA 7 3.602 2.750 10.564 750 HA ALA 7 HA ALA 7 0.857 2.223 10.293 751 HB1 ALA 7 HB1 ALA 7 1.563 4.314 9.478 752 HB2 ALA 7 HB2 ALA 7 1.206 3.405 8.018 753 HB3 ALA 7 HB3 ALA 7 2.885 3.604 8.550 754 H MET 8 H MET 8 3.673 1.140 8.422 755 HA MET 8 HA MET 8 2.251 -0.444 6.541 756 HB2 MET 8 HB3 MET 8 5.080 -0.561 7.605 757 HB3 MET 8 HB2 MET 8 4.477 -1.726 6.430 758 HG2 MET 8 HG3 MET 8 3.792 0.973 5.552 759 HG3 MET 8 HG2 MET 8 5.502 0.840 5.921 760 HE1 MET 8 HE1 MET 8 3.146 -1.416 2.764 761 HE2 MET 8 HE2 MET 8 2.664 0.035 3.636 762 HE3 MET 8 HE3 MET 8 2.709 -1.509 4.481 763 H GLU 9 H GLU 9 3.694 -1.158 9.707 764 HA GLU 9 HA GLU 9 3.055 -3.878 9.775 765 HB2 GLU 9 HB3 GLU 9 3.351 -1.876 12.037 766 HB3 GLU 9 HB2 GLU 9 3.160 -3.607 12.251 767 HG2 GLU 9 HG3 GLU 9 5.319 -2.711 10.377 768 HG3 GLU 9 HG2 GLU 9 5.595 -2.502 12.103 769 H THR 10 H THR 10 1.259 -0.984 10.656 770 HA THR 10 HA THR 10 -0.963 -2.225 11.857 771 HB THR 10 HB THR 10 -1.122 0.317 10.201 772 HG1 THR 10 HG2 THR 10 0.704 0.156 11.837 773 HG21 THR 10 HG21 THR 10 -2.540 -0.521 12.741 774 HG22 THR 10 HG22 THR 10 -3.220 -0.686 11.119 775 HG23 THR 10 HG23 THR 10 -2.846 0.907 11.753 776 H LEU 11 H LEU 11 -0.269 -1.373 8.494 777 HA LEU 11 HA LEU 11 -2.656 -2.486 7.324 778 HB2 LEU 11 HB3 LEU 11 0.118 -1.870 6.317 779 HB3 LEU 11 HB2 LEU 11 -1.029 -2.723 5.301 780 HG LEU 11 HG LEU 11 -0.802 -0.076 5.229 781 HD11 LEU 11 HD11 LEU 11 -3.159 -1.860 4.855 782 HD12 LEU 11 HD12 LEU 11 -2.266 -0.879 3.697 783 HD13 LEU 11 HD13 LEU 11 -3.424 -0.114 4.781 784 HD21 LEU 11 HD21 LEU 11 -2.536 1.021 6.549 785 HD22 LEU 11 HD22 LEU 11 -1.330 0.317 7.613 786 HD23 LEU 11 HD23 LEU 11 -2.899 -0.448 7.437 787 H ILE 12 H ILE 12 0.530 -3.793 8.116 788 HA ILE 12 HA ILE 12 0.126 -6.350 7.001 789 HB ILE 12 HB ILE 12 1.852 -5.480 9.329 790 HG12 ILE 12 HG13 ILE 12 2.399 -4.605 6.963 791 HG13 ILE 12 HG12 ILE 12 3.683 -5.495 7.774 792 HG21 ILE 12 HG21 ILE 12 1.229 -8.163 8.353 793 HG22 ILE 12 HG22 ILE 12 1.995 -7.650 9.842 794 HG23 ILE 12 HG23 ILE 12 2.943 -7.806 8.376 795 HD11 ILE 12 HD11 ILE 12 3.424 -7.373 6.393 796 HD12 ILE 12 HD12 ILE 12 3.146 -6.057 5.302 797 HD13 ILE 12 HD13 ILE 12 1.776 -6.968 5.920 798 H ASN 13 H ASN 13 -0.481 -5.079 10.231 799 HA ASN 13 HA ASN 13 -1.108 -7.483 11.487 800 HB2 ASN 13 HB3 ASN 13 -2.083 -4.673 12.002 801 HB3 ASN 13 HB2 ASN 13 -2.623 -6.028 12.960 802 HD21 ASN 13 HD21 ASN 13 0.218 -4.060 12.241 803 HD22 ASN 13 HD22 ASN 13 1.184 -4.688 13.473 804 H VAL 14 H VAL 14 -3.292 -5.273 9.751 805 HA VAL 14 HA VAL 14 -5.605 -6.863 10.165 806 HB VAL 14 HB VAL 14 -4.983 -4.877 7.968 807 HG11 VAL 14 HG11 VAL 14 -6.768 -6.263 7.167 808 HG12 VAL 14 HG12 VAL 14 -7.540 -4.821 7.819 809 HG13 VAL 14 HG13 VAL 14 -7.530 -6.302 8.756 810 HG21 VAL 14 HG21 VAL 14 -6.510 -4.658 10.590 811 HG22 VAL 14 HG22 VAL 14 -6.455 -3.393 9.374 812 HG23 VAL 14 HG23 VAL 14 -4.987 -3.857 10.220 813 H PHE 15 H PHE 15 -3.294 -6.681 7.489 814 HA PHE 15 HA PHE 15 -4.446 -8.712 5.876 815 HB2 PHE 15 HB3 PHE 15 -2.640 -7.161 5.126 816 HB3 PHE 15 HB2 PHE 15 -1.512 -7.999 6.178 817 HD1 PHE 15 HD2 PHE 15 -0.897 -10.401 5.740 818 HD2 PHE 15 HD1 PHE 15 -3.373 -8.154 3.024 819 HE1 PHE 15 HE2 PHE 15 -0.529 -12.095 3.992 820 HE2 PHE 15 HE1 PHE 15 -2.988 -9.859 1.277 821 HZ PHE 15 HZ PHE 15 -1.567 -11.833 1.762 822 H HIS 16 H HIS 16 -1.935 -8.784 8.347 823 HA HIS 16 HA HIS 16 -1.339 -11.505 8.276 824 HB2 HIS 16 HB3 HIS 16 -0.019 -9.681 9.378 825 HB3 HIS 16 HB2 HIS 16 -1.202 -9.674 10.682 826 HD1 HIS 16 HD1 HIS 16 -0.543 -13.081 9.371 827 HD2 HIS 16 HD2 HIS 16 1.119 -10.528 12.236 828 HE1 HIS 16 HE1 HIS 16 0.968 -14.503 10.799 829 HE2 HIS 16 HE2 HIS 16 1.997 -12.966 12.571 830 H ALA 17 H ALA 17 -3.611 -9.660 10.321 831 HA ALA 17 HA ALA 17 -4.574 -11.780 11.881 832 HB1 ALA 17 HB1 ALA 17 -5.933 -9.250 10.926 833 HB2 ALA 17 HB2 ALA 17 -5.179 -9.538 12.494 834 HB3 ALA 17 HB3 ALA 17 -6.666 -10.375 12.062 835 H HIS 18 H HIS 18 -5.764 -10.513 8.802 836 HA HIS 18 HA HIS 18 -7.783 -12.505 8.592 837 HB2 HIS 18 HB3 HIS 18 -6.728 -10.528 6.575 838 HB3 HIS 18 HB2 HIS 18 -7.951 -11.758 6.196 839 HD1 HIS 18 HD1 HIS 18 -10.374 -11.393 7.048 840 HD2 HIS 18 HD2 HIS 18 -7.652 -8.554 8.540 841 HE1 HIS 18 HE1 HIS 18 -11.716 -9.611 8.226 842 HE2 HIS 18 HE2 HIS 18 -10.103 -7.898 9.132 843 H SER 19 H SER 19 -4.447 -12.366 7.587 844 HA SER 19 HA SER 19 -4.429 -14.112 5.491 845 HB2 SER 19 HB3 SER 19 -2.342 -13.916 7.663 846 HB3 SER 19 HB2 SER 19 -2.099 -14.709 6.114 847 HG SER 19 HG SER 19 -2.974 -11.985 6.385 848 H GLY 20 H GLY 20 -4.251 -15.058 8.923 849 HA2 GLY 20 HA3 GLY 20 -3.903 -17.818 8.478 850 HA3 GLY 20 HA2 GLY 20 -4.528 -17.107 9.952 851 H LYS 21 H LYS 21 -6.663 -15.868 8.050 852 HA LYS 21 HA LYS 21 -8.658 -17.549 8.901 853 HB2 LYS 21 HB3 LYS 21 -8.743 -15.346 6.864 854 HB3 LYS 21 HB2 LYS 21 -10.166 -16.172 7.449 855 HG2 LYS 21 HG3 LYS 21 -9.597 -15.634 9.785 856 HG3 LYS 21 HG2 LYS 21 -8.142 -14.802 9.240 857 HD2 LYS 21 HD3 LYS 21 -9.555 -13.241 7.931 858 HD3 LYS 21 HD2 LYS 21 -10.991 -14.040 8.563 859 HE2 LYS 21 HE2 LYS 21 -8.864 -13.002 10.386 860 HE3 LYS 21 HE1 LYS 21 -10.180 -11.916 9.872 861 HZ1 LYS 21 HZ1 LYS 21 -11.050 -12.800 11.752 862 HZ2 LYS 21 HZ2 LYS 21 -10.164 -14.232 11.659 863 HZ3 LYS 21 HZ3 LYS 21 -11.560 -14.041 10.737 864 H GLU 22 H GLU 22 -7.191 -17.358 5.647 865 HA GLU 22 HA GLU 22 -9.229 -19.076 4.571 866 HB2 GLU 22 HB3 GLU 22 -7.922 -18.907 2.438 867 HB3 GLU 22 HB2 GLU 22 -8.559 -17.421 3.148 868 HG2 GLU 22 HG3 GLU 22 -6.471 -16.530 3.229 869 HG3 GLU 22 HG2 GLU 22 -5.878 -17.853 4.197 870 H GLY 23 H GLY 23 -5.680 -19.516 4.294 871 HA2 GLY 23 HA3 GLY 23 -5.786 -22.207 5.243 872 HA3 GLY 23 HA2 GLY 23 -5.703 -22.130 3.487 873 H ASP 24 H ASP 24 -3.992 -20.094 2.956 874 HA ASP 24 HA ASP 24 -1.449 -21.255 3.674 875 HB2 ASP 24 HB3 ASP 24 -1.996 -19.945 1.450 876 HB3 ASP 24 HB2 ASP 24 -1.732 -18.543 2.468 877 H LYS 25 H LYS 25 0.163 -20.384 4.989 878 HA LYS 25 HA LYS 25 -0.749 -19.003 7.297 879 HB2 LYS 25 HB3 LYS 25 2.057 -19.179 6.247 880 HB3 LYS 25 HB2 LYS 25 1.601 -18.698 7.874 881 HG2 LYS 25 HG3 LYS 25 0.238 -20.943 7.802 882 HG3 LYS 25 HG2 LYS 25 1.433 -21.365 6.592 883 HD2 LYS 25 HD3 LYS 25 2.098 -20.464 9.433 884 HD3 LYS 25 HD2 LYS 25 2.173 -22.131 8.884 885 HE2 LYS 25 HE2 LYS 25 4.002 -19.842 8.272 886 HE3 LYS 25 HE1 LYS 25 4.377 -21.507 8.647 887 HZ1 LYS 25 HZ1 LYS 25 3.047 -20.801 6.075 888 HZ2 LYS 25 HZ2 LYS 25 3.923 -22.202 6.461 889 HZ3 LYS 25 HZ3 LYS 25 4.699 -20.696 6.333 890 H TYR 26 H TYR 26 0.876 -17.969 4.316 891 HA TYR 26 HA TYR 26 0.198 -15.282 5.186 892 HB2 TYR 26 HB3 TYR 26 2.457 -15.285 3.335 893 HB3 TYR 26 HB2 TYR 26 2.337 -14.548 4.917 894 HD1 TYR 26 HD1 TYR 26 2.944 -15.856 6.997 895 HD2 TYR 26 HD2 TYR 26 3.357 -17.482 3.016 896 HE1 TYR 26 HE1 TYR 26 4.345 -17.613 7.870 897 HE2 TYR 26 HE2 TYR 26 4.773 -19.273 3.929 898 HH TYR 26 HH TYR 26 6.350 -19.251 6.253 899 H LYS 27 H LYS 27 -1.665 -15.304 4.053 900 HA LYS 27 HA LYS 27 -1.498 -14.213 1.518 901 HB2 LYS 27 HB3 LYS 27 -2.740 -16.981 1.613 902 HB3 LYS 27 HB2 LYS 27 -3.228 -15.754 0.469 903 HG2 LYS 27 HG3 LYS 27 -0.411 -16.895 0.688 904 HG3 LYS 27 HG2 LYS 27 -1.617 -17.157 -0.555 905 HD2 LYS 27 HD3 LYS 27 -1.690 -14.520 -0.731 906 HD3 LYS 27 HD2 LYS 27 -0.113 -14.609 -0.016 907 HE2 LYS 27 HE2 LYS 27 -0.808 -15.053 -2.745 908 HE3 LYS 27 HE1 LYS 27 0.798 -15.057 -2.035 909 HZ1 LYS 27 HZ1 LYS 27 0.549 -17.175 -2.948 910 HZ2 LYS 27 HZ2 LYS 27 -1.080 -17.289 -2.511 911 HZ3 LYS 27 HZ3 LYS 27 0.129 -17.494 -1.342 912 H LEU 28 H LEU 28 -3.573 -13.390 0.850 913 HA LEU 28 HA LEU 28 -5.635 -13.600 2.907 914 HB2 LEU 28 HB3 LEU 28 -4.642 -11.416 3.142 915 HB3 LEU 28 HB2 LEU 28 -4.760 -11.096 1.422 916 HG LEU 28 HG LEU 28 -7.314 -11.421 1.689 917 HD11 LEU 28 HD11 LEU 28 -6.410 -11.399 4.553 918 HD12 LEU 28 HD12 LEU 28 -7.469 -12.572 3.765 919 HD13 LEU 28 HD13 LEU 28 -8.036 -10.925 4.083 920 HD21 LEU 28 HD21 LEU 28 -6.131 -9.179 1.552 921 HD22 LEU 28 HD22 LEU 28 -6.114 -9.163 3.316 922 HD23 LEU 28 HD23 LEU 28 -7.657 -9.189 2.441 923 H SER 29 H SER 29 -7.496 -14.349 2.007 924 HA SER 29 HA SER 29 -7.493 -14.691 -0.858 925 HB2 SER 29 HB3 SER 29 -9.862 -15.742 -0.147 926 HB3 SER 29 HB2 SER 29 -8.339 -16.590 -0.041 927 HG SER 29 HG SER 29 -8.224 -16.191 2.068 928 H LYS 30 H LYS 30 -9.403 -14.063 -2.173 929 HA LYS 30 HA LYS 30 -9.923 -11.329 -1.617 930 HB2 LYS 30 HB3 LYS 30 -11.153 -13.063 -3.754 931 HB3 LYS 30 HB2 LYS 30 -11.339 -11.327 -3.616 932 HG2 LYS 30 HG3 LYS 30 -8.746 -12.818 -4.016 933 HG3 LYS 30 HG2 LYS 30 -9.671 -11.865 -5.205 934 HD2 LYS 30 HD3 LYS 30 -9.395 -9.955 -3.292 935 HD3 LYS 30 HD2 LYS 30 -7.972 -10.936 -2.950 936 HE2 LYS 30 HE2 LYS 30 -8.607 -9.804 -5.651 937 HE3 LYS 30 HE1 LYS 30 -7.573 -8.992 -4.523 938 HZ1 LYS 30 HZ1 LYS 30 -6.506 -11.672 -4.774 939 HZ2 LYS 30 HZ2 LYS 30 -5.851 -10.192 -5.200 940 HZ3 LYS 30 HZ3 LYS 30 -6.710 -11.011 -6.308 941 H LYS 31 H LYS 31 -11.356 -14.119 -0.588 942 HA LYS 31 HA LYS 31 -14.070 -13.255 -0.386 943 HB2 LYS 31 HB3 LYS 31 -14.353 -15.089 1.181 944 HB3 LYS 31 HB2 LYS 31 -13.495 -15.657 -0.242 945 HG2 LYS 31 HG3 LYS 31 -11.305 -15.187 1.174 946 HG3 LYS 31 HG2 LYS 31 -12.417 -15.102 2.533 947 HD2 LYS 31 HD3 LYS 31 -11.757 -17.287 2.557 948 HD3 LYS 31 HD2 LYS 31 -13.286 -17.420 1.658 949 HE2 LYS 31 HE2 LYS 31 -11.529 -17.021 -0.407 950 HE3 LYS 31 HE1 LYS 31 -10.449 -17.728 0.770 951 HZ1 LYS 31 HZ1 LYS 31 -11.217 -19.541 -0.245 952 HZ2 LYS 31 HZ2 LYS 31 -12.753 -18.939 -0.543 953 HZ3 LYS 31 HZ3 LYS 31 -12.340 -19.501 1.016 954 H GLU 32 H GLU 32 -11.280 -13.282 1.757 955 HA GLU 32 HA GLU 32 -12.527 -11.749 3.831 956 HB2 GLU 32 HB3 GLU 32 -9.652 -12.504 3.246 957 HB3 GLU 32 HB2 GLU 32 -10.144 -11.533 4.624 958 HG2 GLU 32 HG3 GLU 32 -11.218 -14.301 4.036 959 HG3 GLU 32 HG2 GLU 32 -9.930 -13.973 5.173 960 H LEU 33 H LEU 33 -10.492 -11.136 1.021 961 HA LEU 33 HA LEU 33 -9.662 -8.584 1.621 962 HB2 LEU 33 HB3 LEU 33 -8.885 -9.953 -0.364 963 HB3 LEU 33 HB2 LEU 33 -10.381 -9.511 -1.170 964 HG LEU 33 HG LEU 33 -8.263 -8.135 -1.664 965 HD11 LEU 33 HD11 LEU 33 -10.324 -6.152 -1.091 966 HD12 LEU 33 HD12 LEU 33 -10.996 -7.602 -1.846 967 HD13 LEU 33 HD13 LEU 33 -9.698 -6.727 -2.624 968 HD21 LEU 33 HD21 LEU 33 -7.742 -6.341 -0.214 969 HD22 LEU 33 HD22 LEU 33 -7.872 -7.721 0.868 970 HD23 LEU 33 HD23 LEU 33 -9.192 -6.555 0.756 971 H LYS 34 H LYS 34 -12.631 -9.490 -0.164 972 HA LYS 34 HA LYS 34 -13.460 -6.779 -0.434 973 HB2 LYS 34 HB3 LYS 34 -15.097 -9.324 -0.527 974 HB3 LYS 34 HB2 LYS 34 -15.760 -7.717 -0.777 975 HG2 LYS 34 HG3 LYS 34 -14.229 -7.337 -2.676 976 HG3 LYS 34 HG2 LYS 34 -13.564 -8.963 -2.456 977 HD2 LYS 34 HD3 LYS 34 -15.749 -9.976 -2.909 978 HD3 LYS 34 HD2 LYS 34 -16.501 -8.398 -2.957 979 HE2 LYS 34 HE2 LYS 34 -16.108 -9.289 -5.200 980 HE3 LYS 34 HE1 LYS 34 -15.213 -7.782 -4.962 981 HZ1 LYS 34 HZ1 LYS 34 -13.191 -9.063 -4.676 982 HZ2 LYS 34 HZ2 LYS 34 -13.975 -9.577 -6.055 983 HZ3 LYS 34 HZ3 LYS 34 -14.057 -10.521 -4.666 984 H GLU 35 H GLU 35 -14.123 -9.260 1.983 985 HA GLU 35 HA GLU 35 -15.943 -7.781 3.558 986 HB2 GLU 35 HB3 GLU 35 -13.961 -9.959 4.297 987 HB3 GLU 35 HB2 GLU 35 -15.184 -9.325 5.386 988 HG2 GLU 35 HG3 GLU 35 -15.835 -10.520 2.680 989 HG3 GLU 35 HG2 GLU 35 -15.895 -11.424 4.198 990 H LEU 36 H LEU 36 -12.463 -8.214 3.745 991 HA LEU 36 HA LEU 36 -11.948 -6.472 5.908 992 HB2 LEU 36 HB3 LEU 36 -10.185 -7.880 5.519 993 HB3 LEU 36 HB2 LEU 36 -10.418 -7.874 3.790 994 HG LEU 36 HG LEU 36 -9.430 -5.673 3.603 995 HD11 LEU 36 HD11 LEU 36 -9.758 -4.500 5.613 996 HD12 LEU 36 HD12 LEU 36 -8.086 -5.007 5.752 997 HD13 LEU 36 HD13 LEU 36 -9.353 -5.907 6.610 998 HD21 LEU 36 HD21 LEU 36 -7.131 -6.511 4.810 999 HD22 LEU 36 HD22 LEU 36 -7.732 -7.069 3.245 1000 HD23 LEU 36 HD23 LEU 36 -8.036 -8.025 4.696 1001 H LEU 37 H LEU 37 -11.637 -5.937 2.415 1002 HA LEU 37 HA LEU 37 -10.762 -3.312 2.677 1003 HB2 LEU 37 HB3 LEU 37 -10.389 -4.616 0.640 1004 HB3 LEU 37 HB2 LEU 37 -12.114 -4.642 0.308 1005 HG LEU 37 HG LEU 37 -10.574 -2.942 -0.950 1006 HD11 LEU 37 HD11 LEU 37 -13.261 -2.990 -0.510 1007 HD12 LEU 37 HD12 LEU 37 -12.435 -1.811 -1.503 1008 HD13 LEU 37 HD13 LEU 37 -12.850 -1.409 0.158 1009 HD21 LEU 37 HD21 LEU 37 -11.197 -1.125 1.320 1010 HD22 LEU 37 HD22 LEU 37 -9.946 -0.975 0.101 1011 HD23 LEU 37 HD23 LEU 37 -9.711 -2.078 1.445 1012 H GLN 38 H GLN 38 -14.026 -4.556 2.121 1013 HA GLN 38 HA GLN 38 -15.214 -1.994 1.960 1014 HB2 GLN 38 HB3 GLN 38 -17.336 -3.097 2.111 1015 HB3 GLN 38 HB2 GLN 38 -16.297 -4.162 1.173 1016 HG2 GLN 38 HG3 GLN 38 -15.768 -5.370 3.346 1017 HG3 GLN 38 HG2 GLN 38 -17.055 -4.441 4.098 1018 HE21 GLN 38 HE21 GLN 38 -18.008 -6.703 4.412 1019 HE22 GLN 38 HE22 GLN 38 -18.896 -7.376 3.150 1020 H THR 39 H THR 39 -14.521 -4.186 4.574 1021 HA THR 39 HA THR 39 -15.997 -2.817 6.568 1022 HB THR 39 HB THR 39 -13.783 -4.858 6.660 1023 HG1 THR 39 HG2 THR 39 -15.366 -5.912 5.980 1024 HG21 THR 39 HG21 THR 39 -14.714 -5.254 9.002 1025 HG22 THR 39 HG22 THR 39 -15.394 -3.626 8.906 1026 HG23 THR 39 HG23 THR 39 -13.640 -3.897 8.744 1027 H GLU 40 H GLU 40 -12.447 -3.121 6.188 1028 HA GLU 40 HA GLU 40 -11.938 -1.246 8.254 1029 HB2 GLU 40 HB3 GLU 40 -10.089 -2.290 6.114 1030 HB3 GLU 40 HB2 GLU 40 -9.635 -1.430 7.598 1031 HG2 GLU 40 HG3 GLU 40 -11.184 -4.052 7.574 1032 HG3 GLU 40 HG2 GLU 40 -9.460 -3.944 7.850 1033 H LEU 41 H LEU 41 -11.893 -0.914 4.759 1034 HA LEU 41 HA LEU 41 -11.318 1.948 5.070 1035 HB2 LEU 41 HB3 LEU 41 -11.082 -0.007 2.889 1036 HB3 LEU 41 HB2 LEU 41 -11.270 1.663 2.401 1037 HG LEU 41 HG LEU 41 -9.323 1.980 4.309 1038 HD11 LEU 41 HD11 LEU 41 -9.157 -0.329 4.914 1039 HD12 LEU 41 HD12 LEU 41 -7.704 0.138 4.058 1040 HD13 LEU 41 HD13 LEU 41 -8.948 -0.808 3.228 1041 HD21 LEU 41 HD21 LEU 41 -7.705 2.073 2.510 1042 HD22 LEU 41 HD22 LEU 41 -9.236 2.668 1.876 1043 HD23 LEU 41 HD23 LEU 41 -8.701 1.030 1.494 1044 H SER 42 H SER 42 -13.847 0.843 5.812 1045 HA SER 42 HA SER 42 -15.846 1.061 3.901 1046 HB2 SER 42 HB3 SER 42 -17.108 1.861 6.149 1047 HB3 SER 42 HB2 SER 42 -16.719 0.197 5.778 1048 HG SER 42 HG SER 42 -15.211 0.202 7.296 1049 H GLY 43 H GLY 43 -14.179 3.546 5.784 1050 HA2 GLY 43 HA3 GLY 43 -15.890 5.709 5.136 1051 HA3 GLY 43 HA2 GLY 43 -14.208 5.824 5.645 1052 H PHE 44 H PHE 44 -12.867 4.508 3.728 1053 HA PHE 44 HA PHE 44 -12.746 6.377 1.571 1054 HB2 PHE 44 HB3 PHE 44 -11.509 3.649 1.956 1055 HB3 PHE 44 HB2 PHE 44 -11.338 4.552 0.462 1056 HD1 PHE 44 HD2 PHE 44 -10.403 6.901 0.556 1057 HD2 PHE 44 HD1 PHE 44 -10.094 4.153 3.812 1058 HE1 PHE 44 HE2 PHE 44 -8.524 8.241 1.507 1059 HE2 PHE 44 HE1 PHE 44 -8.210 5.492 4.761 1060 HZ PHE 44 HZ PHE 44 -7.440 7.520 3.605 1061 H LEU 45 H LEU 45 -13.967 3.100 1.890 1062 HA LEU 45 HA LEU 45 -14.798 2.782 -0.760 1063 HB2 LEU 45 HB3 LEU 45 -14.749 0.793 0.323 1064 HB3 LEU 45 HB2 LEU 45 -15.354 1.428 1.841 1065 HG LEU 45 HG LEU 45 -17.586 1.618 0.884 1066 HD11 LEU 45 HD11 LEU 45 -17.525 0.014 -1.419 1067 HD12 LEU 45 HD12 LEU 45 -16.153 1.099 -1.623 1068 HD13 LEU 45 HD13 LEU 45 -17.779 1.750 -1.341 1069 HD21 LEU 45 HD21 LEU 45 -16.415 -1.133 0.429 1070 HD22 LEU 45 HD22 LEU 45 -18.108 -0.758 0.788 1071 HD23 LEU 45 HD23 LEU 45 -16.869 -0.466 2.006 1072 H ASP 46 H ASP 46 -16.625 3.885 2.079 1073 HA ASP 46 HA ASP 46 -18.992 4.449 0.612 1074 HB2 ASP 46 HB3 ASP 46 -19.168 4.146 2.908 1075 HB3 ASP 46 HB2 ASP 46 -18.040 5.443 3.298 1076 H ALA 47 H ALA 47 -16.221 6.393 1.515 1077 HA ALA 47 HA ALA 47 -17.259 8.890 0.978 1078 HB1 ALA 47 HB1 ALA 47 -14.706 9.395 0.415 1079 HB2 ALA 47 HB2 ALA 47 -14.497 7.815 1.154 1080 HB3 ALA 47 HB3 ALA 47 -15.274 9.115 2.057 1081 H GLN 48 H GLN 48 -15.779 6.658 -1.310 1082 HA GLN 48 HA GLN 48 -16.472 8.611 -3.420 1083 HB2 GLN 48 HB3 GLN 48 -14.435 7.368 -4.648 1084 HB3 GLN 48 HB2 GLN 48 -14.207 8.788 -3.632 1085 HG2 GLN 48 HG3 GLN 48 -12.609 7.356 -2.809 1086 HG3 GLN 48 HG2 GLN 48 -13.916 6.980 -1.704 1087 HE21 GLN 48 HE21 GLN 48 -14.723 4.839 -1.763 1088 HE22 GLN 48 HE22 GLN 48 -14.193 3.663 -2.870 1089 H LYS 49 H LYS 49 -18.235 6.634 -2.607 1090 HA LYS 49 HA LYS 49 -18.326 4.420 -4.441 1091 HB2 LYS 49 HB3 LYS 49 -20.566 5.969 -3.127 1092 HB3 LYS 49 HB2 LYS 49 -20.728 4.431 -3.985 1093 HG2 LYS 49 HG3 LYS 49 -19.163 3.369 -2.367 1094 HG3 LYS 49 HG2 LYS 49 -19.067 4.886 -1.486 1095 HD2 LYS 49 HD3 LYS 49 -21.588 3.249 -1.931 1096 HD3 LYS 49 HD2 LYS 49 -20.697 3.361 -0.429 1097 HE2 LYS 49 HE2 LYS 49 -22.168 5.018 0.065 1098 HE3 LYS 49 HE1 LYS 49 -21.079 6.023 -0.880 1099 HZ1 LYS 49 HZ1 LYS 49 -22.495 5.546 -2.864 1100 HZ2 LYS 49 HZ2 LYS 49 -23.406 6.260 -1.643 1101 HZ3 LYS 49 HZ3 LYS 49 -23.490 4.606 -1.898 1102 H ASP 50 H ASP 50 -19.353 7.703 -4.398 1103 HA ASP 50 HA ASP 50 -20.764 7.832 -6.843 1104 HB2 ASP 50 HB3 ASP 50 -20.776 9.496 -4.909 1105 HB3 ASP 50 HB2 ASP 50 -19.266 10.092 -5.571 1106 H VAL 51 H VAL 51 -17.373 7.742 -6.126 1107 HA VAL 51 HA VAL 51 -16.552 9.069 -8.520 1108 HB VAL 51 HB VAL 51 -14.923 7.284 -6.665 1109 HG11 VAL 51 HG11 VAL 51 -12.994 8.460 -7.636 1110 HG12 VAL 51 HG12 VAL 51 -14.048 9.361 -8.700 1111 HG13 VAL 51 HG13 VAL 51 -13.865 7.619 -8.913 1112 HG21 VAL 51 HG21 VAL 51 -14.131 9.467 -5.743 1113 HG22 VAL 51 HG22 VAL 51 -15.862 9.259 -5.466 1114 HG23 VAL 51 HG23 VAL 51 -15.291 10.303 -6.755 1115 H ASP 52 H ASP 52 -17.707 5.961 -7.753 1116 HA ASP 52 HA ASP 52 -18.051 4.085 -8.980 1117 HB2 ASP 52 HB3 ASP 52 -18.898 5.390 -10.789 1118 HB3 ASP 52 HB2 ASP 52 -17.299 5.920 -11.266 1119 H ALA 53 H ALA 53 -15.030 5.709 -9.645 1120 HA ALA 53 HA ALA 53 -13.543 3.624 -10.675 1121 HB1 ALA 53 HB1 ALA 53 -12.741 6.007 -10.380 1122 HB2 ALA 53 HB2 ALA 53 -11.578 4.763 -9.943 1123 HB3 ALA 53 HB3 ALA 53 -12.448 5.617 -8.681 1124 H VAL 54 H VAL 54 -14.682 4.101 -7.430 1125 HA VAL 54 HA VAL 54 -12.945 2.376 -6.059 1126 HB VAL 54 HB VAL 54 -14.510 3.815 -4.838 1127 HG11 VAL 54 HG11 VAL 54 -16.734 2.070 -5.947 1128 HG12 VAL 54 HG12 VAL 54 -16.447 3.787 -6.362 1129 HG13 VAL 54 HG13 VAL 54 -16.852 3.315 -4.736 1130 HG21 VAL 54 HG21 VAL 54 -14.819 0.824 -4.423 1131 HG22 VAL 54 HG22 VAL 54 -15.675 1.966 -3.425 1132 HG23 VAL 54 HG23 VAL 54 -13.921 1.973 -3.426 1133 H ASP 55 H ASP 55 -15.906 1.815 -7.844 1134 HA ASP 55 HA ASP 55 -16.057 -1.025 -7.465 1135 HB2 ASP 55 HB3 ASP 55 -17.984 0.045 -8.387 1136 HB3 ASP 55 HB2 ASP 55 -17.053 0.761 -9.692 1137 H LYS 56 H LYS 56 -14.531 1.002 -9.885 1138 HA LYS 56 HA LYS 56 -13.489 -1.113 -11.457 1139 HB2 LYS 56 HB3 LYS 56 -12.640 1.782 -11.210 1140 HB3 LYS 56 HB2 LYS 56 -11.876 0.655 -12.304 1141 HG2 LYS 56 HG3 LYS 56 -13.858 2.127 -13.183 1142 HG3 LYS 56 HG2 LYS 56 -13.779 0.450 -13.688 1143 HD2 LYS 56 HD3 LYS 56 -15.369 -0.156 -11.856 1144 HD3 LYS 56 HD2 LYS 56 -15.455 1.569 -11.417 1145 HE2 LYS 56 HE2 LYS 56 -16.356 2.020 -13.710 1146 HE3 LYS 56 HE1 LYS 56 -16.275 0.320 -14.045 1147 HZ1 LYS 56 HZ1 LYS 56 -18.422 0.538 -13.322 1148 HZ2 LYS 56 HZ2 LYS 56 -18.042 1.705 -12.145 1149 HZ3 LYS 56 HZ3 LYS 56 -17.652 0.052 -11.890 1150 H VAL 57 H VAL 57 -12.102 0.712 -8.770 1151 HA VAL 57 HA VAL 57 -9.569 -0.571 -8.812 1152 HB VAL 57 HB VAL 57 -11.093 0.635 -6.472 1153 HG11 VAL 57 HG11 VAL 57 -9.346 -0.948 -5.778 1154 HG12 VAL 57 HG12 VAL 57 -8.921 0.711 -5.359 1155 HG13 VAL 57 HG13 VAL 57 -8.154 -0.075 -6.736 1156 HG21 VAL 57 HG21 VAL 57 -10.054 2.662 -6.956 1157 HG22 VAL 57 HG22 VAL 57 -10.289 2.045 -8.598 1158 HG23 VAL 57 HG23 VAL 57 -8.721 1.895 -7.814 1159 H MET 58 H MET 58 -12.592 -1.250 -7.137 1160 HA MET 58 HA MET 58 -11.808 -3.621 -5.789 1161 HB2 MET 58 HB3 MET 58 -14.505 -2.804 -6.912 1162 HB3 MET 58 HB2 MET 58 -14.229 -4.099 -5.763 1163 HG2 MET 58 HG3 MET 58 -13.056 -1.495 -5.005 1164 HG3 MET 58 HG2 MET 58 -14.808 -1.527 -5.036 1165 HE1 MET 58 HE1 MET 58 -16.209 -3.230 -2.604 1166 HE2 MET 58 HE2 MET 58 -15.720 -4.662 -3.493 1167 HE3 MET 58 HE3 MET 58 -16.123 -3.192 -4.376 1168 H LYS 59 H LYS 59 -13.146 -2.909 -8.927 1169 HA LYS 59 HA LYS 59 -13.521 -5.512 -9.892 1170 HB2 LYS 59 HB3 LYS 59 -14.269 -3.159 -10.826 1171 HB3 LYS 59 HB2 LYS 59 -12.751 -3.255 -11.684 1172 HG2 LYS 59 HG3 LYS 59 -13.609 -4.560 -13.184 1173 HG3 LYS 59 HG2 LYS 59 -13.921 -5.807 -11.991 1174 HD2 LYS 59 HD3 LYS 59 -15.781 -3.423 -12.370 1175 HD3 LYS 59 HD2 LYS 59 -15.967 -4.871 -13.356 1176 HE2 LYS 59 HE2 LYS 59 -17.478 -5.125 -11.549 1177 HE3 LYS 59 HE1 LYS 59 -16.150 -6.193 -11.160 1178 HZ1 LYS 59 HZ1 LYS 59 -16.548 -5.037 -9.217 1179 HZ2 LYS 59 HZ2 LYS 59 -16.823 -3.554 -9.900 1180 HZ3 LYS 59 HZ3 LYS 59 -15.249 -4.173 -9.780 1181 H GLU 60 H GLU 60 -10.814 -3.283 -10.144 1182 HA GLU 60 HA GLU 60 -9.268 -4.791 -11.863 1183 HB2 GLU 60 HB3 GLU 60 -8.792 -2.482 -11.309 1184 HB3 GLU 60 HB2 GLU 60 -8.338 -2.919 -9.664 1185 HG2 GLU 60 HG3 GLU 60 -6.490 -4.313 -10.518 1186 HG3 GLU 60 HG2 GLU 60 -6.956 -3.894 -12.179 1187 H LEU 61 H LEU 61 -9.517 -4.799 -8.383 1188 HA LEU 61 HA LEU 61 -7.518 -6.751 -7.847 1189 HB2 LEU 61 HB3 LEU 61 -9.846 -5.661 -6.305 1190 HB3 LEU 61 HB2 LEU 61 -9.041 -7.106 -5.723 1191 HG LEU 61 HG LEU 61 -8.206 -4.775 -4.900 1192 HD11 LEU 61 HD11 LEU 61 -5.847 -5.626 -4.878 1193 HD12 LEU 61 HD12 LEU 61 -6.351 -6.944 -5.916 1194 HD13 LEU 61 HD13 LEU 61 -7.037 -6.782 -4.289 1195 HD21 LEU 61 HD21 LEU 61 -7.951 -3.862 -7.299 1196 HD22 LEU 61 HD22 LEU 61 -6.545 -4.934 -7.453 1197 HD23 LEU 61 HD23 LEU 61 -6.553 -3.684 -6.253 1198 H ASP 62 H ASP 62 -10.878 -6.948 -8.761 1199 HA ASP 62 HA ASP 62 -11.266 -9.715 -8.251 1200 HB2 ASP 62 HB3 ASP 62 -12.634 -7.752 -10.083 1201 HB3 ASP 62 HB2 ASP 62 -12.945 -9.475 -10.242 1202 H GLU 63 H GLU 63 -9.808 -8.000 -10.912 1203 HA GLU 63 HA GLU 63 -9.659 -10.059 -12.875 1204 HB2 GLU 63 HB3 GLU 63 -7.526 -8.017 -12.209 1205 HB3 GLU 63 HB2 GLU 63 -7.713 -8.882 -13.719 1206 HG2 GLU 63 HG3 GLU 63 -9.813 -6.952 -12.635 1207 HG3 GLU 63 HG2 GLU 63 -8.665 -6.577 -13.894 1208 H ASN 64 H ASN 64 -7.608 -9.232 -10.191 1209 HA ASN 64 HA ASN 64 -6.091 -11.770 -10.441 1210 HB2 ASN 64 HB3 ASN 64 -5.015 -9.309 -10.171 1211 HB3 ASN 64 HB2 ASN 64 -5.474 -9.679 -8.491 1212 HD21 ASN 64 HD21 ASN 64 -3.252 -9.721 -7.962 1213 HD22 ASN 64 HD22 ASN 64 -2.255 -11.080 -8.258 1214 H GLY 65 H GLY 65 -8.857 -11.092 -9.408 1215 HA2 GLY 65 HA3 GLY 65 -8.501 -11.685 -6.571 1216 HA3 GLY 65 HA2 GLY 65 -9.849 -10.807 -7.289 1217 H ASP 66 H ASP 66 -8.558 -13.728 -8.659 1218 HA ASP 66 HA ASP 66 -11.097 -14.998 -8.613 1219 HB2 ASP 66 HB3 ASP 66 -9.346 -15.619 -10.266 1220 HB3 ASP 66 HB2 ASP 66 -8.378 -16.298 -8.966 1221 H GLY 67 H GLY 67 -8.345 -14.953 -6.469 1222 HA2 GLY 67 HA3 GLY 67 -9.996 -16.120 -4.380 1223 HA3 GLY 67 HA2 GLY 67 -8.680 -17.146 -4.908 1224 H GLU 68 H GLU 68 -6.533 -15.670 -5.110 1225 HA GLU 68 HA GLU 68 -6.086 -14.928 -2.324 1226 HB2 GLU 68 HB3 GLU 68 -4.191 -15.540 -4.594 1227 HB3 GLU 68 HB2 GLU 68 -3.678 -15.114 -2.971 1228 HG2 GLU 68 HG3 GLU 68 -4.801 -17.025 -2.020 1229 HG3 GLU 68 HG2 GLU 68 -5.528 -17.449 -3.557 1230 H VAL 69 H VAL 69 -4.905 -13.143 -1.642 1231 HA VAL 69 HA VAL 69 -4.034 -11.158 -3.502 1232 HB VAL 69 HB VAL 69 -6.178 -10.185 -3.102 1233 HG11 VAL 69 HG11 VAL 69 -6.949 -9.763 -0.705 1234 HG12 VAL 69 HG12 VAL 69 -5.715 -10.904 -0.208 1235 HG13 VAL 69 HG13 VAL 69 -7.038 -11.445 -1.228 1236 HG21 VAL 69 HG21 VAL 69 -4.414 -8.529 -2.885 1237 HG22 VAL 69 HG22 VAL 69 -4.193 -8.916 -1.170 1238 HG23 VAL 69 HG23 VAL 69 -5.680 -8.170 -1.725 1239 H ASP 70 H ASP 70 -2.112 -10.319 -2.805 1240 HA ASP 70 HA ASP 70 -1.193 -11.353 -0.219 1241 HB2 ASP 70 HB3 ASP 70 0.899 -11.498 -1.053 1242 HB3 ASP 70 HB2 ASP 70 0.043 -11.529 -2.590 1243 H PHE 71 H PHE 71 0.639 -9.769 0.645 1244 HA PHE 71 HA PHE 71 -0.789 -7.587 1.702 1245 HB2 PHE 71 HB3 PHE 71 1.144 -8.664 2.850 1246 HB3 PHE 71 HB2 PHE 71 2.212 -7.895 1.677 1247 HD1 PHE 71 HD1 PHE 71 -0.634 -6.971 3.928 1248 HD2 PHE 71 HD2 PHE 71 3.162 -5.781 2.286 1249 HE1 PHE 71 HE1 PHE 71 -0.682 -4.922 5.276 1250 HE2 PHE 71 HE2 PHE 71 3.087 -3.719 3.674 1251 HZ PHE 71 HZ PHE 71 1.196 -3.288 5.144 1252 H GLN 72 H GLN 72 1.664 -7.804 -0.850 1253 HA GLN 72 HA GLN 72 1.934 -5.054 -1.343 1254 HB2 GLN 72 HB3 GLN 72 2.422 -7.517 -2.955 1255 HB3 GLN 72 HB2 GLN 72 2.702 -5.901 -3.689 1256 HG2 GLN 72 HG3 GLN 72 4.262 -5.469 -1.845 1257 HG3 GLN 72 HG2 GLN 72 3.900 -7.053 -1.157 1258 HE21 GLN 72 HE21 GLN 72 4.779 -8.942 -2.236 1259 HE22 GLN 72 HE22 GLN 72 5.935 -8.799 -3.466 1260 H GLU 73 H GLU 73 -0.217 -7.482 -2.822 1261 HA GLU 73 HA GLU 73 -1.556 -5.608 -4.503 1262 HB2 GLU 73 HB3 GLU 73 -1.608 -8.049 -4.944 1263 HB3 GLU 73 HB2 GLU 73 -2.566 -8.291 -3.495 1264 HG2 GLU 73 HG3 GLU 73 -4.375 -6.947 -4.379 1265 HG3 GLU 73 HG2 GLU 73 -3.459 -6.487 -5.792 1266 H TYR 74 H TYR 74 -2.109 -6.878 -1.285 1267 HA TYR 74 HA TYR 74 -4.613 -5.708 -0.804 1268 HB2 TYR 74 HB3 TYR 74 -3.839 -7.400 0.686 1269 HB3 TYR 74 HB2 TYR 74 -2.375 -6.486 1.044 1270 HD1 TYR 74 HD1 TYR 74 -6.125 -5.849 1.124 1271 HD2 TYR 74 HD2 TYR 74 -2.312 -5.446 3.106 1272 HE1 TYR 74 HE1 TYR 74 -7.214 -4.747 3.016 1273 HE2 TYR 74 HE2 TYR 74 -3.443 -4.333 5.014 1274 HH TYR 74 HH TYR 74 -5.982 -2.904 5.073 1275 H VAL 75 H VAL 75 -1.345 -4.414 -0.122 1276 HA VAL 75 HA VAL 75 -2.346 -2.044 1.012 1277 HB VAL 75 HB VAL 75 -0.156 -1.083 0.812 1278 HG11 VAL 75 HG11 VAL 75 -0.741 -3.419 2.187 1279 HG12 VAL 75 HG12 VAL 75 0.690 -2.434 2.407 1280 HG13 VAL 75 HG13 VAL 75 0.748 -3.832 1.344 1281 HG21 VAL 75 HG21 VAL 75 1.583 -1.932 -0.552 1282 HG22 VAL 75 HG22 VAL 75 0.222 -2.031 -1.610 1283 HG23 VAL 75 HG23 VAL 75 0.791 -3.479 -0.768 1284 H VAL 76 H VAL 76 -1.481 -2.821 -2.350 1285 HA VAL 76 HA VAL 76 -1.774 -0.182 -3.255 1286 HB VAL 76 HB VAL 76 -0.632 -2.174 -4.459 1287 HG11 VAL 76 HG11 VAL 76 -2.344 -3.757 -4.619 1288 HG12 VAL 76 HG12 VAL 76 -2.133 -3.156 -6.245 1289 HG13 VAL 76 HG13 VAL 76 -3.516 -2.627 -5.295 1290 HG21 VAL 76 HG21 VAL 76 -2.374 -0.153 -5.913 1291 HG22 VAL 76 HG22 VAL 76 -1.161 -1.148 -6.707 1292 HG23 VAL 76 HG23 VAL 76 -0.669 0.015 -5.484 1293 H LEU 77 H LEU 77 -4.085 -2.826 -2.977 1294 HA LEU 77 HA LEU 77 -6.257 -1.577 -4.285 1295 HB2 LEU 77 HB3 LEU 77 -6.350 -3.925 -3.711 1296 HB3 LEU 77 HB2 LEU 77 -6.208 -3.546 -2.005 1297 HG LEU 77 HG LEU 77 -8.376 -2.361 -2.030 1298 HD11 LEU 77 HD11 LEU 77 -8.895 -1.445 -3.958 1299 HD12 LEU 77 HD12 LEU 77 -9.684 -2.982 -4.319 1300 HD13 LEU 77 HD13 LEU 77 -8.076 -2.645 -4.954 1301 HD21 LEU 77 HD21 LEU 77 -9.714 -4.496 -3.039 1302 HD22 LEU 77 HD22 LEU 77 -8.957 -4.481 -1.449 1303 HD23 LEU 77 HD23 LEU 77 -8.125 -5.223 -2.801 1304 H VAL 78 H VAL 78 -5.410 -1.638 -0.845 1305 HA VAL 78 HA VAL 78 -7.501 0.163 -0.165 1306 HB VAL 78 HB VAL 78 -6.454 0.325 2.035 1307 HG11 VAL 78 HG11 VAL 78 -5.956 -2.539 1.382 1308 HG12 VAL 78 HG12 VAL 78 -7.541 -1.924 0.946 1309 HG13 VAL 78 HG13 VAL 78 -6.996 -1.849 2.620 1310 HG21 VAL 78 HG21 VAL 78 -4.067 0.437 1.289 1311 HG22 VAL 78 HG22 VAL 78 -4.198 -1.255 0.791 1312 HG23 VAL 78 HG23 VAL 78 -4.324 -0.832 2.487 1313 H ALA 79 H ALA 79 -4.101 0.571 -0.914 1314 HA ALA 79 HA ALA 79 -3.956 3.342 -0.414 1315 HB1 ALA 79 HB1 ALA 79 -1.936 3.317 -1.693 1316 HB2 ALA 79 HB2 ALA 79 -2.393 1.794 -2.463 1317 HB3 ALA 79 HB3 ALA 79 -1.998 1.828 -0.745 1318 H ALA 80 H ALA 80 -4.754 1.490 -3.338 1319 HA ALA 80 HA ALA 80 -4.851 3.570 -5.138 1320 HB1 ALA 80 HB1 ALA 80 -6.380 2.177 -6.466 1321 HB2 ALA 80 HB2 ALA 80 -6.717 1.199 -5.052 1322 HB3 ALA 80 HB3 ALA 80 -5.108 1.167 -5.771 1323 H LEU 81 H LEU 81 -7.398 2.227 -3.091 1324 HA LEU 81 HA LEU 81 -9.397 4.161 -3.730 1325 HB2 LEU 81 HB3 LEU 81 -9.033 2.401 -1.301 1326 HB3 LEU 81 HB2 LEU 81 -10.454 3.425 -1.574 1327 HG LEU 81 HG LEU 81 -9.482 1.236 -3.446 1328 HD11 LEU 81 HD11 LEU 81 -10.399 -0.085 -1.853 1329 HD12 LEU 81 HD12 LEU 81 -11.918 0.413 -2.592 1330 HD13 LEU 81 HD13 LEU 81 -11.340 1.226 -1.147 1331 HD21 LEU 81 HD21 LEU 81 -11.827 3.157 -3.495 1332 HD22 LEU 81 HD22 LEU 81 -11.887 1.612 -4.343 1333 HD23 LEU 81 HD23 LEU 81 -10.679 2.803 -4.791 1334 H THR 82 H THR 82 -6.915 3.936 -1.234 1335 HA THR 82 HA THR 82 -7.681 6.190 0.240 1336 HB THR 82 HB THR 82 -4.844 5.214 -0.108 1337 HG1 THR 82 HG2 THR 82 -6.452 3.543 0.485 1338 HG21 THR 82 HG21 THR 82 -5.907 7.360 1.370 1339 HG22 THR 82 HG22 THR 82 -4.322 6.628 1.563 1340 HG23 THR 82 HG23 THR 82 -5.665 6.070 2.541 1341 H VAL 83 H VAL 83 -5.277 5.895 -2.385 1342 HA VAL 83 HA VAL 83 -4.527 8.590 -2.317 1343 HB VAL 83 HB VAL 83 -3.207 6.814 -3.412 1344 HG11 VAL 83 HG11 VAL 83 -4.913 5.570 -4.524 1345 HG12 VAL 83 HG12 VAL 83 -3.759 6.154 -5.721 1346 HG13 VAL 83 HG13 VAL 83 -5.321 6.933 -5.575 1347 HG21 VAL 83 HG21 VAL 83 -2.704 9.155 -3.982 1348 HG22 VAL 83 HG22 VAL 83 -3.917 9.108 -5.264 1349 HG23 VAL 83 HG23 VAL 83 -2.469 8.090 -5.372 1350 H ALA 84 H ALA 84 -7.039 6.982 -4.246 1351 HA ALA 84 HA ALA 84 -7.745 9.215 -5.808 1352 HB1 ALA 84 HB1 ALA 84 -8.667 7.097 -6.433 1353 HB2 ALA 84 HB2 ALA 84 -10.007 8.128 -5.962 1354 HB3 ALA 84 HB3 ALA 84 -9.431 6.887 -4.853 1355 H MET 85 H MET 85 -9.171 8.085 -2.725 1356 HA MET 85 HA MET 85 -10.806 10.423 -2.472 1357 HB2 MET 85 HB3 MET 85 -11.286 8.224 -1.279 1358 HB3 MET 85 HB2 MET 85 -9.922 8.623 -0.220 1359 HG2 MET 85 HG3 MET 85 -11.044 10.772 0.395 1360 HG3 MET 85 HG2 MET 85 -12.416 10.314 -0.594 1361 HE1 MET 85 HE1 MET 85 -11.416 10.160 3.301 1362 HE2 MET 85 HE2 MET 85 -10.152 9.780 2.123 1363 HE3 MET 85 HE3 MET 85 -10.765 8.516 3.168 1364 H ASN 86 H ASN 86 -7.658 9.445 -1.239 1365 HA ASN 86 HA ASN 86 -7.281 11.524 0.572 1366 HB2 ASN 86 HB3 ASN 86 -5.814 9.601 0.599 1367 HB3 ASN 86 HB2 ASN 86 -5.215 9.999 -1.009 1368 HD21 ASN 86 HD21 ASN 86 -4.968 10.828 2.405 1369 HD22 ASN 86 HD22 ASN 86 -3.754 11.980 2.204 1370 H ASN 87 H ASN 87 -6.602 11.404 -2.880 1371 HA ASN 87 HA ASN 87 -5.051 13.610 -3.209 1372 HB2 ASN 87 HB3 ASN 87 -6.251 12.053 -4.970 1373 HB3 ASN 87 HB2 ASN 87 -7.404 13.375 -5.049 1374 HD21 ASN 87 HD21 ASN 87 -5.088 15.358 -4.393 1375 HD22 ASN 87 HD22 ASN 87 -4.274 15.499 -5.872 1376 H PHE 88 H PHE 88 -8.386 13.556 -2.241 1377 HA PHE 88 HA PHE 88 -8.954 16.307 -2.658 1378 HB2 PHE 88 HB3 PHE 88 -10.218 14.226 -0.863 1379 HB3 PHE 88 HB2 PHE 88 -10.730 15.901 -0.866 1380 HD1 PHE 88 HD1 PHE 88 -11.607 16.984 -2.921 1381 HD2 PHE 88 HD2 PHE 88 -10.757 12.763 -2.769 1382 HE1 PHE 88 HE1 PHE 88 -12.948 16.637 -4.967 1383 HE2 PHE 88 HE2 PHE 88 -12.110 12.427 -4.819 1384 HZ PHE 88 HZ PHE 88 -13.204 14.366 -5.916 1385 H PHE 89 H PHE 89 -7.503 14.539 0.024 1386 HA PHE 89 HA PHE 89 -7.595 16.521 2.001 1387 HB2 PHE 89 HB3 PHE 89 -5.754 14.193 1.501 1388 HB3 PHE 89 HB2 PHE 89 -5.312 15.393 2.684 1389 HD1 PHE 89 HD2 PHE 89 -8.021 13.026 1.757 1390 HD2 PHE 89 HD1 PHE 89 -6.353 15.538 4.820 1391 HE1 PHE 89 HE2 PHE 89 -9.561 12.029 3.428 1392 HE2 PHE 89 HE1 PHE 89 -7.898 14.543 6.472 1393 HZ PHE 89 HZ PHE 89 -9.499 12.782 5.769 1394 H TRP 90 H TRP 90 -5.600 16.235 -0.775 1395 HA TRP 90 HA TRP 90 -3.563 18.101 0.026 1396 HB2 TRP 90 HB3 TRP 90 -4.395 17.277 -2.786 1397 HB3 TRP 90 HB2 TRP 90 -2.904 18.066 -2.309 1398 HD1 TRP 90 HD TRP 90 -4.800 14.844 -1.240 1399 HE1 TRP 90 HE1 TRP 90 -3.120 12.994 -0.970 1400 HE3 TRP 90 HE3 TRP 90 -0.569 17.420 -2.343 1401 HZ2 TRP 90 HZ2 TRP 90 -0.263 12.600 -1.218 1402 HZ3 TRP 90 HZ3 TRP 90 1.622 16.306 -2.338 1403 HH2 TRP 90 HH TRP 90 1.803 13.892 -1.779 1404 H GLU 91 H GLU 91 -6.006 18.261 -2.451 1405 HA GLU 91 HA GLU 91 -5.932 21.066 -2.754 1406 HB2 GLU 91 HB3 GLU 91 -7.954 19.023 -3.567 1407 HB3 GLU 91 HB2 GLU 91 -8.031 20.697 -4.094 1408 HG2 GLU 91 HG3 GLU 91 -5.724 20.522 -5.030 1409 HG3 GLU 91 HG2 GLU 91 -5.677 18.838 -4.539 1410 H ASN 92 H ASN 92 -8.053 18.954 -0.840 1411 HA ASN 92 HA ASN 92 -9.616 21.229 0.120 1412 HB2 ASN 92 HB3 ASN 92 -10.644 18.929 -0.068 1413 HB3 ASN 92 HB2 ASN 92 -9.496 18.382 1.151 1414 HD21 ASN 92 HD21 ASN 92 -12.178 18.143 1.794 1415 HD22 ASN 92 HD22 ASN 92 -12.602 19.302 2.955 1416 H SER 93 H SER 93 -8.315 22.577 1.145 1417 HA SER 93 HA SER 93 -6.746 21.593 3.424 1418 HB2 SER 93 HB3 SER 93 -5.845 22.803 0.898 1419 HB3 SER 93 HB2 SER 93 -5.003 23.351 2.365 1420 HG SER 93 HG SER 93 -5.146 20.851 1.064 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -11.903 2.166 8.216 2 HA2 GLY 1 HA3 GLY 1 -11.812 4.480 8.924 3 HA3 GLY 1 HA2 GLY 1 -13.129 4.159 10.042 4 H SER 2 H SER 2 -10.861 1.625 9.892 5 HA SER 2 HA SER 2 -10.026 2.032 12.595 6 HB2 SER 2 HB3 SER 2 -8.477 0.048 11.278 7 HB3 SER 2 HB2 SER 2 -9.732 -0.173 12.456 8 HG SER 2 HG SER 2 -9.861 -0.977 10.082 9 H GLU 3 H GLU 3 -7.564 1.330 12.841 10 HA GLU 3 HA GLU 3 -5.872 3.491 12.345 11 HB2 GLU 3 HB3 GLU 3 -5.154 0.579 12.461 12 HB3 GLU 3 HB2 GLU 3 -4.079 1.932 12.858 13 HG2 GLU 3 HG3 GLU 3 -4.752 1.363 14.961 14 HG3 GLU 3 HG2 GLU 3 -6.070 2.452 14.590 15 H LEU 4 H LEU 4 -7.090 1.039 10.334 16 HA LEU 4 HA LEU 4 -5.131 0.585 8.449 17 HB2 LEU 4 HB3 LEU 4 -7.590 -0.383 8.784 18 HB3 LEU 4 HB2 LEU 4 -8.011 0.850 7.621 19 HG LEU 4 HG LEU 4 -7.578 -1.027 6.290 20 HD11 LEU 4 HD11 LEU 4 -5.523 -0.594 5.067 21 HD12 LEU 4 HD12 LEU 4 -4.890 0.385 6.376 22 HD13 LEU 4 HD13 LEU 4 -6.299 0.924 5.472 23 HD21 LEU 4 HD21 LEU 4 -5.336 -2.333 6.749 24 HD22 LEU 4 HD22 LEU 4 -6.778 -2.578 7.751 25 HD23 LEU 4 HD23 LEU 4 -5.477 -1.580 8.355 26 H GLU 5 H GLU 5 -7.768 2.992 8.444 27 HA GLU 5 HA GLU 5 -6.953 4.205 6.014 28 HB2 GLU 5 HB3 GLU 5 -8.698 5.190 8.265 29 HB3 GLU 5 HB2 GLU 5 -8.495 6.075 6.752 30 HG2 GLU 5 HG3 GLU 5 -9.291 3.943 5.556 31 HG3 GLU 5 HG2 GLU 5 -9.626 3.291 7.125 32 H THR 6 H THR 6 -6.406 5.000 9.414 33 HA THR 6 HA THR 6 -4.930 7.354 8.966 34 HB THR 6 HB THR 6 -4.530 5.409 11.236 35 HG1 THR 6 HG2 THR 6 -6.592 7.211 10.587 36 HG21 THR 6 HG21 THR 6 -4.332 7.765 12.409 37 HG22 THR 6 HG22 THR 6 -4.006 8.336 10.778 38 HG23 THR 6 HG23 THR 6 -2.967 7.114 11.506 39 H ALA 7 H ALA 7 -3.947 3.948 9.294 40 HA ALA 7 HA ALA 7 -1.175 4.309 9.106 41 HB1 ALA 7 HB1 ALA 7 -2.930 2.038 8.135 42 HB2 ALA 7 HB2 ALA 7 -2.069 2.149 9.673 43 HB3 ALA 7 HB3 ALA 7 -1.165 1.973 8.170 44 H MET 8 H MET 8 -3.615 3.848 6.556 45 HA MET 8 HA MET 8 -1.748 4.071 4.425 46 HB2 MET 8 HB3 MET 8 -4.727 4.588 4.436 47 HB3 MET 8 HB2 MET 8 -3.748 4.477 2.978 48 HG2 MET 8 HG3 MET 8 -4.222 2.282 5.021 49 HG3 MET 8 HG2 MET 8 -4.755 2.307 3.342 50 HE1 MET 8 HE1 MET 8 -1.931 1.750 1.213 51 HE2 MET 8 HE2 MET 8 -1.632 3.346 1.855 52 HE3 MET 8 HE3 MET 8 -3.292 2.837 1.547 53 H GLU 9 H GLU 9 -3.793 6.433 6.108 54 HA GLU 9 HA GLU 9 -3.102 8.662 4.494 55 HB2 GLU 9 HB3 GLU 9 -4.043 8.487 7.367 56 HB3 GLU 9 HB2 GLU 9 -3.834 10.004 6.490 57 HG2 GLU 9 HG3 GLU 9 -5.458 9.326 4.813 58 HG3 GLU 9 HG2 GLU 9 -5.642 7.743 5.536 59 H THR 10 H THR 10 -1.657 7.201 7.328 60 HA THR 10 HA THR 10 0.301 9.155 7.884 61 HB THR 10 HB THR 10 0.684 6.148 8.195 62 HG1 THR 10 HG2 THR 10 -1.355 6.931 9.037 63 HG21 THR 10 HG21 THR 10 1.585 8.109 10.231 64 HG22 THR 10 HG22 THR 10 2.466 8.147 8.707 65 HG23 THR 10 HG23 THR 10 2.368 6.659 9.632 66 H LEU 11 H LEU 11 0.273 6.364 5.719 67 HA LEU 11 HA LEU 11 2.849 6.823 4.642 68 HB2 LEU 11 HB3 LEU 11 0.449 5.361 3.530 69 HB3 LEU 11 HB2 LEU 11 1.987 5.416 2.681 70 HG LEU 11 HG LEU 11 1.716 4.413 5.534 71 HD11 LEU 11 HD11 LEU 11 1.947 2.710 3.043 72 HD12 LEU 11 HD12 LEU 11 0.396 3.049 3.821 73 HD13 LEU 11 HD13 LEU 11 1.647 2.178 4.691 74 HD21 LEU 11 HD21 LEU 11 3.878 3.997 3.423 75 HD22 LEU 11 HD22 LEU 11 3.905 3.400 5.068 76 HD23 LEU 11 HD23 LEU 11 4.034 5.119 4.776 77 H ILE 12 H ILE 12 -0.387 7.959 3.754 78 HA ILE 12 HA ILE 12 0.349 9.311 1.364 79 HB ILE 12 HB ILE 12 -1.814 9.990 3.393 80 HG12 ILE 12 HG13 ILE 12 -2.001 7.764 2.123 81 HG13 ILE 12 HG12 ILE 12 -3.343 8.880 1.903 82 HG21 ILE 12 HG21 ILE 12 -1.472 12.008 2.249 83 HG22 ILE 12 HG22 ILE 12 -2.799 11.250 1.389 84 HG23 ILE 12 HG23 ILE 12 -1.182 11.213 0.705 85 HD11 ILE 12 HD11 ILE 12 -1.012 8.656 -0.044 86 HD12 ILE 12 HD12 ILE 12 -2.500 9.584 -0.253 87 HD13 ILE 12 HD13 ILE 12 -2.559 7.833 -0.207 88 H ASN 13 H ASN 13 0.198 10.300 4.743 89 HA ASN 13 HA ASN 13 0.826 12.985 4.463 90 HB2 ASN 13 HB3 ASN 13 1.558 11.060 6.676 91 HB3 ASN 13 HB2 ASN 13 1.664 12.799 6.799 92 HD21 ASN 13 HD21 ASN 13 -0.145 10.878 8.237 93 HD22 ASN 13 HD22 ASN 13 -1.718 11.450 7.973 94 H VAL 14 H VAL 14 2.994 10.200 4.939 95 HA VAL 14 HA VAL 14 5.401 11.711 4.803 96 HB VAL 14 HB VAL 14 4.844 8.774 4.318 97 HG11 VAL 14 HG11 VAL 14 7.269 8.454 4.555 98 HG12 VAL 14 HG12 VAL 14 7.511 10.185 4.704 99 HG13 VAL 14 HG13 VAL 14 6.951 9.502 3.176 100 HG21 VAL 14 HG21 VAL 14 5.679 10.451 6.691 101 HG22 VAL 14 HG22 VAL 14 6.104 8.754 6.629 102 HG23 VAL 14 HG23 VAL 14 4.412 9.240 6.597 103 H PHE 15 H PHE 15 3.563 9.857 2.416 104 HA PHE 15 HA PHE 15 5.202 10.265 0.148 105 HB2 PHE 15 HB3 PHE 15 3.328 8.679 0.209 106 HB3 PHE 15 HB2 PHE 15 2.194 10.003 0.401 107 HD1 PHE 15 HD2 PHE 15 1.664 11.528 -1.462 108 HD2 PHE 15 HD1 PHE 15 4.421 8.255 -1.957 109 HE1 PHE 15 HE2 PHE 15 1.523 11.783 -3.900 110 HE2 PHE 15 HE1 PHE 15 4.275 8.512 -4.400 111 HZ PHE 15 HZ PHE 15 2.825 10.277 -5.385 112 H HIS 16 H HIS 16 2.417 12.007 1.390 113 HA HIS 16 HA HIS 16 2.356 14.030 -0.546 114 HB2 HIS 16 HB3 HIS 16 0.461 13.311 0.910 115 HB3 HIS 16 HB2 HIS 16 1.246 14.111 2.262 116 HD1 HIS 16 HD1 HIS 16 1.590 15.818 -1.023 117 HD2 HIS 16 HD2 HIS 16 -1.009 15.836 2.228 118 HE1 HIS 16 HE1 HIS 16 0.174 17.890 -1.298 119 HE2 HIS 16 HE2 HIS 16 -1.415 17.981 0.690 120 H ALA 17 H ALA 17 3.797 13.895 2.693 121 HA ALA 17 HA ALA 17 4.569 16.569 2.909 122 HB1 ALA 17 HB1 ALA 17 6.110 14.146 3.912 123 HB2 ALA 17 HB2 ALA 17 4.790 14.941 4.773 124 HB3 ALA 17 HB3 ALA 17 6.287 15.804 4.479 125 H HIS 18 H HIS 18 6.244 13.824 1.451 126 HA HIS 18 HA HIS 18 8.446 15.408 0.552 127 HB2 HIS 18 HB3 HIS 18 7.622 12.581 -0.020 128 HB3 HIS 18 HB2 HIS 18 8.939 13.358 -0.906 129 HD1 HIS 18 HD1 HIS 18 11.131 13.983 0.396 130 HD2 HIS 18 HD2 HIS 18 8.144 12.258 2.791 131 HE1 HIS 18 HE1 HIS 18 12.172 13.504 2.647 132 HE2 HIS 18 HE2 HIS 18 10.378 12.473 4.114 133 H SER 19 H SER 19 5.381 14.547 -0.876 134 HA SER 19 HA SER 19 5.871 15.329 -3.527 135 HB2 SER 19 HB3 SER 19 3.397 15.983 -1.886 136 HB3 SER 19 HB2 SER 19 3.532 15.916 -3.623 137 HG SER 19 HG SER 19 4.300 13.659 -3.177 138 H GLY 20 H GLY 20 5.376 17.204 -0.620 139 HA2 GLY 20 HA3 GLY 20 5.304 19.802 -1.792 140 HA3 GLY 20 HA2 GLY 20 5.706 19.428 -0.128 141 H LYS 21 H LYS 21 7.896 17.650 -0.773 142 HA LYS 21 HA LYS 21 10.026 19.500 -0.750 143 HB2 LYS 21 HB3 LYS 21 9.901 16.485 -0.987 144 HB3 LYS 21 HB2 LYS 21 11.381 17.315 -1.343 145 HG2 LYS 21 HG3 LYS 21 11.380 16.690 0.989 146 HG3 LYS 21 HG2 LYS 21 11.338 18.436 0.858 147 HD2 LYS 21 HD3 LYS 21 9.280 18.589 1.819 148 HD3 LYS 21 HD2 LYS 21 8.648 17.241 0.916 149 HE2 LYS 21 HE2 LYS 21 8.659 16.585 3.248 150 HE3 LYS 21 HE1 LYS 21 9.924 15.670 2.447 151 HZ1 LYS 21 HZ1 LYS 21 10.733 16.577 4.478 152 HZ2 LYS 21 HZ2 LYS 21 10.224 18.125 4.059 153 HZ3 LYS 21 HZ3 LYS 21 11.525 17.408 3.226 154 H GLU 22 H GLU 22 9.448 17.027 -3.245 155 HA GLU 22 HA GLU 22 11.196 18.196 -5.084 156 HB2 GLU 22 HB3 GLU 22 9.879 16.727 -6.771 157 HB3 GLU 22 HB2 GLU 22 10.757 15.965 -5.462 158 HG2 GLU 22 HG3 GLU 22 8.879 15.116 -4.537 159 HG3 GLU 22 HG2 GLU 22 8.055 16.656 -4.559 160 H GLY 23 H GLY 23 7.642 18.431 -4.856 161 HA2 GLY 23 HA3 GLY 23 6.556 20.519 -5.079 162 HA3 GLY 23 HA2 GLY 23 7.870 21.089 -6.063 163 H ASP 24 H ASP 24 6.746 18.021 -7.221 164 HA ASP 24 HA ASP 24 5.787 19.144 -9.674 165 HB2 ASP 24 HB3 ASP 24 6.396 16.623 -9.271 166 HB3 ASP 24 HB2 ASP 24 4.836 16.535 -8.506 167 H LYS 25 H LYS 25 4.162 17.813 -6.935 168 HA LYS 25 HA LYS 25 2.227 19.465 -6.248 169 HB2 LYS 25 HB3 LYS 25 0.170 18.803 -7.441 170 HB3 LYS 25 HB2 LYS 25 1.292 19.476 -8.574 171 HG2 LYS 25 HG3 LYS 25 2.055 17.036 -9.086 172 HG3 LYS 25 HG2 LYS 25 0.615 16.508 -8.245 173 HD2 LYS 25 HD3 LYS 25 0.588 18.467 -10.548 174 HD3 LYS 25 HD2 LYS 25 0.330 16.729 -10.704 175 HE2 LYS 25 HE2 LYS 25 -1.579 16.896 -9.124 176 HE3 LYS 25 HE1 LYS 25 -1.413 18.647 -9.084 177 HZ1 LYS 25 HZ1 LYS 25 -1.518 17.691 -11.785 178 HZ2 LYS 25 HZ2 LYS 25 -2.508 18.798 -11.013 179 HZ3 LYS 25 HZ3 LYS 25 -2.863 17.161 -10.925 180 H TYR 26 H TYR 26 0.133 17.081 -6.360 181 HA TYR 26 HA TYR 26 1.491 15.636 -4.243 182 HB2 TYR 26 HB3 TYR 26 -0.610 14.192 -4.304 183 HB3 TYR 26 HB2 TYR 26 -0.833 15.867 -3.820 184 HD1 TYR 26 HD1 TYR 26 -1.895 17.497 -5.327 185 HD2 TYR 26 HD2 TYR 26 -1.423 13.379 -6.459 186 HE1 TYR 26 HE1 TYR 26 -3.469 17.825 -7.180 187 HE2 TYR 26 HE2 TYR 26 -2.987 13.702 -8.309 188 HH TYR 26 HH TYR 26 -5.096 16.091 -8.574 189 H LYS 27 H LYS 27 3.219 14.755 -5.144 190 HA LYS 27 HA LYS 27 2.876 12.249 -6.474 191 HB2 LYS 27 HB3 LYS 27 4.474 14.484 -7.791 192 HB3 LYS 27 HB2 LYS 27 4.761 12.791 -8.136 193 HG2 LYS 27 HG3 LYS 27 2.223 14.351 -8.665 194 HG3 LYS 27 HG2 LYS 27 3.391 13.807 -9.829 195 HD2 LYS 27 HD3 LYS 27 2.549 11.471 -8.257 196 HD3 LYS 27 HD2 LYS 27 1.157 12.245 -8.995 197 HE2 LYS 27 HE2 LYS 27 3.656 11.260 -10.378 198 HE3 LYS 27 HE1 LYS 27 2.057 10.567 -10.515 199 HZ1 LYS 27 HZ1 LYS 27 2.013 13.358 -11.204 200 HZ2 LYS 27 HZ2 LYS 27 1.571 12.007 -12.108 201 HZ3 LYS 27 HZ3 LYS 27 3.187 12.510 -12.078 202 H LEU 28 H LEU 28 5.060 11.150 -6.551 203 HA LEU 28 HA LEU 28 6.891 12.389 -4.673 204 HB2 LEU 28 HB3 LEU 28 5.784 10.617 -3.438 205 HB3 LEU 28 HB2 LEU 28 6.126 9.451 -4.714 206 HG LEU 28 HG LEU 28 8.607 9.968 -4.358 207 HD11 LEU 28 HD11 LEU 28 8.337 12.120 -3.195 208 HD12 LEU 28 HD12 LEU 28 9.200 10.964 -2.199 209 HD13 LEU 28 HD13 LEU 28 7.497 11.299 -1.878 210 HD21 LEU 28 HD21 LEU 28 7.419 7.959 -3.433 211 HD22 LEU 28 HD22 LEU 28 7.136 8.866 -1.945 212 HD23 LEU 28 HD23 LEU 28 8.788 8.495 -2.463 213 H SER 29 H SER 29 8.802 12.625 -5.580 214 HA SER 29 HA SER 29 9.375 11.283 -8.110 215 HB2 SER 29 HB3 SER 29 11.394 12.843 -8.019 216 HB3 SER 29 HB2 SER 29 9.808 13.569 -8.174 217 HG SER 29 HG SER 29 9.870 14.237 -6.146 218 H LYS 30 H LYS 30 11.455 10.169 -8.410 219 HA LYS 30 HA LYS 30 12.036 8.473 -6.166 220 HB2 LYS 30 HB3 LYS 30 13.803 8.787 -8.595 221 HB3 LYS 30 HB2 LYS 30 13.653 7.395 -7.541 222 HG2 LYS 30 HG3 LYS 30 11.625 8.397 -9.561 223 HG3 LYS 30 HG2 LYS 30 12.499 6.865 -9.529 224 HD2 LYS 30 HD3 LYS 30 10.951 7.181 -7.052 225 HD3 LYS 30 HD2 LYS 30 9.931 7.359 -8.478 226 HE2 LYS 30 HE2 LYS 30 11.867 5.092 -8.472 227 HE3 LYS 30 HE1 LYS 30 10.507 4.980 -7.384 228 HZ1 LYS 30 HZ1 LYS 30 9.049 4.666 -9.082 229 HZ2 LYS 30 HZ2 LYS 30 10.438 4.219 -9.854 230 HZ3 LYS 30 HZ3 LYS 30 9.801 5.772 -10.161 231 H LYS 31 H LYS 31 12.751 11.552 -6.846 232 HA LYS 31 HA LYS 31 15.424 11.991 -6.025 233 HB2 LYS 31 HB3 LYS 31 12.932 13.676 -5.669 234 HB3 LYS 31 HB2 LYS 31 14.570 14.250 -5.573 235 HG2 LYS 31 HG3 LYS 31 14.973 13.609 -7.919 236 HG3 LYS 31 HG2 LYS 31 13.355 12.990 -8.012 237 HD2 LYS 31 HD3 LYS 31 12.450 15.237 -7.411 238 HD3 LYS 31 HD2 LYS 31 14.081 15.890 -7.505 239 HE2 LYS 31 HE2 LYS 31 12.759 14.374 -9.731 240 HE3 LYS 31 HE1 LYS 31 12.694 16.126 -9.613 241 HZ1 LYS 31 HZ1 LYS 31 15.394 15.485 -9.310 242 HZ2 LYS 31 HZ2 LYS 31 14.616 16.158 -10.649 243 HZ3 LYS 31 HZ3 LYS 31 14.843 14.506 -10.582 244 H GLU 32 H GLU 32 12.295 11.945 -4.465 245 HA GLU 32 HA GLU 32 13.384 12.345 -1.783 246 HB2 GLU 32 HB3 GLU 32 10.607 12.413 -2.957 247 HB3 GLU 32 HB2 GLU 32 10.994 12.736 -1.254 248 HG2 GLU 32 HG3 GLU 32 12.189 14.235 -3.600 249 HG3 GLU 32 HG2 GLU 32 10.807 14.798 -2.720 250 H LEU 33 H LEU 33 11.886 9.939 -3.773 251 HA LEU 33 HA LEU 33 10.729 8.319 -1.835 252 HB2 LEU 33 HB3 LEU 33 10.322 8.020 -4.254 253 HB3 LEU 33 HB2 LEU 33 11.966 7.442 -4.472 254 HG LEU 33 HG LEU 33 10.091 5.702 -4.295 255 HD11 LEU 33 HD11 LEU 33 11.789 4.287 -4.011 256 HD12 LEU 33 HD12 LEU 33 12.003 4.752 -2.333 257 HD13 LEU 33 HD13 LEU 33 12.826 5.645 -3.599 258 HD21 LEU 33 HD21 LEU 33 10.412 6.360 -1.316 259 HD22 LEU 33 HD22 LEU 33 9.608 4.957 -1.962 260 HD23 LEU 33 HD23 LEU 33 8.948 6.548 -2.282 261 H LYS 34 H LYS 34 14.015 8.276 -3.157 262 HA LYS 34 HA LYS 34 14.950 6.053 -1.654 263 HB2 LYS 34 HB3 LYS 34 16.445 8.460 -2.733 264 HB3 LYS 34 HB2 LYS 34 17.209 7.056 -2.027 265 HG2 LYS 34 HG3 LYS 34 15.336 6.854 -4.421 266 HG3 LYS 34 HG2 LYS 34 17.082 7.024 -4.561 267 HD2 LYS 34 HD3 LYS 34 17.386 4.952 -3.212 268 HD3 LYS 34 HD2 LYS 34 15.636 4.759 -3.139 269 HE2 LYS 34 HE2 LYS 34 15.482 4.534 -5.552 270 HE3 LYS 34 HE1 LYS 34 17.192 4.901 -5.744 271 HZ1 LYS 34 HZ1 LYS 34 17.805 2.904 -4.863 272 HZ2 LYS 34 HZ2 LYS 34 16.510 2.487 -5.803 273 HZ3 LYS 34 HZ3 LYS 34 16.342 2.580 -4.094 274 H GLU 35 H GLU 35 14.894 9.536 -1.023 275 HA GLU 35 HA GLU 35 16.297 9.516 1.408 276 HB2 GLU 35 HB3 GLU 35 14.203 11.396 0.313 277 HB3 GLU 35 HB2 GLU 35 15.011 11.649 1.852 278 HG2 GLU 35 HG3 GLU 35 16.501 11.256 -0.757 279 HG3 GLU 35 HG2 GLU 35 16.100 12.833 -0.100 280 H LEU 36 H LEU 36 12.759 9.756 0.957 281 HA LEU 36 HA LEU 36 12.325 9.444 3.720 282 HB2 LEU 36 HB3 LEU 36 9.944 9.257 3.252 283 HB3 LEU 36 HB2 LEU 36 10.682 10.568 2.349 284 HG LEU 36 HG LEU 36 10.958 8.550 0.526 285 HD11 LEU 36 HD11 LEU 36 8.182 8.032 1.479 286 HD12 LEU 36 HD12 LEU 36 9.484 7.215 2.352 287 HD13 LEU 36 HD13 LEU 36 9.309 7.000 0.612 288 HD21 LEU 36 HD21 LEU 36 8.828 9.452 -0.454 289 HD22 LEU 36 HD22 LEU 36 10.034 10.677 -0.017 290 HD23 LEU 36 HD23 LEU 36 8.624 10.419 1.012 291 H LEU 37 H LEU 37 12.263 7.091 1.101 292 HA LEU 37 HA LEU 37 11.134 5.042 2.615 293 HB2 LEU 37 HB3 LEU 37 11.272 4.883 0.158 294 HB3 LEU 37 HB2 LEU 37 13.029 4.826 0.237 295 HG LEU 37 HG LEU 37 11.767 2.608 -0.075 296 HD11 LEU 37 HD11 LEU 37 14.210 3.115 0.973 297 HD12 LEU 37 HD12 LEU 37 13.548 1.498 0.771 298 HD13 LEU 37 HD13 LEU 37 13.464 2.278 2.333 299 HD21 LEU 37 HD21 LEU 37 10.689 1.611 1.698 300 HD22 LEU 37 HD22 LEU 37 10.152 3.277 1.899 301 HD23 LEU 37 HD23 LEU 37 11.450 2.626 2.910 302 H GLN 38 H GLN 38 14.548 5.865 2.062 303 HA GLN 38 HA GLN 38 15.460 3.797 3.800 304 HB2 GLN 38 HB3 GLN 38 17.652 4.778 3.654 305 HB3 GLN 38 HB2 GLN 38 16.928 4.907 2.056 306 HG2 GLN 38 HG3 GLN 38 16.305 7.270 2.569 307 HG3 GLN 38 HG2 GLN 38 17.088 7.128 4.135 308 HE21 GLN 38 HE21 GLN 38 18.310 9.042 2.943 309 HE22 GLN 38 HE22 GLN 38 19.710 8.595 2.104 310 H THR 39 H THR 39 14.693 7.193 4.218 311 HA THR 39 HA THR 39 15.597 7.466 6.869 312 HB THR 39 HB THR 39 13.355 8.886 5.432 313 HG1 THR 39 HG2 THR 39 15.131 9.258 4.337 314 HG21 THR 39 HG21 THR 39 14.898 9.624 7.931 315 HG22 THR 39 HG22 THR 39 13.185 9.208 7.802 316 HG23 THR 39 HG23 THR 39 13.781 10.685 7.064 317 H GLU 40 H GLU 40 12.292 6.857 5.637 318 HA GLU 40 HA GLU 40 11.266 6.742 8.259 319 HB2 GLU 40 HB3 GLU 40 9.942 5.954 5.658 320 HB3 GLU 40 HB2 GLU 40 9.133 6.227 7.199 321 HG2 GLU 40 HG3 GLU 40 10.740 8.319 5.677 322 HG3 GLU 40 HG2 GLU 40 8.997 8.254 5.776 323 H LEU 41 H LEU 41 12.030 4.261 5.899 324 HA LEU 41 HA LEU 41 11.094 2.140 7.696 325 HB2 LEU 41 HB3 LEU 41 12.008 2.197 4.836 326 HB3 LEU 41 HB2 LEU 41 11.886 0.712 5.700 327 HG LEU 41 HG LEU 41 9.505 1.250 6.349 328 HD11 LEU 41 HD11 LEU 41 9.375 3.605 6.109 329 HD12 LEU 41 HD12 LEU 41 8.377 2.947 4.824 330 HD13 LEU 41 HD13 LEU 41 9.986 3.556 4.453 331 HD21 LEU 41 HD21 LEU 41 10.522 0.245 3.890 332 HD22 LEU 41 HD22 LEU 41 9.170 1.294 3.474 333 HD23 LEU 41 HD23 LEU 41 8.936 -0.035 4.603 334 H SER 42 H SER 42 13.220 3.477 8.760 335 HA SER 42 HA SER 42 15.759 2.699 8.035 336 HB2 SER 42 HB3 SER 42 15.200 2.881 10.958 337 HB3 SER 42 HB2 SER 42 16.441 3.616 9.995 338 HG SER 42 HG SER 42 14.946 5.119 9.182 339 H GLY 43 H GLY 43 13.383 0.951 10.038 340 HA2 GLY 43 HA3 GLY 43 15.124 -1.093 10.970 341 HA3 GLY 43 HA2 GLY 43 13.368 -1.141 10.926 342 H PHE 44 H PHE 44 12.853 -0.896 8.266 343 HA PHE 44 HA PHE 44 13.374 -3.573 7.319 344 HB2 PHE 44 HB3 PHE 44 12.025 -1.189 6.029 345 HB3 PHE 44 HB2 PHE 44 12.245 -2.717 5.185 346 HD1 PHE 44 HD2 PHE 44 11.077 -4.766 5.963 347 HD2 PHE 44 HD1 PHE 44 10.484 -0.959 7.833 348 HE1 PHE 44 HE2 PHE 44 9.036 -5.641 7.090 349 HE2 PHE 44 HE1 PHE 44 8.423 -1.846 8.954 350 HZ PHE 44 HZ PHE 44 7.726 -4.179 8.572 351 H LEU 45 H LEU 45 14.499 -0.358 6.633 352 HA LEU 45 HA LEU 45 16.187 -0.950 4.466 353 HB2 LEU 45 HB3 LEU 45 15.644 1.308 4.934 354 HB3 LEU 45 HB2 LEU 45 16.257 1.230 6.571 355 HG LEU 45 HG LEU 45 18.469 0.738 5.703 356 HD11 LEU 45 HD11 LEU 45 18.445 1.602 3.020 357 HD12 LEU 45 HD12 LEU 45 16.998 0.622 3.132 358 HD13 LEU 45 HD13 LEU 45 18.563 -0.065 3.556 359 HD21 LEU 45 HD21 LEU 45 17.041 3.273 5.105 360 HD22 LEU 45 HD22 LEU 45 18.665 3.105 4.419 361 HD23 LEU 45 HD23 LEU 45 18.419 2.957 6.157 362 H ASP 46 H ASP 46 16.747 -0.911 7.962 363 HA ASP 46 HA ASP 46 19.499 -1.605 7.931 364 HB2 ASP 46 HB3 ASP 46 18.432 -0.797 9.938 365 HB3 ASP 46 HB2 ASP 46 17.320 -2.158 9.952 366 H ALA 47 H ALA 47 16.603 -3.614 8.115 367 HA ALA 47 HA ALA 47 18.044 -6.088 8.116 368 HB1 ALA 47 HB1 ALA 47 15.175 -5.317 7.884 369 HB2 ALA 47 HB2 ALA 47 15.980 -6.382 9.040 370 HB3 ALA 47 HB3 ALA 47 15.658 -6.947 7.403 371 H GLN 48 H GLN 48 16.495 -4.147 5.615 372 HA GLN 48 HA GLN 48 16.769 -6.145 3.609 373 HB2 GLN 48 HB3 GLN 48 15.976 -3.238 3.446 374 HB3 GLN 48 HB2 GLN 48 16.042 -4.306 2.053 375 HG2 GLN 48 HG3 GLN 48 14.390 -4.872 4.544 376 HG3 GLN 48 HG2 GLN 48 13.767 -4.244 3.026 377 HE21 GLN 48 HE21 GLN 48 14.508 -7.132 4.693 378 HE22 GLN 48 HE22 GLN 48 14.400 -8.174 3.357 379 H LYS 49 H LYS 49 19.217 -4.773 4.936 380 HA LYS 49 HA LYS 49 20.676 -3.704 2.745 381 HB2 LYS 49 HB3 LYS 49 21.601 -4.814 5.395 382 HB3 LYS 49 HB2 LYS 49 22.725 -4.256 4.149 383 HG2 LYS 49 HG3 LYS 49 21.655 -2.063 4.138 384 HG3 LYS 49 HG2 LYS 49 20.495 -2.614 5.353 385 HD2 LYS 49 HD3 LYS 49 22.268 -2.929 6.992 386 HD3 LYS 49 HD2 LYS 49 23.502 -2.631 5.781 387 HE2 LYS 49 HE2 LYS 49 22.909 -0.695 7.355 388 HE3 LYS 49 HE1 LYS 49 23.015 -0.322 5.648 389 HZ1 LYS 49 HZ1 LYS 49 20.336 -1.144 6.292 390 HZ2 LYS 49 HZ2 LYS 49 20.923 0.315 5.656 391 HZ3 LYS 49 HZ3 LYS 49 20.878 0.096 7.313 392 H ASP 50 H ASP 50 20.466 -7.020 4.025 393 HA ASP 50 HA ASP 50 21.947 -7.928 1.637 394 HB2 ASP 50 HB3 ASP 50 23.000 -8.235 4.022 395 HB3 ASP 50 HB2 ASP 50 21.845 -9.553 4.148 396 H VAL 51 H VAL 51 19.203 -7.517 1.569 397 HA VAL 51 HA VAL 51 18.218 -10.300 1.382 398 HB VAL 51 HB VAL 51 16.696 -7.735 1.884 399 HG11 VAL 51 HG11 VAL 51 14.853 -9.719 2.197 400 HG12 VAL 51 HG12 VAL 51 15.777 -10.352 0.859 401 HG13 VAL 51 HG13 VAL 51 15.037 -8.748 0.746 402 HG21 VAL 51 HG21 VAL 51 17.909 -9.640 3.638 403 HG22 VAL 51 HG22 VAL 51 16.179 -9.896 3.746 404 HG23 VAL 51 HG23 VAL 51 16.855 -8.304 4.074 405 H ASP 52 H ASP 52 17.489 -11.020 -0.511 406 HA ASP 52 HA ASP 52 18.336 -9.847 -2.909 407 HB2 ASP 52 HB3 ASP 52 17.927 -12.269 -2.621 408 HB3 ASP 52 HB2 ASP 52 16.203 -11.920 -2.507 409 H ALA 53 H ALA 53 15.202 -9.881 -1.362 410 HA ALA 53 HA ALA 53 13.579 -9.069 -3.436 411 HB1 ALA 53 HB1 ALA 53 12.099 -9.460 -1.820 412 HB2 ALA 53 HB2 ALA 53 12.450 -7.860 -1.185 413 HB3 ALA 53 HB3 ALA 53 13.307 -9.251 -0.554 414 H VAL 54 H VAL 54 15.367 -6.979 -1.181 415 HA VAL 54 HA VAL 54 14.127 -4.619 -1.822 416 HB VAL 54 HB VAL 54 15.727 -4.820 0.028 417 HG11 VAL 54 HG11 VAL 54 18.014 -5.166 -0.236 418 HG12 VAL 54 HG12 VAL 54 18.049 -4.487 -1.853 419 HG13 VAL 54 HG13 VAL 54 17.406 -6.098 -1.586 420 HG21 VAL 54 HG21 VAL 54 15.179 -2.560 -1.183 421 HG22 VAL 54 HG22 VAL 54 16.800 -2.680 -1.833 422 HG23 VAL 54 HG23 VAL 54 16.556 -2.598 -0.094 423 H ASP 55 H ASP 55 16.818 -6.168 -3.482 424 HA ASP 55 HA ASP 55 17.375 -4.160 -5.391 425 HB2 ASP 55 HB3 ASP 55 18.887 -6.005 -5.135 426 HB3 ASP 55 HB2 ASP 55 17.592 -7.153 -5.492 427 H LYS 56 H LYS 56 15.236 -6.949 -5.520 428 HA LYS 56 HA LYS 56 14.282 -6.444 -8.146 429 HB2 LYS 56 HB3 LYS 56 12.666 -7.926 -6.084 430 HB3 LYS 56 HB2 LYS 56 12.802 -8.230 -7.804 431 HG2 LYS 56 HG3 LYS 56 14.928 -8.727 -5.702 432 HG3 LYS 56 HG2 LYS 56 14.051 -9.917 -6.631 433 HD2 LYS 56 HD3 LYS 56 14.987 -9.156 -8.689 434 HD3 LYS 56 HD2 LYS 56 15.856 -7.844 -7.914 435 HE2 LYS 56 HE2 LYS 56 16.330 -10.813 -7.337 436 HE3 LYS 56 HE1 LYS 56 17.360 -9.765 -8.306 437 HZ1 LYS 56 HZ1 LYS 56 18.084 -8.616 -6.497 438 HZ2 LYS 56 HZ2 LYS 56 17.871 -10.146 -5.835 439 HZ3 LYS 56 HZ3 LYS 56 16.754 -8.966 -5.489 440 H VAL 57 H VAL 57 13.064 -5.637 -4.957 441 HA VAL 57 HA VAL 57 10.635 -4.403 -5.838 442 HB VAL 57 HB VAL 57 12.228 -4.140 -3.265 443 HG11 VAL 57 HG11 VAL 57 10.743 -2.215 -3.724 444 HG12 VAL 57 HG12 VAL 57 10.212 -3.141 -2.314 445 HG13 VAL 57 HG13 VAL 57 9.382 -3.318 -3.868 446 HG21 VAL 57 HG21 VAL 57 9.700 -5.700 -3.895 447 HG22 VAL 57 HG22 VAL 57 10.579 -5.718 -2.363 448 HG23 VAL 57 HG23 VAL 57 11.300 -6.420 -3.804 449 H MET 58 H MET 58 13.841 -3.311 -4.963 450 HA MET 58 HA MET 58 13.475 -0.571 -5.417 451 HB2 MET 58 HB3 MET 58 15.412 -1.398 -4.193 452 HB3 MET 58 HB2 MET 58 15.944 -2.313 -5.606 453 HG2 MET 58 HG3 MET 58 16.275 -0.393 -6.834 454 HG3 MET 58 HG2 MET 58 15.633 0.704 -5.595 455 HE1 MET 58 HE1 MET 58 18.508 -0.919 -7.191 456 HE2 MET 58 HE2 MET 58 18.315 -2.264 -6.075 457 HE3 MET 58 HE3 MET 58 19.736 -1.243 -5.961 458 H LYS 59 H LYS 59 14.316 -3.292 -7.498 459 HA LYS 59 HA LYS 59 15.028 -1.852 -9.763 460 HB2 LYS 59 HB3 LYS 59 15.387 -4.319 -9.524 461 HB3 LYS 59 HB2 LYS 59 13.653 -4.553 -9.686 462 HG2 LYS 59 HG3 LYS 59 14.494 -4.934 -11.828 463 HG3 LYS 59 HG2 LYS 59 13.819 -3.328 -11.960 464 HD2 LYS 59 HD3 LYS 59 16.731 -3.667 -11.202 465 HD3 LYS 59 HD2 LYS 59 16.249 -3.895 -12.866 466 HE2 LYS 59 HE2 LYS 59 16.345 -1.361 -11.287 467 HE3 LYS 59 HE1 LYS 59 16.702 -1.658 -12.960 468 HZ1 LYS 59 HZ1 LYS 59 14.247 -1.816 -13.427 469 HZ2 LYS 59 HZ2 LYS 59 14.840 -0.369 -12.810 470 HZ3 LYS 59 HZ3 LYS 59 13.938 -1.357 -11.802 471 H GLU 60 H GLU 60 11.914 -3.120 -8.645 472 HA GLU 60 HA GLU 60 10.349 -2.370 -10.850 473 HB2 GLU 60 HB3 GLU 60 9.623 -2.657 -7.932 474 HB3 GLU 60 HB2 GLU 60 8.464 -2.423 -9.226 475 HG2 GLU 60 HG3 GLU 60 9.223 -4.498 -10.330 476 HG3 GLU 60 HG2 GLU 60 10.447 -4.718 -9.089 477 H LEU 61 H LEU 61 11.128 -0.663 -7.877 478 HA LEU 61 HA LEU 61 9.652 1.717 -8.468 479 HB2 LEU 61 HB3 LEU 61 11.918 1.056 -6.610 480 HB3 LEU 61 HB2 LEU 61 11.509 2.744 -6.894 481 HG LEU 61 HG LEU 61 10.393 1.486 -4.900 482 HD11 LEU 61 HD11 LEU 61 9.774 3.752 -5.678 483 HD12 LEU 61 HD12 LEU 61 8.372 2.831 -5.134 484 HD13 LEU 61 HD13 LEU 61 8.681 3.017 -6.850 485 HD21 LEU 61 HD21 LEU 61 8.444 0.204 -5.362 486 HD22 LEU 61 HD22 LEU 61 9.635 -0.457 -6.447 487 HD23 LEU 61 HD23 LEU 61 8.407 0.664 -7.052 488 H ASP 62 H ASP 62 12.889 0.592 -9.135 489 HA ASP 62 HA ASP 62 13.874 2.936 -10.403 490 HB2 ASP 62 HB3 ASP 62 15.439 1.287 -9.722 491 HB3 ASP 62 HB2 ASP 62 14.688 0.035 -10.680 492 H GLU 63 H GLU 63 12.082 0.143 -11.668 493 HA GLU 63 HA GLU 63 12.275 0.720 -14.434 494 HB2 GLU 63 HB3 GLU 63 9.855 -0.345 -12.921 495 HB3 GLU 63 HB2 GLU 63 10.096 -0.407 -14.650 496 HG2 GLU 63 HG3 GLU 63 11.910 -1.753 -12.631 497 HG3 GLU 63 HG2 GLU 63 10.642 -2.527 -13.537 498 H ASN 64 H ASN 64 10.183 1.891 -11.921 499 HA ASN 64 HA ASN 64 8.965 3.852 -13.717 500 HB2 ASN 64 HB3 ASN 64 8.210 2.626 -11.177 501 HB3 ASN 64 HB2 ASN 64 7.882 4.371 -11.246 502 HD21 ASN 64 HD21 ASN 64 5.575 3.603 -11.249 503 HD22 ASN 64 HD22 ASN 64 4.853 3.161 -12.734 504 H GLY 65 H GLY 65 11.814 3.821 -12.728 505 HA2 GLY 65 HA3 GLY 65 11.968 6.310 -11.250 506 HA3 GLY 65 HA2 GLY 65 13.353 5.395 -11.894 507 H ASP 66 H ASP 66 11.254 5.365 -14.300 508 HA ASP 66 HA ASP 66 12.535 7.201 -16.009 509 HB2 ASP 66 HB3 ASP 66 9.806 5.871 -16.149 510 HB3 ASP 66 HB2 ASP 66 10.503 6.842 -17.431 511 H GLY 67 H GLY 67 9.682 7.356 -13.979 512 HA2 GLY 67 HA3 GLY 67 9.572 10.279 -14.357 513 HA3 GLY 67 HA2 GLY 67 8.114 9.285 -14.429 514 H GLU 68 H GLU 68 7.060 9.942 -12.668 515 HA GLU 68 HA GLU 68 8.416 10.274 -10.115 516 HB2 GLU 68 HB3 GLU 68 5.465 10.405 -10.534 517 HB3 GLU 68 HB2 GLU 68 6.438 11.343 -9.414 518 HG2 GLU 68 HG3 GLU 68 6.251 12.992 -10.955 519 HG3 GLU 68 HG2 GLU 68 7.505 12.143 -11.827 520 H VAL 69 H VAL 69 7.190 9.352 -8.183 521 HA VAL 69 HA VAL 69 6.158 6.652 -8.725 522 HB VAL 69 HB VAL 69 8.167 6.167 -7.609 523 HG11 VAL 69 HG11 VAL 69 8.830 8.519 -7.072 524 HG12 VAL 69 HG12 VAL 69 9.040 7.438 -5.699 525 HG13 VAL 69 HG13 VAL 69 7.652 8.506 -5.755 526 HG21 VAL 69 HG21 VAL 69 6.352 6.610 -5.224 527 HG22 VAL 69 HG22 VAL 69 7.534 5.330 -5.452 528 HG23 VAL 69 HG23 VAL 69 6.057 5.341 -6.399 529 H ASP 70 H ASP 70 4.109 6.417 -8.103 530 HA ASP 70 HA ASP 70 2.916 8.645 -6.669 531 HB2 ASP 70 HB3 ASP 70 0.929 8.144 -7.647 532 HB3 ASP 70 HB2 ASP 70 1.994 7.416 -8.839 533 H PHE 71 H PHE 71 0.899 7.751 -5.383 534 HA PHE 71 HA PHE 71 1.999 6.764 -3.000 535 HB2 PHE 71 HB3 PHE 71 -0.073 8.158 -3.142 536 HB3 PHE 71 HB2 PHE 71 -0.919 6.744 -3.775 537 HD1 PHE 71 HD1 PHE 71 1.435 7.557 -0.985 538 HD2 PHE 71 HD2 PHE 71 -2.135 5.498 -2.208 539 HE1 PHE 71 HE1 PHE 71 1.093 6.784 1.328 540 HE2 PHE 71 HE2 PHE 71 -2.469 4.726 0.137 541 HZ PHE 71 HZ PHE 71 -0.867 5.368 1.893 542 H GLN 72 H GLN 72 0.087 5.219 -5.551 543 HA GLN 72 HA GLN 72 -0.203 2.688 -4.350 544 HB2 GLN 72 HB3 GLN 72 -0.097 3.541 -7.252 545 HB3 GLN 72 HB2 GLN 72 -0.545 1.914 -6.733 546 HG2 GLN 72 HG3 GLN 72 -2.409 2.824 -5.444 547 HG3 GLN 72 HG2 GLN 72 -1.929 4.470 -5.875 548 HE21 GLN 72 HE21 GLN 72 -2.240 5.147 -8.128 549 HE22 GLN 72 HE22 GLN 72 -3.274 4.287 -9.151 550 H GLU 73 H GLU 73 2.254 4.012 -6.539 551 HA GLU 73 HA GLU 73 3.895 1.682 -6.565 552 HB2 GLU 73 HB3 GLU 73 4.045 3.334 -8.321 553 HB3 GLU 73 HB2 GLU 73 4.543 4.575 -7.200 554 HG2 GLU 73 HG3 GLU 73 6.623 3.353 -6.704 555 HG3 GLU 73 HG2 GLU 73 6.127 2.012 -7.718 556 H TYR 74 H TYR 74 3.839 4.615 -4.601 557 HA TYR 74 HA TYR 74 6.171 4.069 -3.106 558 HB2 TYR 74 HB3 TYR 74 5.264 6.281 -3.015 559 HB3 TYR 74 HB2 TYR 74 3.725 5.677 -2.405 560 HD1 TYR 74 HD1 TYR 74 7.322 5.011 -1.440 561 HD2 TYR 74 HD2 TYR 74 3.411 6.305 -0.164 562 HE1 TYR 74 HE1 TYR 74 8.131 5.196 0.872 563 HE2 TYR 74 HE2 TYR 74 4.232 6.492 2.149 564 HH TYR 74 HH TYR 74 7.179 6.782 3.061 565 H VAL 75 H VAL 75 2.760 3.246 -2.360 566 HA VAL 75 HA VAL 75 3.457 2.101 0.095 567 HB VAL 75 HB VAL 75 1.251 1.031 0.133 568 HG11 VAL 75 HG11 VAL 75 -0.074 3.176 -0.163 569 HG12 VAL 75 HG12 VAL 75 1.400 3.923 -0.767 570 HG13 VAL 75 HG13 VAL 75 1.338 3.295 0.879 571 HG21 VAL 75 HG21 VAL 75 -0.093 0.789 -1.710 572 HG22 VAL 75 HG22 VAL 75 1.393 0.871 -2.616 573 HG23 VAL 75 HG23 VAL 75 0.409 2.318 -2.402 574 H VAL 76 H VAL 76 3.249 0.635 -3.123 575 HA VAL 76 HA VAL 76 3.490 -1.999 -2.161 576 HB VAL 76 HB VAL 76 2.667 -1.474 -4.430 577 HG11 VAL 76 HG11 VAL 76 3.993 0.275 -5.159 578 HG12 VAL 76 HG12 VAL 76 4.427 -1.074 -6.201 579 HG13 VAL 76 HG13 VAL 76 5.516 -0.580 -4.904 580 HG21 VAL 76 HG21 VAL 76 4.703 -3.131 -5.467 581 HG22 VAL 76 HG22 VAL 76 3.186 -3.639 -4.766 582 HG23 VAL 76 HG23 VAL 76 4.619 -3.546 -3.756 583 H LEU 77 H LEU 77 5.823 0.496 -2.937 584 HA LEU 77 HA LEU 77 8.167 -1.083 -2.905 585 HB2 LEU 77 HB3 LEU 77 8.183 1.284 -3.652 586 HB3 LEU 77 HB2 LEU 77 7.740 1.777 -2.030 587 HG LEU 77 HG LEU 77 9.823 0.909 -1.112 588 HD11 LEU 77 HD11 LEU 77 10.060 -0.312 -3.794 589 HD12 LEU 77 HD12 LEU 77 10.655 -0.849 -2.216 590 HD13 LEU 77 HD13 LEU 77 11.549 0.358 -3.120 591 HD21 LEU 77 HD21 LEU 77 9.669 3.032 -3.111 592 HD22 LEU 77 HD22 LEU 77 11.283 2.332 -3.036 593 HD23 LEU 77 HD23 LEU 77 10.537 2.978 -1.582 594 H VAL 78 H VAL 78 6.550 0.728 -0.288 595 HA VAL 78 HA VAL 78 8.330 -0.315 1.679 596 HB VAL 78 HB VAL 78 6.904 0.744 3.335 597 HG11 VAL 78 HG11 VAL 78 8.307 2.041 1.394 598 HG12 VAL 78 HG12 VAL 78 7.491 2.874 2.725 599 HG13 VAL 78 HG13 VAL 78 6.709 2.744 1.159 600 HG21 VAL 78 HG21 VAL 78 4.796 1.863 2.646 601 HG22 VAL 78 HG22 VAL 78 4.657 0.135 2.360 602 HG23 VAL 78 HG23 VAL 78 5.018 1.242 1.027 603 H ALA 79 H ALA 79 5.068 -1.159 0.613 604 HA ALA 79 HA ALA 79 4.612 -3.162 2.554 605 HB1 ALA 79 HB1 ALA 79 2.906 -2.064 0.963 606 HB2 ALA 79 HB2 ALA 79 2.724 -3.781 1.337 607 HB3 ALA 79 HB3 ALA 79 3.433 -3.283 -0.198 608 H ALA 80 H ALA 80 5.998 -3.313 -0.707 609 HA ALA 80 HA ALA 80 6.185 -6.093 -0.910 610 HB1 ALA 80 HB1 ALA 80 6.623 -4.626 -2.796 611 HB2 ALA 80 HB2 ALA 80 7.986 -5.690 -2.507 612 HB3 ALA 80 HB3 ALA 80 8.064 -3.992 -1.994 613 H LEU 81 H LEU 81 8.457 -3.707 0.353 614 HA LEU 81 HA LEU 81 10.400 -5.553 1.279 615 HB2 LEU 81 HB3 LEU 81 9.708 -2.757 2.175 616 HB3 LEU 81 HB2 LEU 81 11.087 -3.657 2.788 617 HG LEU 81 HG LEU 81 10.606 -3.022 -0.149 618 HD11 LEU 81 HD11 LEU 81 12.559 -1.752 1.785 619 HD12 LEU 81 HD12 LEU 81 11.083 -0.999 1.170 620 HD13 LEU 81 HD13 LEU 81 12.394 -1.396 0.066 621 HD21 LEU 81 HD21 LEU 81 12.046 -4.799 -0.311 622 HD22 LEU 81 HD22 LEU 81 12.619 -4.652 1.342 623 HD23 LEU 81 HD23 LEU 81 13.256 -3.591 0.084 624 H THR 82 H THR 82 7.542 -4.063 2.726 625 HA THR 82 HA THR 82 7.867 -5.115 5.316 626 HB THR 82 HB THR 82 5.231 -4.589 3.946 627 HG1 THR 82 HG2 THR 82 6.816 -2.809 3.829 628 HG21 THR 82 HG21 THR 82 4.486 -4.042 6.240 629 HG22 THR 82 HG22 THR 82 6.079 -4.488 6.852 630 HG23 THR 82 HG23 THR 82 5.052 -5.697 6.093 631 H VAL 83 H VAL 83 5.923 -6.396 2.569 632 HA VAL 83 HA VAL 83 5.266 -8.737 4.019 633 HB VAL 83 HB VAL 83 3.938 -7.973 2.103 634 HG11 VAL 83 HG11 VAL 83 4.812 -8.815 -0.196 635 HG12 VAL 83 HG12 VAL 83 6.412 -8.631 0.506 636 HG13 VAL 83 HG13 VAL 83 5.285 -7.258 0.436 637 HG21 VAL 83 HG21 VAL 83 3.731 -10.318 2.855 638 HG22 VAL 83 HG22 VAL 83 5.009 -10.794 1.739 639 HG23 VAL 83 HG23 VAL 83 3.487 -10.159 1.122 640 H ALA 84 H ALA 84 7.926 -7.924 1.878 641 HA ALA 84 HA ALA 84 9.043 -10.482 1.628 642 HB1 ALA 84 HB1 ALA 84 9.914 -8.576 0.367 643 HB2 ALA 84 HB2 ALA 84 11.202 -9.316 1.316 644 HB3 ALA 84 HB3 ALA 84 10.461 -7.816 1.862 645 H MET 85 H MET 85 9.849 -7.970 4.044 646 HA MET 85 HA MET 85 11.326 -9.802 5.659 647 HB2 MET 85 HB3 MET 85 10.268 -7.060 6.190 648 HB3 MET 85 HB2 MET 85 11.033 -8.032 7.453 649 HG2 MET 85 HG3 MET 85 13.043 -8.285 6.020 650 HG3 MET 85 HG2 MET 85 12.278 -7.258 4.803 651 HE1 MET 85 HE1 MET 85 13.171 -7.760 8.362 652 HE2 MET 85 HE2 MET 85 11.890 -6.649 8.799 653 HE3 MET 85 HE3 MET 85 13.549 -6.172 9.060 654 H ASN 86 H ASN 86 8.009 -8.579 5.836 655 HA ASN 86 HA ASN 86 7.452 -9.761 8.293 656 HB2 ASN 86 HB3 ASN 86 5.648 -8.787 6.094 657 HB3 ASN 86 HB2 ASN 86 4.996 -9.705 7.434 658 HD21 ASN 86 HD21 ASN 86 4.938 -8.715 9.582 659 HD22 ASN 86 HD22 ASN 86 5.346 -7.092 9.800 660 H ASN 87 H ASN 87 7.284 -11.100 5.050 661 HA ASN 87 HA ASN 87 5.805 -13.408 5.494 662 HB2 ASN 87 HB3 ASN 87 7.110 -12.585 3.355 663 HB3 ASN 87 HB2 ASN 87 8.373 -13.650 3.959 664 HD21 ASN 87 HD21 ASN 87 7.915 -15.972 4.017 665 HD22 ASN 87 HD22 ASN 87 6.567 -16.597 3.206 666 H PHE 88 H PHE 88 9.125 -12.705 6.397 667 HA PHE 88 HA PHE 88 9.843 -15.288 7.317 668 HB2 PHE 88 HB3 PHE 88 10.858 -12.542 8.122 669 HB3 PHE 88 HB2 PHE 88 11.529 -14.037 8.715 670 HD1 PHE 88 HD2 PHE 88 12.481 -15.742 7.096 671 HD2 PHE 88 HD1 PHE 88 11.415 -11.750 5.939 672 HE1 PHE 88 HE2 PHE 88 13.863 -15.973 5.064 673 HE2 PHE 88 HE1 PHE 88 12.809 -11.983 3.884 674 HZ PHE 88 HZ PHE 88 14.026 -14.094 3.452 675 H PHE 89 H PHE 89 8.058 -12.635 8.745 676 HA PHE 89 HA PHE 89 8.212 -13.343 11.462 677 HB2 PHE 89 HB3 PHE 89 5.890 -12.040 9.994 678 HB3 PHE 89 HB2 PHE 89 6.106 -12.130 11.715 679 HD1 PHE 89 HD1 PHE 89 9.286 -11.655 9.864 680 HD2 PHE 89 HD2 PHE 89 5.915 -9.586 11.639 681 HE1 PHE 89 HE1 PHE 89 10.535 -9.576 9.830 682 HE2 PHE 89 HE2 PHE 89 7.232 -7.488 11.592 683 HZ PHE 89 HZ PHE 89 9.520 -7.477 10.691 684 H TRP 90 H TRP 90 5.967 -14.306 8.946 685 HA TRP 90 HA TRP 90 4.267 -15.969 10.562 686 HB2 TRP 90 HB3 TRP 90 4.886 -16.471 7.662 687 HB3 TRP 90 HB2 TRP 90 3.405 -16.862 8.538 688 HD1 TRP 90 HD TRP 90 5.394 -13.678 7.602 689 HE1 TRP 90 HE1 TRP 90 3.730 -11.859 6.862 690 HE3 TRP 90 HE3 TRP 90 1.032 -16.180 8.284 691 HZ2 TRP 90 HZ2 TRP 90 0.919 -11.527 6.574 692 HZ3 TRP 90 HZ3 TRP 90 -1.131 -15.100 7.746 693 HH2 TRP 90 HH TRP 90 -1.188 -12.778 6.888 694 H GLU 91 H GLU 91 7.018 -16.562 8.467 695 HA GLU 91 HA GLU 91 7.139 -19.362 8.861 696 HB2 GLU 91 HB3 GLU 91 9.129 -17.341 7.873 697 HB3 GLU 91 HB2 GLU 91 9.388 -19.089 7.784 698 HG2 GLU 91 HG3 GLU 91 7.318 -19.356 6.474 699 HG3 GLU 91 HG2 GLU 91 6.995 -17.652 6.600 700 H ASN 92 H ASN 92 9.004 -16.681 10.227 701 HA ASN 92 HA ASN 92 10.338 -18.439 12.155 702 HB2 ASN 92 HB3 ASN 92 11.606 -16.579 11.119 703 HB3 ASN 92 HB2 ASN 92 10.448 -15.429 11.788 704 HD21 ASN 92 HD21 ASN 92 12.077 -14.413 13.160 705 HD22 ASN 92 HD22 ASN 92 12.703 -15.206 14.512 706 H SER 93 H SER 93 8.804 -19.099 13.556 707 HA SER 93 HA SER 93 7.704 -17.239 15.421 708 HB2 SER 93 HB3 SER 93 6.108 -18.140 13.087 709 HB3 SER 93 HB2 SER 93 5.273 -18.196 14.625 710 HG SER 93 HG SER 93 6.446 -16.044 13.210 711 H1 GLY 1 H GLY 1 13.688 4.221 11.223 712 HA2 GLY 1 HA3 GLY 1 11.910 2.892 10.524 713 HA3 GLY 1 HA2 GLY 1 11.935 2.028 12.050 714 H SER 2 H SER 2 10.522 4.559 10.267 715 HA SER 2 HA SER 2 9.351 5.987 12.493 716 HB2 SER 2 HB3 SER 2 8.497 6.116 9.603 717 HB3 SER 2 HB2 SER 2 8.253 7.294 10.871 718 HG SER 2 HG SER 2 9.919 7.671 9.385 719 H GLU 3 H GLU 3 6.984 6.385 12.427 720 HA GLU 3 HA GLU 3 5.565 4.159 13.277 721 HB2 GLU 3 HB3 GLU 3 4.258 6.555 11.983 722 HB3 GLU 3 HB2 GLU 3 3.646 5.522 13.261 723 HG2 GLU 3 HG3 GLU 3 4.365 7.324 14.483 724 HG3 GLU 3 HG2 GLU 3 5.794 6.309 14.582 725 H LEU 4 H LEU 4 6.360 5.172 10.095 726 HA LEU 4 HA LEU 4 4.215 4.147 8.620 727 HB2 LEU 4 HB3 LEU 4 7.148 4.232 7.893 728 HB3 LEU 4 HB2 LEU 4 5.843 3.860 6.779 729 HG LEU 4 HG LEU 4 6.271 6.470 8.256 730 HD11 LEU 4 HD11 LEU 4 7.139 5.500 5.749 731 HD12 LEU 4 HD12 LEU 4 7.310 7.117 6.436 732 HD13 LEU 4 HD13 LEU 4 5.900 6.720 5.455 733 HD21 LEU 4 HD21 LEU 4 3.999 6.411 8.266 734 HD22 LEU 4 HD22 LEU 4 3.861 5.349 6.854 735 HD23 LEU 4 HD23 LEU 4 4.236 7.065 6.652 736 H GLU 5 H GLU 5 7.154 2.623 9.909 737 HA GLU 5 HA GLU 5 6.729 0.083 8.753 738 HB2 GLU 5 HB3 GLU 5 8.102 0.882 11.337 739 HB3 GLU 5 HB2 GLU 5 8.137 -0.746 10.681 740 HG2 GLU 5 HG3 GLU 5 9.139 0.188 8.558 741 HG3 GLU 5 HG2 GLU 5 9.165 1.756 9.308 742 H THR 6 H THR 6 5.643 1.589 11.760 743 HA THR 6 HA THR 6 4.176 -0.629 12.739 744 HB THR 6 HB THR 6 3.506 2.276 13.234 745 HG1 THR 6 HG2 THR 6 5.040 1.918 15.011 746 HG21 THR 6 HG21 THR 6 1.931 0.868 14.252 747 HG22 THR 6 HG22 THR 6 3.071 1.187 15.548 748 HG23 THR 6 HG23 THR 6 3.123 -0.341 14.691 749 H ALA 7 H ALA 7 3.310 2.186 10.723 750 HA ALA 7 HA ALA 7 0.594 1.598 10.399 751 HB1 ALA 7 HB1 ALA 7 2.459 2.834 8.353 752 HB2 ALA 7 HB2 ALA 7 1.688 3.722 9.670 753 HB3 ALA 7 HB3 ALA 7 0.708 2.996 8.402 754 H MET 8 H MET 8 3.453 0.580 8.561 755 HA MET 8 HA MET 8 2.026 -1.032 6.717 756 HB2 MET 8 HB3 MET 8 4.899 -1.220 7.636 757 HB3 MET 8 HB2 MET 8 4.236 -2.097 6.266 758 HG2 MET 8 HG3 MET 8 4.452 0.925 6.539 759 HG3 MET 8 HG2 MET 8 5.310 -0.100 5.406 760 HE1 MET 8 HE1 MET 8 3.051 -1.271 2.876 761 HE2 MET 8 HE2 MET 8 2.518 -2.103 4.325 762 HE3 MET 8 HE3 MET 8 4.229 -1.775 4.101 763 H GLU 9 H GLU 9 3.560 -1.750 9.858 764 HA GLU 9 HA GLU 9 2.972 -4.516 9.808 765 HB2 GLU 9 HB3 GLU 9 3.328 -2.625 12.149 766 HB3 GLU 9 HB2 GLU 9 3.088 -4.353 12.341 767 HG2 GLU 9 HG3 GLU 9 5.118 -4.798 11.002 768 HG3 GLU 9 HG2 GLU 9 5.343 -3.083 10.750 769 H THR 10 H THR 10 1.210 -1.680 10.827 770 HA THR 10 HA THR 10 -1.042 -2.941 11.968 771 HB THR 10 HB THR 10 -1.109 -0.331 10.409 772 HG1 THR 10 HG2 THR 10 0.615 -0.362 11.883 773 HG21 THR 10 HG21 THR 10 -3.142 -1.728 11.665 774 HG22 THR 10 HG22 THR 10 -3.122 0.005 11.383 775 HG23 THR 10 HG23 THR 10 -2.595 -0.631 12.927 776 H LEU 11 H LEU 11 -0.291 -2.022 8.642 777 HA LEU 11 HA LEU 11 -2.702 -3.016 7.537 778 HB2 LEU 11 HB3 LEU 11 0.045 -2.642 6.346 779 HB3 LEU 11 HB2 LEU 11 -1.337 -3.164 5.376 780 HG LEU 11 HG LEU 11 -1.204 -0.578 6.975 781 HD11 LEU 11 HD11 LEU 11 -0.609 0.556 5.086 782 HD12 LEU 11 HD12 LEU 11 -1.191 -0.680 3.986 783 HD13 LEU 11 HD13 LEU 11 0.326 -0.914 4.861 784 HD21 LEU 11 HD21 LEU 11 -3.164 -0.098 5.339 785 HD22 LEU 11 HD22 LEU 11 -3.489 -1.121 6.728 786 HD23 LEU 11 HD23 LEU 11 -3.248 -1.847 5.132 787 H ILE 12 H ILE 12 0.457 -4.441 8.204 788 HA ILE 12 HA ILE 12 -0.073 -7.017 7.124 789 HB ILE 12 HB ILE 12 1.800 -6.177 9.375 790 HG12 ILE 12 HG13 ILE 12 2.261 -5.314 6.994 791 HG13 ILE 12 HG12 ILE 12 3.546 -6.264 7.727 792 HG21 ILE 12 HG21 ILE 12 1.377 -8.467 9.742 793 HG22 ILE 12 HG22 ILE 12 2.908 -8.388 8.883 794 HG23 ILE 12 HG23 ILE 12 1.433 -8.846 8.021 795 HD11 ILE 12 HD11 ILE 12 1.468 -7.529 5.887 796 HD12 ILE 12 HD12 ILE 12 3.002 -8.196 6.438 797 HD13 ILE 12 HD13 ILE 12 2.989 -6.843 5.328 798 H ASN 13 H ASN 13 -0.530 -5.599 10.304 799 HA ASN 13 HA ASN 13 -1.259 -7.862 11.769 800 HB2 ASN 13 HB3 ASN 13 -2.306 -5.031 11.998 801 HB3 ASN 13 HB2 ASN 13 -2.560 -6.281 13.187 802 HD21 ASN 13 HD21 ASN 13 -1.080 -3.793 13.526 803 HD22 ASN 13 HD22 ASN 13 0.503 -4.210 13.990 804 H VAL 14 H VAL 14 -3.298 -5.621 9.925 805 HA VAL 14 HA VAL 14 -5.731 -7.032 10.369 806 HB VAL 14 HB VAL 14 -4.919 -5.137 8.142 807 HG11 VAL 14 HG11 VAL 14 -7.567 -6.436 8.815 808 HG12 VAL 14 HG12 VAL 14 -6.740 -6.346 7.254 809 HG13 VAL 14 HG13 VAL 14 -7.457 -4.906 7.951 810 HG21 VAL 14 HG21 VAL 14 -6.384 -4.820 10.784 811 HG22 VAL 14 HG22 VAL 14 -6.491 -3.625 9.508 812 HG23 VAL 14 HG23 VAL 14 -4.932 -3.970 10.255 813 H PHE 15 H PHE 15 -3.351 -7.011 7.779 814 HA PHE 15 HA PHE 15 -4.529 -8.878 6.061 815 HB2 PHE 15 HB3 PHE 15 -2.529 -7.418 5.578 816 HB3 PHE 15 HB2 PHE 15 -1.573 -8.509 6.575 817 HD1 PHE 15 HD2 PHE 15 -1.081 -10.808 5.841 818 HD2 PHE 15 HD1 PHE 15 -3.408 -8.134 3.409 819 HE1 PHE 15 HE2 PHE 15 -0.800 -12.306 3.912 820 HE2 PHE 15 HE1 PHE 15 -3.121 -9.642 1.483 821 HZ PHE 15 HZ PHE 15 -1.813 -11.729 1.727 822 H HIS 16 H HIS 16 -2.233 -9.320 8.711 823 HA HIS 16 HA HIS 16 -1.814 -12.075 8.527 824 HB2 HIS 16 HB3 HIS 16 -0.907 -10.131 10.213 825 HB3 HIS 16 HB2 HIS 16 -1.989 -11.012 11.285 826 HD1 HIS 16 HD1 HIS 16 -1.579 -13.888 10.242 827 HD2 HIS 16 HD2 HIS 16 1.551 -11.198 10.906 828 HE1 HIS 16 HE1 HIS 16 0.545 -15.273 10.528 829 HE2 HIS 16 HE2 HIS 16 2.438 -13.630 10.969 830 H ALA 17 H ALA 17 -4.303 -10.311 10.255 831 HA ALA 17 HA ALA 17 -5.489 -12.461 11.583 832 HB1 ALA 17 HB1 ALA 17 -6.615 -10.696 12.409 833 HB2 ALA 17 HB2 ALA 17 -7.598 -10.725 10.950 834 HB3 ALA 17 HB3 ALA 17 -6.195 -9.692 11.026 835 H HIS 18 H HIS 18 -6.334 -11.035 8.452 836 HA HIS 18 HA HIS 18 -8.455 -12.843 7.949 837 HB2 HIS 18 HB3 HIS 18 -6.923 -11.030 6.098 838 HB3 HIS 18 HB2 HIS 18 -8.337 -11.969 5.599 839 HD1 HIS 18 HD1 HIS 18 -10.684 -11.409 6.931 840 HD2 HIS 18 HD2 HIS 18 -7.534 -8.700 7.542 841 HE1 HIS 18 HE1 HIS 18 -11.666 -9.378 8.011 842 HE2 HIS 18 HE2 HIS 18 -9.798 -7.725 8.415 843 H SER 19 H SER 19 -5.032 -12.940 6.961 844 HA SER 19 HA SER 19 -5.240 -15.140 5.231 845 HB2 SER 19 HB3 SER 19 -2.990 -14.383 7.102 846 HB3 SER 19 HB2 SER 19 -2.814 -15.580 5.840 847 HG SER 19 HG SER 19 -3.609 -13.759 4.414 848 H GLY 20 H GLY 20 -4.856 -14.954 8.744 849 HA2 GLY 20 HA3 GLY 20 -4.666 -17.719 9.285 850 HA3 GLY 20 HA2 GLY 20 -5.241 -16.497 10.407 851 H LYS 21 H LYS 21 -7.440 -15.518 8.991 852 HA LYS 21 HA LYS 21 -9.402 -17.439 9.713 853 HB2 LYS 21 HB3 LYS 21 -9.617 -14.854 8.156 854 HB3 LYS 21 HB2 LYS 21 -11.004 -15.823 8.625 855 HG2 LYS 21 HG3 LYS 21 -8.938 -14.872 10.627 856 HG3 LYS 21 HG2 LYS 21 -10.382 -13.963 10.229 857 HD2 LYS 21 HD3 LYS 21 -11.753 -15.344 11.429 858 HD3 LYS 21 HD2 LYS 21 -11.008 -16.787 10.791 859 HE2 LYS 21 HE2 LYS 21 -10.611 -16.710 13.202 860 HE3 LYS 21 HE1 LYS 21 -9.092 -16.481 12.368 861 HZ1 LYS 21 HZ1 LYS 21 -8.883 -14.658 13.565 862 HZ2 LYS 21 HZ2 LYS 21 -10.485 -14.670 14.083 863 HZ3 LYS 21 HZ3 LYS 21 -10.073 -13.936 12.615 864 H GLU 22 H GLU 22 -8.219 -16.357 6.561 865 HA GLU 22 HA GLU 22 -9.925 -18.131 5.121 866 HB2 GLU 22 HB3 GLU 22 -7.418 -16.648 4.247 867 HB3 GLU 22 HB2 GLU 22 -8.453 -17.604 3.200 868 HG2 GLU 22 HG3 GLU 22 -10.365 -16.197 3.668 869 HG3 GLU 22 HG2 GLU 22 -9.449 -15.322 4.887 870 H GLY 23 H GLY 23 -6.603 -18.358 6.318 871 HA2 GLY 23 HA3 GLY 23 -6.066 -20.498 7.266 872 HA3 GLY 23 HA2 GLY 23 -6.791 -21.288 5.888 873 H ASP 24 H ASP 24 -5.376 -19.159 4.108 874 HA ASP 24 HA ASP 24 -3.108 -20.772 3.512 875 HB2 ASP 24 HB3 ASP 24 -4.130 -19.218 1.816 876 HB3 ASP 24 HB2 ASP 24 -3.457 -17.874 2.746 877 H LYS 25 H LYS 25 -0.954 -20.486 3.923 878 HA LYS 25 HA LYS 25 -0.250 -19.623 6.461 879 HB2 LYS 25 HB3 LYS 25 2.073 -19.451 5.537 880 HB3 LYS 25 HB2 LYS 25 1.326 -21.058 5.471 881 HG2 LYS 25 HG3 LYS 25 0.573 -20.041 3.018 882 HG3 LYS 25 HG2 LYS 25 2.087 -19.183 3.256 883 HD2 LYS 25 HD3 LYS 25 2.094 -22.153 3.752 884 HD3 LYS 25 HD2 LYS 25 1.978 -21.578 2.109 885 HE2 LYS 25 HE2 LYS 25 4.286 -21.769 2.454 886 HE3 LYS 25 HE1 LYS 25 3.984 -20.048 2.647 887 HZ1 LYS 25 HZ1 LYS 25 4.902 -21.969 4.589 888 HZ2 LYS 25 HZ2 LYS 25 3.663 -21.000 5.206 889 HZ3 LYS 25 HZ3 LYS 25 5.064 -20.316 4.556 890 H TYR 26 H TYR 26 0.142 -17.896 3.389 891 HA TYR 26 HA TYR 26 -0.456 -15.447 4.697 892 HB2 TYR 26 HB3 TYR 26 1.850 -14.541 3.424 893 HB3 TYR 26 HB2 TYR 26 1.583 -14.667 5.144 894 HD1 TYR 26 HD1 TYR 26 2.424 -16.620 6.433 895 HD2 TYR 26 HD2 TYR 26 3.211 -16.159 2.243 896 HE1 TYR 26 HE1 TYR 26 4.220 -18.331 6.574 897 HE2 TYR 26 HE2 TYR 26 4.985 -17.849 2.371 898 HH TYR 26 HH TYR 26 6.575 -18.715 4.594 899 H LYS 27 H LYS 27 -2.079 -15.293 3.471 900 HA LYS 27 HA LYS 27 -1.711 -13.970 0.995 901 HB2 LYS 27 HB3 LYS 27 -3.181 -16.652 0.945 902 HB3 LYS 27 HB2 LYS 27 -3.436 -15.304 -0.168 903 HG2 LYS 27 HG3 LYS 27 -0.773 -16.668 0.210 904 HG3 LYS 27 HG2 LYS 27 -1.937 -16.997 -1.081 905 HD2 LYS 27 HD3 LYS 27 -1.839 -14.293 -1.292 906 HD3 LYS 27 HD2 LYS 27 -0.256 -14.572 -0.643 907 HE2 LYS 27 HE2 LYS 27 -1.100 -14.947 -3.343 908 HE3 LYS 27 HE1 LYS 27 0.506 -15.090 -2.687 909 HZ1 LYS 27 HZ1 LYS 27 -1.499 -17.257 -3.178 910 HZ2 LYS 27 HZ2 LYS 27 -0.323 -17.472 -1.951 911 HZ3 LYS 27 HZ3 LYS 27 0.142 -17.170 -3.512 912 H LEU 28 H LEU 28 -3.809 -13.119 0.261 913 HA LEU 28 HA LEU 28 -5.877 -13.243 2.318 914 HB2 LEU 28 HB3 LEU 28 -4.813 -11.055 2.497 915 HB3 LEU 28 HB2 LEU 28 -5.012 -10.777 0.762 916 HG LEU 28 HG LEU 28 -7.522 -11.064 1.149 917 HD11 LEU 28 HD11 LEU 28 -8.185 -10.625 3.571 918 HD12 LEU 28 HD12 LEU 28 -6.532 -11.058 3.995 919 HD13 LEU 28 HD13 LEU 28 -7.583 -12.243 3.216 920 HD21 LEU 28 HD21 LEU 28 -7.755 -8.833 2.235 921 HD22 LEU 28 HD22 LEU 28 -6.582 -8.815 0.905 922 HD23 LEU 28 HD23 LEU 28 -6.030 -8.838 2.579 923 H SER 29 H SER 29 -7.823 -13.728 1.487 924 HA SER 29 HA SER 29 -7.935 -14.132 -1.403 925 HB2 SER 29 HB3 SER 29 -9.780 -15.371 0.622 926 HB3 SER 29 HB2 SER 29 -9.456 -15.922 -1.006 927 HG SER 29 HG SER 29 -7.732 -15.766 1.212 928 H LYS 30 H LYS 30 -10.078 -13.747 -2.437 929 HA LYS 30 HA LYS 30 -10.855 -11.100 -1.803 930 HB2 LYS 30 HB3 LYS 30 -12.348 -12.934 -3.661 931 HB3 LYS 30 HB2 LYS 30 -12.324 -11.175 -3.676 932 HG2 LYS 30 HG3 LYS 30 -10.064 -13.063 -4.400 933 HG3 LYS 30 HG2 LYS 30 -10.893 -11.938 -5.455 934 HD2 LYS 30 HD3 LYS 30 -9.625 -10.576 -3.101 935 HD3 LYS 30 HD2 LYS 30 -8.511 -11.438 -4.145 936 HE2 LYS 30 HE2 LYS 30 -10.527 -9.425 -5.124 937 HE3 LYS 30 HE1 LYS 30 -8.827 -9.076 -4.836 938 HZ1 LYS 30 HZ1 LYS 30 -8.270 -10.820 -6.573 939 HZ2 LYS 30 HZ2 LYS 30 -9.254 -9.570 -7.138 940 HZ3 LYS 30 HZ3 LYS 30 -9.952 -11.020 -6.760 941 H LYS 31 H LYS 31 -11.821 -13.868 -0.331 942 HA LYS 31 HA LYS 31 -14.542 -13.090 0.155 943 HB2 LYS 31 HB3 LYS 31 -14.531 -14.777 1.970 944 HB3 LYS 31 HB2 LYS 31 -14.041 -15.431 0.414 945 HG2 LYS 31 HG3 LYS 31 -11.571 -14.892 1.328 946 HG3 LYS 31 HG2 LYS 31 -12.402 -14.877 2.866 947 HD2 LYS 31 HD3 LYS 31 -11.648 -17.072 2.628 948 HD3 LYS 31 HD2 LYS 31 -13.340 -17.196 2.292 949 HE2 LYS 31 HE2 LYS 31 -11.340 -16.764 0.051 950 HE3 LYS 31 HE1 LYS 31 -11.646 -18.357 0.727 951 HZ1 LYS 31 HZ1 LYS 31 -13.237 -18.428 -0.747 952 HZ2 LYS 31 HZ2 LYS 31 -13.364 -16.790 -1.018 953 HZ3 LYS 31 HZ3 LYS 31 -14.162 -17.534 0.307 954 H GLU 32 H GLU 32 -11.624 -13.043 2.247 955 HA GLU 32 HA GLU 32 -12.879 -11.330 4.166 956 HB2 GLU 32 HB3 GLU 32 -9.983 -12.032 3.689 957 HB3 GLU 32 HB2 GLU 32 -10.597 -11.091 5.045 958 HG2 GLU 32 HG3 GLU 32 -11.449 -13.920 4.380 959 HG3 GLU 32 HG2 GLU 32 -10.272 -13.514 5.617 960 H LEU 33 H LEU 33 -10.630 -10.924 1.488 961 HA LEU 33 HA LEU 33 -9.841 -8.325 2.036 962 HB2 LEU 33 HB3 LEU 33 -8.693 -9.689 0.396 963 HB3 LEU 33 HB2 LEU 33 -10.086 -9.682 -0.648 964 HG LEU 33 HG LEU 33 -8.158 -8.051 -1.222 965 HD11 LEU 33 HD11 LEU 33 -10.553 -6.373 -1.117 966 HD12 LEU 33 HD12 LEU 33 -10.850 -7.977 -1.775 967 HD13 LEU 33 HD13 LEU 33 -9.625 -6.941 -2.494 968 HD21 LEU 33 HD21 LEU 33 -9.501 -6.169 0.703 969 HD22 LEU 33 HD22 LEU 33 -7.916 -6.062 -0.017 970 HD23 LEU 33 HD23 LEU 33 -8.193 -7.185 1.298 971 H LYS 34 H LYS 34 -12.572 -9.300 -0.061 972 HA LYS 34 HA LYS 34 -13.232 -6.634 -0.791 973 HB2 LYS 34 HB3 LYS 34 -15.011 -9.069 -0.557 974 HB3 LYS 34 HB2 LYS 34 -15.485 -7.552 -1.303 975 HG2 LYS 34 HG3 LYS 34 -13.627 -7.765 -2.950 976 HG3 LYS 34 HG2 LYS 34 -13.184 -9.315 -2.251 977 HD2 LYS 34 HD3 LYS 34 -15.918 -8.699 -3.444 978 HD3 LYS 34 HD2 LYS 34 -14.619 -9.523 -4.289 979 HE2 LYS 34 HE2 LYS 34 -14.794 -11.468 -3.013 980 HE3 LYS 34 HE1 LYS 34 -15.451 -10.644 -1.615 981 HZ1 LYS 34 HZ1 LYS 34 -17.350 -11.408 -2.313 982 HZ2 LYS 34 HZ2 LYS 34 -16.825 -11.754 -3.887 983 HZ3 LYS 34 HZ3 LYS 34 -17.335 -10.179 -3.448 984 H GLU 35 H GLU 35 -14.313 -8.739 1.799 985 HA GLU 35 HA GLU 35 -16.155 -6.855 2.895 986 HB2 GLU 35 HB3 GLU 35 -15.017 -9.436 3.968 987 HB3 GLU 35 HB2 GLU 35 -16.268 -8.479 4.771 988 HG2 GLU 35 HG3 GLU 35 -17.747 -8.669 2.830 989 HG3 GLU 35 HG2 GLU 35 -16.485 -9.460 1.922 990 H LEU 36 H LEU 36 -12.888 -7.911 3.847 991 HA LEU 36 HA LEU 36 -12.772 -6.251 6.116 992 HB2 LEU 36 HB3 LEU 36 -10.848 -7.220 6.497 993 HB3 LEU 36 HB2 LEU 36 -11.090 -8.242 5.119 994 HG LEU 36 HG LEU 36 -9.969 -6.201 3.789 995 HD11 LEU 36 HD11 LEU 36 -9.485 -5.599 6.669 996 HD12 LEU 36 HD12 LEU 36 -9.607 -4.497 5.290 997 HD13 LEU 36 HD13 LEU 36 -8.132 -5.389 5.568 998 HD21 LEU 36 HD21 LEU 36 -8.129 -7.759 5.588 999 HD22 LEU 36 HD22 LEU 36 -7.916 -7.302 3.915 1000 HD23 LEU 36 HD23 LEU 36 -9.067 -8.580 4.335 1001 H LEU 37 H LEU 37 -11.800 -5.696 2.786 1002 HA LEU 37 HA LEU 37 -10.501 -3.260 3.234 1003 HB2 LEU 37 HB3 LEU 37 -10.246 -4.430 1.138 1004 HB3 LEU 37 HB2 LEU 37 -11.956 -4.283 0.766 1005 HG LEU 37 HG LEU 37 -10.376 -2.671 -0.437 1006 HD11 LEU 37 HD11 LEU 37 -12.958 -2.389 0.175 1007 HD12 LEU 37 HD12 LEU 37 -12.031 -1.159 -0.656 1008 HD13 LEU 37 HD13 LEU 37 -12.328 -0.995 1.064 1009 HD21 LEU 37 HD21 LEU 37 -10.424 -1.068 2.112 1010 HD22 LEU 37 HD22 LEU 37 -9.393 -0.881 0.711 1011 HD23 LEU 37 HD23 LEU 37 -9.139 -2.237 1.823 1012 H GLN 38 H GLN 38 -13.843 -3.881 2.355 1013 HA GLN 38 HA GLN 38 -14.649 -1.138 2.465 1014 HB2 GLN 38 HB3 GLN 38 -16.978 -2.020 2.623 1015 HB3 GLN 38 HB2 GLN 38 -16.093 -2.739 1.282 1016 HG2 GLN 38 HG3 GLN 38 -15.546 -4.664 2.858 1017 HG3 GLN 38 HG2 GLN 38 -16.736 -3.980 3.975 1018 HE21 GLN 38 HE21 GLN 38 -16.332 -5.218 0.650 1019 HE22 GLN 38 HE22 GLN 38 -17.940 -5.727 0.473 1020 H THR 39 H THR 39 -14.560 -3.719 4.817 1021 HA THR 39 HA THR 39 -15.799 -2.335 6.953 1022 HB THR 39 HB THR 39 -13.705 -4.495 7.093 1023 HG1 THR 39 HG2 THR 39 -15.302 -5.280 5.840 1024 HG21 THR 39 HG21 THR 39 -14.801 -5.068 9.175 1025 HG22 THR 39 HG22 THR 39 -15.893 -3.677 9.021 1026 HG23 THR 39 HG23 THR 39 -14.152 -3.435 9.226 1027 H GLU 40 H GLU 40 -12.305 -2.804 6.215 1028 HA GLU 40 HA GLU 40 -11.472 -1.155 8.385 1029 HB2 GLU 40 HB3 GLU 40 -9.957 -2.120 5.953 1030 HB3 GLU 40 HB2 GLU 40 -9.260 -1.277 7.338 1031 HG2 GLU 40 HG3 GLU 40 -10.744 -3.932 7.521 1032 HG3 GLU 40 HG2 GLU 40 -9.002 -3.701 7.546 1033 H LEU 41 H LEU 41 -11.918 -0.533 4.935 1034 HA LEU 41 HA LEU 41 -11.084 2.241 5.384 1035 HB2 LEU 41 HB3 LEU 41 -11.279 0.511 2.961 1036 HB3 LEU 41 HB2 LEU 41 -11.354 2.233 2.761 1037 HG LEU 41 HG LEU 41 -9.227 2.482 4.088 1038 HD11 LEU 41 HD11 LEU 41 -7.891 0.214 4.089 1039 HD12 LEU 41 HD12 LEU 41 -9.501 -0.493 4.164 1040 HD13 LEU 41 HD13 LEU 41 -8.969 0.629 5.415 1041 HD21 LEU 41 HD21 LEU 41 -8.520 0.598 1.885 1042 HD22 LEU 41 HD22 LEU 41 -7.922 2.216 2.221 1043 HD23 LEU 41 HD23 LEU 41 -9.478 2.011 1.433 1044 H SER 42 H SER 42 -13.673 1.257 6.300 1045 HA SER 42 HA SER 42 -15.769 1.864 4.591 1046 HB2 SER 42 HB3 SER 42 -15.642 2.310 7.582 1047 HB3 SER 42 HB2 SER 42 -17.094 2.329 6.603 1048 HG SER 42 HG SER 42 -15.641 0.112 6.024 1049 H GLY 43 H GLY 43 -13.773 4.075 6.527 1050 HA2 GLY 43 HA3 GLY 43 -15.309 6.398 6.031 1051 HA3 GLY 43 HA2 GLY 43 -13.608 6.361 6.491 1052 H PHE 44 H PHE 44 -12.476 4.979 4.452 1053 HA PHE 44 HA PHE 44 -12.318 6.923 2.339 1054 HB2 PHE 44 HB3 PHE 44 -11.069 4.269 2.841 1055 HB3 PHE 44 HB2 PHE 44 -11.105 4.826 1.171 1056 HD1 PHE 44 HD2 PHE 44 -9.999 6.922 0.527 1057 HD2 PHE 44 HD1 PHE 44 -9.725 5.383 4.485 1058 HE1 PHE 44 HE2 PHE 44 -8.088 8.456 0.973 1059 HE2 PHE 44 HE1 PHE 44 -7.806 6.908 4.956 1060 HZ PHE 44 HZ PHE 44 -6.998 8.435 3.202 1061 H LEU 45 H LEU 45 -13.775 3.770 2.625 1062 HA LEU 45 HA LEU 45 -14.826 3.586 0.007 1063 HB2 LEU 45 HB3 LEU 45 -14.892 1.543 1.025 1064 HB3 LEU 45 HB2 LEU 45 -15.281 2.207 2.604 1065 HG LEU 45 HG LEU 45 -17.566 2.592 1.934 1066 HD11 LEU 45 HD11 LEU 45 -16.515 2.368 -0.743 1067 HD12 LEU 45 HD12 LEU 45 -18.123 2.830 -0.193 1068 HD13 LEU 45 HD13 LEU 45 -17.782 1.145 -0.527 1069 HD21 LEU 45 HD21 LEU 45 -16.769 0.289 2.727 1070 HD22 LEU 45 HD22 LEU 45 -16.851 -0.203 1.035 1071 HD23 LEU 45 HD23 LEU 45 -18.309 0.320 1.868 1072 H ASP 46 H ASP 46 -16.204 4.805 3.024 1073 HA ASP 46 HA ASP 46 -18.722 5.353 1.994 1074 HB2 ASP 46 HB3 ASP 46 -18.408 5.285 4.287 1075 HB3 ASP 46 HB2 ASP 46 -17.236 6.593 4.297 1076 H ALA 47 H ALA 47 -15.880 7.397 2.154 1077 HA ALA 47 HA ALA 47 -17.097 9.647 0.855 1078 HB1 ALA 47 HB1 ALA 47 -14.421 9.804 0.207 1079 HB2 ALA 47 HB2 ALA 47 -14.393 8.901 1.721 1080 HB3 ALA 47 HB3 ALA 47 -15.160 10.485 1.651 1081 H GLN 48 H GLN 48 -15.872 6.615 -0.174 1082 HA GLN 48 HA GLN 48 -15.698 7.456 -2.951 1083 HB2 GLN 48 HB3 GLN 48 -14.497 5.318 -1.375 1084 HB3 GLN 48 HB2 GLN 48 -15.140 4.727 -2.890 1085 HG2 GLN 48 HG3 GLN 48 -13.416 7.217 -2.758 1086 HG3 GLN 48 HG2 GLN 48 -12.731 5.612 -2.945 1087 HE21 GLN 48 HE21 GLN 48 -15.795 5.653 -4.435 1088 HE22 GLN 48 HE22 GLN 48 -15.300 5.953 -6.012 1089 H LYS 49 H LYS 49 -18.285 6.785 -1.237 1090 HA LYS 49 HA LYS 49 -19.495 4.577 -2.496 1091 HB2 LYS 49 HB3 LYS 49 -20.755 7.050 -1.326 1092 HB3 LYS 49 HB2 LYS 49 -21.706 5.769 -2.040 1093 HG2 LYS 49 HG3 LYS 49 -20.715 4.139 -0.443 1094 HG3 LYS 49 HG2 LYS 49 -19.777 5.459 0.274 1095 HD2 LYS 49 HD3 LYS 49 -21.774 6.615 1.003 1096 HD3 LYS 49 HD2 LYS 49 -22.809 5.546 0.070 1097 HE2 LYS 49 HE2 LYS 49 -22.866 5.025 2.461 1098 HE3 LYS 49 HE1 LYS 49 -22.252 3.664 1.532 1099 HZ1 LYS 49 HZ1 LYS 49 -20.526 5.691 2.888 1100 HZ2 LYS 49 HZ2 LYS 49 -20.054 4.181 2.190 1101 HZ3 LYS 49 HZ3 LYS 49 -21.002 4.221 3.589 1102 H ASP 50 H ASP 50 -19.473 7.983 -3.521 1103 HA ASP 50 HA ASP 50 -20.743 7.069 -6.036 1104 HB2 ASP 50 HB3 ASP 50 -21.973 8.734 -4.462 1105 HB3 ASP 50 HB2 ASP 50 -20.855 9.920 -5.138 1106 H VAL 51 H VAL 51 -17.930 6.953 -5.699 1107 HA VAL 51 HA VAL 51 -17.284 8.746 -7.944 1108 HB VAL 51 HB VAL 51 -15.078 7.879 -6.097 1109 HG11 VAL 51 HG11 VAL 51 -14.228 8.850 -8.029 1110 HG12 VAL 51 HG12 VAL 51 -14.284 10.187 -6.881 1111 HG13 VAL 51 HG13 VAL 51 -15.518 10.057 -8.118 1112 HG21 VAL 51 HG21 VAL 51 -16.473 8.951 -4.483 1113 HG22 VAL 51 HG22 VAL 51 -17.060 10.133 -5.654 1114 HG23 VAL 51 HG23 VAL 51 -15.412 10.237 -5.048 1115 H ASP 52 H ASP 52 -16.896 7.650 -9.688 1116 HA ASP 52 HA ASP 52 -16.994 4.867 -9.772 1117 HB2 ASP 52 HB3 ASP 52 -17.647 6.449 -11.605 1118 HB3 ASP 52 HB2 ASP 52 -15.925 6.610 -11.964 1119 H ALA 53 H ALA 53 -14.393 6.734 -8.968 1120 HA ALA 53 HA ALA 53 -12.230 5.335 -10.135 1121 HB1 ALA 53 HB1 ALA 53 -10.835 6.386 -8.493 1122 HB2 ALA 53 HB2 ALA 53 -12.232 6.776 -7.480 1123 HB3 ALA 53 HB3 ALA 53 -12.031 7.551 -9.059 1124 H VAL 54 H VAL 54 -14.075 4.777 -7.189 1125 HA VAL 54 HA VAL 54 -12.407 2.824 -6.021 1126 HB VAL 54 HB VAL 54 -14.325 3.867 -4.817 1127 HG11 VAL 54 HG11 VAL 54 -15.865 3.589 -6.957 1128 HG12 VAL 54 HG12 VAL 54 -16.554 3.523 -5.346 1129 HG13 VAL 54 HG13 VAL 54 -16.245 2.038 -6.214 1130 HG21 VAL 54 HG21 VAL 54 -15.399 1.369 -4.288 1131 HG22 VAL 54 HG22 VAL 54 -13.979 2.027 -3.520 1132 HG23 VAL 54 HG23 VAL 54 -13.806 0.956 -4.905 1133 H ASP 55 H ASP 55 -14.879 2.616 -8.499 1134 HA ASP 55 HA ASP 55 -15.152 -0.167 -8.652 1135 HB2 ASP 55 HB3 ASP 55 -16.466 1.687 -9.920 1136 HB3 ASP 55 HB2 ASP 55 -15.142 1.596 -11.071 1137 H LYS 56 H LYS 56 -12.922 2.071 -10.171 1138 HA LYS 56 HA LYS 56 -11.622 0.252 -11.915 1139 HB2 LYS 56 HB3 LYS 56 -10.325 2.665 -10.610 1140 HB3 LYS 56 HB2 LYS 56 -9.914 1.929 -12.142 1141 HG2 LYS 56 HG3 LYS 56 -12.484 3.366 -11.473 1142 HG3 LYS 56 HG2 LYS 56 -11.209 3.940 -12.534 1143 HD2 LYS 56 HD3 LYS 56 -11.553 1.980 -13.997 1144 HD3 LYS 56 HD2 LYS 56 -12.922 1.472 -13.022 1145 HE2 LYS 56 HE2 LYS 56 -12.700 3.807 -14.867 1146 HE3 LYS 56 HE1 LYS 56 -14.052 2.708 -14.610 1147 HZ1 LYS 56 HZ1 LYS 56 -14.858 4.486 -13.509 1148 HZ2 LYS 56 HZ2 LYS 56 -13.371 5.155 -13.158 1149 HZ3 LYS 56 HZ3 LYS 56 -13.998 3.913 -12.194 1150 H VAL 57 H VAL 57 -10.890 1.312 -8.641 1151 HA VAL 57 HA VAL 57 -8.553 -0.253 -8.329 1152 HB VAL 57 HB VAL 57 -10.507 0.729 -6.234 1153 HG11 VAL 57 HG11 VAL 57 -8.193 0.646 -4.952 1154 HG12 VAL 57 HG12 VAL 57 -7.842 -0.615 -6.132 1155 HG13 VAL 57 HG13 VAL 57 -9.270 -0.734 -5.092 1156 HG21 VAL 57 HG21 VAL 57 -8.162 2.013 -7.660 1157 HG22 VAL 57 HG22 VAL 57 -8.574 2.489 -6.015 1158 HG23 VAL 57 HG23 VAL 57 -9.741 2.703 -7.302 1159 H MET 58 H MET 58 -11.960 -0.732 -7.569 1160 HA MET 58 HA MET 58 -11.812 -3.316 -6.425 1161 HB2 MET 58 HB3 MET 58 -14.030 -2.077 -8.090 1162 HB3 MET 58 HB2 MET 58 -14.180 -3.486 -7.060 1163 HG2 MET 58 HG3 MET 58 -13.009 -1.118 -5.779 1164 HG3 MET 58 HG2 MET 58 -14.711 -0.956 -6.184 1165 HE1 MET 58 HE1 MET 58 -16.471 -1.668 -4.123 1166 HE2 MET 58 HE2 MET 58 -16.665 -3.391 -4.354 1167 HE3 MET 58 HE3 MET 58 -16.396 -2.345 -5.750 1168 H LYS 59 H LYS 59 -12.203 -2.109 -9.706 1169 HA LYS 59 HA LYS 59 -12.584 -4.498 -11.019 1170 HB2 LYS 59 HB3 LYS 59 -12.869 -2.173 -11.939 1171 HB3 LYS 59 HB2 LYS 59 -11.126 -2.087 -12.098 1172 HG2 LYS 59 HG3 LYS 59 -11.819 -2.776 -14.210 1173 HG3 LYS 59 HG2 LYS 59 -11.242 -4.268 -13.507 1174 HD2 LYS 59 HD3 LYS 59 -14.166 -3.511 -13.212 1175 HD3 LYS 59 HD2 LYS 59 -13.612 -4.150 -14.738 1176 HE2 LYS 59 HE2 LYS 59 -13.936 -5.567 -12.130 1177 HE3 LYS 59 HE1 LYS 59 -14.175 -6.122 -13.755 1178 HZ1 LYS 59 HZ1 LYS 59 -11.751 -6.246 -14.074 1179 HZ2 LYS 59 HZ2 LYS 59 -12.393 -7.223 -12.850 1180 HZ3 LYS 59 HZ3 LYS 59 -11.486 -5.877 -12.417 1181 H GLU 60 H GLU 60 -9.631 -2.682 -10.289 1182 HA GLU 60 HA GLU 60 -7.776 -4.389 -11.531 1183 HB2 GLU 60 HB3 GLU 60 -7.682 -2.248 -9.498 1184 HB3 GLU 60 HB2 GLU 60 -6.348 -3.376 -9.420 1185 HG2 GLU 60 HG3 GLU 60 -7.149 -2.395 -12.120 1186 HG3 GLU 60 HG2 GLU 60 -6.346 -1.240 -11.094 1187 H LEU 61 H LEU 61 -9.001 -4.348 -8.223 1188 HA LEU 61 HA LEU 61 -7.586 -6.701 -7.440 1189 HB2 LEU 61 HB3 LEU 61 -9.898 -5.198 -6.261 1190 HB3 LEU 61 HB2 LEU 61 -9.529 -6.810 -5.678 1191 HG LEU 61 HG LEU 61 -8.397 -4.849 -4.455 1192 HD11 LEU 61 HD11 LEU 61 -7.611 -6.962 -3.866 1193 HD12 LEU 61 HD12 LEU 61 -6.154 -6.158 -4.431 1194 HD13 LEU 61 HD13 LEU 61 -6.979 -7.297 -5.478 1195 HD21 LEU 61 HD21 LEU 61 -6.511 -4.977 -6.855 1196 HD22 LEU 61 HD22 LEU 61 -6.356 -3.955 -5.451 1197 HD23 LEU 61 HD23 LEU 61 -7.669 -3.677 -6.586 1198 H ASP 62 H ASP 62 -10.726 -6.133 -8.895 1199 HA ASP 62 HA ASP 62 -11.673 -8.804 -8.800 1200 HB2 ASP 62 HB3 ASP 62 -13.174 -7.039 -9.418 1201 HB3 ASP 62 HB2 ASP 62 -12.190 -6.594 -10.796 1202 H GLU 63 H GLU 63 -9.658 -7.103 -11.122 1203 HA GLU 63 HA GLU 63 -9.312 -9.296 -12.938 1204 HB2 GLU 63 HB3 GLU 63 -7.537 -6.900 -12.339 1205 HB3 GLU 63 HB2 GLU 63 -7.303 -8.023 -13.672 1206 HG2 GLU 63 HG3 GLU 63 -9.529 -7.468 -14.584 1207 HG3 GLU 63 HG2 GLU 63 -9.808 -6.409 -13.214 1208 H ASN 64 H ASN 64 -7.734 -8.206 -10.051 1209 HA ASN 64 HA ASN 64 -5.857 -10.451 -10.050 1210 HB2 ASN 64 HB3 ASN 64 -6.062 -7.933 -8.634 1211 HB3 ASN 64 HB2 ASN 64 -5.764 -9.251 -7.505 1212 HD21 ASN 64 HD21 ASN 64 -4.099 -7.047 -9.338 1213 HD22 ASN 64 HD22 ASN 64 -2.691 -7.927 -9.627 1214 H GLY 65 H GLY 65 -8.565 -11.121 -10.192 1215 HA2 GLY 65 HA3 GLY 65 -9.147 -12.348 -7.558 1216 HA3 GLY 65 HA2 GLY 65 -10.303 -12.128 -8.894 1217 H ASP 66 H ASP 66 -7.167 -13.065 -9.759 1218 HA ASP 66 HA ASP 66 -7.955 -15.454 -11.014 1219 HB2 ASP 66 HB3 ASP 66 -5.855 -14.080 -11.421 1220 HB3 ASP 66 HB2 ASP 66 -5.180 -14.859 -10.006 1221 H GLY 67 H GLY 67 -6.425 -14.866 -7.922 1222 HA2 GLY 67 HA3 GLY 67 -7.551 -17.313 -6.850 1223 HA3 GLY 67 HA2 GLY 67 -5.796 -17.289 -6.938 1224 H GLU 68 H GLU 68 -4.636 -15.773 -5.693 1225 HA GLU 68 HA GLU 68 -6.146 -14.818 -3.340 1226 HB2 GLU 68 HB3 GLU 68 -3.235 -15.498 -3.600 1227 HB3 GLU 68 HB2 GLU 68 -4.034 -15.015 -2.117 1228 HG2 GLU 68 HG3 GLU 68 -4.332 -17.251 -1.796 1229 HG3 GLU 68 HG2 GLU 68 -5.652 -17.076 -2.946 1230 H VAL 69 H VAL 69 -5.193 -12.990 -2.211 1231 HA VAL 69 HA VAL 69 -3.757 -11.118 -3.926 1232 HB VAL 69 HB VAL 69 -5.843 -10.042 -3.867 1233 HG11 VAL 69 HG11 VAL 69 -7.380 -10.014 -1.972 1234 HG12 VAL 69 HG12 VAL 69 -6.215 -10.853 -0.974 1235 HG13 VAL 69 HG13 VAL 69 -6.950 -11.679 -2.357 1236 HG21 VAL 69 HG21 VAL 69 -5.597 -8.562 -1.531 1237 HG22 VAL 69 HG22 VAL 69 -4.867 -8.163 -3.062 1238 HG23 VAL 69 HG23 VAL 69 -3.929 -9.017 -1.841 1239 H ASP 70 H ASP 70 -1.880 -10.612 -3.061 1240 HA ASP 70 HA ASP 70 -1.297 -11.583 -0.375 1241 HB2 ASP 70 HB3 ASP 70 0.302 -12.329 -1.873 1242 HB3 ASP 70 HB2 ASP 70 0.303 -10.862 -2.797 1243 H PHE 71 H PHE 71 0.492 -10.072 0.671 1244 HA PHE 71 HA PHE 71 -0.911 -7.902 1.681 1245 HB2 PHE 71 HB3 PHE 71 1.052 -9.015 2.771 1246 HB3 PHE 71 HB2 PHE 71 2.083 -8.201 1.592 1247 HD1 PHE 71 HD1 PHE 71 -0.700 -7.368 3.966 1248 HD2 PHE 71 HD2 PHE 71 3.063 -6.111 2.268 1249 HE1 PHE 71 HE1 PHE 71 -0.701 -5.379 5.398 1250 HE2 PHE 71 HE2 PHE 71 3.045 -4.134 3.723 1251 HZ PHE 71 HZ PHE 71 1.197 -3.748 5.278 1252 H GLN 72 H GLN 72 1.501 -8.150 -0.843 1253 HA GLN 72 HA GLN 72 1.906 -5.436 -1.463 1254 HB2 GLN 72 HB3 GLN 72 2.068 -7.989 -3.008 1255 HB3 GLN 72 HB2 GLN 72 2.539 -6.418 -3.732 1256 HG2 GLN 72 HG3 GLN 72 4.212 -6.163 -2.013 1257 HG3 GLN 72 HG2 GLN 72 3.586 -7.582 -1.162 1258 HE21 GLN 72 HE21 GLN 72 4.011 -9.679 -2.097 1259 HE22 GLN 72 HE22 GLN 72 5.175 -9.909 -3.303 1260 H GLU 73 H GLU 73 -0.451 -7.794 -2.766 1261 HA GLU 73 HA GLU 73 -1.743 -5.869 -4.445 1262 HB2 GLU 73 HB3 GLU 73 -2.698 -8.511 -3.351 1263 HB3 GLU 73 HB2 GLU 73 -3.624 -7.509 -4.494 1264 HG2 GLU 73 HG3 GLU 73 -2.536 -8.875 -5.980 1265 HG3 GLU 73 HG2 GLU 73 -1.329 -7.612 -5.860 1266 H TYR 74 H TYR 74 -2.181 -7.026 -1.181 1267 HA TYR 74 HA TYR 74 -4.629 -5.776 -0.597 1268 HB2 TYR 74 HB3 TYR 74 -3.723 -7.497 0.855 1269 HB3 TYR 74 HB2 TYR 74 -2.330 -6.480 1.208 1270 HD1 TYR 74 HD1 TYR 74 -6.065 -5.954 1.202 1271 HD2 TYR 74 HD2 TYR 74 -2.360 -5.571 3.354 1272 HE1 TYR 74 HE1 TYR 74 -7.263 -4.921 3.098 1273 HE2 TYR 74 HE2 TYR 74 -3.583 -4.539 5.256 1274 HH TYR 74 HH TYR 74 -6.528 -3.247 5.060 1275 H VAL 75 H VAL 75 -1.296 -4.571 -0.078 1276 HA VAL 75 HA VAL 75 -2.196 -2.162 1.035 1277 HB VAL 75 HB VAL 75 0.064 -1.255 0.609 1278 HG11 VAL 75 HG11 VAL 75 1.036 -2.537 2.311 1279 HG12 VAL 75 HG12 VAL 75 0.381 -4.050 1.705 1280 HG13 VAL 75 HG13 VAL 75 -0.664 -2.911 2.529 1281 HG21 VAL 75 HG21 VAL 75 1.078 -3.892 -0.264 1282 HG22 VAL 75 HG22 VAL 75 1.580 -2.264 -0.777 1283 HG23 VAL 75 HG23 VAL 75 0.220 -3.009 -1.519 1284 H VAL 76 H VAL 76 -1.506 -3.011 -2.351 1285 HA VAL 76 HA VAL 76 -1.790 -0.347 -3.243 1286 HB VAL 76 HB VAL 76 -0.606 -2.003 -4.608 1287 HG11 VAL 76 HG11 VAL 76 -3.329 -3.295 -4.914 1288 HG12 VAL 76 HG12 VAL 76 -1.852 -3.974 -4.217 1289 HG13 VAL 76 HG13 VAL 76 -1.929 -3.646 -5.935 1290 HG21 VAL 76 HG21 VAL 76 -1.502 -1.356 -6.765 1291 HG22 VAL 76 HG22 VAL 76 -1.688 0.014 -5.680 1292 HG23 VAL 76 HG23 VAL 76 -3.078 -0.997 -6.077 1293 H LEU 77 H LEU 77 -4.092 -2.976 -2.768 1294 HA LEU 77 HA LEU 77 -6.307 -1.740 -4.002 1295 HB2 LEU 77 HB3 LEU 77 -6.450 -4.061 -3.355 1296 HB3 LEU 77 HB2 LEU 77 -6.158 -3.655 -1.668 1297 HG LEU 77 HG LEU 77 -8.303 -2.415 -1.569 1298 HD11 LEU 77 HD11 LEU 77 -9.768 -3.083 -3.749 1299 HD12 LEU 77 HD12 LEU 77 -8.210 -2.698 -4.487 1300 HD13 LEU 77 HD13 LEU 77 -9.013 -1.542 -3.407 1301 HD21 LEU 77 HD21 LEU 77 -9.621 -4.666 -2.597 1302 HD22 LEU 77 HD22 LEU 77 -9.106 -4.405 -0.944 1303 HD23 LEU 77 HD23 LEU 77 -8.054 -5.278 -2.056 1304 H VAL 78 H VAL 78 -5.219 -1.647 -0.621 1305 HA VAL 78 HA VAL 78 -7.230 0.256 0.070 1306 HB VAL 78 HB VAL 78 -6.068 0.511 2.217 1307 HG11 VAL 78 HG11 VAL 78 -5.760 -2.308 2.264 1308 HG12 VAL 78 HG12 VAL 78 -7.013 -1.982 1.093 1309 HG13 VAL 78 HG13 VAL 78 -7.171 -1.378 2.750 1310 HG21 VAL 78 HG21 VAL 78 -4.008 -0.779 2.658 1311 HG22 VAL 78 HG22 VAL 78 -3.706 0.379 1.366 1312 HG23 VAL 78 HG23 VAL 78 -4.007 -1.330 0.995 1313 H ALA 79 H ALA 79 -3.814 0.512 -0.808 1314 HA ALA 79 HA ALA 79 -3.627 3.296 -0.431 1315 HB1 ALA 79 HB1 ALA 79 -1.608 3.210 -1.700 1316 HB2 ALA 79 HB2 ALA 79 -2.078 1.697 -2.464 1317 HB3 ALA 79 HB3 ALA 79 -1.703 1.741 -0.732 1318 H ALA 80 H ALA 80 -4.509 1.344 -3.251 1319 HA ALA 80 HA ALA 80 -4.617 3.450 -5.057 1320 HB1 ALA 80 HB1 ALA 80 -4.660 1.262 -5.958 1321 HB2 ALA 80 HB2 ALA 80 -6.234 1.933 -6.331 1322 HB3 ALA 80 HB3 ALA 80 -6.048 0.797 -4.986 1323 H LEU 81 H LEU 81 -7.091 2.050 -2.935 1324 HA LEU 81 HA LEU 81 -9.169 3.892 -3.653 1325 HB2 LEU 81 HB3 LEU 81 -8.703 2.282 -1.122 1326 HB3 LEU 81 HB2 LEU 81 -10.132 3.269 -1.410 1327 HG LEU 81 HG LEU 81 -9.241 1.025 -3.254 1328 HD11 LEU 81 HD11 LEU 81 -9.842 -0.081 -1.316 1329 HD12 LEU 81 HD12 LEU 81 -11.300 -0.090 -2.303 1330 HD13 LEU 81 HD13 LEU 81 -11.165 1.037 -0.951 1331 HD21 LEU 81 HD21 LEU 81 -11.657 1.257 -3.976 1332 HD22 LEU 81 HD22 LEU 81 -10.601 2.565 -4.478 1333 HD23 LEU 81 HD23 LEU 81 -11.705 2.789 -3.106 1334 H THR 82 H THR 82 -6.624 3.880 -1.223 1335 HA THR 82 HA THR 82 -7.385 6.260 0.055 1336 HB THR 82 HB THR 82 -4.524 5.339 -0.290 1337 HG1 THR 82 HG2 THR 82 -5.974 3.616 0.466 1338 HG21 THR 82 HG21 THR 82 -4.026 6.621 1.559 1339 HG22 THR 82 HG22 THR 82 -5.653 6.494 2.213 1340 HG23 THR 82 HG23 THR 82 -5.331 7.599 0.892 1341 H VAL 83 H VAL 83 -5.025 5.701 -2.587 1342 HA VAL 83 HA VAL 83 -4.502 8.448 -2.970 1343 HB VAL 83 HB VAL 83 -3.199 6.293 -3.856 1344 HG11 VAL 83 HG11 VAL 83 -4.914 6.967 -6.262 1345 HG12 VAL 83 HG12 VAL 83 -4.947 5.474 -5.311 1346 HG13 VAL 83 HG13 VAL 83 -3.512 5.906 -6.203 1347 HG21 VAL 83 HG21 VAL 83 -2.362 8.620 -4.047 1348 HG22 VAL 83 HG22 VAL 83 -3.392 8.856 -5.467 1349 HG23 VAL 83 HG23 VAL 83 -2.064 7.698 -5.525 1350 H ALA 84 H ALA 84 -6.814 6.228 -4.480 1351 HA ALA 84 HA ALA 84 -7.783 7.975 -6.431 1352 HB1 ALA 84 HB1 ALA 84 -8.383 5.582 -6.360 1353 HB2 ALA 84 HB2 ALA 84 -9.819 6.591 -6.420 1354 HB3 ALA 84 HB3 ALA 84 -9.325 5.860 -4.897 1355 H MET 85 H MET 85 -8.965 7.431 -3.098 1356 HA MET 85 HA MET 85 -10.853 9.570 -3.289 1357 HB2 MET 85 HB3 MET 85 -11.018 7.621 -1.656 1358 HB3 MET 85 HB2 MET 85 -9.733 8.428 -0.748 1359 HG2 MET 85 HG3 MET 85 -11.139 10.455 -0.526 1360 HG3 MET 85 HG2 MET 85 -12.411 9.668 -1.437 1361 HE1 MET 85 HE1 MET 85 -11.578 10.294 2.418 1362 HE2 MET 85 HE2 MET 85 -10.191 9.874 1.421 1363 HE3 MET 85 HE3 MET 85 -10.752 8.755 2.654 1364 H ASN 86 H ASN 86 -7.579 9.243 -1.942 1365 HA ASN 86 HA ASN 86 -7.403 11.805 -0.789 1366 HB2 ASN 86 HB3 ASN 86 -5.742 9.793 -0.563 1367 HB3 ASN 86 HB2 ASN 86 -4.963 10.512 -1.986 1368 HD21 ASN 86 HD21 ASN 86 -3.955 12.676 -1.665 1369 HD22 ASN 86 HD22 ASN 86 -3.681 13.236 -0.102 1370 H ASN 87 H ASN 87 -7.004 10.666 -4.063 1371 HA ASN 87 HA ASN 87 -5.567 12.631 -5.259 1372 HB2 ASN 87 HB3 ASN 87 -6.649 10.669 -6.405 1373 HB3 ASN 87 HB2 ASN 87 -8.147 11.585 -6.453 1374 HD21 ASN 87 HD21 ASN 87 -6.809 14.261 -7.013 1375 HD22 ASN 87 HD22 ASN 87 -6.226 14.105 -8.578 1376 H PHE 88 H PHE 88 -8.979 12.678 -4.360 1377 HA PHE 88 HA PHE 88 -9.567 15.307 -5.321 1378 HB2 PHE 88 HB3 PHE 88 -10.961 13.569 -3.273 1379 HB3 PHE 88 HB2 PHE 88 -11.563 15.107 -3.859 1380 HD1 PHE 88 HD2 PHE 88 -11.983 15.431 -6.365 1381 HD2 PHE 88 HD1 PHE 88 -11.261 11.585 -4.566 1382 HE1 PHE 88 HE2 PHE 88 -12.950 14.314 -8.350 1383 HE2 PHE 88 HE1 PHE 88 -12.230 10.485 -6.554 1384 HZ PHE 88 HZ PHE 88 -13.075 11.835 -8.441 1385 H PHE 89 H PHE 89 -8.526 13.996 -2.214 1386 HA PHE 89 HA PHE 89 -9.087 16.056 -0.479 1387 HB2 PHE 89 HB3 PHE 89 -6.753 14.201 -0.611 1388 HB3 PHE 89 HB2 PHE 89 -6.784 15.484 0.560 1389 HD1 PHE 89 HD1 PHE 89 -10.253 14.658 0.130 1390 HD2 PHE 89 HD2 PHE 89 -6.607 13.044 1.832 1391 HE1 PHE 89 HE1 PHE 89 -11.549 13.269 1.633 1392 HE2 PHE 89 HE2 PHE 89 -7.970 11.640 3.324 1393 HZ PHE 89 HZ PHE 89 -10.438 11.756 3.232 1394 H TRP 90 H TRP 90 -5.783 15.893 -1.618 1395 HA TRP 90 HA TRP 90 -5.220 18.441 -0.766 1396 HB2 TRP 90 HB3 TRP 90 -3.480 18.254 -2.873 1397 HB3 TRP 90 HB2 TRP 90 -3.204 17.521 -1.307 1398 HD1 TRP 90 HD TRP 90 -5.561 16.397 -4.113 1399 HE1 TRP 90 HE1 TRP 90 -5.003 14.053 -4.804 1400 HE3 TRP 90 HE3 TRP 90 -1.581 15.583 -1.067 1401 HZ2 TRP 90 HZ2 TRP 90 -3.078 11.973 -4.134 1402 HZ3 TRP 90 HZ3 TRP 90 -0.401 13.397 -1.095 1403 HH2 TRP 90 HH TRP 90 -1.150 11.590 -2.627 1404 H GLU 91 H GLU 91 -6.750 17.502 -3.722 1405 HA GLU 91 HA GLU 91 -6.642 20.035 -5.050 1406 HB2 GLU 91 HB3 GLU 91 -8.462 17.693 -5.207 1407 HB3 GLU 91 HB2 GLU 91 -8.505 19.030 -6.358 1408 HG2 GLU 91 HG3 GLU 91 -6.081 18.586 -6.897 1409 HG3 GLU 91 HG2 GLU 91 -6.122 17.238 -5.816 1410 H ASN 92 H ASN 92 -9.116 18.282 -3.154 1411 HA ASN 92 HA ASN 92 -10.809 20.678 -3.042 1412 HB2 ASN 92 HB3 ASN 92 -11.781 18.415 -3.523 1413 HB3 ASN 92 HB2 ASN 92 -11.259 17.901 -1.926 1414 HD21 ASN 92 HD21 ASN 92 -14.036 17.891 -2.621 1415 HD22 ASN 92 HD22 ASN 92 -14.809 19.080 -1.700 1416 H SER 93 H SER 93 -9.851 22.046 -1.648 1417 HA SER 93 HA SER 93 -9.261 21.054 1.070 1418 HB2 SER 93 HB3 SER 93 -7.202 21.229 -0.119 1419 HB3 SER 93 HB2 SER 93 -7.665 22.752 -0.809 1420 HG SER 93 HG SER 93 -7.895 23.527 1.344 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -12.383 5.511 7.783 2 HA2 GLY 1 HA3 GLY 1 -13.274 2.886 8.387 3 HA3 GLY 1 HA2 GLY 1 -11.763 3.336 7.642 4 H SER 2 H SER 2 -10.931 1.591 8.935 5 HA SER 2 HA SER 2 -10.661 2.025 11.824 6 HB2 SER 2 HB3 SER 2 -9.389 -0.091 10.130 7 HB3 SER 2 HB2 SER 2 -9.643 -0.150 11.863 8 HG SER 2 HG SER 2 -11.115 -1.313 10.382 9 H GLU 3 H GLU 3 -8.170 1.249 12.452 10 HA GLU 3 HA GLU 3 -6.539 3.434 12.226 11 HB2 GLU 3 HB3 GLU 3 -5.513 0.585 12.255 12 HB3 GLU 3 HB2 GLU 3 -4.682 2.035 12.820 13 HG2 GLU 3 HG3 GLU 3 -5.454 1.218 14.773 14 HG3 GLU 3 HG2 GLU 3 -6.785 2.293 14.376 15 H LEU 4 H LEU 4 -7.214 1.029 9.832 16 HA LEU 4 HA LEU 4 -4.885 1.180 8.288 17 HB2 LEU 4 HB3 LEU 4 -7.728 0.662 7.392 18 HB3 LEU 4 HB2 LEU 4 -6.309 0.418 6.397 19 HG LEU 4 HG LEU 4 -7.442 -1.260 8.481 20 HD11 LEU 4 HD11 LEU 4 -5.974 -1.580 5.982 21 HD12 LEU 4 HD12 LEU 4 -7.248 -2.540 6.712 22 HD13 LEU 4 HD13 LEU 4 -5.589 -2.783 7.214 23 HD21 LEU 4 HD21 LEU 4 -5.214 -2.154 9.200 24 HD22 LEU 4 HD22 LEU 4 -5.747 -0.664 9.940 25 HD23 LEU 4 HD23 LEU 4 -4.462 -0.629 8.693 26 H GLU 5 H GLU 5 -7.826 3.176 8.234 27 HA GLU 5 HA GLU 5 -6.942 4.650 5.973 28 HB2 GLU 5 HB3 GLU 5 -8.935 5.359 8.139 29 HB3 GLU 5 HB2 GLU 5 -8.609 6.404 6.753 30 HG2 GLU 5 HG3 GLU 5 -9.181 4.445 5.249 31 HG3 GLU 5 HG2 GLU 5 -9.625 3.561 6.681 32 H THR 6 H THR 6 -6.559 5.115 9.465 33 HA THR 6 HA THR 6 -5.081 7.532 9.267 34 HB THR 6 HB THR 6 -4.787 5.398 11.397 35 HG1 THR 6 HG2 THR 6 -6.699 7.461 11.034 36 HG21 THR 6 HG21 THR 6 -4.548 7.620 12.753 37 HG22 THR 6 HG22 THR 6 -4.196 8.345 11.192 38 HG23 THR 6 HG23 THR 6 -3.176 7.059 11.809 39 H ALA 7 H ALA 7 -4.150 4.108 9.378 40 HA ALA 7 HA ALA 7 -1.373 4.507 9.194 41 HB1 ALA 7 HB1 ALA 7 -1.237 2.192 8.513 42 HB2 ALA 7 HB2 ALA 7 -2.921 2.185 8.015 43 HB3 ALA 7 HB3 ALA 7 -2.510 2.317 9.732 44 H MET 8 H MET 8 -3.902 4.142 6.738 45 HA MET 8 HA MET 8 -2.226 4.244 4.449 46 HB2 MET 8 HB3 MET 8 -5.140 4.942 4.898 47 HB3 MET 8 HB2 MET 8 -4.373 5.050 3.328 48 HG2 MET 8 HG3 MET 8 -3.762 2.475 4.565 49 HG3 MET 8 HG2 MET 8 -5.488 2.750 4.468 50 HE1 MET 8 HE1 MET 8 -2.246 2.145 2.811 51 HE2 MET 8 HE2 MET 8 -2.378 3.762 2.108 52 HE3 MET 8 HE3 MET 8 -2.506 2.353 1.072 53 H GLU 9 H GLU 9 -3.968 6.723 6.316 54 HA GLU 9 HA GLU 9 -3.111 8.849 4.720 55 HB2 GLU 9 HB3 GLU 9 -4.078 8.819 7.581 56 HB3 GLU 9 HB2 GLU 9 -3.636 10.292 6.732 57 HG2 GLU 9 HG3 GLU 9 -5.298 9.821 4.969 58 HG3 GLU 9 HG2 GLU 9 -5.743 8.324 5.774 59 H THR 10 H THR 10 -1.755 7.245 7.509 60 HA THR 10 HA THR 10 0.341 9.024 8.103 61 HB THR 10 HB THR 10 0.475 5.999 8.265 62 HG1 THR 10 HG2 THR 10 -1.484 6.961 9.193 63 HG21 THR 10 HG21 THR 10 1.583 7.651 10.452 64 HG22 THR 10 HG22 THR 10 2.393 7.884 8.910 65 HG23 THR 10 HG23 THR 10 2.271 6.276 9.604 66 H LEU 11 H LEU 11 0.114 6.310 5.854 67 HA LEU 11 HA LEU 11 2.703 6.667 4.691 68 HB2 LEU 11 HB3 LEU 11 0.171 5.361 3.672 69 HB3 LEU 11 HB2 LEU 11 1.686 5.358 2.765 70 HG LEU 11 HG LEU 11 1.459 4.305 5.614 71 HD11 LEU 11 HD11 LEU 11 1.231 2.840 2.980 72 HD12 LEU 11 HD12 LEU 11 0.037 2.903 4.283 73 HD13 LEU 11 HD13 LEU 11 1.566 2.059 4.524 74 HD21 LEU 11 HD21 LEU 11 3.529 3.941 3.415 75 HD22 LEU 11 HD22 LEU 11 3.586 3.165 4.988 76 HD23 LEU 11 HD23 LEU 11 3.773 4.904 4.869 77 H ILE 12 H ILE 12 -0.522 7.965 3.965 78 HA ILE 12 HA ILE 12 0.196 9.367 1.605 79 HB ILE 12 HB ILE 12 -1.920 10.020 3.672 80 HG12 ILE 12 HG13 ILE 12 -2.206 7.841 2.305 81 HG13 ILE 12 HG12 ILE 12 -3.498 9.027 2.140 82 HG21 ILE 12 HG21 ILE 12 -1.477 12.058 2.613 83 HG22 ILE 12 HG22 ILE 12 -2.924 11.408 1.875 84 HG23 ILE 12 HG23 ILE 12 -1.382 11.314 1.012 85 HD11 ILE 12 HD11 ILE 12 -2.591 7.952 -0.007 86 HD12 ILE 12 HD12 ILE 12 -1.191 8.996 0.172 87 HD13 ILE 12 HD13 ILE 12 -2.801 9.688 0.007 88 H ASN 13 H ASN 13 0.187 10.343 5.002 89 HA ASN 13 HA ASN 13 0.773 13.046 4.581 90 HB2 ASN 13 HB3 ASN 13 1.333 11.225 6.916 91 HB3 ASN 13 HB2 ASN 13 1.820 12.912 6.918 92 HD21 ASN 13 HD21 ASN 13 -0.923 10.789 7.204 93 HD22 ASN 13 HD22 ASN 13 -2.094 11.994 7.424 94 H VAL 14 H VAL 14 2.965 10.328 5.042 95 HA VAL 14 HA VAL 14 5.373 11.813 4.840 96 HB VAL 14 HB VAL 14 4.736 8.914 4.225 97 HG11 VAL 14 HG11 VAL 14 7.245 8.627 4.456 98 HG12 VAL 14 HG12 VAL 14 7.397 10.368 4.379 99 HG13 VAL 14 HG13 VAL 14 6.748 9.482 2.997 100 HG21 VAL 14 HG21 VAL 14 4.441 9.311 6.565 101 HG22 VAL 14 HG22 VAL 14 5.797 10.422 6.630 102 HG23 VAL 14 HG23 VAL 14 6.086 8.700 6.433 103 H PHE 15 H PHE 15 3.393 10.112 2.487 104 HA PHE 15 HA PHE 15 4.892 10.743 0.170 105 HB2 PHE 15 HB3 PHE 15 3.053 9.043 0.304 106 HB3 PHE 15 HB2 PHE 15 1.896 10.363 0.408 107 HD1 PHE 15 HD1 PHE 15 4.500 8.820 -1.763 108 HD2 PHE 15 HD2 PHE 15 1.207 11.579 -1.531 109 HE1 PHE 15 HE1 PHE 15 4.477 9.019 -4.238 110 HE2 PHE 15 HE2 PHE 15 1.207 11.772 -4.006 111 HZ PHE 15 HZ PHE 15 2.825 10.501 -5.345 112 H HIS 16 H HIS 16 2.199 12.346 1.781 113 HA HIS 16 HA HIS 16 1.719 14.497 0.076 114 HB2 HIS 16 HB3 HIS 16 0.753 13.647 2.530 115 HB3 HIS 16 HB2 HIS 16 1.539 15.155 2.940 116 HD1 HIS 16 HD1 HIS 16 0.561 15.966 -0.329 117 HD2 HIS 16 HD2 HIS 16 -1.650 15.199 3.144 118 HE1 HIS 16 HE1 HIS 16 -1.688 17.071 -0.620 119 HE2 HIS 16 HE2 HIS 16 -3.035 16.601 1.485 120 H ALA 17 H ALA 17 3.837 14.324 2.928 121 HA ALA 17 HA ALA 17 4.821 16.947 2.779 122 HB1 ALA 17 HB1 ALA 17 5.075 15.480 4.757 123 HB2 ALA 17 HB2 ALA 17 6.598 16.210 4.259 124 HB3 ALA 17 HB3 ALA 17 6.271 14.524 3.884 125 H HIS 18 H HIS 18 6.236 13.935 1.559 126 HA HIS 18 HA HIS 18 8.462 15.240 0.361 127 HB2 HIS 18 HB3 HIS 18 7.335 12.457 -0.092 128 HB3 HIS 18 HB2 HIS 18 8.782 13.112 -0.876 129 HD1 HIS 18 HD1 HIS 18 10.887 13.689 0.647 130 HD2 HIS 18 HD2 HIS 18 7.742 11.751 2.652 131 HE1 HIS 18 HE1 HIS 18 11.770 12.932 2.892 132 HE2 HIS 18 HE2 HIS 18 9.884 11.767 4.105 133 H SER 19 H SER 19 5.276 14.369 -0.868 134 HA SER 19 HA SER 19 5.771 14.782 -3.591 135 HB2 SER 19 HB3 SER 19 3.235 15.429 -2.062 136 HB3 SER 19 HB2 SER 19 3.345 15.313 -3.808 137 HG SER 19 HG SER 19 3.901 13.287 -1.872 138 H GLY 20 H GLY 20 4.988 17.072 -1.048 139 HA2 GLY 20 HA3 GLY 20 4.711 19.370 -2.658 140 HA3 GLY 20 HA2 GLY 20 5.148 19.354 -0.946 141 H LYS 21 H LYS 21 7.538 17.742 -1.309 142 HA LYS 21 HA LYS 21 9.382 19.836 -1.595 143 HB2 LYS 21 HB3 LYS 21 9.950 16.864 -1.742 144 HB3 LYS 21 HB2 LYS 21 11.112 18.134 -1.407 145 HG2 LYS 21 HG3 LYS 21 8.692 17.507 0.319 146 HG3 LYS 21 HG2 LYS 21 10.338 16.999 0.642 147 HD2 LYS 21 HD3 LYS 21 11.059 19.403 0.715 148 HD3 LYS 21 HD2 LYS 21 9.388 19.872 0.470 149 HE2 LYS 21 HE2 LYS 21 9.816 19.951 2.832 150 HE3 LYS 21 HE1 LYS 21 8.741 18.596 2.524 151 HZ1 LYS 21 HZ1 LYS 21 10.617 17.091 2.594 152 HZ2 LYS 21 HZ2 LYS 21 10.607 17.984 4.015 153 HZ3 LYS 21 HZ3 LYS 21 11.711 18.335 2.792 154 H GLU 22 H GLU 22 9.553 16.905 -3.555 155 HA GLU 22 HA GLU 22 10.417 18.569 -5.860 156 HB2 GLU 22 HB3 GLU 22 11.491 15.950 -4.823 157 HB3 GLU 22 HB2 GLU 22 11.947 16.639 -6.376 158 HG2 GLU 22 HG3 GLU 22 12.772 18.664 -5.270 159 HG3 GLU 22 HG2 GLU 22 12.239 18.047 -3.712 160 H GLY 23 H GLY 23 8.041 16.467 -4.874 161 HA2 GLY 23 HA3 GLY 23 7.808 14.829 -7.214 162 HA3 GLY 23 HA2 GLY 23 6.621 15.030 -5.926 163 H ASP 24 H ASP 24 4.805 16.056 -6.429 164 HA ASP 24 HA ASP 24 4.684 18.222 -8.368 165 HB2 ASP 24 HB3 ASP 24 4.297 15.908 -9.579 166 HB3 ASP 24 HB2 ASP 24 2.763 15.936 -8.755 167 H LYS 25 H LYS 25 1.719 17.921 -8.495 168 HA LYS 25 HA LYS 25 0.982 19.182 -6.012 169 HB2 LYS 25 HB3 LYS 25 -0.707 17.617 -7.929 170 HB3 LYS 25 HB2 LYS 25 -1.337 18.633 -6.631 171 HG2 LYS 25 HG3 LYS 25 0.170 20.438 -7.688 172 HG3 LYS 25 HG2 LYS 25 0.066 19.415 -9.134 173 HD2 LYS 25 HD3 LYS 25 -2.368 20.451 -7.624 174 HD3 LYS 25 HD2 LYS 25 -1.725 21.241 -9.064 175 HE2 LYS 25 HE2 LYS 25 -2.108 19.192 -10.373 176 HE3 LYS 25 HE1 LYS 25 -2.700 18.368 -8.941 177 HZ1 LYS 25 HZ1 LYS 25 -4.708 19.427 -9.046 178 HZ2 LYS 25 HZ2 LYS 25 -4.267 19.726 -10.663 179 HZ3 LYS 25 HZ3 LYS 25 -4.025 20.901 -9.505 180 H TYR 26 H TYR 26 0.744 16.015 -7.433 181 HA TYR 26 HA TYR 26 1.154 14.903 -4.882 182 HB2 TYR 26 HB3 TYR 26 -0.760 13.087 -5.780 183 HB3 TYR 26 HB2 TYR 26 -1.010 14.281 -4.526 184 HD1 TYR 26 HD2 TYR 26 -0.886 14.139 -8.273 185 HD2 TYR 26 HD1 TYR 26 -2.815 15.730 -4.796 186 HE1 TYR 26 HE2 TYR 26 -2.509 15.309 -9.714 187 HE2 TYR 26 HE1 TYR 26 -4.441 16.892 -6.210 188 HH TYR 26 HH TYR 26 -4.942 17.529 -8.378 189 H LYS 27 H LYS 27 3.076 14.210 -5.597 190 HA LYS 27 HA LYS 27 3.227 11.754 -6.952 191 HB2 LYS 27 HB3 LYS 27 4.315 14.206 -8.358 192 HB3 LYS 27 HB2 LYS 27 5.043 12.634 -8.579 193 HG2 LYS 27 HG3 LYS 27 2.183 13.411 -9.274 194 HG3 LYS 27 HG2 LYS 27 3.475 13.008 -10.377 195 HD2 LYS 27 HD3 LYS 27 3.523 10.759 -8.844 196 HD3 LYS 27 HD2 LYS 27 1.835 11.180 -8.705 197 HE2 LYS 27 HE2 LYS 27 2.752 11.403 -11.509 198 HE3 LYS 27 HE1 LYS 27 2.956 9.804 -10.833 199 HZ1 LYS 27 HZ1 LYS 27 0.333 11.099 -10.369 200 HZ2 LYS 27 HZ2 LYS 27 0.758 9.471 -10.632 201 HZ3 LYS 27 HZ3 LYS 27 0.702 10.511 -11.901 202 H LEU 28 H LEU 28 5.449 10.903 -6.733 203 HA LEU 28 HA LEU 28 7.039 12.481 -4.826 204 HB2 LEU 28 HB3 LEU 28 5.997 10.691 -3.642 205 HB3 LEU 28 HB2 LEU 28 6.473 9.504 -4.849 206 HG LEU 28 HG LEU 28 8.896 10.111 -4.306 207 HD11 LEU 28 HD11 LEU 28 9.097 11.115 -1.953 208 HD12 LEU 28 HD12 LEU 28 7.433 11.647 -2.163 209 HD13 LEU 28 HD13 LEU 28 8.692 12.242 -3.256 210 HD21 LEU 28 HD21 LEU 28 7.219 9.064 -2.007 211 HD22 LEU 28 HD22 LEU 28 8.940 8.757 -2.308 212 HD23 LEU 28 HD23 LEU 28 7.726 8.099 -3.400 213 H SER 29 H SER 29 9.139 12.794 -5.443 214 HA SER 29 HA SER 29 9.964 11.823 -8.008 215 HB2 SER 29 HB3 SER 29 12.118 13.031 -7.336 216 HB3 SER 29 HB2 SER 29 10.679 14.030 -7.430 217 HG SER 29 HG SER 29 11.975 14.284 -5.439 218 H LYS 30 H LYS 30 11.938 10.530 -8.282 219 HA LYS 30 HA LYS 30 12.091 8.440 -6.269 220 HB2 LYS 30 HB3 LYS 30 13.886 8.788 -8.683 221 HB3 LYS 30 HB2 LYS 30 13.643 7.343 -7.728 222 HG2 LYS 30 HG3 LYS 30 11.517 8.708 -9.417 223 HG3 LYS 30 HG2 LYS 30 12.361 7.226 -9.819 224 HD2 LYS 30 HD3 LYS 30 10.845 7.361 -7.188 225 HD3 LYS 30 HD2 LYS 30 9.981 7.115 -8.703 226 HE2 LYS 30 HE2 LYS 30 12.159 5.356 -7.545 227 HE3 LYS 30 HE1 LYS 30 10.475 4.954 -7.788 228 HZ1 LYS 30 HZ1 LYS 30 12.527 5.411 -9.859 229 HZ2 LYS 30 HZ2 LYS 30 10.838 5.361 -10.214 230 HZ3 LYS 30 HZ3 LYS 30 11.623 4.026 -9.587 231 H LYS 31 H LYS 31 13.323 11.438 -6.673 232 HA LYS 31 HA LYS 31 15.997 11.264 -5.668 233 HB2 LYS 31 HB3 LYS 31 13.985 13.510 -5.326 234 HB3 LYS 31 HB2 LYS 31 15.736 13.607 -5.316 235 HG2 LYS 31 HG3 LYS 31 15.836 12.910 -7.673 236 HG3 LYS 31 HG2 LYS 31 14.094 12.748 -7.692 237 HD2 LYS 31 HD3 LYS 31 13.956 15.184 -6.988 238 HD3 LYS 31 HD2 LYS 31 15.663 15.327 -7.412 239 HE2 LYS 31 HE2 LYS 31 13.475 14.305 -9.218 240 HE3 LYS 31 HE1 LYS 31 14.098 15.951 -9.268 241 HZ1 LYS 31 HZ1 LYS 31 16.241 14.053 -9.392 242 HZ2 LYS 31 HZ2 LYS 31 15.809 15.272 -10.493 243 HZ3 LYS 31 HZ3 LYS 31 15.104 13.742 -10.601 244 H GLU 32 H GLU 32 12.859 12.022 -4.332 245 HA GLU 32 HA GLU 32 13.601 12.033 -1.566 246 HB2 GLU 32 HB3 GLU 32 10.969 12.065 -3.037 247 HB3 GLU 32 HB2 GLU 32 11.128 12.221 -1.283 248 HG2 GLU 32 HG3 GLU 32 12.585 14.021 -3.223 249 HG3 GLU 32 HG2 GLU 32 11.014 14.438 -2.605 250 H LEU 33 H LEU 33 11.991 9.818 -3.770 251 HA LEU 33 HA LEU 33 10.957 8.037 -1.921 252 HB2 LEU 33 HB3 LEU 33 10.452 8.037 -4.386 253 HB3 LEU 33 HB2 LEU 33 12.056 7.351 -4.628 254 HG LEU 33 HG LEU 33 10.017 5.723 -4.564 255 HD11 LEU 33 HD11 LEU 33 11.959 4.578 -2.710 256 HD12 LEU 33 HD12 LEU 33 12.741 5.405 -4.050 257 HD13 LEU 33 HD13 LEU 33 11.582 4.130 -4.360 258 HD21 LEU 33 HD21 LEU 33 9.354 4.944 -2.380 259 HD22 LEU 33 HD22 LEU 33 9.154 6.689 -2.377 260 HD23 LEU 33 HD23 LEU 33 10.549 5.959 -1.578 261 H LYS 34 H LYS 34 14.122 7.989 -3.525 262 HA LYS 34 HA LYS 34 15.020 5.583 -2.361 263 HB2 LYS 34 HB3 LYS 34 16.539 7.978 -3.381 264 HB3 LYS 34 HB2 LYS 34 17.303 6.492 -2.815 265 HG2 LYS 34 HG3 LYS 34 16.109 5.182 -4.528 266 HG3 LYS 34 HG2 LYS 34 15.238 6.613 -5.051 267 HD2 LYS 34 HD3 LYS 34 16.914 6.557 -6.621 268 HD3 LYS 34 HD2 LYS 34 17.661 7.615 -5.446 269 HE2 LYS 34 HE2 LYS 34 18.158 4.627 -5.787 270 HE3 LYS 34 HE1 LYS 34 19.275 5.932 -6.136 271 HZ1 LYS 34 HZ1 LYS 34 18.925 6.519 -3.626 272 HZ2 LYS 34 HZ2 LYS 34 19.963 5.286 -4.062 273 HZ3 LYS 34 HZ3 LYS 34 18.417 4.911 -3.502 274 H GLU 35 H GLU 35 15.325 8.955 -1.325 275 HA GLU 35 HA GLU 35 16.925 8.333 0.949 276 HB2 GLU 35 HB3 GLU 35 15.253 10.779 0.385 277 HB3 GLU 35 HB2 GLU 35 16.525 10.677 1.593 278 HG2 GLU 35 HG3 GLU 35 16.887 10.325 -1.386 279 HG3 GLU 35 HG2 GLU 35 17.332 11.750 -0.472 280 H LEU 36 H LEU 36 13.521 9.275 0.548 281 HA LEU 36 HA LEU 36 12.925 9.065 3.253 282 HB2 LEU 36 HB3 LEU 36 11.004 9.988 2.661 283 HB3 LEU 36 HB2 LEU 36 11.589 10.023 1.023 284 HG LEU 36 HG LEU 36 10.623 7.521 0.955 285 HD11 LEU 36 HD11 LEU 36 9.381 8.764 3.382 286 HD12 LEU 36 HD12 LEU 36 9.859 7.082 3.105 287 HD13 LEU 36 HD13 LEU 36 8.413 7.722 2.355 288 HD21 LEU 36 HD21 LEU 36 8.630 9.786 0.983 289 HD22 LEU 36 HD22 LEU 36 8.693 8.349 -0.047 290 HD23 LEU 36 HD23 LEU 36 9.876 9.641 -0.270 291 H LEU 37 H LEU 37 12.548 6.669 0.661 292 HA LEU 37 HA LEU 37 11.109 4.828 2.213 293 HB2 LEU 37 HB3 LEU 37 11.255 4.597 -0.215 294 HB3 LEU 37 HB2 LEU 37 12.977 4.313 -0.134 295 HG LEU 37 HG LEU 37 11.472 2.232 -0.386 296 HD11 LEU 37 HD11 LEU 37 13.131 0.977 0.474 297 HD12 LEU 37 HD12 LEU 37 13.019 1.708 2.060 298 HD13 LEU 37 HD13 LEU 37 13.931 2.511 0.785 299 HD21 LEU 37 HD21 LEU 37 10.215 1.457 1.383 300 HD22 LEU 37 HD22 LEU 37 9.929 3.186 1.511 301 HD23 LEU 37 HD23 LEU 37 11.089 2.396 2.587 302 H GLN 38 H GLN 38 14.588 5.115 1.654 303 HA GLN 38 HA GLN 38 15.203 2.939 3.367 304 HB2 GLN 38 HB3 GLN 38 17.523 3.695 3.267 305 HB3 GLN 38 HB2 GLN 38 16.821 3.774 1.660 306 HG2 GLN 38 HG3 GLN 38 16.367 6.191 2.012 307 HG3 GLN 38 HG2 GLN 38 17.194 6.109 3.569 308 HE21 GLN 38 HE21 GLN 38 19.274 6.900 3.356 309 HE22 GLN 38 HE22 GLN 38 20.271 6.673 2.010 310 H THR 39 H THR 39 14.929 6.398 3.844 311 HA THR 39 HA THR 39 15.867 6.497 6.482 312 HB THR 39 HB THR 39 13.886 8.228 5.017 313 HG1 THR 39 HG2 THR 39 15.710 8.371 3.966 314 HG21 THR 39 HG21 THR 39 14.715 9.961 6.689 315 HG22 THR 39 HG22 THR 39 15.338 8.599 7.631 316 HG23 THR 39 HG23 THR 39 13.612 8.727 7.288 317 H GLU 40 H GLU 40 12.499 6.355 5.245 318 HA GLU 40 HA GLU 40 11.410 6.317 7.850 319 HB2 GLU 40 HB3 GLU 40 10.113 5.647 5.210 320 HB3 GLU 40 HB2 GLU 40 9.282 5.920 6.748 321 HG2 GLU 40 HG3 GLU 40 11.042 7.967 5.338 322 HG3 GLU 40 HG2 GLU 40 9.288 7.985 5.401 323 H LEU 41 H LEU 41 11.943 3.740 5.495 324 HA LEU 41 HA LEU 41 10.956 1.806 7.446 325 HB2 LEU 41 HB3 LEU 41 11.459 1.698 4.507 326 HB3 LEU 41 HB2 LEU 41 11.506 0.219 5.428 327 HG LEU 41 HG LEU 41 9.275 0.720 6.422 328 HD11 LEU 41 HD11 LEU 41 9.005 3.014 6.342 329 HD12 LEU 41 HD12 LEU 41 7.925 2.465 5.071 330 HD13 LEU 41 HD13 LEU 41 9.499 3.148 4.654 331 HD21 LEU 41 HD21 LEU 41 9.623 -0.638 4.294 332 HD22 LEU 41 HD22 LEU 41 9.135 0.813 3.417 333 HD23 LEU 41 HD23 LEU 41 8.008 0.031 4.549 334 H SER 42 H SER 42 13.363 3.154 7.988 335 HA SER 42 HA SER 42 15.666 1.816 7.225 336 HB2 SER 42 HB3 SER 42 16.202 2.709 9.775 337 HB3 SER 42 HB2 SER 42 16.331 3.663 8.312 338 HG SER 42 HG SER 42 14.523 4.695 8.814 339 H GLY 43 H GLY 43 13.272 1.071 9.676 340 HA2 GLY 43 HA3 GLY 43 14.723 -0.948 11.064 341 HA3 GLY 43 HA2 GLY 43 12.980 -0.701 11.079 342 H PHE 44 H PHE 44 12.255 -1.053 8.501 343 HA PHE 44 HA PHE 44 12.501 -3.926 8.197 344 HB2 PHE 44 HB3 PHE 44 11.038 -1.843 6.566 345 HB3 PHE 44 HB2 PHE 44 11.234 -3.480 5.967 346 HD1 PHE 44 HD2 PHE 44 10.889 -5.263 8.100 347 HD2 PHE 44 HD1 PHE 44 8.926 -1.513 7.501 348 HE1 PHE 44 HE2 PHE 44 9.013 -6.034 9.518 349 HE2 PHE 44 HE1 PHE 44 7.044 -2.265 8.924 350 HZ PHE 44 HZ PHE 44 7.078 -4.516 9.933 351 H LEU 45 H LEU 45 13.729 -1.089 6.626 352 HA LEU 45 HA LEU 45 14.902 -2.364 4.469 353 HB2 LEU 45 HB3 LEU 45 14.664 -0.006 4.415 354 HB3 LEU 45 HB2 LEU 45 15.618 0.217 5.870 355 HG LEU 45 HG LEU 45 17.521 -0.706 4.820 356 HD11 LEU 45 HD11 LEU 45 16.915 -2.199 3.109 357 HD12 LEU 45 HD12 LEU 45 17.271 -0.798 2.107 358 HD13 LEU 45 HD13 LEU 45 15.602 -1.170 2.537 359 HD21 LEU 45 HD21 LEU 45 16.777 1.779 4.550 360 HD22 LEU 45 HD22 LEU 45 16.609 1.353 2.825 361 HD23 LEU 45 HD23 LEU 45 18.163 1.203 3.623 362 H ASP 46 H ASP 46 16.219 -1.640 7.689 363 HA ASP 46 HA ASP 46 18.845 -2.347 7.169 364 HB2 ASP 46 HB3 ASP 46 17.877 -1.413 9.403 365 HB3 ASP 46 HB2 ASP 46 17.523 -3.092 9.748 366 H ALA 47 H ALA 47 16.199 -4.409 8.207 367 HA ALA 47 HA ALA 47 17.719 -6.842 8.236 368 HB1 ALA 47 HB1 ALA 47 14.735 -6.428 7.944 369 HB2 ALA 47 HB2 ALA 47 15.614 -6.690 9.456 370 HB3 ALA 47 HB3 ALA 47 15.538 -7.969 8.247 371 H GLN 48 H GLN 48 15.752 -5.190 5.857 372 HA GLN 48 HA GLN 48 15.989 -7.300 3.939 373 HB2 GLN 48 HB3 GLN 48 14.959 -4.478 3.602 374 HB3 GLN 48 HB2 GLN 48 14.859 -5.756 2.391 375 HG2 GLN 48 HG3 GLN 48 13.631 -5.920 5.171 376 HG3 GLN 48 HG2 GLN 48 12.738 -5.638 3.682 377 HE21 GLN 48 HE21 GLN 48 13.917 -8.052 5.770 378 HE22 GLN 48 HE22 GLN 48 13.695 -9.373 4.731 379 H LYS 49 H LYS 49 18.119 -5.023 4.913 380 HA LYS 49 HA LYS 49 19.451 -4.217 2.534 381 HB2 LYS 49 HB3 LYS 49 20.565 -4.838 5.283 382 HB3 LYS 49 HB2 LYS 49 21.542 -4.261 3.947 383 HG2 LYS 49 HG3 LYS 49 20.282 -2.179 3.820 384 HG3 LYS 49 HG2 LYS 49 19.125 -2.749 5.011 385 HD2 LYS 49 HD3 LYS 49 20.660 -1.304 6.137 386 HD3 LYS 49 HD2 LYS 49 20.972 -2.955 6.666 387 HE2 LYS 49 HE2 LYS 49 22.697 -2.751 4.495 388 HE3 LYS 49 HE1 LYS 49 22.717 -1.114 5.106 389 HZ1 LYS 49 HZ1 LYS 49 23.660 -3.568 6.379 390 HZ2 LYS 49 HZ2 LYS 49 23.042 -2.393 7.417 391 HZ3 LYS 49 HZ3 LYS 49 24.319 -2.038 6.372 392 H ASP 50 H ASP 50 19.631 -7.131 4.456 393 HA ASP 50 HA ASP 50 21.602 -8.292 2.625 394 HB2 ASP 50 HB3 ASP 50 21.761 -8.364 5.224 395 HB3 ASP 50 HB2 ASP 50 20.529 -9.619 5.079 396 H VAL 51 H VAL 51 18.597 -7.909 2.115 397 HA VAL 51 HA VAL 51 17.997 -10.731 1.478 398 HB VAL 51 HB VAL 51 16.153 -8.443 2.183 399 HG11 VAL 51 HG11 VAL 51 15.601 -11.065 0.885 400 HG12 VAL 51 HG12 VAL 51 14.761 -9.500 0.756 401 HG13 VAL 51 HG13 VAL 51 14.505 -10.523 2.150 402 HG21 VAL 51 HG21 VAL 51 16.834 -11.055 3.589 403 HG22 VAL 51 HG22 VAL 51 15.524 -9.994 4.084 404 HG23 VAL 51 HG23 VAL 51 17.189 -9.429 4.153 405 H ASP 52 H ASP 52 17.646 -11.205 -0.557 406 HA ASP 52 HA ASP 52 18.415 -9.556 -2.675 407 HB2 ASP 52 HB3 ASP 52 18.317 -12.048 -2.808 408 HB3 ASP 52 HB2 ASP 52 16.566 -11.929 -2.774 409 H ALA 53 H ALA 53 15.269 -10.083 -1.297 410 HA ALA 53 HA ALA 53 13.669 -9.024 -3.302 411 HB1 ALA 53 HB1 ALA 53 13.072 -8.571 -0.382 412 HB2 ALA 53 HB2 ALA 53 12.906 -10.159 -1.133 413 HB3 ALA 53 HB3 ALA 53 11.945 -8.805 -1.711 414 H VAL 54 H VAL 54 15.684 -7.339 -0.958 415 HA VAL 54 HA VAL 54 14.443 -4.839 -1.147 416 HB VAL 54 HB VAL 54 16.356 -5.659 0.436 417 HG11 VAL 54 HG11 VAL 54 18.562 -4.850 -0.142 418 HG12 VAL 54 HG12 VAL 54 18.008 -4.289 -1.712 419 HG13 VAL 54 HG13 VAL 54 18.060 -6.023 -1.347 420 HG21 VAL 54 HG21 VAL 54 16.046 -2.846 -0.651 421 HG22 VAL 54 HG22 VAL 54 17.062 -3.208 0.741 422 HG23 VAL 54 HG23 VAL 54 15.336 -3.534 0.811 423 H ASP 55 H ASP 55 16.948 -6.300 -3.133 424 HA ASP 55 HA ASP 55 17.446 -4.125 -4.901 425 HB2 ASP 55 HB3 ASP 55 18.970 -5.894 -5.071 426 HB3 ASP 55 HB2 ASP 55 17.710 -7.118 -5.090 427 H LYS 56 H LYS 56 15.460 -6.942 -5.201 428 HA LYS 56 HA LYS 56 14.300 -6.208 -7.640 429 HB2 LYS 56 HB3 LYS 56 13.535 -8.303 -5.628 430 HB3 LYS 56 HB2 LYS 56 12.865 -8.193 -7.266 431 HG2 LYS 56 HG3 LYS 56 15.121 -8.240 -8.254 432 HG3 LYS 56 HG2 LYS 56 15.813 -8.283 -6.639 433 HD2 LYS 56 HD3 LYS 56 14.827 -10.447 -6.245 434 HD3 LYS 56 HD2 LYS 56 14.064 -10.431 -7.835 435 HE2 LYS 56 HE2 LYS 56 16.322 -11.664 -7.711 436 HE3 LYS 56 HE1 LYS 56 16.157 -10.464 -8.985 437 HZ1 LYS 56 HZ1 LYS 56 17.547 -10.051 -6.346 438 HZ2 LYS 56 HZ2 LYS 56 17.375 -8.826 -7.525 439 HZ3 LYS 56 HZ3 LYS 56 18.252 -10.211 -7.851 440 H VAL 57 H VAL 57 13.109 -5.812 -4.364 441 HA VAL 57 HA VAL 57 10.504 -4.853 -5.069 442 HB VAL 57 HB VAL 57 12.271 -4.471 -2.622 443 HG11 VAL 57 HG11 VAL 57 9.538 -3.400 -3.255 444 HG12 VAL 57 HG12 VAL 57 10.971 -2.603 -2.582 445 HG13 VAL 57 HG13 VAL 57 10.066 -3.729 -1.589 446 HG21 VAL 57 HG21 VAL 57 11.357 -6.778 -3.027 447 HG22 VAL 57 HG22 VAL 57 9.746 -6.111 -3.084 448 HG23 VAL 57 HG23 VAL 57 10.680 -6.030 -1.583 449 H MET 58 H MET 58 13.629 -3.441 -4.371 450 HA MET 58 HA MET 58 12.964 -0.745 -4.841 451 HB2 MET 58 HB3 MET 58 14.980 -1.362 -3.647 452 HB3 MET 58 HB2 MET 58 15.575 -2.244 -5.047 453 HG2 MET 58 HG3 MET 58 15.659 -0.312 -6.342 454 HG3 MET 58 HG2 MET 58 14.991 0.733 -5.072 455 HE1 MET 58 HE1 MET 58 18.872 -0.810 -6.157 456 HE2 MET 58 HE2 MET 58 17.391 -1.748 -6.195 457 HE3 MET 58 HE3 MET 58 18.524 -1.964 -4.865 458 H LYS 59 H LYS 59 14.023 -3.404 -6.851 459 HA LYS 59 HA LYS 59 14.712 -1.983 -9.127 460 HB2 LYS 59 HB3 LYS 59 15.124 -4.482 -8.571 461 HB3 LYS 59 HB2 LYS 59 13.525 -4.746 -9.275 462 HG2 LYS 59 HG3 LYS 59 15.140 -5.048 -11.042 463 HG3 LYS 59 HG2 LYS 59 14.284 -3.532 -11.284 464 HD2 LYS 59 HD3 LYS 59 16.328 -2.546 -11.442 465 HD3 LYS 59 HD2 LYS 59 16.418 -2.678 -9.705 466 HE2 LYS 59 HE2 LYS 59 17.581 -4.555 -11.765 467 HE3 LYS 59 HE1 LYS 59 18.422 -3.642 -10.515 468 HZ1 LYS 59 HZ1 LYS 59 16.391 -5.674 -9.768 469 HZ2 LYS 59 HZ2 LYS 59 17.672 -5.104 -8.828 470 HZ3 LYS 59 HZ3 LYS 59 17.948 -6.136 -10.114 471 H GLU 60 H GLU 60 11.603 -3.336 -8.152 472 HA GLU 60 HA GLU 60 10.177 -2.786 -10.520 473 HB2 GLU 60 HB3 GLU 60 9.377 -2.767 -7.626 474 HB3 GLU 60 HB2 GLU 60 8.208 -2.619 -8.934 475 HG2 GLU 60 HG3 GLU 60 8.954 -4.834 -9.805 476 HG3 GLU 60 HG2 GLU 60 10.109 -4.930 -8.472 477 H LEU 61 H LEU 61 10.808 -0.895 -7.627 478 HA LEU 61 HA LEU 61 9.579 1.515 -8.523 479 HB2 LEU 61 HB3 LEU 61 11.530 0.822 -6.359 480 HB3 LEU 61 HB2 LEU 61 11.265 2.506 -6.768 481 HG LEU 61 HG LEU 61 9.797 1.514 -4.917 482 HD11 LEU 61 HD11 LEU 61 9.318 3.663 -6.096 483 HD12 LEU 61 HD12 LEU 61 7.867 2.807 -5.575 484 HD13 LEU 61 HD13 LEU 61 8.332 2.768 -7.264 485 HD21 LEU 61 HD21 LEU 61 9.257 -0.619 -6.130 486 HD22 LEU 61 HD22 LEU 61 8.302 0.321 -7.288 487 HD23 LEU 61 HD23 LEU 61 7.823 0.252 -5.616 488 H ASP 62 H ASP 62 12.835 0.186 -8.701 489 HA ASP 62 HA ASP 62 14.122 2.449 -9.731 490 HB2 ASP 62 HB3 ASP 62 15.166 0.214 -8.882 491 HB3 ASP 62 HB2 ASP 62 14.882 -0.352 -10.522 492 H GLU 63 H GLU 63 12.369 -0.155 -11.292 493 HA GLU 63 HA GLU 63 12.719 0.675 -14.054 494 HB2 GLU 63 HB3 GLU 63 10.462 -0.758 -12.634 495 HB3 GLU 63 HB2 GLU 63 10.595 -0.571 -14.377 496 HG2 GLU 63 HG3 GLU 63 12.665 -1.870 -14.401 497 HG3 GLU 63 HG2 GLU 63 12.654 -1.964 -12.645 498 H ASN 64 H ASN 64 10.418 1.322 -11.506 499 HA ASN 64 HA ASN 64 8.911 3.164 -13.116 500 HB2 ASN 64 HB3 ASN 64 8.211 1.779 -10.942 501 HB3 ASN 64 HB2 ASN 64 8.662 3.279 -10.135 502 HD21 ASN 64 HD21 ASN 64 5.897 2.387 -10.259 503 HD22 ASN 64 HD22 ASN 64 5.075 3.486 -11.236 504 H GLY 65 H GLY 65 11.666 3.753 -13.108 505 HA2 GLY 65 HA3 GLY 65 11.943 6.239 -11.536 506 HA3 GLY 65 HA2 GLY 65 13.224 5.341 -12.362 507 H ASP 66 H ASP 66 10.847 5.153 -14.424 508 HA ASP 66 HA ASP 66 11.973 6.838 -16.339 509 HB2 ASP 66 HB3 ASP 66 9.317 5.487 -16.082 510 HB3 ASP 66 HB2 ASP 66 9.748 6.396 -17.544 511 H GLY 67 H GLY 67 9.227 7.267 -14.202 512 HA2 GLY 67 HA3 GLY 67 9.265 10.162 -14.769 513 HA3 GLY 67 HA2 GLY 67 7.758 9.254 -14.586 514 H GLU 68 H GLU 68 7.037 10.169 -12.777 515 HA GLU 68 HA GLU 68 8.683 10.209 -10.331 516 HB2 GLU 68 HB3 GLU 68 5.794 11.085 -10.739 517 HB3 GLU 68 HB2 GLU 68 6.744 11.328 -9.290 518 HG2 GLU 68 HG3 GLU 68 6.861 13.375 -10.490 519 HG3 GLU 68 HG2 GLU 68 8.424 12.595 -10.696 520 H VAL 69 H VAL 69 7.359 9.447 -8.301 521 HA VAL 69 HA VAL 69 6.003 6.904 -8.946 522 HB VAL 69 HB VAL 69 8.072 6.257 -7.963 523 HG11 VAL 69 HG11 VAL 69 7.607 8.446 -5.946 524 HG12 VAL 69 HG12 VAL 69 8.890 8.363 -7.147 525 HG13 VAL 69 HG13 VAL 69 8.859 7.224 -5.792 526 HG21 VAL 69 HG21 VAL 69 7.224 5.818 -5.417 527 HG22 VAL 69 HG22 VAL 69 6.723 4.847 -6.780 528 HG23 VAL 69 HG23 VAL 69 5.666 6.120 -6.178 529 H ASP 70 H ASP 70 4.022 6.696 -8.151 530 HA ASP 70 HA ASP 70 2.963 8.984 -6.692 531 HB2 ASP 70 HB3 ASP 70 0.958 8.563 -7.646 532 HB3 ASP 70 HB2 ASP 70 1.955 7.721 -8.824 533 H PHE 71 H PHE 71 0.942 8.153 -5.369 534 HA PHE 71 HA PHE 71 2.012 7.096 -3.007 535 HB2 PHE 71 HB3 PHE 71 -0.038 8.533 -3.107 536 HB3 PHE 71 HB2 PHE 71 -0.919 7.145 -3.742 537 HD1 PHE 71 HD1 PHE 71 1.439 7.952 -0.960 538 HD2 PHE 71 HD2 PHE 71 -2.068 5.784 -2.168 539 HE1 PHE 71 HE1 PHE 71 1.155 7.133 1.340 540 HE2 PHE 71 HE2 PHE 71 -2.351 4.974 0.152 541 HZ PHE 71 HZ PHE 71 -0.763 5.638 1.901 542 H GLN 72 H GLN 72 0.044 5.636 -5.570 543 HA GLN 72 HA GLN 72 -0.319 3.115 -4.379 544 HB2 GLN 72 HB3 GLN 72 -0.324 3.987 -7.272 545 HB3 GLN 72 HB2 GLN 72 -0.780 2.356 -6.770 546 HG2 GLN 72 HG3 GLN 72 -2.536 3.319 -5.326 547 HG3 GLN 72 HG2 GLN 72 -2.032 4.935 -5.830 548 HE21 GLN 72 HE21 GLN 72 -2.531 5.603 -8.040 549 HE22 GLN 72 HE22 GLN 72 -3.643 4.738 -8.987 550 H GLU 73 H GLU 73 2.198 4.352 -6.533 551 HA GLU 73 HA GLU 73 3.681 1.883 -6.572 552 HB2 GLU 73 HB3 GLU 73 4.479 4.723 -7.236 553 HB3 GLU 73 HB2 GLU 73 5.526 3.305 -7.426 554 HG2 GLU 73 HG3 GLU 73 2.804 3.586 -8.717 555 HG3 GLU 73 HG2 GLU 73 4.317 3.927 -9.518 556 H TYR 74 H TYR 74 3.699 4.803 -4.641 557 HA TYR 74 HA TYR 74 6.019 4.291 -3.146 558 HB2 TYR 74 HB3 TYR 74 5.068 6.499 -3.129 559 HB3 TYR 74 HB2 TYR 74 3.547 5.871 -2.512 560 HD1 TYR 74 HD1 TYR 74 7.184 5.675 -1.529 561 HD2 TYR 74 HD2 TYR 74 3.121 6.270 -0.265 562 HE1 TYR 74 HE1 TYR 74 7.951 6.005 0.797 563 HE2 TYR 74 HE2 TYR 74 3.891 6.602 2.061 564 HH TYR 74 HH TYR 74 6.619 7.427 3.006 565 H VAL 75 H VAL 75 2.605 3.496 -2.375 566 HA VAL 75 HA VAL 75 3.229 2.405 0.112 567 HB VAL 75 HB VAL 75 1.002 1.248 -0.007 568 HG11 VAL 75 HG11 VAL 75 1.423 3.637 0.778 569 HG12 VAL 75 HG12 VAL 75 -0.216 3.285 0.233 570 HG13 VAL 75 HG13 VAL 75 0.883 4.155 -0.818 571 HG21 VAL 75 HG21 VAL 75 1.334 1.556 -2.784 572 HG22 VAL 75 HG22 VAL 75 0.184 2.786 -2.343 573 HG23 VAL 75 HG23 VAL 75 -0.146 1.092 -1.954 574 H VAL 76 H VAL 76 3.078 0.811 -3.059 575 HA VAL 76 HA VAL 76 3.303 -1.794 -2.019 576 HB VAL 76 HB VAL 76 2.501 -1.416 -4.305 577 HG11 VAL 76 HG11 VAL 76 4.159 -0.852 -6.087 578 HG12 VAL 76 HG12 VAL 76 5.319 -0.433 -4.845 579 HG13 VAL 76 HG13 VAL 76 3.809 0.474 -4.991 580 HG21 VAL 76 HG21 VAL 76 3.581 -3.602 -3.734 581 HG22 VAL 76 HG22 VAL 76 5.126 -2.952 -4.295 582 HG23 VAL 76 HG23 VAL 76 3.805 -3.158 -5.423 583 H LEU 77 H LEU 77 5.690 0.624 -2.936 584 HA LEU 77 HA LEU 77 7.971 -1.030 -2.778 585 HB2 LEU 77 HB3 LEU 77 8.045 1.238 -3.719 586 HB3 LEU 77 HB2 LEU 77 7.683 1.915 -2.137 587 HG LEU 77 HG LEU 77 9.802 0.954 -1.229 588 HD11 LEU 77 HD11 LEU 77 10.505 -0.831 -2.223 589 HD12 LEU 77 HD12 LEU 77 11.372 0.254 -3.311 590 HD13 LEU 77 HD13 LEU 77 9.837 -0.456 -3.810 591 HD21 LEU 77 HD21 LEU 77 9.772 2.883 -3.524 592 HD22 LEU 77 HD22 LEU 77 11.339 2.257 -3.019 593 HD23 LEU 77 HD23 LEU 77 10.306 3.091 -1.861 594 H VAL 78 H VAL 78 6.399 0.994 -0.315 595 HA VAL 78 HA VAL 78 8.151 0.065 1.743 596 HB VAL 78 HB VAL 78 6.543 1.140 3.345 597 HG11 VAL 78 HG11 VAL 78 6.754 3.487 2.077 598 HG12 VAL 78 HG12 VAL 78 7.811 2.546 1.022 599 HG13 VAL 78 HG13 VAL 78 8.145 2.657 2.756 600 HG21 VAL 78 HG21 VAL 78 4.478 0.766 1.892 601 HG22 VAL 78 HG22 VAL 78 5.100 2.064 0.855 602 HG23 VAL 78 HG23 VAL 78 4.686 2.394 2.528 603 H ALA 79 H ALA 79 4.924 -0.842 0.692 604 HA ALA 79 HA ALA 79 4.421 -2.696 2.752 605 HB1 ALA 79 HB1 ALA 79 2.681 -3.530 1.416 606 HB2 ALA 79 HB2 ALA 79 3.438 -2.957 -0.071 607 HB3 ALA 79 HB3 ALA 79 2.731 -1.801 1.061 608 H ALA 80 H ALA 80 5.935 -2.992 -0.406 609 HA ALA 80 HA ALA 80 6.229 -5.751 -0.517 610 HB1 ALA 80 HB1 ALA 80 7.927 -3.532 -1.612 611 HB2 ALA 80 HB2 ALA 80 6.636 -4.379 -2.433 612 HB3 ALA 80 HB3 ALA 80 8.139 -5.231 -2.056 613 H LEU 81 H LEU 81 8.427 -3.280 0.749 614 HA LEU 81 HA LEU 81 10.366 -5.112 1.727 615 HB2 LEU 81 HB3 LEU 81 9.699 -2.270 2.529 616 HB3 LEU 81 HB2 LEU 81 11.052 -3.173 3.202 617 HG LEU 81 HG LEU 81 10.676 -2.733 0.215 618 HD11 LEU 81 HD11 LEU 81 11.016 -0.569 1.283 619 HD12 LEU 81 HD12 LEU 81 12.469 -1.054 0.421 620 HD13 LEU 81 HD13 LEU 81 12.409 -1.192 2.176 621 HD21 LEU 81 HD21 LEU 81 12.957 -3.776 1.941 622 HD22 LEU 81 HD22 LEU 81 13.154 -3.273 0.268 623 HD23 LEU 81 HD23 LEU 81 12.127 -4.640 0.641 624 H THR 82 H THR 82 7.487 -3.605 3.147 625 HA THR 82 HA THR 82 7.854 -4.572 5.751 626 HB THR 82 HB THR 82 5.216 -4.064 4.374 627 HG1 THR 82 HG2 THR 82 6.579 -2.243 4.103 628 HG21 THR 82 HG21 THR 82 5.717 -3.349 7.216 629 HG22 THR 82 HG22 THR 82 5.594 -5.066 6.858 630 HG23 THR 82 HG23 THR 82 4.272 -3.986 6.439 631 H VAL 83 H VAL 83 5.913 -5.935 3.065 632 HA VAL 83 HA VAL 83 5.106 -8.206 4.553 633 HB VAL 83 HB VAL 83 3.905 -7.550 2.556 634 HG11 VAL 83 HG11 VAL 83 6.187 -8.643 0.893 635 HG12 VAL 83 HG12 VAL 83 5.990 -6.916 1.231 636 HG13 VAL 83 HG13 VAL 83 4.748 -7.793 0.340 637 HG21 VAL 83 HG21 VAL 83 3.708 -9.791 1.452 638 HG22 VAL 83 HG22 VAL 83 3.635 -9.896 3.206 639 HG23 VAL 83 HG23 VAL 83 5.120 -10.324 2.349 640 H ALA 84 H ALA 84 7.823 -7.678 2.355 641 HA ALA 84 HA ALA 84 8.793 -10.269 2.263 642 HB1 ALA 84 HB1 ALA 84 9.741 -8.492 0.892 643 HB2 ALA 84 HB2 ALA 84 11.002 -9.254 1.853 644 HB3 ALA 84 HB3 ALA 84 10.369 -7.683 2.330 645 H MET 85 H MET 85 9.640 -7.701 4.609 646 HA MET 85 HA MET 85 11.083 -9.619 6.176 647 HB2 MET 85 HB3 MET 85 11.825 -7.273 6.203 648 HB3 MET 85 HB2 MET 85 10.293 -6.827 6.971 649 HG2 MET 85 HG3 MET 85 10.783 -8.254 8.902 650 HG3 MET 85 HG2 MET 85 12.260 -8.829 8.135 651 HE1 MET 85 HE1 MET 85 12.224 -7.389 11.212 652 HE2 MET 85 HE2 MET 85 13.898 -7.013 10.864 653 HE3 MET 85 HE3 MET 85 13.204 -8.505 10.246 654 H ASN 86 H ASN 86 7.939 -7.968 6.503 655 HA ASN 86 HA ASN 86 7.417 -8.896 9.073 656 HB2 ASN 86 HB3 ASN 86 6.149 -7.085 7.781 657 HB3 ASN 86 HB2 ASN 86 5.170 -8.416 7.137 658 HD21 ASN 86 HD21 ASN 86 5.620 -6.353 9.859 659 HD22 ASN 86 HD22 ASN 86 4.551 -7.154 10.906 660 H ASN 87 H ASN 87 6.698 -10.357 5.952 661 HA ASN 87 HA ASN 87 5.002 -12.384 6.653 662 HB2 ASN 87 HB3 ASN 87 5.747 -11.939 4.360 663 HB3 ASN 87 HB2 ASN 87 7.351 -12.551 4.748 664 HD21 ASN 87 HD21 ASN 87 5.758 -14.791 6.466 665 HD22 ASN 87 HD22 ASN 87 5.326 -15.859 5.243 666 H PHE 88 H PHE 88 8.429 -12.098 7.342 667 HA PHE 88 HA PHE 88 8.855 -14.774 8.150 668 HB2 PHE 88 HB3 PHE 88 10.331 -12.245 8.951 669 HB3 PHE 88 HB2 PHE 88 10.823 -13.874 9.386 670 HD1 PHE 88 HD1 PHE 88 10.992 -15.617 7.441 671 HD2 PHE 88 HD2 PHE 88 11.063 -11.386 6.910 672 HE1 PHE 88 HE1 PHE 88 12.059 -15.928 5.241 673 HE2 PHE 88 HE2 PHE 88 12.138 -11.680 4.682 674 HZ PHE 88 HZ PHE 88 12.635 -13.940 3.847 675 H PHE 89 H PHE 89 7.565 -11.978 9.813 676 HA PHE 89 HA PHE 89 7.595 -13.059 12.458 677 HB2 PHE 89 HB3 PHE 89 5.801 -10.986 11.138 678 HB3 PHE 89 HB2 PHE 89 5.595 -11.526 12.787 679 HD1 PHE 89 HD2 PHE 89 8.042 -9.954 10.479 680 HD2 PHE 89 HD1 PHE 89 6.953 -10.719 14.557 681 HE1 PHE 89 HE2 PHE 89 9.785 -8.355 11.245 682 HE2 PHE 89 HE1 PHE 89 8.708 -9.126 15.321 683 HZ PHE 89 HZ PHE 89 10.114 -7.956 13.676 684 H TRP 90 H TRP 90 5.422 -13.327 9.735 685 HA TRP 90 HA TRP 90 3.352 -14.734 11.118 686 HB2 TRP 90 HB3 TRP 90 4.006 -15.157 8.208 687 HB3 TRP 90 HB2 TRP 90 2.432 -15.230 8.982 688 HD1 TRP 90 HD TRP 90 3.984 -12.171 10.351 689 HE1 TRP 90 HE1 TRP 90 3.356 -10.153 9.106 690 HE3 TRP 90 HE3 TRP 90 1.940 -14.369 6.218 691 HZ2 TRP 90 HZ2 TRP 90 2.063 -9.428 6.582 692 HZ3 TRP 90 HZ3 TRP 90 1.007 -12.955 4.400 693 HH2 TRP 90 HH TRP 90 1.069 -10.487 4.590 694 H GLU 91 H GLU 91 6.189 -15.656 9.367 695 HA GLU 91 HA GLU 91 5.882 -18.495 9.745 696 HB2 GLU 91 HB3 GLU 91 8.238 -16.800 9.069 697 HB3 GLU 91 HB2 GLU 91 8.306 -18.557 9.068 698 HG2 GLU 91 HG3 GLU 91 6.376 -18.597 7.481 699 HG3 GLU 91 HG2 GLU 91 6.427 -16.853 7.398 700 H ASN 92 H ASN 92 7.736 -15.965 11.369 701 HA ASN 92 HA ASN 92 8.606 -17.834 13.454 702 HB2 ASN 92 HB3 ASN 92 10.268 -16.313 12.552 703 HB3 ASN 92 HB2 ASN 92 9.267 -14.923 12.949 704 HD21 ASN 92 HD21 ASN 92 10.976 -14.135 14.410 705 HD22 ASN 92 HD22 ASN 92 11.198 -14.843 15.931 706 H SER 93 H SER 93 6.858 -18.218 14.706 707 HA SER 93 HA SER 93 5.847 -16.063 16.344 708 HB2 SER 93 HB3 SER 93 4.411 -17.223 14.024 709 HB3 SER 93 HB2 SER 93 3.437 -16.932 15.463 710 HG SER 93 HG SER 93 5.037 -15.119 13.904 711 H1 GLY 1 H GLY 1 10.897 0.398 12.091 712 HA2 GLY 1 HA3 GLY 1 12.655 2.674 12.200 713 HA3 GLY 1 HA2 GLY 1 11.728 2.128 10.813 714 H SER 2 H SER 2 10.571 3.841 10.178 715 HA SER 2 HA SER 2 9.454 5.764 12.005 716 HB2 SER 2 HB3 SER 2 9.201 5.324 9.029 717 HB3 SER 2 HB2 SER 2 8.268 6.519 9.886 718 HG SER 2 HG SER 2 10.054 7.475 9.191 719 H GLU 3 H GLU 3 7.259 6.260 12.210 720 HA GLU 3 HA GLU 3 5.578 4.252 13.074 721 HB2 GLU 3 HB3 GLU 3 4.737 6.870 11.798 722 HB3 GLU 3 HB2 GLU 3 3.761 5.872 12.861 723 HG2 GLU 3 HG3 GLU 3 4.613 7.446 14.337 724 HG3 GLU 3 HG2 GLU 3 5.720 6.110 14.553 725 H LEU 4 H LEU 4 6.410 5.150 9.885 726 HA LEU 4 HA LEU 4 4.168 4.293 8.428 727 HB2 LEU 4 HB3 LEU 4 7.096 4.160 7.689 728 HB3 LEU 4 HB2 LEU 4 5.750 3.930 6.586 729 HG LEU 4 HG LEU 4 6.282 6.468 8.168 730 HD11 LEU 4 HD11 LEU 4 6.263 6.762 5.330 731 HD12 LEU 4 HD12 LEU 4 7.421 5.522 5.781 732 HD13 LEU 4 HD13 LEU 4 7.543 7.146 6.485 733 HD21 LEU 4 HD21 LEU 4 4.161 6.980 7.750 734 HD22 LEU 4 HD22 LEU 4 3.868 5.477 6.863 735 HD23 LEU 4 HD23 LEU 4 4.490 6.907 6.032 736 H GLU 5 H GLU 5 7.032 2.606 9.714 737 HA GLU 5 HA GLU 5 6.443 0.088 8.567 738 HB2 GLU 5 HB3 GLU 5 7.968 0.827 11.082 739 HB3 GLU 5 HB2 GLU 5 7.914 -0.797 10.419 740 HG2 GLU 5 HG3 GLU 5 8.847 0.149 8.251 741 HG3 GLU 5 HG2 GLU 5 9.018 1.672 9.079 742 H THR 6 H THR 6 5.620 1.638 11.637 743 HA THR 6 HA THR 6 4.111 -0.472 12.753 744 HB THR 6 HB THR 6 3.573 2.478 13.131 745 HG1 THR 6 HG2 THR 6 5.189 2.281 14.773 746 HG21 THR 6 HG21 THR 6 2.033 0.827 14.153 747 HG22 THR 6 HG22 THR 6 2.889 1.767 15.360 748 HG23 THR 6 HG23 THR 6 3.382 0.106 15.017 749 H ALA 7 H ALA 7 3.271 2.301 10.725 750 HA ALA 7 HA ALA 7 0.509 1.804 10.472 751 HB1 ALA 7 HB1 ALA 7 2.148 2.921 8.200 752 HB2 ALA 7 HB2 ALA 7 1.909 3.857 9.677 753 HB3 ALA 7 HB3 ALA 7 0.522 3.354 8.719 754 H MET 8 H MET 8 3.278 0.751 8.514 755 HA MET 8 HA MET 8 1.778 -0.798 6.679 756 HB2 MET 8 HB3 MET 8 4.675 -1.083 7.519 757 HB3 MET 8 HB2 MET 8 3.943 -1.880 6.129 758 HG2 MET 8 HG3 MET 8 3.276 0.871 5.853 759 HG3 MET 8 HG2 MET 8 4.953 0.807 6.364 760 HE1 MET 8 HE1 MET 8 2.794 -1.649 3.870 761 HE2 MET 8 HE2 MET 8 3.035 -0.516 2.542 762 HE3 MET 8 HE3 MET 8 2.314 0.050 4.042 763 H GLU 9 H GLU 9 3.385 -1.588 9.738 764 HA GLU 9 HA GLU 9 2.688 -4.324 9.662 765 HB2 GLU 9 HB3 GLU 9 3.468 -2.538 11.982 766 HB3 GLU 9 HB2 GLU 9 3.122 -4.258 12.170 767 HG2 GLU 9 HG3 GLU 9 4.887 -4.812 10.518 768 HG3 GLU 9 HG2 GLU 9 5.252 -3.103 10.315 769 H THR 10 H THR 10 1.028 -1.473 10.805 770 HA THR 10 HA THR 10 -1.149 -2.761 12.093 771 HB THR 10 HB THR 10 -1.370 -0.195 10.476 772 HG1 THR 10 HG2 THR 10 0.477 -0.320 12.048 773 HG21 THR 10 HG21 THR 10 -3.447 -1.191 11.407 774 HG22 THR 10 HG22 THR 10 -3.071 0.379 12.095 775 HG23 THR 10 HG23 THR 10 -2.760 -1.079 13.025 776 H LEU 11 H LEU 11 -0.534 -1.833 8.731 777 HA LEU 11 HA LEU 11 -2.950 -2.879 7.657 778 HB2 LEU 11 HB3 LEU 11 -0.246 -2.385 6.384 779 HB3 LEU 11 HB2 LEU 11 -1.653 -2.917 5.473 780 HG LEU 11 HG LEU 11 -1.587 -0.385 7.153 781 HD11 LEU 11 HD11 LEU 11 -1.348 0.835 5.066 782 HD12 LEU 11 HD12 LEU 11 -1.317 -0.667 4.151 783 HD13 LEU 11 HD13 LEU 11 0.011 -0.272 5.246 784 HD21 LEU 11 HD21 LEU 11 -3.543 -1.510 5.110 785 HD22 LEU 11 HD22 LEU 11 -3.591 0.148 5.684 786 HD23 LEU 11 HD23 LEU 11 -3.863 -1.168 6.811 787 H ILE 12 H ILE 12 0.222 -4.252 8.287 788 HA ILE 12 HA ILE 12 -0.135 -6.736 6.987 789 HB ILE 12 HB ILE 12 1.539 -6.026 9.419 790 HG12 ILE 12 HG13 ILE 12 2.093 -4.976 7.123 791 HG13 ILE 12 HG12 ILE 12 3.398 -5.876 7.882 792 HG21 ILE 12 HG21 ILE 12 0.979 -8.634 8.235 793 HG22 ILE 12 HG22 ILE 12 1.741 -8.217 9.768 794 HG23 ILE 12 HG23 ILE 12 2.692 -8.258 8.303 795 HD11 ILE 12 HD11 ILE 12 1.569 -7.381 6.023 796 HD12 ILE 12 HD12 ILE 12 3.285 -7.592 6.338 797 HD13 ILE 12 HD13 ILE 12 2.744 -6.262 5.345 798 H ASN 13 H ASN 13 -0.825 -5.721 10.289 799 HA ASN 13 HA ASN 13 -1.487 -8.187 11.387 800 HB2 ASN 13 HB3 ASN 13 -2.562 -5.424 11.974 801 HB3 ASN 13 HB2 ASN 13 -3.028 -6.829 12.901 802 HD21 ASN 13 HD21 ASN 13 -1.122 -4.353 13.343 803 HD22 ASN 13 HD22 ASN 13 0.226 -5.068 14.085 804 H VAL 14 H VAL 14 -3.607 -5.895 9.686 805 HA VAL 14 HA VAL 14 -5.978 -7.447 9.920 806 HB VAL 14 HB VAL 14 -5.159 -5.424 7.817 807 HG11 VAL 14 HG11 VAL 14 -7.033 -6.928 7.062 808 HG12 VAL 14 HG12 VAL 14 -7.535 -5.259 7.293 809 HG13 VAL 14 HG13 VAL 14 -7.921 -6.459 8.515 810 HG21 VAL 14 HG21 VAL 14 -6.678 -3.924 9.176 811 HG22 VAL 14 HG22 VAL 14 -5.222 -4.417 10.037 812 HG23 VAL 14 HG23 VAL 14 -6.757 -5.192 10.394 813 H PHE 15 H PHE 15 -3.558 -7.155 7.373 814 HA PHE 15 HA PHE 15 -4.629 -9.055 5.573 815 HB2 PHE 15 HB3 PHE 15 -2.843 -7.403 5.041 816 HB3 PHE 15 HB2 PHE 15 -1.730 -8.331 6.041 817 HD1 PHE 15 HD2 PHE 15 -1.080 -10.635 5.399 818 HD2 PHE 15 HD1 PHE 15 -3.528 -8.193 2.858 819 HE1 PHE 15 HE2 PHE 15 -0.641 -12.158 3.514 820 HE2 PHE 15 HE1 PHE 15 -3.084 -9.727 0.970 821 HZ PHE 15 HZ PHE 15 -1.636 -11.719 1.315 822 H HIS 16 H HIS 16 -2.184 -9.309 8.092 823 HA HIS 16 HA HIS 16 -1.501 -11.989 7.738 824 HB2 HIS 16 HB3 HIS 16 -0.191 -10.301 9.000 825 HB3 HIS 16 HB2 HIS 16 -1.389 -10.366 10.288 826 HD1 HIS 16 HD1 HIS 16 -0.901 -13.696 8.845 827 HD2 HIS 16 HD2 HIS 16 1.034 -11.346 11.704 828 HE1 HIS 16 HE1 HIS 16 0.605 -15.247 10.138 829 HE2 HIS 16 HE2 HIS 16 1.783 -13.829 11.926 830 H ALA 17 H ALA 17 -3.817 -10.501 10.002 831 HA ALA 17 HA ALA 17 -4.594 -12.869 11.288 832 HB1 ALA 17 HB1 ALA 17 -5.178 -10.625 12.137 833 HB2 ALA 17 HB2 ALA 17 -6.586 -11.671 11.995 834 HB3 ALA 17 HB3 ALA 17 -6.308 -10.415 10.793 835 H HIS 18 H HIS 18 -5.960 -11.239 8.457 836 HA HIS 18 HA HIS 18 -7.976 -13.227 8.093 837 HB2 HIS 18 HB3 HIS 18 -7.040 -10.980 6.306 838 HB3 HIS 18 HB2 HIS 18 -8.275 -12.163 5.841 839 HD1 HIS 18 HD1 HIS 18 -10.508 -12.288 7.321 840 HD2 HIS 18 HD2 HIS 18 -7.993 -9.021 8.125 841 HE1 HIS 18 HE1 HIS 18 -11.814 -10.688 8.738 842 HE2 HIS 18 HE2 HIS 18 -10.350 -8.687 9.206 843 H SER 19 H SER 19 -4.675 -13.000 7.036 844 HA SER 19 HA SER 19 -4.712 -14.737 4.847 845 HB2 SER 19 HB3 SER 19 -2.609 -14.642 7.045 846 HB3 SER 19 HB2 SER 19 -2.372 -15.325 5.454 847 HG SER 19 HG SER 19 -3.200 -12.596 5.863 848 H GLY 20 H GLY 20 -4.665 -15.391 8.311 849 HA2 GLY 20 HA3 GLY 20 -4.467 -18.211 8.272 850 HA3 GLY 20 HA2 GLY 20 -5.170 -17.233 9.530 851 H LYS 21 H LYS 21 -7.275 -16.053 8.239 852 HA LYS 21 HA LYS 21 -9.204 -18.056 8.656 853 HB2 LYS 21 HB3 LYS 21 -9.553 -15.347 7.370 854 HB3 LYS 21 HB2 LYS 21 -10.848 -16.368 7.956 855 HG2 LYS 21 HG3 LYS 21 -8.585 -15.292 9.694 856 HG3 LYS 21 HG2 LYS 21 -10.217 -14.648 9.622 857 HD2 LYS 21 HD3 LYS 21 -11.134 -16.823 10.431 858 HD3 LYS 21 HD2 LYS 21 -9.514 -17.480 10.493 859 HE2 LYS 21 HE2 LYS 21 -10.354 -16.663 12.700 860 HE3 LYS 21 HE1 LYS 21 -8.830 -15.960 12.201 861 HZ1 LYS 21 HZ1 LYS 21 -11.452 -14.616 11.697 862 HZ2 LYS 21 HZ2 LYS 21 -9.888 -13.958 11.580 863 HZ3 LYS 21 HZ3 LYS 21 -10.515 -14.366 13.074 864 H GLU 22 H GLU 22 -8.170 -16.573 5.612 865 HA GLU 22 HA GLU 22 -9.309 -18.904 4.172 866 HB2 GLU 22 HB3 GLU 22 -9.911 -16.017 3.543 867 HB3 GLU 22 HB2 GLU 22 -10.272 -17.363 2.476 868 HG2 GLU 22 HG3 GLU 22 -11.310 -17.142 5.314 869 HG3 GLU 22 HG2 GLU 22 -12.198 -16.626 3.893 870 H GLY 23 H GLY 23 -6.715 -16.872 4.623 871 HA2 GLY 23 HA3 GLY 23 -5.857 -16.799 1.846 872 HA3 GLY 23 HA2 GLY 23 -5.038 -16.129 3.247 873 H ASP 24 H ASP 24 -3.430 -17.362 1.571 874 HA ASP 24 HA ASP 24 -3.102 -20.150 2.262 875 HB2 ASP 24 HB3 ASP 24 -2.300 -19.046 0.068 876 HB3 ASP 24 HB2 ASP 24 -0.961 -18.411 1.016 877 H LYS 25 H LYS 25 -0.212 -20.078 2.706 878 HA LYS 25 HA LYS 25 -0.215 -19.734 5.539 879 HB2 LYS 25 HB3 LYS 25 2.084 -19.518 3.707 880 HB3 LYS 25 HB2 LYS 25 2.173 -19.960 5.411 881 HG2 LYS 25 HG3 LYS 25 0.379 -21.772 4.575 882 HG3 LYS 25 HG2 LYS 25 1.296 -21.561 3.081 883 HD2 LYS 25 HD3 LYS 25 2.261 -22.709 5.725 884 HD3 LYS 25 HD2 LYS 25 2.454 -23.362 4.115 885 HE2 LYS 25 HE2 LYS 25 4.493 -22.463 4.034 886 HE3 LYS 25 HE1 LYS 25 3.790 -20.870 3.998 887 HZ1 LYS 25 HZ1 LYS 25 5.063 -20.734 5.843 888 HZ2 LYS 25 HZ2 LYS 25 4.902 -22.350 6.263 889 HZ3 LYS 25 HZ3 LYS 25 3.638 -21.245 6.597 890 H TYR 26 H TYR 26 0.964 -17.832 2.812 891 HA TYR 26 HA TYR 26 0.410 -15.525 4.424 892 HB2 TYR 26 HB3 TYR 26 2.812 -15.107 2.736 893 HB3 TYR 26 HB2 TYR 26 2.522 -14.584 4.380 894 HD1 TYR 26 HD1 TYR 26 2.775 -16.285 6.297 895 HD2 TYR 26 HD2 TYR 26 4.057 -17.081 2.256 896 HE1 TYR 26 HE1 TYR 26 4.203 -18.124 7.097 897 HE2 TYR 26 HE2 TYR 26 5.469 -18.900 3.059 898 HH TYR 26 HH TYR 26 6.649 -19.315 5.583 899 H LYS 27 H LYS 27 -1.409 -15.310 3.188 900 HA LYS 27 HA LYS 27 -1.155 -13.682 0.974 901 HB2 LYS 27 HB3 LYS 27 -1.744 -16.542 0.388 902 HB3 LYS 27 HB2 LYS 27 -2.842 -15.412 -0.364 903 HG2 LYS 27 HG3 LYS 27 0.197 -15.331 -0.618 904 HG3 LYS 27 HG2 LYS 27 -0.880 -15.918 -1.830 905 HD2 LYS 27 HD3 LYS 27 -1.688 -13.252 -0.943 906 HD3 LYS 27 HD2 LYS 27 -0.038 -13.265 -1.536 907 HE2 LYS 27 HE2 LYS 27 -1.569 -14.826 -3.405 908 HE3 LYS 27 HE1 LYS 27 -2.495 -13.376 -3.039 909 HZ1 LYS 27 HZ1 LYS 27 -1.035 -12.090 -4.186 910 HZ2 LYS 27 HZ2 LYS 27 -0.588 -13.545 -4.842 911 HZ3 LYS 27 HZ3 LYS 27 0.335 -12.909 -3.584 912 H LEU 28 H LEU 28 -3.422 -12.997 0.250 913 HA LEU 28 HA LEU 28 -5.380 -13.575 2.362 914 HB2 LEU 28 HB3 LEU 28 -4.527 -11.314 2.682 915 HB3 LEU 28 HB2 LEU 28 -4.856 -10.919 0.996 916 HG LEU 28 HG LEU 28 -7.304 -11.411 1.448 917 HD11 LEU 28 HD11 LEU 28 -7.757 -11.176 4.021 918 HD12 LEU 28 HD12 LEU 28 -6.129 -11.820 4.184 919 HD13 LEU 28 HD13 LEU 28 -7.377 -12.767 3.360 920 HD21 LEU 28 HD21 LEU 28 -7.703 -9.269 2.275 921 HD22 LEU 28 HD22 LEU 28 -6.070 -9.092 1.646 922 HD23 LEU 28 HD23 LEU 28 -6.330 -9.306 3.376 923 H SER 29 H SER 29 -7.322 -14.242 1.579 924 HA SER 29 HA SER 29 -7.477 -14.558 -1.277 925 HB2 SER 29 HB3 SER 29 -9.742 -15.716 -0.414 926 HB3 SER 29 HB2 SER 29 -8.171 -16.472 -0.419 927 HG SER 29 HG SER 29 -8.473 -16.656 1.615 928 H LYS 30 H LYS 30 -9.650 -14.193 -2.342 929 HA LYS 30 HA LYS 30 -10.201 -11.385 -2.046 930 HB2 LYS 30 HB3 LYS 30 -11.641 -13.297 -3.891 931 HB3 LYS 30 HB2 LYS 30 -11.439 -11.560 -4.072 932 HG2 LYS 30 HG3 LYS 30 -9.252 -13.655 -4.246 933 HG3 LYS 30 HG2 LYS 30 -9.852 -12.710 -5.579 934 HD2 LYS 30 HD3 LYS 30 -8.641 -11.284 -3.167 935 HD3 LYS 30 HD2 LYS 30 -7.635 -11.925 -4.444 936 HE2 LYS 30 HE2 LYS 30 -9.765 -9.798 -4.695 937 HE3 LYS 30 HE1 LYS 30 -8.053 -9.657 -5.035 938 HZ1 LYS 30 HZ1 LYS 30 -8.859 -11.710 -6.698 939 HZ2 LYS 30 HZ2 LYS 30 -8.634 -10.095 -7.144 940 HZ3 LYS 30 HZ3 LYS 30 -10.164 -10.650 -6.689 941 H LYS 31 H LYS 31 -11.346 -13.938 -0.407 942 HA LYS 31 HA LYS 31 -14.171 -13.242 -0.234 943 HB2 LYS 31 HB3 LYS 31 -12.890 -14.849 1.945 944 HB3 LYS 31 HB2 LYS 31 -14.392 -15.094 1.089 945 HG2 LYS 31 HG3 LYS 31 -13.260 -15.948 -0.864 946 HG3 LYS 31 HG2 LYS 31 -11.690 -15.548 -0.213 947 HD2 LYS 31 HD3 LYS 31 -12.188 -17.064 1.739 948 HD3 LYS 31 HD2 LYS 31 -13.617 -17.602 0.857 949 HE2 LYS 31 HE2 LYS 31 -12.117 -18.172 -1.085 950 HE3 LYS 31 HE1 LYS 31 -10.769 -17.748 -0.095 951 HZ1 LYS 31 HZ1 LYS 31 -10.873 -20.008 0.332 952 HZ2 LYS 31 HZ2 LYS 31 -12.556 -20.054 0.308 953 HZ3 LYS 31 HZ3 LYS 31 -11.747 -19.402 1.638 954 H GLU 32 H GLU 32 -11.504 -13.354 2.061 955 HA GLU 32 HA GLU 32 -12.650 -11.846 4.142 956 HB2 GLU 32 HB3 GLU 32 -9.748 -12.398 3.449 957 HB3 GLU 32 HB2 GLU 32 -10.354 -11.793 4.989 958 HG2 GLU 32 HG3 GLU 32 -11.245 -14.454 3.796 959 HG3 GLU 32 HG2 GLU 32 -9.926 -14.287 4.947 960 H LEU 33 H LEU 33 -10.643 -11.085 1.402 961 HA LEU 33 HA LEU 33 -9.732 -8.566 2.073 962 HB2 LEU 33 HB3 LEU 33 -8.850 -9.849 0.210 963 HB3 LEU 33 HB2 LEU 33 -10.372 -9.705 -0.655 964 HG LEU 33 HG LEU 33 -8.492 -8.106 -1.362 965 HD11 LEU 33 HD11 LEU 33 -10.685 -6.305 -0.681 966 HD12 LEU 33 HD12 LEU 33 -11.221 -7.815 -1.427 967 HD13 LEU 33 HD13 LEU 33 -10.048 -6.797 -2.239 968 HD21 LEU 33 HD21 LEU 33 -9.294 -6.683 1.226 969 HD22 LEU 33 HD22 LEU 33 -8.200 -6.097 -0.012 970 HD23 LEU 33 HD23 LEU 33 -7.757 -7.507 0.933 971 H LYS 34 H LYS 34 -12.713 -9.476 0.372 972 HA LYS 34 HA LYS 34 -13.619 -6.859 -0.231 973 HB2 LYS 34 HB3 LYS 34 -15.188 -9.380 0.376 974 HB3 LYS 34 HB2 LYS 34 -15.861 -7.898 -0.295 975 HG2 LYS 34 HG3 LYS 34 -14.426 -8.048 -2.249 976 HG3 LYS 34 HG2 LYS 34 -13.646 -9.506 -1.622 977 HD2 LYS 34 HD3 LYS 34 -15.896 -10.630 -1.616 978 HD3 LYS 34 HD2 LYS 34 -16.572 -9.185 -2.341 979 HE2 LYS 34 HE2 LYS 34 -16.172 -10.509 -4.203 980 HE3 LYS 34 HE1 LYS 34 -14.734 -9.488 -4.178 981 HZ1 LYS 34 HZ1 LYS 34 -13.919 -11.638 -4.430 982 HZ2 LYS 34 HZ2 LYS 34 -15.102 -12.285 -3.438 983 HZ3 LYS 34 HZ3 LYS 34 -13.792 -11.472 -2.727 984 H GLU 35 H GLU 35 -14.081 -8.975 2.555 985 HA GLU 35 HA GLU 35 -15.852 -7.232 3.923 986 HB2 GLU 35 HB3 GLU 35 -14.249 -9.627 4.804 987 HB3 GLU 35 HB2 GLU 35 -15.380 -8.783 5.865 988 HG2 GLU 35 HG3 GLU 35 -17.200 -9.191 4.355 989 HG3 GLU 35 HG2 GLU 35 -16.133 -9.894 3.145 990 H LEU 36 H LEU 36 -12.388 -7.934 4.460 991 HA LEU 36 HA LEU 36 -12.235 -6.037 6.574 992 HB2 LEU 36 HB3 LEU 36 -9.752 -6.168 6.344 993 HB3 LEU 36 HB2 LEU 36 -10.542 -7.701 6.635 994 HG LEU 36 HG LEU 36 -10.495 -7.501 3.824 995 HD11 LEU 36 HD11 LEU 36 -8.164 -7.008 3.298 996 HD12 LEU 36 HD12 LEU 36 -7.866 -6.579 4.978 997 HD13 LEU 36 HD13 LEU 36 -8.944 -5.588 3.997 998 HD21 LEU 36 HD21 LEU 36 -9.134 -9.424 3.970 999 HD22 LEU 36 HD22 LEU 36 -9.947 -9.429 5.525 1000 HD23 LEU 36 HD23 LEU 36 -8.296 -8.844 5.404 1001 H LEU 37 H LEU 37 -11.515 -5.788 3.146 1002 HA LEU 37 HA LEU 37 -10.290 -3.293 3.289 1003 HB2 LEU 37 HB3 LEU 37 -10.162 -4.682 1.265 1004 HB3 LEU 37 HB2 LEU 37 -11.880 -4.488 0.983 1005 HG LEU 37 HG LEU 37 -10.230 -3.004 -0.364 1006 HD11 LEU 37 HD11 LEU 37 -12.237 -1.242 0.962 1007 HD12 LEU 37 HD12 LEU 37 -12.840 -2.695 0.155 1008 HD13 LEU 37 HD13 LEU 37 -11.909 -1.515 -0.739 1009 HD21 LEU 37 HD21 LEU 37 -9.369 -1.057 0.665 1010 HD22 LEU 37 HD22 LEU 37 -9.005 -2.361 1.792 1011 HD23 LEU 37 HD23 LEU 37 -10.359 -1.272 2.103 1012 H GLN 38 H GLN 38 -13.706 -4.091 2.736 1013 HA GLN 38 HA GLN 38 -14.531 -1.373 2.636 1014 HB2 GLN 38 HB3 GLN 38 -16.814 -2.219 3.012 1015 HB3 GLN 38 HB2 GLN 38 -16.013 -3.169 1.764 1016 HG2 GLN 38 HG3 GLN 38 -15.443 -4.849 3.576 1017 HG3 GLN 38 HG2 GLN 38 -16.447 -3.922 4.677 1018 HE21 GLN 38 HE21 GLN 38 -16.499 -6.210 2.065 1019 HE22 GLN 38 HE22 GLN 38 -18.198 -6.357 1.992 1020 H THR 39 H THR 39 -14.259 -3.735 5.199 1021 HA THR 39 HA THR 39 -15.450 -2.205 7.228 1022 HB THR 39 HB THR 39 -13.365 -4.381 7.369 1023 HG1 THR 39 HG2 THR 39 -15.069 -5.265 6.454 1024 HG21 THR 39 HG21 THR 39 -14.335 -4.754 9.613 1025 HG22 THR 39 HG22 THR 39 -15.216 -3.224 9.474 1026 HG23 THR 39 HG23 THR 39 -13.442 -3.253 9.457 1027 H GLU 40 H GLU 40 -11.967 -2.715 6.469 1028 HA GLU 40 HA GLU 40 -11.031 -0.903 8.470 1029 HB2 GLU 40 HB3 GLU 40 -9.671 -2.150 6.098 1030 HB3 GLU 40 HB2 GLU 40 -8.887 -1.221 7.369 1031 HG2 GLU 40 HG3 GLU 40 -10.534 -3.743 7.858 1032 HG3 GLU 40 HG2 GLU 40 -8.786 -3.678 7.847 1033 H LEU 41 H LEU 41 -11.620 -0.493 5.007 1034 HA LEU 41 HA LEU 41 -10.929 2.374 5.339 1035 HB2 LEU 41 HB3 LEU 41 -10.848 0.536 2.962 1036 HB3 LEU 41 HB2 LEU 41 -11.048 2.262 2.739 1037 HG LEU 41 HG LEU 41 -9.020 2.651 4.182 1038 HD11 LEU 41 HD11 LEU 41 -7.485 0.568 4.249 1039 HD12 LEU 41 HD12 LEU 41 -8.978 -0.354 4.085 1040 HD13 LEU 41 HD13 LEU 41 -8.751 0.728 5.458 1041 HD21 LEU 41 HD21 LEU 41 -8.308 0.876 1.846 1042 HD22 LEU 41 HD22 LEU 41 -7.520 2.369 2.380 1043 HD23 LEU 41 HD23 LEU 41 -9.068 2.442 1.570 1044 H SER 42 H SER 42 -13.375 1.347 6.299 1045 HA SER 42 HA SER 42 -15.484 1.471 4.517 1046 HB2 SER 42 HB3 SER 42 -16.555 2.358 6.889 1047 HB3 SER 42 HB2 SER 42 -16.340 0.680 6.430 1048 HG SER 42 HG SER 42 -14.562 0.556 7.714 1049 H GLY 43 H GLY 43 -13.824 4.078 6.218 1050 HA2 GLY 43 HA3 GLY 43 -15.663 6.159 5.588 1051 HA3 GLY 43 HA2 GLY 43 -13.972 6.358 6.036 1052 H PHE 44 H PHE 44 -12.604 5.126 4.111 1053 HA PHE 44 HA PHE 44 -12.814 6.927 1.869 1054 HB2 PHE 44 HB3 PHE 44 -11.114 4.481 2.335 1055 HB3 PHE 44 HB2 PHE 44 -11.111 5.315 0.791 1056 HD1 PHE 44 HD2 PHE 44 -11.214 8.160 1.428 1057 HD2 PHE 44 HD1 PHE 44 -9.159 4.995 3.489 1058 HE1 PHE 44 HE2 PHE 44 -9.629 9.785 2.318 1059 HE2 PHE 44 HE1 PHE 44 -7.557 6.642 4.402 1060 HZ PHE 44 HZ PHE 44 -7.777 9.047 3.824 1061 H LEU 45 H LEU 45 -13.678 3.566 2.424 1062 HA LEU 45 HA LEU 45 -14.446 2.935 -0.189 1063 HB2 LEU 45 HB3 LEU 45 -14.390 1.078 1.203 1064 HB3 LEU 45 HB2 LEU 45 -15.120 1.955 2.539 1065 HG LEU 45 HG LEU 45 -17.259 1.965 1.459 1066 HD11 LEU 45 HD11 LEU 45 -15.705 1.109 -0.886 1067 HD12 LEU 45 HD12 LEU 45 -17.309 1.822 -0.790 1068 HD13 LEU 45 HD13 LEU 45 -17.123 0.089 -0.619 1069 HD21 LEU 45 HD21 LEU 45 -16.402 -0.032 2.821 1070 HD22 LEU 45 HD22 LEU 45 -16.270 -0.869 1.263 1071 HD23 LEU 45 HD23 LEU 45 -17.836 -0.303 1.834 1072 H ASP 46 H ASP 46 -16.291 4.249 2.508 1073 HA ASP 46 HA ASP 46 -18.741 4.468 1.135 1074 HB2 ASP 46 HB3 ASP 46 -18.567 4.504 3.452 1075 HB3 ASP 46 HB2 ASP 46 -17.680 6.024 3.507 1076 H ALA 47 H ALA 47 -16.071 6.697 1.530 1077 HA ALA 47 HA ALA 47 -17.250 8.815 0.013 1078 HB1 ALA 47 HB1 ALA 47 -15.402 9.455 1.360 1079 HB2 ALA 47 HB2 ALA 47 -14.829 9.515 -0.295 1080 HB3 ALA 47 HB3 ALA 47 -14.382 8.154 0.733 1081 H GLN 48 H GLN 48 -15.377 5.965 -0.727 1082 HA GLN 48 HA GLN 48 -14.967 6.663 -3.471 1083 HB2 GLN 48 HB3 GLN 48 -14.431 4.180 -1.876 1084 HB3 GLN 48 HB2 GLN 48 -14.186 4.203 -3.610 1085 HG2 GLN 48 HG3 GLN 48 -12.931 6.207 -1.705 1086 HG3 GLN 48 HG2 GLN 48 -12.085 4.790 -2.301 1087 HE21 GLN 48 HE21 GLN 48 -14.006 5.603 -4.838 1088 HE22 GLN 48 HE22 GLN 48 -12.986 6.677 -5.654 1089 H LYS 49 H LYS 49 -17.621 5.389 -1.866 1090 HA LYS 49 HA LYS 49 -18.534 3.464 -3.673 1091 HB2 LYS 49 HB3 LYS 49 -20.136 5.262 -1.855 1092 HB3 LYS 49 HB2 LYS 49 -20.891 4.002 -2.804 1093 HG2 LYS 49 HG3 LYS 49 -19.384 2.326 -1.759 1094 HG3 LYS 49 HG2 LYS 49 -18.718 3.605 -0.754 1095 HD2 LYS 49 HD3 LYS 49 -20.927 4.075 0.193 1096 HD3 LYS 49 HD2 LYS 49 -21.646 2.818 -0.799 1097 HE2 LYS 49 HE2 LYS 49 -19.457 2.328 1.254 1098 HE3 LYS 49 HE1 LYS 49 -21.188 2.103 1.482 1099 HZ1 LYS 49 HZ1 LYS 49 -20.153 0.774 -0.887 1100 HZ2 LYS 49 HZ2 LYS 49 -21.225 0.249 0.310 1101 HZ3 LYS 49 HZ3 LYS 49 -19.589 0.150 0.578 1102 H ASP 50 H ASP 50 -18.999 6.955 -3.794 1103 HA ASP 50 HA ASP 50 -20.557 6.639 -6.248 1104 HB2 ASP 50 HB3 ASP 50 -21.007 8.454 -4.367 1105 HB3 ASP 50 HB2 ASP 50 -19.747 9.333 -5.224 1106 H VAL 51 H VAL 51 -17.528 6.140 -5.900 1107 HA VAL 51 HA VAL 51 -16.769 7.659 -8.306 1108 HB VAL 51 HB VAL 51 -14.815 6.487 -6.369 1109 HG11 VAL 51 HG11 VAL 51 -14.705 8.731 -8.419 1110 HG12 VAL 51 HG12 VAL 51 -13.900 7.177 -8.555 1111 HG13 VAL 51 HG13 VAL 51 -13.368 8.342 -7.349 1112 HG21 VAL 51 HG21 VAL 51 -15.979 7.977 -4.911 1113 HG22 VAL 51 HG22 VAL 51 -16.257 9.137 -6.206 1114 HG23 VAL 51 HG23 VAL 51 -14.646 8.960 -5.527 1115 H ASP 52 H ASP 52 -16.452 6.419 -10.033 1116 HA ASP 52 HA ASP 52 -16.956 3.662 -10.003 1117 HB2 ASP 52 HB3 ASP 52 -17.172 5.099 -12.031 1118 HB3 ASP 52 HB2 ASP 52 -15.413 5.131 -12.144 1119 H ALA 53 H ALA 53 -13.960 5.424 -9.844 1120 HA ALA 53 HA ALA 53 -12.073 3.555 -10.440 1121 HB1 ALA 53 HB1 ALA 53 -10.518 4.726 -9.150 1122 HB2 ALA 53 HB2 ALA 53 -11.710 5.215 -7.954 1123 HB3 ALA 53 HB3 ALA 53 -11.713 5.954 -9.554 1124 H VAL 54 H VAL 54 -14.142 3.554 -7.618 1125 HA VAL 54 HA VAL 54 -12.657 1.728 -6.068 1126 HB VAL 54 HB VAL 54 -14.605 3.070 -5.221 1127 HG11 VAL 54 HG11 VAL 54 -16.088 2.398 -7.273 1128 HG12 VAL 54 HG12 VAL 54 -16.815 2.562 -5.699 1129 HG13 VAL 54 HG13 VAL 54 -16.442 0.961 -6.317 1130 HG21 VAL 54 HG21 VAL 54 -15.672 0.953 -4.012 1131 HG22 VAL 54 HG22 VAL 54 -14.036 1.462 -3.650 1132 HG23 VAL 54 HG23 VAL 54 -14.306 0.110 -4.736 1133 H ASP 55 H ASP 55 -15.066 1.262 -8.593 1134 HA ASP 55 HA ASP 55 -15.263 -1.569 -8.479 1135 HB2 ASP 55 HB3 ASP 55 -16.851 -0.284 -9.809 1136 HB3 ASP 55 HB2 ASP 55 -15.522 0.342 -10.794 1137 H LYS 56 H LYS 56 -13.386 0.598 -10.470 1138 HA LYS 56 HA LYS 56 -12.005 -1.394 -11.868 1139 HB2 LYS 56 HB3 LYS 56 -11.389 1.516 -11.416 1140 HB3 LYS 56 HB2 LYS 56 -10.431 0.476 -12.463 1141 HG2 LYS 56 HG3 LYS 56 -12.439 -0.042 -13.840 1142 HG3 LYS 56 HG2 LYS 56 -13.425 0.946 -12.763 1143 HD2 LYS 56 HD3 LYS 56 -12.386 2.891 -13.357 1144 HD3 LYS 56 HD2 LYS 56 -11.012 2.110 -14.172 1145 HE2 LYS 56 HE2 LYS 56 -12.736 3.084 -15.777 1146 HE3 LYS 56 HE1 LYS 56 -12.511 1.350 -15.967 1147 HZ1 LYS 56 HZ1 LYS 56 -14.645 2.351 -14.155 1148 HZ2 LYS 56 HZ2 LYS 56 -14.581 0.912 -15.055 1149 HZ3 LYS 56 HZ3 LYS 56 -14.846 2.372 -15.814 1150 H VAL 57 H VAL 57 -11.115 0.361 -8.940 1151 HA VAL 57 HA VAL 57 -8.473 -0.702 -8.784 1152 HB VAL 57 HB VAL 57 -10.327 0.420 -6.655 1153 HG11 VAL 57 HG11 VAL 57 -8.684 -1.166 -5.717 1154 HG12 VAL 57 HG12 VAL 57 -8.373 0.493 -5.198 1155 HG13 VAL 57 HG13 VAL 57 -7.385 -0.246 -6.468 1156 HG21 VAL 57 HG21 VAL 57 -9.435 1.975 -8.483 1157 HG22 VAL 57 HG22 VAL 57 -7.822 1.594 -7.905 1158 HG23 VAL 57 HG23 VAL 57 -8.963 2.402 -6.838 1159 H MET 58 H MET 58 -11.567 -1.558 -7.401 1160 HA MET 58 HA MET 58 -10.717 -3.883 -6.067 1161 HB2 MET 58 HB3 MET 58 -12.832 -2.798 -5.525 1162 HB3 MET 58 HB2 MET 58 -13.421 -3.109 -7.157 1163 HG2 MET 58 HG3 MET 58 -13.315 -5.367 -6.884 1164 HG3 MET 58 HG2 MET 58 -12.578 -5.333 -5.268 1165 HE1 MET 58 HE1 MET 58 -15.454 -3.461 -7.205 1166 HE2 MET 58 HE2 MET 58 -16.884 -4.223 -6.537 1167 HE3 MET 58 HE3 MET 58 -15.732 -5.198 -7.434 1168 H LYS 59 H LYS 59 -11.984 -3.288 -9.317 1169 HA LYS 59 HA LYS 59 -12.186 -5.978 -10.077 1170 HB2 LYS 59 HB3 LYS 59 -13.223 -3.929 -11.236 1171 HB3 LYS 59 HB2 LYS 59 -11.661 -3.723 -11.992 1172 HG2 LYS 59 HG3 LYS 59 -12.994 -5.050 -13.525 1173 HG3 LYS 59 HG2 LYS 59 -11.752 -6.064 -12.818 1174 HD2 LYS 59 HD3 LYS 59 -14.172 -7.025 -12.933 1175 HD3 LYS 59 HD2 LYS 59 -13.284 -7.244 -11.449 1176 HE2 LYS 59 HE2 LYS 59 -15.702 -6.441 -11.222 1177 HE3 LYS 59 HE1 LYS 59 -14.527 -5.497 -10.322 1178 HZ1 LYS 59 HZ1 LYS 59 -16.043 -4.838 -12.725 1179 HZ2 LYS 59 HZ2 LYS 59 -14.524 -4.098 -12.567 1180 HZ3 LYS 59 HZ3 LYS 59 -15.731 -3.874 -11.392 1181 H GLU 60 H GLU 60 -9.555 -3.613 -10.391 1182 HA GLU 60 HA GLU 60 -7.840 -5.310 -11.883 1183 HB2 GLU 60 HB3 GLU 60 -7.269 -3.095 -9.928 1184 HB3 GLU 60 HB2 GLU 60 -6.002 -3.906 -10.857 1185 HG2 GLU 60 HG3 GLU 60 -7.146 -3.177 -12.972 1186 HG3 GLU 60 HG2 GLU 60 -8.379 -2.395 -12.008 1187 H LEU 61 H LEU 61 -8.420 -4.899 -8.441 1188 HA LEU 61 HA LEU 61 -6.556 -6.898 -7.587 1189 HB2 LEU 61 HB3 LEU 61 -8.894 -5.516 -6.299 1190 HB3 LEU 61 HB2 LEU 61 -8.306 -7.000 -5.578 1191 HG LEU 61 HG LEU 61 -7.303 -4.813 -4.726 1192 HD11 LEU 61 HD11 LEU 61 -6.168 -6.656 -3.951 1193 HD12 LEU 61 HD12 LEU 61 -4.897 -5.886 -4.884 1194 HD13 LEU 61 HD13 LEU 61 -5.765 -7.254 -5.562 1195 HD21 LEU 61 HD21 LEU 61 -5.527 -3.799 -5.985 1196 HD22 LEU 61 HD22 LEU 61 -6.903 -3.868 -7.067 1197 HD23 LEU 61 HD23 LEU 61 -5.581 -5.034 -7.233 1198 H ASP 62 H ASP 62 -9.907 -6.898 -8.620 1199 HA ASP 62 HA ASP 62 -10.484 -9.611 -8.058 1200 HB2 ASP 62 HB3 ASP 62 -12.147 -7.819 -8.797 1201 HB3 ASP 62 HB2 ASP 62 -11.546 -8.084 -10.433 1202 H GLU 63 H GLU 63 -9.167 -7.991 -10.893 1203 HA GLU 63 HA GLU 63 -8.768 -10.333 -12.486 1204 HB2 GLU 63 HB3 GLU 63 -7.452 -7.606 -12.583 1205 HB3 GLU 63 HB2 GLU 63 -7.243 -8.875 -13.791 1206 HG2 GLU 63 HG3 GLU 63 -9.626 -8.882 -14.287 1207 HG3 GLU 63 HG2 GLU 63 -9.910 -7.738 -12.982 1208 H ASN 64 H ASN 64 -6.527 -8.340 -10.587 1209 HA ASN 64 HA ASN 64 -4.269 -10.022 -11.051 1210 HB2 ASN 64 HB3 ASN 64 -4.501 -7.541 -10.075 1211 HB3 ASN 64 HB2 ASN 64 -4.444 -8.505 -8.575 1212 HD21 ASN 64 HD21 ASN 64 -2.227 -6.693 -9.822 1213 HD22 ASN 64 HD22 ASN 64 -0.899 -7.737 -9.880 1214 H GLY 65 H GLY 65 -6.424 -9.617 -8.297 1215 HA2 GLY 65 HA3 GLY 65 -5.292 -11.833 -6.857 1216 HA3 GLY 65 HA2 GLY 65 -6.725 -10.923 -6.378 1217 H ASP 66 H ASP 66 -5.896 -12.610 -9.347 1218 HA ASP 66 HA ASP 66 -8.473 -13.588 -9.785 1219 HB2 ASP 66 HB3 ASP 66 -6.631 -13.401 -11.490 1220 HB3 ASP 66 HB2 ASP 66 -5.911 -14.844 -10.794 1221 H GLY 67 H GLY 67 -5.743 -14.752 -8.090 1222 HA2 GLY 67 HA3 GLY 67 -7.231 -17.191 -7.247 1223 HA3 GLY 67 HA2 GLY 67 -5.478 -17.044 -7.221 1224 H GLU 68 H GLU 68 -4.762 -14.997 -5.985 1225 HA GLU 68 HA GLU 68 -6.251 -14.686 -3.450 1226 HB2 GLU 68 HB3 GLU 68 -3.372 -15.532 -3.795 1227 HB3 GLU 68 HB2 GLU 68 -4.053 -14.992 -2.270 1228 HG2 GLU 68 HG3 GLU 68 -5.593 -16.822 -2.190 1229 HG3 GLU 68 HG2 GLU 68 -5.240 -17.322 -3.828 1230 H VAL 69 H VAL 69 -5.171 -12.892 -2.115 1231 HA VAL 69 HA VAL 69 -3.843 -10.923 -3.830 1232 HB VAL 69 HB VAL 69 -5.992 -9.973 -3.569 1233 HG11 VAL 69 HG11 VAL 69 -6.914 -11.545 -1.924 1234 HG12 VAL 69 HG12 VAL 69 -7.203 -9.891 -1.404 1235 HG13 VAL 69 HG13 VAL 69 -5.912 -10.821 -0.674 1236 HG21 VAL 69 HG21 VAL 69 -4.709 -8.123 -3.013 1237 HG22 VAL 69 HG22 VAL 69 -3.990 -8.870 -1.592 1238 HG23 VAL 69 HG23 VAL 69 -5.633 -8.272 -1.539 1239 H ASP 70 H ASP 70 -1.913 -10.265 -3.063 1240 HA ASP 70 HA ASP 70 -1.174 -11.236 -0.407 1241 HB2 ASP 70 HB3 ASP 70 0.964 -11.463 -1.123 1242 HB3 ASP 70 HB2 ASP 70 0.245 -11.369 -2.723 1243 H PHE 71 H PHE 71 0.650 -9.700 0.563 1244 HA PHE 71 HA PHE 71 -0.805 -7.522 1.617 1245 HB2 PHE 71 HB3 PHE 71 1.094 -8.669 2.775 1246 HB3 PHE 71 HB2 PHE 71 2.191 -7.867 1.647 1247 HD1 PHE 71 HD1 PHE 71 -0.644 -7.060 3.974 1248 HD2 PHE 71 HD2 PHE 71 3.085 -5.708 2.264 1249 HE1 PHE 71 HE1 PHE 71 -0.700 -5.038 5.387 1250 HE2 PHE 71 HE2 PHE 71 3.003 -3.722 3.691 1251 HZ PHE 71 HZ PHE 71 1.136 -3.363 5.245 1252 H GLN 72 H GLN 72 1.723 -7.773 -0.833 1253 HA GLN 72 HA GLN 72 1.899 -5.015 -1.452 1254 HB2 GLN 72 HB3 GLN 72 2.679 -7.546 -2.835 1255 HB3 GLN 72 HB2 GLN 72 2.756 -6.007 -3.742 1256 HG2 GLN 72 HG3 GLN 72 4.276 -5.156 -2.015 1257 HG3 GLN 72 HG2 GLN 72 4.058 -6.642 -1.085 1258 HE21 GLN 72 HE21 GLN 72 5.769 -5.236 -3.806 1259 HE22 GLN 72 HE22 GLN 72 6.651 -6.623 -4.193 1260 H GLU 73 H GLU 73 -0.187 -7.602 -2.679 1261 HA GLU 73 HA GLU 73 -1.568 -5.962 -4.592 1262 HB2 GLU 73 HB3 GLU 73 -2.455 -8.446 -3.089 1263 HB3 GLU 73 HB2 GLU 73 -3.358 -7.680 -4.386 1264 HG2 GLU 73 HG3 GLU 73 -1.568 -8.070 -5.966 1265 HG3 GLU 73 HG2 GLU 73 -0.539 -8.749 -4.716 1266 H TYR 74 H TYR 74 -2.096 -6.877 -1.236 1267 HA TYR 74 HA TYR 74 -4.571 -5.631 -0.847 1268 HB2 TYR 74 HB3 TYR 74 -3.768 -7.327 0.679 1269 HB3 TYR 74 HB2 TYR 74 -2.416 -6.301 1.141 1270 HD1 TYR 74 HD1 TYR 74 -6.115 -5.714 0.741 1271 HD2 TYR 74 HD2 TYR 74 -2.668 -5.447 3.307 1272 HE1 TYR 74 HE1 TYR 74 -7.495 -4.678 2.492 1273 HE2 TYR 74 HE2 TYR 74 -4.054 -4.415 5.060 1274 HH TYR 74 HH TYR 74 -6.994 -4.589 5.436 1275 H VAL 75 H VAL 75 -1.321 -4.411 -0.065 1276 HA VAL 75 HA VAL 75 -2.243 -2.031 1.070 1277 HB VAL 75 HB VAL 75 0.065 -1.119 0.598 1278 HG11 VAL 75 HG11 VAL 75 -0.755 -2.503 2.650 1279 HG12 VAL 75 HG12 VAL 75 0.973 -2.374 2.404 1280 HG13 VAL 75 HG13 VAL 75 0.126 -3.839 1.924 1281 HG21 VAL 75 HG21 VAL 75 1.189 -3.725 0.073 1282 HG22 VAL 75 HG22 VAL 75 1.424 -2.234 -0.855 1283 HG23 VAL 75 HG23 VAL 75 0.103 -3.312 -1.231 1284 H VAL 76 H VAL 76 -1.406 -2.746 -2.307 1285 HA VAL 76 HA VAL 76 -1.682 -0.072 -3.177 1286 HB VAL 76 HB VAL 76 -0.472 -1.787 -4.505 1287 HG11 VAL 76 HG11 VAL 76 -3.228 -3.019 -4.783 1288 HG12 VAL 76 HG12 VAL 76 -1.718 -3.766 -4.258 1289 HG13 VAL 76 HG13 VAL 76 -1.923 -3.311 -5.929 1290 HG21 VAL 76 HG21 VAL 76 -1.236 -1.075 -6.658 1291 HG22 VAL 76 HG22 VAL 76 -1.490 0.284 -5.565 1292 HG23 VAL 76 HG23 VAL 76 -2.855 -0.718 -6.066 1293 H LEU 77 H LEU 77 -3.914 -2.739 -2.753 1294 HA LEU 77 HA LEU 77 -6.143 -1.608 -4.049 1295 HB2 LEU 77 HB3 LEU 77 -6.108 -3.961 -3.380 1296 HB3 LEU 77 HB2 LEU 77 -6.013 -3.506 -1.695 1297 HG LEU 77 HG LEU 77 -8.226 -2.423 -1.803 1298 HD11 LEU 77 HD11 LEU 77 -8.818 -1.645 -3.792 1299 HD12 LEU 77 HD12 LEU 77 -9.449 -3.252 -4.102 1300 HD13 LEU 77 HD13 LEU 77 -7.853 -2.802 -4.704 1301 HD21 LEU 77 HD21 LEU 77 -9.430 -4.701 -2.747 1302 HD22 LEU 77 HD22 LEU 77 -8.778 -4.506 -1.138 1303 HD23 LEU 77 HD23 LEU 77 -7.807 -5.297 -2.380 1304 H VAL 78 H VAL 78 -5.152 -1.516 -0.650 1305 HA VAL 78 HA VAL 78 -7.248 0.288 0.072 1306 HB VAL 78 HB VAL 78 -5.998 0.654 2.194 1307 HG11 VAL 78 HG11 VAL 78 -7.365 -1.123 2.554 1308 HG12 VAL 78 HG12 VAL 78 -5.853 -2.009 2.636 1309 HG13 VAL 78 HG13 VAL 78 -6.790 -2.016 1.144 1310 HG21 VAL 78 HG21 VAL 78 -3.670 0.412 1.279 1311 HG22 VAL 78 HG22 VAL 78 -4.044 -1.294 0.979 1312 HG23 VAL 78 HG23 VAL 78 -3.984 -0.696 2.623 1313 H ALA 79 H ALA 79 -3.860 0.715 -0.807 1314 HA ALA 79 HA ALA 79 -3.764 3.506 -0.387 1315 HB1 ALA 79 HB1 ALA 79 -1.756 3.504 -1.649 1316 HB2 ALA 79 HB2 ALA 79 -2.212 2.026 -2.490 1317 HB3 ALA 79 HB3 ALA 79 -1.782 1.969 -0.778 1318 H ALA 80 H ALA 80 -4.573 1.548 -3.224 1319 HA ALA 80 HA ALA 80 -4.778 3.607 -5.043 1320 HB1 ALA 80 HB1 ALA 80 -6.373 2.030 -6.251 1321 HB2 ALA 80 HB2 ALA 80 -6.128 0.932 -4.879 1322 HB3 ALA 80 HB3 ALA 80 -4.771 1.397 -5.879 1323 H LEU 81 H LEU 81 -7.206 2.147 -2.928 1324 HA LEU 81 HA LEU 81 -9.345 3.877 -3.683 1325 HB2 LEU 81 HB3 LEU 81 -8.839 2.284 -1.162 1326 HB3 LEU 81 HB2 LEU 81 -10.321 3.190 -1.458 1327 HG LEU 81 HG LEU 81 -9.260 1.051 -3.332 1328 HD11 LEU 81 HD11 LEU 81 -11.219 0.908 -1.038 1329 HD12 LEU 81 HD12 LEU 81 -9.872 -0.168 -1.415 1330 HD13 LEU 81 HD13 LEU 81 -11.322 -0.204 -2.404 1331 HD21 LEU 81 HD21 LEU 81 -11.795 2.715 -3.206 1332 HD22 LEU 81 HD22 LEU 81 -11.743 1.161 -4.034 1333 HD23 LEU 81 HD23 LEU 81 -10.705 2.462 -4.580 1334 H THR 82 H THR 82 -6.856 3.986 -1.167 1335 HA THR 82 HA THR 82 -7.773 6.331 0.070 1336 HB THR 82 HB THR 82 -4.905 5.391 -0.076 1337 HG1 THR 82 HG2 THR 82 -6.229 3.677 0.611 1338 HG21 THR 82 HG21 THR 82 -4.496 6.751 1.724 1339 HG22 THR 82 HG22 THR 82 -6.126 6.608 2.351 1340 HG23 THR 82 HG23 THR 82 -5.796 7.697 1.009 1341 H VAL 83 H VAL 83 -5.281 5.910 -2.491 1342 HA VAL 83 HA VAL 83 -4.614 8.636 -2.619 1343 HB VAL 83 HB VAL 83 -3.246 6.789 -3.618 1344 HG11 VAL 83 HG11 VAL 83 -5.231 6.854 -5.896 1345 HG12 VAL 83 HG12 VAL 83 -5.127 5.604 -4.643 1346 HG13 VAL 83 HG13 VAL 83 -3.781 5.864 -5.739 1347 HG21 VAL 83 HG21 VAL 83 -2.544 8.016 -5.618 1348 HG22 VAL 83 HG22 VAL 83 -2.810 9.137 -4.284 1349 HG23 VAL 83 HG23 VAL 83 -4.014 8.978 -5.570 1350 H ALA 84 H ALA 84 -6.989 6.781 -4.497 1351 HA ALA 84 HA ALA 84 -7.819 8.881 -6.173 1352 HB1 ALA 84 HB1 ALA 84 -9.953 7.547 -6.349 1353 HB2 ALA 84 HB2 ALA 84 -9.288 6.438 -5.156 1354 HB3 ALA 84 HB3 ALA 84 -8.485 6.644 -6.709 1355 H MET 85 H MET 85 -9.130 7.725 -3.086 1356 HA MET 85 HA MET 85 -11.110 9.761 -2.841 1357 HB2 MET 85 HB3 MET 85 -10.512 7.420 -1.479 1358 HB3 MET 85 HB2 MET 85 -10.104 8.672 -0.320 1359 HG2 MET 85 HG3 MET 85 -12.712 8.792 -1.826 1360 HG3 MET 85 HG2 MET 85 -12.546 7.787 -0.400 1361 HE1 MET 85 HE1 MET 85 -12.388 11.828 -1.480 1362 HE2 MET 85 HE2 MET 85 -13.831 11.849 -0.476 1363 HE3 MET 85 HE3 MET 85 -13.685 10.642 -1.741 1364 H ASN 86 H ASN 86 -7.873 9.356 -1.533 1365 HA ASN 86 HA ASN 86 -7.862 11.620 0.090 1366 HB2 ASN 86 HB3 ASN 86 -6.210 9.840 0.356 1367 HB3 ASN 86 HB2 ASN 86 -5.521 10.238 -1.207 1368 HD21 ASN 86 HD21 ASN 86 -6.509 12.328 1.600 1369 HD22 ASN 86 HD22 ASN 86 -5.010 13.111 1.662 1370 H ASN 87 H ASN 87 -6.901 11.170 -3.255 1371 HA ASN 87 HA ASN 87 -5.509 13.415 -3.842 1372 HB2 ASN 87 HB3 ASN 87 -5.960 11.751 -5.487 1373 HB3 ASN 87 HB2 ASN 87 -7.675 12.123 -5.493 1374 HD21 ASN 87 HD21 ASN 87 -4.549 13.226 -6.696 1375 HD22 ASN 87 HD22 ASN 87 -5.162 14.492 -7.640 1376 H PHE 88 H PHE 88 -8.946 13.221 -3.242 1377 HA PHE 88 HA PHE 88 -9.630 15.826 -4.107 1378 HB2 PHE 88 HB3 PHE 88 -10.926 13.923 -2.154 1379 HB3 PHE 88 HB2 PHE 88 -11.578 15.524 -2.460 1380 HD1 PHE 88 HD1 PHE 88 -12.178 16.219 -4.806 1381 HD2 PHE 88 HD2 PHE 88 -11.213 12.153 -3.793 1382 HE1 PHE 88 HE1 PHE 88 -13.203 15.457 -6.917 1383 HE2 PHE 88 HE2 PHE 88 -12.254 11.393 -5.923 1384 HZ PHE 88 HZ PHE 88 -13.242 13.043 -7.483 1385 H PHE 89 H PHE 89 -8.333 14.619 -1.074 1386 HA PHE 89 HA PHE 89 -8.661 16.951 0.507 1387 HB2 PHE 89 HB3 PHE 89 -6.604 14.722 0.611 1388 HB3 PHE 89 HB2 PHE 89 -6.654 16.042 1.753 1389 HD1 PHE 89 HD2 PHE 89 -8.888 13.394 0.280 1390 HD2 PHE 89 HD1 PHE 89 -8.025 15.931 3.648 1391 HE1 PHE 89 HE2 PHE 89 -10.639 12.255 1.584 1392 HE2 PHE 89 HE1 PHE 89 -9.788 14.785 4.953 1393 HZ PHE 89 HZ PHE 89 -11.095 12.947 3.926 1394 H TRP 90 H TRP 90 -6.137 15.896 -1.697 1395 HA TRP 90 HA TRP 90 -4.180 17.886 -1.176 1396 HB2 TRP 90 HB3 TRP 90 -4.833 16.491 -3.779 1397 HB3 TRP 90 HB2 TRP 90 -3.377 17.419 -3.443 1398 HD1 TRP 90 HD TRP 90 -5.244 14.500 -1.745 1399 HE1 TRP 90 HE1 TRP 90 -3.535 12.813 -0.965 1400 HE3 TRP 90 HE3 TRP 90 -1.037 16.859 -3.222 1401 HZ2 TRP 90 HZ2 TRP 90 -0.701 12.460 -0.974 1402 HZ3 TRP 90 HZ3 TRP 90 1.206 15.828 -2.838 1403 HH2 TRP 90 HH TRP 90 1.375 13.624 -1.722 1404 H GLU 91 H GLU 91 -6.717 17.669 -3.454 1405 HA GLU 91 HA GLU 91 -6.256 20.353 -4.512 1406 HB2 GLU 91 HB3 GLU 91 -8.542 18.491 -5.085 1407 HB3 GLU 91 HB2 GLU 91 -7.953 19.836 -6.077 1408 HG2 GLU 91 HG3 GLU 91 -6.139 17.529 -5.352 1409 HG3 GLU 91 HG2 GLU 91 -7.137 17.421 -6.753 1410 H ASN 92 H ASN 92 -8.892 18.757 -2.731 1411 HA ASN 92 HA ASN 92 -10.126 21.352 -2.202 1412 HB2 ASN 92 HB3 ASN 92 -11.581 19.432 -2.771 1413 HB3 ASN 92 HB2 ASN 92 -10.950 18.565 -1.381 1414 HD21 ASN 92 HD21 ASN 92 -12.907 21.408 -2.295 1415 HD22 ASN 92 HD22 ASN 92 -13.637 21.579 -0.777 1416 H SER 93 H SER 93 -8.891 22.405 -0.751 1417 HA SER 93 HA SER 93 -8.779 21.559 1.956 1418 HB2 SER 93 HB3 SER 93 -6.532 20.938 0.154 1419 HB3 SER 93 HB2 SER 93 -6.051 21.729 1.644 1420 HG SER 93 HG SER 93 -7.033 19.253 1.084 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -11.791 8.410 11.878 2 HA2 GLY 1 HA3 GLY 1 -10.509 7.300 9.448 3 HA3 GLY 1 HA2 GLY 1 -9.746 8.474 10.509 4 H SER 2 H SER 2 -10.504 5.146 10.048 5 HA SER 2 HA SER 2 -9.839 4.204 12.687 6 HB2 SER 2 HB3 SER 2 -9.749 2.576 10.145 7 HB3 SER 2 HB2 SER 2 -10.143 2.044 11.769 8 HG SER 2 HG SER 2 -11.604 3.732 10.014 9 H GLU 3 H GLU 3 -7.961 2.582 12.948 10 HA GLU 3 HA GLU 3 -5.517 3.891 12.497 11 HB2 GLU 3 HB3 GLU 3 -6.300 1.158 13.438 12 HB3 GLU 3 HB2 GLU 3 -4.666 1.374 12.859 13 HG2 GLU 3 HG3 GLU 3 -4.065 2.362 14.726 14 HG3 GLU 3 HG2 GLU 3 -5.255 3.625 14.545 15 H LEU 4 H LEU 4 -7.022 1.201 10.762 16 HA LEU 4 HA LEU 4 -4.920 0.866 8.840 17 HB2 LEU 4 HB3 LEU 4 -7.896 0.272 8.623 18 HB3 LEU 4 HB2 LEU 4 -6.725 -0.184 7.418 19 HG LEU 4 HG LEU 4 -6.833 -2.137 8.643 20 HD11 LEU 4 HD11 LEU 4 -4.772 -0.711 10.337 21 HD12 LEU 4 HD12 LEU 4 -4.439 -1.231 8.670 22 HD13 LEU 4 HD13 LEU 4 -4.823 -2.403 9.902 23 HD21 LEU 4 HD21 LEU 4 -8.184 -0.680 10.525 24 HD22 LEU 4 HD22 LEU 4 -6.691 -1.038 11.400 25 HD23 LEU 4 HD23 LEU 4 -7.658 -2.337 10.738 26 H GLU 5 H GLU 5 -7.810 2.847 8.874 27 HA GLU 5 HA GLU 5 -7.455 3.954 6.286 28 HB2 GLU 5 HB3 GLU 5 -8.880 4.985 8.762 29 HB3 GLU 5 HB2 GLU 5 -9.033 5.710 7.180 30 HG2 GLU 5 HG3 GLU 5 -9.925 3.642 6.233 31 HG3 GLU 5 HG2 GLU 5 -9.714 2.789 7.739 32 H THR 6 H THR 6 -6.606 5.037 9.544 33 HA THR 6 HA THR 6 -5.260 7.401 8.807 34 HB THR 6 HB THR 6 -4.704 5.754 11.280 35 HG1 THR 6 HG2 THR 6 -6.936 6.024 11.034 36 HG21 THR 6 HG21 THR 6 -3.218 7.575 11.174 37 HG22 THR 6 HG22 THR 6 -4.520 8.164 12.192 38 HG23 THR 6 HG23 THR 6 -4.428 8.663 10.507 39 H ALA 7 H ALA 7 -4.070 4.091 9.362 40 HA ALA 7 HA ALA 7 -1.349 4.578 9.160 41 HB1 ALA 7 HB1 ALA 7 -1.942 2.370 9.728 42 HB2 ALA 7 HB2 ALA 7 -1.331 2.199 8.085 43 HB3 ALA 7 HB3 ALA 7 -3.063 2.224 8.379 44 H MET 8 H MET 8 -3.742 4.016 6.615 45 HA MET 8 HA MET 8 -1.922 4.294 4.446 46 HB2 MET 8 HB3 MET 8 -4.920 4.717 4.542 47 HB3 MET 8 HB2 MET 8 -3.962 4.623 3.073 48 HG2 MET 8 HG3 MET 8 -4.256 2.417 5.142 49 HG3 MET 8 HG2 MET 8 -4.932 2.427 3.518 50 HE1 MET 8 HE1 MET 8 -3.749 2.775 1.548 51 HE2 MET 8 HE2 MET 8 -2.219 1.991 1.134 52 HE3 MET 8 HE3 MET 8 -2.208 3.637 1.744 53 H GLU 9 H GLU 9 -3.971 6.566 6.226 54 HA GLU 9 HA GLU 9 -3.424 8.828 4.636 55 HB2 GLU 9 HB3 GLU 9 -4.096 8.637 7.600 56 HB3 GLU 9 HB2 GLU 9 -3.970 10.138 6.719 57 HG2 GLU 9 HG3 GLU 9 -5.769 9.508 5.211 58 HG3 GLU 9 HG2 GLU 9 -5.871 7.911 5.936 59 H THR 10 H THR 10 -1.825 7.306 7.328 60 HA THR 10 HA THR 10 0.091 9.271 7.936 61 HB THR 10 HB THR 10 0.631 6.290 8.085 62 HG1 THR 10 HG2 THR 10 -1.539 7.000 8.934 63 HG21 THR 10 HG21 THR 10 1.296 8.274 10.224 64 HG22 THR 10 HG22 THR 10 2.264 8.302 8.771 65 HG23 THR 10 HG23 THR 10 2.153 6.825 9.729 66 H LEU 11 H LEU 11 0.158 6.568 5.642 67 HA LEU 11 HA LEU 11 2.732 7.117 4.539 68 HB2 LEU 11 HB3 LEU 11 0.292 5.754 3.367 69 HB3 LEU 11 HB2 LEU 11 1.857 5.804 2.571 70 HG LEU 11 HG LEU 11 1.377 4.622 5.331 71 HD11 LEU 11 HD11 LEU 11 0.297 3.412 3.345 72 HD12 LEU 11 HD12 LEU 11 1.387 2.488 4.368 73 HD13 LEU 11 HD13 LEU 11 1.947 3.078 2.809 74 HD21 LEU 11 HD21 LEU 11 3.708 5.321 5.098 75 HD22 LEU 11 HD22 LEU 11 3.787 4.644 3.463 76 HD23 LEU 11 HD23 LEU 11 3.630 3.584 4.846 77 H ILE 12 H ILE 12 -0.543 8.211 3.799 78 HA ILE 12 HA ILE 12 0.089 9.702 1.474 79 HB ILE 12 HB ILE 12 -2.110 10.095 3.534 80 HG12 ILE 12 HG13 ILE 12 -2.130 7.943 2.152 81 HG13 ILE 12 HG12 ILE 12 -3.549 8.972 1.955 82 HG21 ILE 12 HG21 ILE 12 -1.816 12.201 2.445 83 HG22 ILE 12 HG22 ILE 12 -3.244 11.430 1.792 84 HG23 ILE 12 HG23 ILE 12 -1.745 11.434 0.856 85 HD11 ILE 12 HD11 ILE 12 -1.202 9.180 0.025 86 HD12 ILE 12 HD12 ILE 12 -2.868 9.699 -0.177 87 HD13 ILE 12 HD13 ILE 12 -2.491 8.000 -0.161 88 H ASN 13 H ASN 13 0.003 10.580 4.883 89 HA ASN 13 HA ASN 13 0.573 13.329 4.582 90 HB2 ASN 13 HB3 ASN 13 1.072 11.369 6.817 91 HB3 ASN 13 HB2 ASN 13 1.615 13.024 6.933 92 HD21 ASN 13 HD21 ASN 13 -1.264 10.999 6.846 93 HD22 ASN 13 HD22 ASN 13 -2.353 12.230 7.253 94 H VAL 14 H VAL 14 2.696 10.514 4.939 95 HA VAL 14 HA VAL 14 5.157 11.926 4.817 96 HB VAL 14 HB VAL 14 4.400 9.067 4.158 97 HG11 VAL 14 HG11 VAL 14 7.137 10.368 4.323 98 HG12 VAL 14 HG12 VAL 14 6.419 9.585 2.912 99 HG13 VAL 14 HG13 VAL 14 6.843 8.635 4.327 100 HG21 VAL 14 HG21 VAL 14 4.132 9.496 6.488 101 HG22 VAL 14 HG22 VAL 14 5.573 10.512 6.531 102 HG23 VAL 14 HG23 VAL 14 5.737 8.777 6.337 103 H PHE 15 H PHE 15 3.133 10.303 2.410 104 HA PHE 15 HA PHE 15 4.736 10.716 0.145 105 HB2 PHE 15 HB3 PHE 15 2.719 9.243 0.254 106 HB3 PHE 15 HB2 PHE 15 1.710 10.680 0.293 107 HD1 PHE 15 HD1 PHE 15 4.142 8.761 -1.753 108 HD2 PHE 15 HD2 PHE 15 1.249 11.945 -1.701 109 HE1 PHE 15 HE1 PHE 15 4.198 8.856 -4.215 110 HE2 PHE 15 HE2 PHE 15 1.306 12.035 -4.162 111 HZ PHE 15 HZ PHE 15 2.777 10.489 -5.427 112 H HIS 16 H HIS 16 2.116 12.658 1.485 113 HA HIS 16 HA HIS 16 2.386 14.798 -0.374 114 HB2 HIS 16 HB3 HIS 16 0.863 14.402 2.145 115 HB3 HIS 16 HB2 HIS 16 1.230 16.062 1.706 116 HD1 HIS 16 HD1 HIS 16 -0.062 17.102 -0.137 117 HD2 HIS 16 HD2 HIS 16 -0.574 12.976 -0.020 118 HE1 HIS 16 HE1 HIS 16 -1.860 16.564 -1.857 119 HE2 HIS 16 HE2 HIS 16 -2.199 14.060 -1.820 120 H ALA 17 H ALA 17 3.819 14.202 2.790 121 HA ALA 17 HA ALA 17 5.047 16.709 3.150 122 HB1 ALA 17 HB1 ALA 17 6.640 15.565 4.583 123 HB2 ALA 17 HB2 ALA 17 6.222 14.009 3.888 124 HB3 ALA 17 HB3 ALA 17 5.042 14.886 4.871 125 H HIS 18 H HIS 18 6.159 13.804 1.488 126 HA HIS 18 HA HIS 18 8.540 15.045 0.514 127 HB2 HIS 18 HB3 HIS 18 7.166 12.481 -0.251 128 HB3 HIS 18 HB2 HIS 18 8.650 13.107 -1.015 129 HD1 HIS 18 HD1 HIS 18 10.851 13.282 0.513 130 HD2 HIS 18 HD2 HIS 18 7.573 11.375 2.321 131 HE1 HIS 18 HE1 HIS 18 11.709 12.162 2.580 132 HE2 HIS 18 HE2 HIS 18 9.751 10.950 3.690 133 H SER 19 H SER 19 5.276 14.607 -0.915 134 HA SER 19 HA SER 19 5.893 15.337 -3.534 135 HB2 SER 19 HB3 SER 19 3.426 16.010 -1.913 136 HB3 SER 19 HB2 SER 19 3.502 16.244 -3.646 137 HG SER 19 HG SER 19 4.258 13.867 -3.476 138 H GLY 20 H GLY 20 5.340 17.366 -0.742 139 HA2 GLY 20 HA3 GLY 20 5.531 19.865 -2.055 140 HA3 GLY 20 HA2 GLY 20 5.816 19.595 -0.340 141 H LYS 21 H LYS 21 7.878 17.508 -1.029 142 HA LYS 21 HA LYS 21 10.108 19.158 -0.781 143 HB2 LYS 21 HB3 LYS 21 10.046 16.787 0.023 144 HB3 LYS 21 HB2 LYS 21 10.096 16.254 -1.649 145 HG2 LYS 21 HG3 LYS 21 12.295 16.152 -1.237 146 HG3 LYS 21 HG2 LYS 21 12.300 17.812 -1.738 147 HD2 LYS 21 HD3 LYS 21 12.040 16.845 1.136 148 HD3 LYS 21 HD2 LYS 21 13.540 17.418 0.422 149 HE2 LYS 21 HE2 LYS 21 11.043 19.005 1.088 150 HE3 LYS 21 HE1 LYS 21 12.686 19.264 1.623 151 HZ1 LYS 21 HZ1 LYS 21 11.860 20.791 -0.103 152 HZ2 LYS 21 HZ2 LYS 21 11.929 19.607 -1.277 153 HZ3 LYS 21 HZ3 LYS 21 13.322 20.128 -0.475 154 H GLU 22 H GLU 22 8.835 17.378 -3.584 155 HA GLU 22 HA GLU 22 10.853 18.642 -5.284 156 HB2 GLU 22 HB3 GLU 22 10.245 17.033 -7.000 157 HB3 GLU 22 HB2 GLU 22 10.299 16.228 -5.488 158 HG2 GLU 22 HG3 GLU 22 7.719 16.843 -5.294 159 HG3 GLU 22 HG2 GLU 22 7.845 16.856 -7.057 160 H GLY 23 H GLY 23 7.770 19.245 -4.170 161 HA2 GLY 23 HA3 GLY 23 6.606 21.231 -4.456 162 HA3 GLY 23 HA2 GLY 23 7.558 21.581 -5.887 163 H ASP 24 H ASP 24 6.057 18.458 -5.703 164 HA ASP 24 HA ASP 24 4.334 19.089 -7.969 165 HB2 ASP 24 HB3 ASP 24 5.491 16.828 -7.598 166 HB3 ASP 24 HB2 ASP 24 4.280 16.528 -6.368 167 H LYS 25 H LYS 25 1.999 18.776 -7.910 168 HA LYS 25 HA LYS 25 0.740 19.908 -5.612 169 HB2 LYS 25 HB3 LYS 25 -1.348 19.069 -6.565 170 HB3 LYS 25 HB2 LYS 25 -0.496 20.129 -7.703 171 HG2 LYS 25 HG3 LYS 25 0.336 18.040 -8.861 172 HG3 LYS 25 HG2 LYS 25 -0.583 17.059 -7.720 173 HD2 LYS 25 HD3 LYS 25 -2.656 18.352 -8.448 174 HD3 LYS 25 HD2 LYS 25 -1.693 18.997 -9.765 175 HE2 LYS 25 HE2 LYS 25 -1.950 16.019 -9.258 176 HE3 LYS 25 HE1 LYS 25 -3.063 16.929 -10.274 177 HZ1 LYS 25 HZ1 LYS 25 -0.114 16.894 -10.677 178 HZ2 LYS 25 HZ2 LYS 25 -1.246 17.549 -11.707 179 HZ3 LYS 25 HZ3 LYS 25 -1.158 15.872 -11.488 180 H TYR 26 H TYR 26 1.216 16.652 -6.793 181 HA TYR 26 HA TYR 26 1.558 15.610 -4.295 182 HB2 TYR 26 HB3 TYR 26 -0.480 14.031 -4.234 183 HB3 TYR 26 HB2 TYR 26 -0.687 15.683 -3.671 184 HD1 TYR 26 HD2 TYR 26 -1.402 13.322 -6.433 185 HD2 TYR 26 HD1 TYR 26 -2.064 17.299 -4.933 186 HE1 TYR 26 HE2 TYR 26 -3.161 13.659 -8.101 187 HE2 TYR 26 HE1 TYR 26 -3.834 17.624 -6.601 188 HH TYR 26 HH TYR 26 -5.203 16.546 -8.100 189 H LYS 27 H LYS 27 3.243 14.711 -5.172 190 HA LYS 27 HA LYS 27 2.914 12.172 -6.407 191 HB2 LYS 27 HB3 LYS 27 4.434 14.366 -7.843 192 HB3 LYS 27 HB2 LYS 27 4.686 12.651 -8.138 193 HG2 LYS 27 HG3 LYS 27 1.972 13.975 -8.424 194 HG3 LYS 27 HG2 LYS 27 3.115 13.833 -9.732 195 HD2 LYS 27 HD3 LYS 27 2.321 11.333 -8.194 196 HD3 LYS 27 HD2 LYS 27 1.355 11.932 -9.527 197 HE2 LYS 27 HE2 LYS 27 4.323 11.392 -9.769 198 HE3 LYS 27 HE1 LYS 27 3.086 10.223 -10.204 199 HZ1 LYS 27 HZ1 LYS 27 2.776 12.892 -11.399 200 HZ2 LYS 27 HZ2 LYS 27 2.541 11.381 -12.057 201 HZ3 LYS 27 HZ3 LYS 27 4.110 11.998 -11.909 202 H LEU 28 H LEU 28 5.200 11.149 -6.486 203 HA LEU 28 HA LEU 28 6.941 12.478 -4.546 204 HB2 LEU 28 HB3 LEU 28 5.875 10.687 -3.402 205 HB3 LEU 28 HB2 LEU 28 6.220 9.524 -4.666 206 HG LEU 28 HG LEU 28 8.715 10.074 -4.270 207 HD11 LEU 28 HD11 LEU 28 8.942 10.888 -1.783 208 HD12 LEU 28 HD12 LEU 28 7.355 11.607 -2.141 209 HD13 LEU 28 HD13 LEU 28 8.746 12.053 -3.105 210 HD21 LEU 28 HD21 LEU 28 7.376 8.983 -1.820 211 HD22 LEU 28 HD22 LEU 28 8.883 8.453 -2.599 212 HD23 LEU 28 HD23 LEU 28 7.322 8.071 -3.332 213 H SER 29 H SER 29 8.909 12.776 -5.286 214 HA SER 29 HA SER 29 9.569 11.868 -7.922 215 HB2 SER 29 HB3 SER 29 11.774 13.097 -7.367 216 HB3 SER 29 HB2 SER 29 10.309 14.045 -7.409 217 HG SER 29 HG SER 29 10.178 13.945 -5.231 218 H LYS 30 H LYS 30 11.546 10.577 -8.419 219 HA LYS 30 HA LYS 30 11.813 8.440 -6.492 220 HB2 LYS 30 HB3 LYS 30 13.519 8.802 -8.980 221 HB3 LYS 30 HB2 LYS 30 13.298 7.344 -8.053 222 HG2 LYS 30 HG3 LYS 30 11.191 8.764 -9.700 223 HG3 LYS 30 HG2 LYS 30 11.975 7.223 -10.052 224 HD2 LYS 30 HD3 LYS 30 10.845 6.962 -7.411 225 HD3 LYS 30 HD2 LYS 30 9.642 7.732 -8.455 226 HE2 LYS 30 HE2 LYS 30 11.039 5.349 -9.543 227 HE3 LYS 30 HE1 LYS 30 9.964 5.062 -8.231 228 HZ1 LYS 30 HZ1 LYS 30 8.566 6.806 -10.100 229 HZ2 LYS 30 HZ2 LYS 30 8.120 5.328 -9.536 230 HZ3 LYS 30 HZ3 LYS 30 9.085 5.427 -10.875 231 H LYS 31 H LYS 31 12.986 11.428 -6.813 232 HA LYS 31 HA LYS 31 15.710 11.398 -6.028 233 HB2 LYS 31 HB3 LYS 31 13.479 13.310 -5.259 234 HB3 LYS 31 HB2 LYS 31 15.200 13.634 -5.228 235 HG2 LYS 31 HG3 LYS 31 15.364 13.465 -7.633 236 HG3 LYS 31 HG2 LYS 31 13.707 12.916 -7.765 237 HD2 LYS 31 HD3 LYS 31 13.011 15.101 -6.701 238 HD3 LYS 31 HD2 LYS 31 14.682 15.633 -6.871 239 HE2 LYS 31 HE2 LYS 31 13.055 14.551 -9.152 240 HE3 LYS 31 HE1 LYS 31 13.099 16.276 -8.753 241 HZ1 LYS 31 HZ1 LYS 31 14.802 16.088 -10.296 242 HZ2 LYS 31 HZ2 LYS 31 15.301 14.560 -9.786 243 HZ3 LYS 31 HZ3 LYS 31 15.644 15.935 -8.863 244 H GLU 32 H GLU 32 12.621 11.590 -4.407 245 HA GLU 32 HA GLU 32 13.686 11.381 -1.730 246 HB2 GLU 32 HB3 GLU 32 10.901 11.690 -2.867 247 HB3 GLU 32 HB2 GLU 32 11.296 11.732 -1.141 248 HG2 GLU 32 HG3 GLU 32 12.632 13.538 -3.137 249 HG3 GLU 32 HG2 GLU 32 11.145 13.989 -2.327 250 H LEU 33 H LEU 33 12.064 9.415 -4.106 251 HA LEU 33 HA LEU 33 10.870 7.539 -2.482 252 HB2 LEU 33 HB3 LEU 33 10.616 7.685 -4.974 253 HB3 LEU 33 HB2 LEU 33 12.171 6.931 -5.178 254 HG LEU 33 HG LEU 33 10.127 5.403 -5.319 255 HD11 LEU 33 HD11 LEU 33 11.968 4.328 -3.245 256 HD12 LEU 33 HD12 LEU 33 12.679 4.858 -4.770 257 HD13 LEU 33 HD13 LEU 33 11.446 3.620 -4.764 258 HD21 LEU 33 HD21 LEU 33 9.168 6.442 -3.106 259 HD22 LEU 33 HD22 LEU 33 10.291 5.341 -2.297 260 HD23 LEU 33 HD23 LEU 33 9.042 4.708 -3.351 261 H LYS 34 H LYS 34 14.150 7.406 -3.837 262 HA LYS 34 HA LYS 34 14.819 4.985 -2.513 263 HB2 LYS 34 HB3 LYS 34 16.555 7.147 -3.725 264 HB3 LYS 34 HB2 LYS 34 17.191 5.659 -3.025 265 HG2 LYS 34 HG3 LYS 34 15.888 4.296 -4.606 266 HG3 LYS 34 HG2 LYS 34 15.131 5.736 -5.264 267 HD2 LYS 34 HD3 LYS 34 16.839 5.214 -6.786 268 HD3 LYS 34 HD2 LYS 34 17.516 6.542 -5.864 269 HE2 LYS 34 HE2 LYS 34 18.047 3.770 -4.826 270 HE3 LYS 34 HE1 LYS 34 18.830 4.228 -6.323 271 HZ1 LYS 34 HZ1 LYS 34 20.275 4.857 -4.650 272 HZ2 LYS 34 HZ2 LYS 34 19.105 5.571 -3.687 273 HZ3 LYS 34 HZ3 LYS 34 19.600 6.311 -5.131 274 H GLU 35 H GLU 35 15.399 8.376 -1.674 275 HA GLU 35 HA GLU 35 16.821 7.712 0.721 276 HB2 GLU 35 HB3 GLU 35 15.747 10.341 -0.298 277 HB3 GLU 35 HB2 GLU 35 16.613 10.177 1.226 278 HG2 GLU 35 HG3 GLU 35 18.544 9.222 0.105 279 HG3 GLU 35 HG2 GLU 35 17.689 9.243 -1.439 280 H LEU 36 H LEU 36 13.498 8.823 0.138 281 HA LEU 36 HA LEU 36 12.856 8.938 2.885 282 HB2 LEU 36 HB3 LEU 36 10.972 9.772 2.233 283 HB3 LEU 36 HB2 LEU 36 11.522 9.753 0.575 284 HG LEU 36 HG LEU 36 10.564 7.241 0.675 285 HD11 LEU 36 HD11 LEU 36 8.633 8.561 2.579 286 HD12 LEU 36 HD12 LEU 36 10.050 7.736 3.217 287 HD13 LEU 36 HD13 LEU 36 8.889 6.848 2.263 288 HD21 LEU 36 HD21 LEU 36 8.499 8.036 -0.187 289 HD22 LEU 36 HD22 LEU 36 9.802 9.105 -0.738 290 HD23 LEU 36 HD23 LEU 36 8.711 9.632 0.553 291 H LEU 37 H LEU 37 12.481 6.395 0.499 292 HA LEU 37 HA LEU 37 10.964 4.726 2.112 293 HB2 LEU 37 HB3 LEU 37 11.202 4.305 -0.285 294 HB3 LEU 37 HB2 LEU 37 12.918 4.000 -0.099 295 HG LEU 37 HG LEU 37 11.383 1.954 -0.301 296 HD11 LEU 37 HD11 LEU 37 13.803 2.234 0.881 297 HD12 LEU 37 HD12 LEU 37 12.961 0.708 0.761 298 HD13 LEU 37 HD13 LEU 37 12.872 1.631 2.252 299 HD21 LEU 37 HD21 LEU 37 9.775 3.028 1.472 300 HD22 LEU 37 HD22 LEU 37 10.897 2.336 2.641 301 HD23 LEU 37 HD23 LEU 37 10.060 1.288 1.499 302 H GLN 38 H GLN 38 14.467 4.890 1.713 303 HA GLN 38 HA GLN 38 15.019 2.858 3.632 304 HB2 GLN 38 HB3 GLN 38 17.314 3.723 3.649 305 HB3 GLN 38 HB2 GLN 38 16.720 3.554 1.993 306 HG2 GLN 38 HG3 GLN 38 16.197 5.967 1.945 307 HG3 GLN 38 HG2 GLN 38 16.822 6.157 3.587 308 HE21 GLN 38 HE21 GLN 38 18.497 3.909 1.487 309 HE22 GLN 38 HE22 GLN 38 19.800 4.945 1.177 310 H THR 39 H THR 39 14.717 6.360 3.798 311 HA THR 39 HA THR 39 15.454 6.640 6.503 312 HB THR 39 HB THR 39 13.691 8.336 4.738 313 HG1 THR 39 HG2 THR 39 15.634 8.364 3.901 314 HG21 THR 39 HG21 THR 39 14.827 8.839 7.497 315 HG22 THR 39 HG22 THR 39 13.160 8.951 6.924 316 HG23 THR 39 HG23 THR 39 14.333 10.149 6.407 317 H GLU 40 H GLU 40 12.208 6.540 5.017 318 HA GLU 40 HA GLU 40 10.913 6.567 7.514 319 HB2 GLU 40 HB3 GLU 40 9.992 6.224 4.685 320 HB3 GLU 40 HB2 GLU 40 8.929 5.737 6.009 321 HG2 GLU 40 HG3 GLU 40 8.358 7.981 5.599 322 HG3 GLU 40 HG2 GLU 40 9.343 8.054 7.039 323 H LEU 41 H LEU 41 11.819 3.880 5.379 324 HA LEU 41 HA LEU 41 10.670 2.001 7.344 325 HB2 LEU 41 HB3 LEU 41 11.493 1.689 4.466 326 HB3 LEU 41 HB2 LEU 41 11.345 0.322 5.502 327 HG LEU 41 HG LEU 41 9.033 0.931 6.143 328 HD11 LEU 41 HD11 LEU 41 9.545 3.212 4.241 329 HD12 LEU 41 HD12 LEU 41 8.857 3.243 5.869 330 HD13 LEU 41 HD13 LEU 41 7.910 2.614 4.533 331 HD21 LEU 41 HD21 LEU 41 8.195 -0.224 4.377 332 HD22 LEU 41 HD22 LEU 41 9.866 -0.329 3.843 333 HD23 LEU 41 HD23 LEU 41 8.811 0.940 3.210 334 H SER 42 H SER 42 13.003 3.432 8.012 335 HA SER 42 HA SER 42 15.363 2.148 7.380 336 HB2 SER 42 HB3 SER 42 15.766 3.122 9.939 337 HB3 SER 42 HB2 SER 42 15.982 3.998 8.441 338 HG SER 42 HG SER 42 14.136 5.036 8.752 339 H GLY 43 H GLY 43 12.946 1.424 9.831 340 HA2 GLY 43 HA3 GLY 43 14.436 -0.543 11.234 341 HA3 GLY 43 HA2 GLY 43 12.688 -0.351 11.249 342 H PHE 44 H PHE 44 12.049 -0.730 8.620 343 HA PHE 44 HA PHE 44 12.202 -3.596 8.343 344 HB2 PHE 44 HB3 PHE 44 11.085 -1.420 6.591 345 HB3 PHE 44 HB2 PHE 44 11.246 -3.052 5.966 346 HD1 PHE 44 HD2 PHE 44 10.518 -4.849 7.975 347 HD2 PHE 44 HD1 PHE 44 8.918 -0.943 7.298 348 HE1 PHE 44 HE2 PHE 44 8.423 -5.530 9.092 349 HE2 PHE 44 HE1 PHE 44 6.803 -1.625 8.430 350 HZ PHE 44 HZ PHE 44 6.565 -3.914 9.316 351 H LEU 45 H LEU 45 13.688 -0.850 6.839 352 HA LEU 45 HA LEU 45 15.189 -2.213 4.918 353 HB2 LEU 45 HB3 LEU 45 14.882 0.131 4.742 354 HB3 LEU 45 HB2 LEU 45 15.574 0.424 6.321 355 HG LEU 45 HG LEU 45 17.673 -0.405 5.621 356 HD11 LEU 45 HD11 LEU 45 17.980 -0.693 2.999 357 HD12 LEU 45 HD12 LEU 45 16.225 -0.876 2.978 358 HD13 LEU 45 HD13 LEU 45 17.224 -2.013 3.887 359 HD21 LEU 45 HD21 LEU 45 16.935 2.021 5.205 360 HD22 LEU 45 HD22 LEU 45 16.845 1.572 3.497 361 HD23 LEU 45 HD23 LEU 45 18.382 1.487 4.349 362 H ASP 46 H ASP 46 15.954 -1.281 8.257 363 HA ASP 46 HA ASP 46 18.619 -2.042 8.381 364 HB2 ASP 46 HB3 ASP 46 17.172 -0.955 10.190 365 HB3 ASP 46 HB2 ASP 46 16.645 -2.578 10.569 366 H ALA 47 H ALA 47 15.732 -3.958 8.842 367 HA ALA 47 HA ALA 47 16.967 -6.391 9.583 368 HB1 ALA 47 HB1 ALA 47 14.715 -7.362 8.718 369 HB2 ALA 47 HB2 ALA 47 14.250 -5.673 8.550 370 HB3 ALA 47 HB3 ALA 47 14.712 -6.307 10.127 371 H GLN 48 H GLN 48 16.540 -4.927 6.455 372 HA GLN 48 HA GLN 48 17.773 -7.293 5.222 373 HB2 GLN 48 HB3 GLN 48 15.983 -6.706 3.248 374 HB3 GLN 48 HB2 GLN 48 15.732 -7.933 4.475 375 HG2 GLN 48 HG3 GLN 48 13.806 -6.824 4.807 376 HG3 GLN 48 HG2 GLN 48 14.747 -5.758 5.816 377 HE21 GLN 48 HE21 GLN 48 16.181 -4.538 3.418 378 HE22 GLN 48 HE22 GLN 48 15.003 -3.566 2.686 379 H LYS 49 H LYS 49 19.121 -4.992 5.764 380 HA LYS 49 HA LYS 49 19.150 -3.145 3.607 381 HB2 LYS 49 HB3 LYS 49 21.338 -3.872 5.569 382 HB3 LYS 49 HB2 LYS 49 21.476 -2.571 4.394 383 HG2 LYS 49 HG3 LYS 49 19.402 -1.521 5.355 384 HG3 LYS 49 HG2 LYS 49 19.381 -2.806 6.558 385 HD2 LYS 49 HD3 LYS 49 20.453 -1.092 7.708 386 HD3 LYS 49 HD2 LYS 49 21.798 -2.061 7.113 387 HE2 LYS 49 HE2 LYS 49 22.410 -0.491 5.484 388 HE3 LYS 49 HE1 LYS 49 20.790 0.177 5.366 389 HZ1 LYS 49 HZ1 LYS 49 22.268 1.690 6.471 390 HZ2 LYS 49 HZ2 LYS 49 22.670 0.555 7.646 391 HZ3 LYS 49 HZ3 LYS 49 21.088 1.182 7.562 392 H ASP 50 H ASP 50 20.822 -6.152 4.202 393 HA ASP 50 HA ASP 50 22.103 -6.015 1.538 394 HB2 ASP 50 HB3 ASP 50 23.197 -6.579 4.039 395 HB3 ASP 50 HB2 ASP 50 23.051 -8.150 3.291 396 H VAL 51 H VAL 51 19.366 -6.746 1.829 397 HA VAL 51 HA VAL 51 19.436 -9.628 1.149 398 HB VAL 51 HB VAL 51 17.230 -7.898 2.263 399 HG11 VAL 51 HG11 VAL 51 16.074 -10.289 2.306 400 HG12 VAL 51 HG12 VAL 51 17.105 -10.566 0.914 401 HG13 VAL 51 HG13 VAL 51 15.938 -9.234 0.905 402 HG21 VAL 51 HG21 VAL 51 18.550 -10.424 3.322 403 HG22 VAL 51 HG22 VAL 51 17.324 -9.486 4.156 404 HG23 VAL 51 HG23 VAL 51 18.922 -8.793 3.868 405 H ASP 52 H ASP 52 18.830 -10.225 -0.822 406 HA ASP 52 HA ASP 52 18.938 -8.460 -2.939 407 HB2 ASP 52 HB3 ASP 52 19.340 -10.828 -3.172 408 HB3 ASP 52 HB2 ASP 52 17.645 -11.165 -2.835 409 H ALA 53 H ALA 53 16.124 -9.635 -1.250 410 HA ALA 53 HA ALA 53 14.115 -8.942 -3.004 411 HB1 ALA 53 HB1 ALA 53 12.632 -8.652 -1.072 412 HB2 ALA 53 HB2 ALA 53 14.015 -8.606 0.008 413 HB3 ALA 53 HB3 ALA 53 13.632 -10.088 -0.886 414 H VAL 54 H VAL 54 15.836 -6.801 -0.734 415 HA VAL 54 HA VAL 54 14.230 -4.576 -1.335 416 HB VAL 54 HB VAL 54 15.660 -4.652 0.729 417 HG11 VAL 54 HG11 VAL 54 17.737 -5.324 0.543 418 HG12 VAL 54 HG12 VAL 54 18.114 -3.718 -0.029 419 HG13 VAL 54 HG13 VAL 54 17.862 -5.002 -1.184 420 HG21 VAL 54 HG21 VAL 54 14.913 -2.462 0.201 421 HG22 VAL 54 HG22 VAL 54 15.972 -2.346 -1.207 422 HG23 VAL 54 HG23 VAL 54 16.652 -2.295 0.415 423 H ASP 55 H ASP 55 17.166 -5.840 -2.833 424 HA ASP 55 HA ASP 55 17.597 -3.675 -4.654 425 HB2 ASP 55 HB3 ASP 55 19.232 -5.655 -4.238 426 HB3 ASP 55 HB2 ASP 55 18.123 -6.558 -5.292 427 H LYS 56 H LYS 56 15.785 -6.685 -4.762 428 HA LYS 56 HA LYS 56 14.938 -6.329 -7.455 429 HB2 LYS 56 HB3 LYS 56 13.730 -8.046 -5.280 430 HB3 LYS 56 HB2 LYS 56 13.303 -8.127 -6.982 431 HG2 LYS 56 HG3 LYS 56 16.047 -8.662 -5.801 432 HG3 LYS 56 HG2 LYS 56 14.942 -9.863 -6.473 433 HD2 LYS 56 HD3 LYS 56 15.052 -8.251 -8.591 434 HD3 LYS 56 HD2 LYS 56 16.570 -7.790 -7.876 435 HE2 LYS 56 HE2 LYS 56 15.799 -10.631 -8.637 436 HE3 LYS 56 HE1 LYS 56 16.995 -9.623 -9.425 437 HZ1 LYS 56 HZ1 LYS 56 17.151 -10.622 -6.606 438 HZ2 LYS 56 HZ2 LYS 56 18.212 -9.539 -7.254 439 HZ3 LYS 56 HZ3 LYS 56 18.114 -11.098 -7.900 440 H VAL 57 H VAL 57 13.279 -5.727 -4.379 441 HA VAL 57 HA VAL 57 10.898 -4.790 -5.576 442 HB VAL 57 HB VAL 57 12.074 -4.242 -2.841 443 HG11 VAL 57 HG11 VAL 57 9.781 -3.538 -2.243 444 HG12 VAL 57 HG12 VAL 57 9.308 -3.649 -3.941 445 HG13 VAL 57 HG13 VAL 57 10.508 -2.468 -3.432 446 HG21 VAL 57 HG21 VAL 57 9.915 -6.141 -3.844 447 HG22 VAL 57 HG22 VAL 57 10.351 -5.909 -2.156 448 HG23 VAL 57 HG23 VAL 57 11.513 -6.611 -3.273 449 H MET 58 H MET 58 13.751 -3.052 -4.347 450 HA MET 58 HA MET 58 12.789 -0.487 -5.015 451 HB2 MET 58 HB3 MET 58 14.918 0.329 -4.493 452 HB3 MET 58 HB2 MET 58 14.801 -1.112 -3.493 453 HG2 MET 58 HG3 MET 58 15.904 -2.319 -5.515 454 HG3 MET 58 HG2 MET 58 16.394 -0.707 -6.033 455 HE1 MET 58 HE1 MET 58 18.824 0.172 -5.190 456 HE2 MET 58 HE2 MET 58 18.716 0.632 -3.495 457 HE3 MET 58 HE3 MET 58 17.356 0.956 -4.578 458 H LYS 59 H LYS 59 14.230 -2.993 -6.870 459 HA LYS 59 HA LYS 59 15.183 -1.538 -9.056 460 HB2 LYS 59 HB3 LYS 59 15.262 -4.201 -8.486 461 HB3 LYS 59 HB2 LYS 59 13.864 -4.151 -9.479 462 HG2 LYS 59 HG3 LYS 59 15.823 -4.587 -10.871 463 HG3 LYS 59 HG2 LYS 59 15.020 -3.105 -11.329 464 HD2 LYS 59 HD3 LYS 59 17.641 -3.078 -11.094 465 HD3 LYS 59 HD2 LYS 59 16.722 -1.724 -10.467 466 HE2 LYS 59 HE2 LYS 59 18.570 -2.711 -8.963 467 HE3 LYS 59 HE1 LYS 59 17.025 -2.427 -8.206 468 HZ1 LYS 59 HZ1 LYS 59 18.378 -4.826 -8.286 469 HZ2 LYS 59 HZ2 LYS 59 17.102 -5.026 -9.388 470 HZ3 LYS 59 HZ3 LYS 59 16.812 -4.509 -7.768 471 H GLU 60 H GLU 60 11.974 -3.004 -8.517 472 HA GLU 60 HA GLU 60 10.948 -2.250 -11.025 473 HB2 GLU 60 HB3 GLU 60 9.845 -3.915 -9.536 474 HB3 GLU 60 HB2 GLU 60 9.382 -2.610 -8.445 475 HG2 GLU 60 HG3 GLU 60 8.055 -1.542 -10.169 476 HG3 GLU 60 HG2 GLU 60 8.599 -2.694 -11.379 477 H LEU 61 H LEU 61 11.029 -0.637 -7.932 478 HA LEU 61 HA LEU 61 9.626 1.706 -8.738 479 HB2 LEU 61 HB3 LEU 61 11.573 1.100 -6.521 480 HB3 LEU 61 HB2 LEU 61 11.109 2.759 -6.848 481 HG LEU 61 HG LEU 61 9.715 1.514 -5.101 482 HD11 LEU 61 HD11 LEU 61 8.994 3.607 -6.188 483 HD12 LEU 61 HD12 LEU 61 7.642 2.533 -5.807 484 HD13 LEU 61 HD13 LEU 61 8.202 2.667 -7.461 485 HD21 LEU 61 HD21 LEU 61 8.543 0.174 -7.587 486 HD22 LEU 61 HD22 LEU 61 7.937 0.049 -5.952 487 HD23 LEU 61 HD23 LEU 61 9.506 -0.631 -6.346 488 H ASP 62 H ASP 62 13.017 0.729 -8.798 489 HA ASP 62 HA ASP 62 14.048 3.171 -9.863 490 HB2 ASP 62 HB3 ASP 62 15.418 1.258 -8.799 491 HB3 ASP 62 HB2 ASP 62 15.235 0.446 -10.345 492 H GLU 63 H GLU 63 12.969 0.170 -11.343 493 HA GLU 63 HA GLU 63 13.402 0.897 -14.085 494 HB2 GLU 63 HB3 GLU 63 11.374 -0.949 -12.783 495 HB3 GLU 63 HB2 GLU 63 11.634 -0.806 -14.511 496 HG2 GLU 63 HG3 GLU 63 13.836 -1.531 -12.571 497 HG3 GLU 63 HG2 GLU 63 12.851 -2.710 -13.437 498 H ASN 64 H ASN 64 10.738 1.218 -11.852 499 HA ASN 64 HA ASN 64 9.177 2.698 -13.767 500 HB2 ASN 64 HB3 ASN 64 8.405 1.168 -11.739 501 HB3 ASN 64 HB2 ASN 64 8.472 2.711 -10.873 502 HD21 ASN 64 HD21 ASN 64 5.976 1.360 -11.417 503 HD22 ASN 64 HD22 ASN 64 5.090 2.327 -12.494 504 H GLY 65 H GLY 65 11.917 3.534 -12.545 505 HA2 GLY 65 HA3 GLY 65 11.262 6.090 -11.345 506 HA3 GLY 65 HA2 GLY 65 12.893 5.484 -11.732 507 H ASP 66 H ASP 66 10.192 5.485 -13.902 508 HA ASP 66 HA ASP 66 11.517 6.611 -16.085 509 HB2 ASP 66 HB3 ASP 66 9.483 5.203 -16.080 510 HB3 ASP 66 HB2 ASP 66 8.542 6.591 -15.543 511 H GLY 67 H GLY 67 9.399 8.034 -13.656 512 HA2 GLY 67 HA3 GLY 67 10.444 10.713 -14.305 513 HA3 GLY 67 HA2 GLY 67 8.711 10.459 -14.367 514 H GLU 68 H GLU 68 7.676 9.588 -12.443 515 HA GLU 68 HA GLU 68 8.950 10.514 -9.914 516 HB2 GLU 68 HB3 GLU 68 6.029 10.560 -10.618 517 HB3 GLU 68 HB2 GLU 68 6.719 11.246 -9.183 518 HG2 GLU 68 HG3 GLU 68 6.687 13.178 -10.415 519 HG3 GLU 68 HG2 GLU 68 8.202 12.546 -11.055 520 H VAL 69 H VAL 69 7.343 9.653 -8.082 521 HA VAL 69 HA VAL 69 6.478 6.949 -8.643 522 HB VAL 69 HB VAL 69 8.472 6.491 -7.394 523 HG11 VAL 69 HG11 VAL 69 8.761 7.691 -5.119 524 HG12 VAL 69 HG12 VAL 69 7.648 8.867 -5.778 525 HG13 VAL 69 HG13 VAL 69 9.196 8.608 -6.568 526 HG21 VAL 69 HG21 VAL 69 7.452 6.099 -4.951 527 HG22 VAL 69 HG22 VAL 69 7.021 5.096 -6.308 528 HG23 VAL 69 HG23 VAL 69 5.933 6.386 -5.791 529 H ASP 70 H ASP 70 4.433 6.720 -8.063 530 HA ASP 70 HA ASP 70 3.230 8.991 -6.661 531 HB2 ASP 70 HB3 ASP 70 2.047 8.749 -8.590 532 HB3 ASP 70 HB2 ASP 70 2.224 7.012 -8.643 533 H PHE 71 H PHE 71 1.168 8.232 -5.421 534 HA PHE 71 HA PHE 71 2.103 7.043 -3.083 535 HB2 PHE 71 HB3 PHE 71 0.065 8.504 -3.338 536 HB3 PHE 71 HB2 PHE 71 -0.781 7.096 -3.977 537 HD1 PHE 71 HD1 PHE 71 1.316 8.149 -1.079 538 HD2 PHE 71 HD2 PHE 71 -1.892 5.604 -2.412 539 HE1 PHE 71 HE1 PHE 71 0.919 7.419 1.239 540 HE2 PHE 71 HE2 PHE 71 -2.275 4.903 -0.044 541 HZ PHE 71 HZ PHE 71 -0.891 5.790 1.741 542 H GLN 72 H GLN 72 0.300 5.773 -5.843 543 HA GLN 72 HA GLN 72 -0.102 3.170 -4.851 544 HB2 GLN 72 HB3 GLN 72 0.019 4.276 -7.653 545 HB3 GLN 72 HB2 GLN 72 -0.382 2.579 -7.312 546 HG2 GLN 72 HG3 GLN 72 -2.270 3.353 -5.909 547 HG3 GLN 72 HG2 GLN 72 -1.814 5.024 -6.256 548 HE21 GLN 72 HE21 GLN 72 -4.275 4.809 -7.103 549 HE22 GLN 72 HE22 GLN 72 -4.416 4.412 -8.735 550 H GLU 73 H GLU 73 2.625 4.573 -6.699 551 HA GLU 73 HA GLU 73 4.090 2.066 -6.805 552 HB2 GLU 73 HB3 GLU 73 5.067 4.926 -7.044 553 HB3 GLU 73 HB2 GLU 73 6.104 3.503 -7.196 554 HG2 GLU 73 HG3 GLU 73 4.742 2.753 -9.123 555 HG3 GLU 73 HG2 GLU 73 3.749 4.209 -8.981 556 H TYR 74 H TYR 74 3.946 4.843 -4.696 557 HA TYR 74 HA TYR 74 6.099 4.223 -3.047 558 HB2 TYR 74 HB3 TYR 74 5.151 6.438 -3.054 559 HB3 TYR 74 HB2 TYR 74 3.606 5.797 -2.504 560 HD1 TYR 74 HD1 TYR 74 7.147 5.246 -1.343 561 HD2 TYR 74 HD2 TYR 74 3.160 6.505 -0.333 562 HE1 TYR 74 HE1 TYR 74 7.833 5.548 0.997 563 HE2 TYR 74 HE2 TYR 74 3.846 6.816 2.010 564 HH TYR 74 HH TYR 74 6.993 6.992 3.015 565 H VAL 75 H VAL 75 2.667 3.390 -2.603 566 HA VAL 75 HA VAL 75 3.099 2.219 -0.089 567 HB VAL 75 HB VAL 75 0.864 1.112 -0.434 568 HG11 VAL 75 HG11 VAL 75 -0.331 3.240 -0.238 569 HG12 VAL 75 HG12 VAL 75 1.024 4.105 -0.954 570 HG13 VAL 75 HG13 VAL 75 1.196 3.346 0.625 571 HG21 VAL 75 HG21 VAL 75 1.404 1.752 -3.173 572 HG22 VAL 75 HG22 VAL 75 0.116 2.804 -2.681 573 HG23 VAL 75 HG23 VAL 75 -0.062 1.053 -2.510 574 H VAL 76 H VAL 76 3.109 0.825 -3.338 575 HA VAL 76 HA VAL 76 3.278 -1.844 -2.471 576 HB VAL 76 HB VAL 76 4.039 -2.352 -4.722 577 HG11 VAL 76 HG11 VAL 76 2.026 -1.693 -5.854 578 HG12 VAL 76 HG12 VAL 76 1.831 -0.277 -4.841 579 HG13 VAL 76 HG13 VAL 76 1.612 -1.889 -4.157 580 HG21 VAL 76 HG21 VAL 76 4.371 -0.611 -6.374 581 HG22 VAL 76 HG22 VAL 76 5.462 -0.312 -5.041 582 HG23 VAL 76 HG23 VAL 76 3.966 0.634 -5.207 583 H LEU 77 H LEU 77 5.703 0.615 -3.145 584 HA LEU 77 HA LEU 77 7.976 -1.041 -3.021 585 HB2 LEU 77 HB3 LEU 77 8.083 1.246 -3.828 586 HB3 LEU 77 HB2 LEU 77 7.620 1.859 -2.249 587 HG LEU 77 HG LEU 77 9.675 0.887 -1.244 588 HD11 LEU 77 HD11 LEU 77 11.392 0.356 -3.306 589 HD12 LEU 77 HD12 LEU 77 9.896 -0.386 -3.883 590 HD13 LEU 77 HD13 LEU 77 10.566 -0.828 -2.310 591 HD21 LEU 77 HD21 LEU 77 9.995 3.120 -1.810 592 HD22 LEU 77 HD22 LEU 77 9.896 2.820 -3.539 593 HD23 LEU 77 HD23 LEU 77 11.339 2.336 -2.631 594 H VAL 78 H VAL 78 6.350 0.886 -0.506 595 HA VAL 78 HA VAL 78 8.035 -0.128 1.539 596 HB VAL 78 HB VAL 78 6.585 1.010 3.109 597 HG11 VAL 78 HG11 VAL 78 7.382 3.012 2.415 598 HG12 VAL 78 HG12 VAL 78 6.258 3.048 1.065 599 HG13 VAL 78 HG13 VAL 78 7.807 2.253 0.883 600 HG21 VAL 78 HG21 VAL 78 4.462 2.063 2.317 601 HG22 VAL 78 HG22 VAL 78 4.381 0.320 2.240 602 HG23 VAL 78 HG23 VAL 78 4.695 1.273 0.767 603 H ALA 79 H ALA 79 4.819 -0.998 0.359 604 HA ALA 79 HA ALA 79 4.286 -2.961 2.297 605 HB1 ALA 79 HB1 ALA 79 2.614 -2.012 0.724 606 HB2 ALA 79 HB2 ALA 79 2.591 -3.781 0.822 607 HB3 ALA 79 HB3 ALA 79 3.345 -2.982 -0.560 608 H ALA 80 H ALA 80 5.755 -3.239 -0.943 609 HA ALA 80 HA ALA 80 6.070 -6.013 -0.925 610 HB1 ALA 80 HB1 ALA 80 8.032 -5.495 -2.494 611 HB2 ALA 80 HB2 ALA 80 7.587 -3.795 -2.277 612 HB3 ALA 80 HB3 ALA 80 6.439 -4.920 -2.984 613 H LEU 81 H LEU 81 8.247 -3.439 0.174 614 HA LEU 81 HA LEU 81 10.288 -5.161 1.153 615 HB2 LEU 81 HB3 LEU 81 9.502 -2.345 1.927 616 HB3 LEU 81 HB2 LEU 81 10.925 -3.177 2.552 617 HG LEU 81 HG LEU 81 10.377 -2.716 -0.400 618 HD11 LEU 81 HD11 LEU 81 12.268 -1.086 -0.198 619 HD12 LEU 81 HD12 LEU 81 12.092 -1.205 1.556 620 HD13 LEU 81 HD13 LEU 81 10.763 -0.586 0.570 621 HD21 LEU 81 HD21 LEU 81 12.921 -3.200 -0.419 622 HD22 LEU 81 HD22 LEU 81 11.847 -4.573 -0.248 623 HD23 LEU 81 HD23 LEU 81 12.675 -3.911 1.174 624 H THR 82 H THR 82 7.405 -3.717 2.606 625 HA THR 82 HA THR 82 7.864 -4.520 5.240 626 HB THR 82 HB THR 82 5.224 -4.165 3.797 627 HG1 THR 82 HG2 THR 82 6.612 -2.352 3.782 628 HG21 THR 82 HG21 THR 82 4.994 -5.394 5.905 629 HG22 THR 82 HG22 THR 82 4.276 -3.809 6.052 630 HG23 THR 82 HG23 THR 82 5.855 -4.133 6.763 631 H VAL 83 H VAL 83 5.964 -6.147 2.678 632 HA VAL 83 HA VAL 83 5.400 -8.405 4.296 633 HB VAL 83 HB VAL 83 4.058 -7.866 2.314 634 HG11 VAL 83 HG11 VAL 83 5.916 -7.157 0.812 635 HG12 VAL 83 HG12 VAL 83 4.872 -8.352 0.050 636 HG13 VAL 83 HG13 VAL 83 6.429 -8.837 0.677 637 HG21 VAL 83 HG21 VAL 83 3.990 -10.158 3.162 638 HG22 VAL 83 HG22 VAL 83 5.389 -10.595 2.179 639 HG23 VAL 83 HG23 VAL 83 3.866 -10.171 1.407 640 H ALA 84 H ALA 84 7.964 -7.726 1.965 641 HA ALA 84 HA ALA 84 9.199 -10.241 2.042 642 HB1 ALA 84 HB1 ALA 84 9.764 -8.230 0.529 643 HB2 ALA 84 HB2 ALA 84 11.107 -9.212 1.113 644 HB3 ALA 84 HB3 ALA 84 10.761 -7.661 1.871 645 H MET 85 H MET 85 9.769 -7.344 4.034 646 HA MET 85 HA MET 85 11.640 -8.610 5.740 647 HB2 MET 85 HB3 MET 85 11.003 -6.040 5.401 648 HB3 MET 85 HB2 MET 85 9.998 -6.379 6.804 649 HG2 MET 85 HG3 MET 85 12.824 -7.379 6.946 650 HG3 MET 85 HG2 MET 85 12.575 -5.651 7.002 651 HE1 MET 85 HE1 MET 85 12.684 -8.801 8.443 652 HE2 MET 85 HE2 MET 85 11.570 -8.930 9.792 653 HE3 MET 85 HE3 MET 85 13.110 -8.147 10.034 654 H ASN 86 H ASN 86 8.148 -8.004 6.001 655 HA ASN 86 HA ASN 86 7.912 -9.071 8.589 656 HB2 ASN 86 HB3 ASN 86 5.912 -8.440 6.458 657 HB3 ASN 86 HB2 ASN 86 5.410 -9.382 7.855 658 HD21 ASN 86 HD21 ASN 86 6.436 -8.310 10.087 659 HD22 ASN 86 HD22 ASN 86 6.181 -6.639 10.150 660 H ASN 87 H ASN 87 8.232 -10.613 5.577 661 HA ASN 87 HA ASN 87 7.082 -13.149 6.119 662 HB2 ASN 87 HB3 ASN 87 8.003 -12.507 3.903 663 HB3 ASN 87 HB2 ASN 87 9.617 -12.478 4.611 664 HD21 ASN 87 HD21 ASN 87 10.718 -14.359 3.983 665 HD22 ASN 87 HD22 ASN 87 10.001 -15.894 3.961 666 H PHE 88 H PHE 88 10.146 -11.645 6.929 667 HA PHE 88 HA PHE 88 11.340 -13.870 8.188 668 HB2 PHE 88 HB3 PHE 88 11.834 -10.900 8.525 669 HB3 PHE 88 HB2 PHE 88 12.770 -12.152 9.313 670 HD1 PHE 88 HD1 PHE 88 13.990 -13.882 7.943 671 HD2 PHE 88 HD2 PHE 88 12.186 -10.407 6.207 672 HE1 PHE 88 HE1 PHE 88 15.355 -14.196 5.900 673 HE2 PHE 88 HE2 PHE 88 13.555 -10.717 4.157 674 HZ PHE 88 HZ PHE 88 15.142 -12.618 4.009 675 H PHE 89 H PHE 89 9.113 -11.389 9.349 676 HA PHE 89 HA PHE 89 9.430 -11.773 12.125 677 HB2 PHE 89 HB3 PHE 89 7.138 -10.848 10.418 678 HB3 PHE 89 HB2 PHE 89 6.786 -11.315 12.053 679 HD1 PHE 89 HD2 PHE 89 9.172 -9.148 10.090 680 HD2 PHE 89 HD1 PHE 89 7.083 -9.801 13.802 681 HE1 PHE 89 HE2 PHE 89 9.960 -6.973 10.921 682 HE2 PHE 89 HE1 PHE 89 7.881 -7.613 14.622 683 HZ PHE 89 HZ PHE 89 9.324 -6.194 13.175 684 H TRP 90 H TRP 90 7.286 -13.416 9.856 685 HA TRP 90 HA TRP 90 6.351 -15.306 11.836 686 HB2 TRP 90 HB3 TRP 90 6.050 -15.583 8.850 687 HB3 TRP 90 HB2 TRP 90 5.009 -16.194 10.135 688 HD1 TRP 90 HD TRP 90 5.596 -13.174 8.036 689 HE1 TRP 90 HE1 TRP 90 3.990 -11.300 8.716 690 HE3 TRP 90 HE3 TRP 90 3.695 -15.172 12.319 691 HZ2 TRP 90 HZ2 TRP 90 2.111 -10.714 10.819 692 HZ3 TRP 90 HZ3 TRP 90 2.003 -13.941 13.639 693 HH2 TRP 90 HH TRP 90 1.212 -11.715 12.890 694 H GLU 91 H GLU 91 8.541 -15.455 9.079 695 HA GLU 91 HA GLU 91 9.140 -18.190 9.523 696 HB2 GLU 91 HB3 GLU 91 10.533 -16.098 7.913 697 HB3 GLU 91 HB2 GLU 91 11.116 -17.761 7.980 698 HG2 GLU 91 HG3 GLU 91 8.813 -18.510 7.226 699 HG3 GLU 91 HG2 GLU 91 8.385 -16.823 7.045 700 H ASN 92 H ASN 92 10.683 -15.246 10.719 701 HA ASN 92 HA ASN 92 13.086 -16.300 11.632 702 HB2 ASN 92 HB3 ASN 92 12.519 -13.896 11.813 703 HB3 ASN 92 HB2 ASN 92 11.353 -14.265 13.083 704 HD21 ASN 92 HD21 ASN 92 12.462 -13.197 14.814 705 HD22 ASN 92 HD22 ASN 92 13.988 -13.672 15.356 706 H SER 93 H SER 93 13.250 -18.189 12.626 707 HA SER 93 HA SER 93 11.652 -18.689 15.037 708 HB2 SER 93 HB3 SER 93 10.591 -19.643 12.920 709 HB3 SER 93 HB2 SER 93 11.966 -20.705 12.814 710 HG SER 93 HG SER 93 11.480 -21.394 14.958 711 H1 GLY 1 H GLY 1 11.236 1.231 14.797 712 HA2 GLY 1 HA3 GLY 1 11.554 1.481 12.276 713 HA3 GLY 1 HA2 GLY 1 10.060 0.569 12.173 714 H SER 2 H SER 2 10.043 2.923 10.991 715 HA SER 2 HA SER 2 9.153 5.098 12.661 716 HB2 SER 2 HB3 SER 2 8.671 4.751 9.701 717 HB3 SER 2 HB2 SER 2 8.787 6.257 10.574 718 HG SER 2 HG SER 2 10.653 4.673 9.489 719 H GLU 3 H GLU 3 6.928 6.078 12.329 720 HA GLU 3 HA GLU 3 4.929 4.273 13.107 721 HB2 GLU 3 HB3 GLU 3 4.665 7.008 11.839 722 HB3 GLU 3 HB2 GLU 3 3.348 6.087 12.519 723 HG2 GLU 3 HG3 GLU 3 4.447 6.039 14.722 724 HG3 GLU 3 HG2 GLU 3 5.809 6.948 14.068 725 H LEU 4 H LEU 4 5.988 5.413 9.990 726 HA LEU 4 HA LEU 4 3.840 4.431 8.386 727 HB2 LEU 4 HB3 LEU 4 6.812 4.620 7.719 728 HB3 LEU 4 HB2 LEU 4 5.516 4.317 6.595 729 HG LEU 4 HG LEU 4 5.588 6.566 6.261 730 HD11 LEU 4 HD11 LEU 4 4.072 6.621 8.887 731 HD12 LEU 4 HD12 LEU 4 3.367 6.254 7.291 732 HD13 LEU 4 HD13 LEU 4 4.043 7.828 7.621 733 HD21 LEU 4 HD21 LEU 4 7.191 7.703 7.333 734 HD22 LEU 4 HD22 LEU 4 7.282 6.513 8.623 735 HD23 LEU 4 HD23 LEU 4 6.148 7.852 8.724 736 H GLU 5 H GLU 5 6.798 2.986 9.658 737 HA GLU 5 HA GLU 5 6.428 0.483 8.438 738 HB2 GLU 5 HB3 GLU 5 7.934 1.194 10.994 739 HB3 GLU 5 HB2 GLU 5 8.010 -0.328 10.127 740 HG2 GLU 5 HG3 GLU 5 8.832 0.796 8.111 741 HG3 GLU 5 HG2 GLU 5 8.751 2.343 8.927 742 H THR 6 H THR 6 5.459 1.893 11.545 743 HA THR 6 HA THR 6 4.181 -0.401 12.637 744 HB THR 6 HB THR 6 3.259 2.459 13.054 745 HG1 THR 6 HG2 THR 6 5.663 1.221 13.742 746 HG21 THR 6 HG21 THR 6 1.933 0.596 14.071 747 HG22 THR 6 HG22 THR 6 2.662 1.650 15.265 748 HG23 THR 6 HG23 THR 6 3.376 0.077 14.937 749 H ALA 7 H ALA 7 3.053 2.268 10.598 750 HA ALA 7 HA ALA 7 0.359 1.486 10.379 751 HB1 ALA 7 HB1 ALA 7 0.700 2.680 8.010 752 HB2 ALA 7 HB2 ALA 7 2.191 3.201 8.780 753 HB3 ALA 7 HB3 ALA 7 0.642 3.605 9.512 754 H MET 8 H MET 8 3.195 0.701 8.392 755 HA MET 8 HA MET 8 1.768 -0.973 6.600 756 HB2 MET 8 HB3 MET 8 4.709 -0.977 7.323 757 HB3 MET 8 HB2 MET 8 4.006 -1.884 5.992 758 HG2 MET 8 HG3 MET 8 3.982 1.143 6.296 759 HG3 MET 8 HG2 MET 8 4.892 0.209 5.124 760 HE1 MET 8 HE1 MET 8 2.800 -1.004 2.595 761 HE2 MET 8 HE2 MET 8 2.255 -1.997 3.938 762 HE3 MET 8 HE3 MET 8 3.957 -1.521 3.844 763 H GLU 9 H GLU 9 3.439 -1.575 9.659 764 HA GLU 9 HA GLU 9 3.012 -4.361 9.651 765 HB2 GLU 9 HB3 GLU 9 3.367 -2.417 11.944 766 HB3 GLU 9 HB2 GLU 9 3.151 -4.147 12.181 767 HG2 GLU 9 HG3 GLU 9 5.176 -4.595 10.831 768 HG3 GLU 9 HG2 GLU 9 5.360 -2.863 10.550 769 H THR 10 H THR 10 1.109 -1.579 10.632 770 HA THR 10 HA THR 10 -1.000 -2.936 11.910 771 HB THR 10 HB THR 10 -1.383 -0.431 10.230 772 HG1 THR 10 HG2 THR 10 0.516 -0.605 11.928 773 HG21 THR 10 HG21 THR 10 -3.277 -1.721 11.508 774 HG22 THR 10 HG22 THR 10 -3.161 0.030 11.660 775 HG23 THR 10 HG23 THR 10 -2.550 -0.998 12.940 776 H LEU 11 H LEU 11 -0.437 -2.075 8.512 777 HA LEU 11 HA LEU 11 -2.800 -3.297 7.469 778 HB2 LEU 11 HB3 LEU 11 -0.119 -2.723 6.190 779 HB3 LEU 11 HB2 LEU 11 -1.497 -3.364 5.295 780 HG LEU 11 HG LEU 11 -1.481 -0.738 6.826 781 HD11 LEU 11 HD11 LEU 11 -1.303 0.366 4.730 782 HD12 LEU 11 HD12 LEU 11 -1.458 -1.148 3.843 783 HD13 LEU 11 HD13 LEU 11 -0.002 -0.822 4.778 784 HD21 LEU 11 HD21 LEU 11 -3.563 -0.393 5.373 785 HD22 LEU 11 HD22 LEU 11 -3.764 -1.525 6.692 786 HD23 LEU 11 HD23 LEU 11 -3.525 -2.118 5.041 787 H ILE 12 H ILE 12 0.494 -4.457 8.060 788 HA ILE 12 HA ILE 12 0.188 -7.046 6.958 789 HB ILE 12 HB ILE 12 1.950 -6.023 9.196 790 HG12 ILE 12 HG13 ILE 12 2.279 -5.154 6.793 791 HG13 ILE 12 HG12 ILE 12 3.682 -5.881 7.552 792 HG21 ILE 12 HG21 ILE 12 1.909 -8.739 7.898 793 HG22 ILE 12 HG22 ILE 12 1.834 -8.333 9.614 794 HG23 ILE 12 HG23 ILE 12 3.321 -8.080 8.718 795 HD11 ILE 12 HD11 ILE 12 3.527 -7.838 6.287 796 HD12 ILE 12 HD12 ILE 12 3.119 -6.579 5.145 797 HD13 ILE 12 HD13 ILE 12 1.837 -7.572 5.836 798 H ASN 13 H ASN 13 -0.328 -5.795 10.204 799 HA ASN 13 HA ASN 13 -0.959 -8.244 11.443 800 HB2 ASN 13 HB3 ASN 13 -1.638 -5.385 12.062 801 HB3 ASN 13 HB2 ASN 13 -2.305 -6.689 13.026 802 HD21 ASN 13 HD21 ASN 13 0.728 -5.168 12.056 803 HD22 ASN 13 HD22 ASN 13 1.681 -5.854 13.285 804 H VAL 14 H VAL 14 -3.030 -5.844 9.853 805 HA VAL 14 HA VAL 14 -5.439 -7.325 10.263 806 HB VAL 14 HB VAL 14 -4.706 -5.143 8.296 807 HG11 VAL 14 HG11 VAL 14 -7.201 -4.995 7.958 808 HG12 VAL 14 HG12 VAL 14 -7.346 -6.553 8.755 809 HG13 VAL 14 HG13 VAL 14 -6.455 -6.418 7.231 810 HG21 VAL 14 HG21 VAL 14 -6.384 -3.917 9.792 811 HG22 VAL 14 HG22 VAL 14 -4.846 -4.305 10.558 812 HG23 VAL 14 HG23 VAL 14 -6.271 -5.275 10.898 813 H PHE 15 H PHE 15 -3.183 -7.061 7.548 814 HA PHE 15 HA PHE 15 -4.515 -8.778 5.770 815 HB2 PHE 15 HB3 PHE 15 -2.634 -7.326 5.154 816 HB3 PHE 15 HB2 PHE 15 -1.538 -8.333 6.085 817 HD1 PHE 15 HD2 PHE 15 -1.050 -10.699 5.338 818 HD2 PHE 15 HD1 PHE 15 -3.511 -8.039 3.021 819 HE1 PHE 15 HE2 PHE 15 -0.803 -12.164 3.420 820 HE2 PHE 15 HE1 PHE 15 -3.252 -9.551 1.066 821 HZ PHE 15 HZ PHE 15 -1.899 -11.617 1.278 822 H HIS 16 H HIS 16 -1.960 -9.473 8.132 823 HA HIS 16 HA HIS 16 -1.880 -12.239 7.543 824 HB2 HIS 16 HB3 HIS 16 -0.777 -10.638 9.863 825 HB3 HIS 16 HB2 HIS 16 -0.551 -12.382 9.700 826 HD1 HIS 16 HD1 HIS 16 1.848 -12.623 8.883 827 HD2 HIS 16 HD2 HIS 16 -0.259 -9.714 6.773 828 HE1 HIS 16 HE1 HIS 16 3.321 -11.923 6.918 829 HE2 HIS 16 HE2 HIS 16 2.031 -10.186 5.611 830 H ALA 17 H ALA 17 -3.736 -10.390 9.872 831 HA ALA 17 HA ALA 17 -4.615 -12.568 11.440 832 HB1 ALA 17 HB1 ALA 17 -6.653 -11.050 11.869 833 HB2 ALA 17 HB2 ALA 17 -5.820 -9.860 10.874 834 HB3 ALA 17 HB3 ALA 17 -5.067 -10.467 12.357 835 H HIS 18 H HIS 18 -6.002 -11.091 8.550 836 HA HIS 18 HA HIS 18 -8.263 -12.801 8.419 837 HB2 HIS 18 HB3 HIS 18 -6.924 -11.098 6.313 838 HB3 HIS 18 HB2 HIS 18 -8.352 -12.076 5.984 839 HD1 HIS 18 HD1 HIS 18 -10.595 -11.477 7.361 840 HD2 HIS 18 HD2 HIS 18 -7.457 -8.727 7.781 841 HE1 HIS 18 HE1 HIS 18 -11.543 -9.405 8.472 842 HE2 HIS 18 HE2 HIS 18 -9.649 -7.752 8.737 843 H SER 19 H SER 19 -4.969 -13.129 7.340 844 HA SER 19 HA SER 19 -5.147 -15.027 5.376 845 HB2 SER 19 HB3 SER 19 -3.096 -15.087 7.590 846 HB3 SER 19 HB2 SER 19 -3.002 -15.700 5.930 847 HG SER 19 HG SER 19 -3.391 -13.465 5.317 848 H GLY 20 H GLY 20 -5.657 -15.487 8.800 849 HA2 GLY 20 HA3 GLY 20 -5.411 -18.243 8.945 850 HA3 GLY 20 HA2 GLY 20 -6.521 -17.313 9.956 851 H LYS 21 H LYS 21 -7.970 -16.268 7.612 852 HA LYS 21 HA LYS 21 -9.911 -18.327 7.323 853 HB2 LYS 21 HB3 LYS 21 -9.477 -15.707 5.851 854 HB3 LYS 21 HB2 LYS 21 -10.795 -16.806 5.488 855 HG2 LYS 21 HG3 LYS 21 -11.839 -15.428 7.040 856 HG3 LYS 21 HG2 LYS 21 -11.275 -16.685 8.100 857 HD2 LYS 21 HD3 LYS 21 -9.220 -15.313 8.556 858 HD3 LYS 21 HD2 LYS 21 -9.945 -13.982 7.660 859 HE2 LYS 21 HE2 LYS 21 -11.132 -15.370 10.071 860 HE3 LYS 21 HE1 LYS 21 -10.361 -13.785 10.106 861 HZ1 LYS 21 HZ1 LYS 21 -12.967 -14.589 9.015 862 HZ2 LYS 21 HZ2 LYS 21 -12.165 -13.271 8.269 863 HZ3 LYS 21 HZ3 LYS 21 -12.544 -13.238 9.919 864 H GLU 22 H GLU 22 -7.335 -17.094 5.245 865 HA GLU 22 HA GLU 22 -7.814 -18.927 3.086 866 HB2 GLU 22 HB3 GLU 22 -6.720 -16.751 2.793 867 HB3 GLU 22 HB2 GLU 22 -5.372 -17.291 3.743 868 HG2 GLU 22 HG3 GLU 22 -4.881 -19.110 2.120 869 HG3 GLU 22 HG2 GLU 22 -6.277 -18.636 1.168 870 H GLY 23 H GLY 23 -5.509 -18.797 5.760 871 HA2 GLY 23 HA3 GLY 23 -4.517 -20.532 6.933 872 HA3 GLY 23 HA2 GLY 23 -5.386 -21.673 5.914 873 H ASP 24 H ASP 24 -3.834 -19.741 3.747 874 HA ASP 24 HA ASP 24 -1.907 -21.663 2.944 875 HB2 ASP 24 HB3 ASP 24 -2.740 -19.801 1.463 876 HB3 ASP 24 HB2 ASP 24 -1.900 -18.667 2.483 877 H LYS 25 H LYS 25 -1.607 -18.661 4.645 878 HA LYS 25 HA LYS 25 -0.236 -19.172 6.786 879 HB2 LYS 25 HB3 LYS 25 2.192 -18.688 6.351 880 HB3 LYS 25 HB2 LYS 25 1.665 -20.181 5.646 881 HG2 LYS 25 HG3 LYS 25 1.496 -19.204 3.445 882 HG3 LYS 25 HG2 LYS 25 1.883 -17.593 3.998 883 HD2 LYS 25 HD3 LYS 25 4.056 -18.556 4.930 884 HD3 LYS 25 HD2 LYS 25 3.653 -20.042 4.094 885 HE2 LYS 25 HE2 LYS 25 3.699 -18.942 1.942 886 HE3 LYS 25 HE1 LYS 25 3.883 -17.366 2.698 887 HZ1 LYS 25 HZ1 LYS 25 6.060 -17.868 3.413 888 HZ2 LYS 25 HZ2 LYS 25 6.026 -18.585 1.878 889 HZ3 LYS 25 HZ3 LYS 25 5.840 -19.513 3.248 890 H TYR 26 H TYR 26 1.824 -16.788 5.781 891 HA TYR 26 HA TYR 26 -0.089 -14.769 6.521 892 HB2 TYR 26 HB3 TYR 26 1.913 -13.293 5.558 893 HB3 TYR 26 HB2 TYR 26 1.965 -14.019 7.167 894 HD1 TYR 26 HD1 TYR 26 3.294 -15.984 7.603 895 HD2 TYR 26 HD2 TYR 26 3.280 -14.181 3.729 896 HE1 TYR 26 HE1 TYR 26 5.345 -17.304 6.973 897 HE2 TYR 26 HE2 TYR 26 5.264 -15.458 3.089 898 HH TYR 26 HH TYR 26 7.313 -16.612 4.741 899 H LYS 27 H LYS 27 -1.708 -14.900 4.948 900 HA LYS 27 HA LYS 27 -1.140 -13.900 2.251 901 HB2 LYS 27 HB3 LYS 27 -2.313 -16.630 2.799 902 HB3 LYS 27 HB2 LYS 27 -2.510 -15.752 1.292 903 HG2 LYS 27 HG3 LYS 27 0.241 -16.359 2.435 904 HG3 LYS 27 HG2 LYS 27 -0.603 -17.435 1.385 905 HD2 LYS 27 HD3 LYS 27 -0.010 -14.553 0.638 906 HD3 LYS 27 HD2 LYS 27 0.895 -15.931 0.061 907 HE2 LYS 27 HE2 LYS 27 -1.933 -15.135 -0.600 908 HE3 LYS 27 HE1 LYS 27 -0.630 -15.588 -1.678 909 HZ1 LYS 27 HZ1 LYS 27 -2.544 -17.317 -0.255 910 HZ2 LYS 27 HZ2 LYS 27 -0.971 -17.928 -0.304 911 HZ3 LYS 27 HZ3 LYS 27 -1.773 -17.525 -1.725 912 H LEU 28 H LEU 28 -3.167 -13.461 1.052 913 HA LEU 28 HA LEU 28 -5.538 -13.521 2.709 914 HB2 LEU 28 HB3 LEU 28 -4.621 -11.283 2.963 915 HB3 LEU 28 HB2 LEU 28 -4.670 -11.077 1.192 916 HG LEU 28 HG LEU 28 -7.145 -11.517 1.278 917 HD11 LEU 28 HD11 LEU 28 -6.462 -11.852 4.150 918 HD12 LEU 28 HD12 LEU 28 -7.726 -12.613 3.198 919 HD13 LEU 28 HD13 LEU 28 -7.932 -10.952 3.794 920 HD21 LEU 28 HD21 LEU 28 -6.368 -9.223 1.189 921 HD22 LEU 28 HD22 LEU 28 -6.092 -9.211 2.938 922 HD23 LEU 28 HD23 LEU 28 -7.737 -9.342 2.294 923 H SER 29 H SER 29 -7.297 -14.132 1.622 924 HA SER 29 HA SER 29 -7.053 -14.302 -1.305 925 HB2 SER 29 HB3 SER 29 -9.034 -16.061 -0.783 926 HB3 SER 29 HB2 SER 29 -7.347 -16.475 -0.896 927 HG SER 29 HG SER 29 -7.132 -16.435 1.222 928 H LYS 30 H LYS 30 -9.232 -14.271 -2.366 929 HA LYS 30 HA LYS 30 -10.339 -11.712 -1.878 930 HB2 LYS 30 HB3 LYS 30 -11.522 -13.930 -3.556 931 HB3 LYS 30 HB2 LYS 30 -11.912 -12.215 -3.625 932 HG2 LYS 30 HG3 LYS 30 -9.216 -13.433 -4.183 933 HG3 LYS 30 HG2 LYS 30 -10.289 -12.864 -5.447 934 HD2 LYS 30 HD3 LYS 30 -9.761 -10.760 -3.379 935 HD3 LYS 30 HD2 LYS 30 -8.315 -11.336 -4.198 936 HE2 LYS 30 HE2 LYS 30 -9.699 -9.344 -5.172 937 HE3 LYS 30 HE1 LYS 30 -9.001 -10.510 -6.273 938 HZ1 LYS 30 HZ1 LYS 30 -11.736 -9.897 -5.732 939 HZ2 LYS 30 HZ2 LYS 30 -11.526 -11.526 -5.546 940 HZ3 LYS 30 HZ3 LYS 30 -11.160 -10.793 -7.011 941 H LYS 31 H LYS 31 -10.780 -14.422 -0.166 942 HA LYS 31 HA LYS 31 -13.547 -14.554 0.395 943 HB2 LYS 31 HB3 LYS 31 -11.373 -15.082 2.501 944 HB3 LYS 31 HB2 LYS 31 -12.938 -15.809 2.271 945 HG2 LYS 31 HG3 LYS 31 -12.233 -17.009 0.332 946 HG3 LYS 31 HG2 LYS 31 -10.767 -16.059 0.229 947 HD2 LYS 31 HD3 LYS 31 -9.925 -16.980 2.348 948 HD3 LYS 31 HD2 LYS 31 -11.405 -17.942 2.520 949 HE2 LYS 31 HE2 LYS 31 -9.653 -18.039 0.112 950 HE3 LYS 31 HE1 LYS 31 -9.345 -19.095 1.500 951 HZ1 LYS 31 HZ1 LYS 31 -11.137 -20.362 1.024 952 HZ2 LYS 31 HZ2 LYS 31 -10.985 -19.739 -0.522 953 HZ3 LYS 31 HZ3 LYS 31 -12.123 -19.082 0.543 954 H GLU 32 H GLU 32 -11.028 -13.294 2.515 955 HA GLU 32 HA GLU 32 -12.745 -11.645 4.059 956 HB2 GLU 32 HB3 GLU 32 -9.754 -12.032 3.968 957 HB3 GLU 32 HB2 GLU 32 -10.643 -11.187 5.244 958 HG2 GLU 32 HG3 GLU 32 -11.199 -14.050 4.465 959 HG3 GLU 32 HG2 GLU 32 -10.079 -13.592 5.724 960 H LEU 33 H LEU 33 -10.236 -11.141 1.616 961 HA LEU 33 HA LEU 33 -9.533 -8.575 1.941 962 HB2 LEU 33 HB3 LEU 33 -8.592 -9.985 0.185 963 HB3 LEU 33 HB2 LEU 33 -10.087 -9.897 -0.731 964 HG LEU 33 HG LEU 33 -8.148 -8.354 -1.443 965 HD11 LEU 33 HD11 LEU 33 -10.503 -6.605 -1.018 966 HD12 LEU 33 HD12 LEU 33 -10.808 -8.144 -1.824 967 HD13 LEU 33 HD13 LEU 33 -9.631 -7.033 -2.480 968 HD21 LEU 33 HD21 LEU 33 -9.167 -6.635 0.862 969 HD22 LEU 33 HD22 LEU 33 -7.863 -6.287 -0.257 970 HD23 LEU 33 HD23 LEU 33 -7.663 -7.561 0.929 971 H LYS 34 H LYS 34 -12.259 -9.422 -0.165 972 HA LYS 34 HA LYS 34 -13.043 -6.765 -0.621 973 HB2 LYS 34 HB3 LYS 34 -15.161 -7.698 -1.444 974 HB3 LYS 34 HB2 LYS 34 -13.764 -8.572 -2.065 975 HG2 LYS 34 HG3 LYS 34 -14.091 -10.291 -0.233 976 HG3 LYS 34 HG2 LYS 34 -15.579 -9.443 0.198 977 HD2 LYS 34 HD3 LYS 34 -16.464 -9.823 -2.063 978 HD3 LYS 34 HD2 LYS 34 -14.998 -10.686 -2.504 979 HE2 LYS 34 HE2 LYS 34 -16.999 -11.491 -0.371 980 HE3 LYS 34 HE1 LYS 34 -16.644 -12.328 -1.869 981 HZ1 LYS 34 HZ1 LYS 34 -14.210 -12.437 -0.925 982 HZ2 LYS 34 HZ2 LYS 34 -15.441 -13.463 -0.327 983 HZ3 LYS 34 HZ3 LYS 34 -14.967 -12.180 0.572 984 H GLU 35 H GLU 35 -14.232 -9.093 1.764 985 HA GLU 35 HA GLU 35 -16.167 -7.324 2.874 986 HB2 GLU 35 HB3 GLU 35 -14.878 -9.843 3.946 987 HB3 GLU 35 HB2 GLU 35 -16.157 -8.971 4.782 988 HG2 GLU 35 HG3 GLU 35 -17.669 -9.239 2.879 989 HG3 GLU 35 HG2 GLU 35 -16.407 -10.014 1.939 990 H LEU 36 H LEU 36 -12.874 -8.200 3.812 991 HA LEU 36 HA LEU 36 -12.802 -6.551 6.092 992 HB2 LEU 36 HB3 LEU 36 -10.845 -7.517 6.459 993 HB3 LEU 36 HB2 LEU 36 -11.109 -8.494 5.037 994 HG LEU 36 HG LEU 36 -10.013 -6.463 3.749 995 HD11 LEU 36 HD11 LEU 36 -9.970 -5.452 6.368 996 HD12 LEU 36 HD12 LEU 36 -9.146 -4.780 4.963 997 HD13 LEU 36 HD13 LEU 36 -8.310 -5.916 6.021 998 HD21 LEU 36 HD21 LEU 36 -7.968 -7.557 3.825 999 HD22 LEU 36 HD22 LEU 36 -9.051 -8.833 4.376 1000 HD23 LEU 36 HD23 LEU 36 -8.093 -7.917 5.542 1001 H LEU 37 H LEU 37 -11.832 -5.952 2.735 1002 HA LEU 37 HA LEU 37 -10.573 -3.518 3.219 1003 HB2 LEU 37 HB3 LEU 37 -10.313 -4.680 1.095 1004 HB3 LEU 37 HB2 LEU 37 -12.014 -4.455 0.713 1005 HG LEU 37 HG LEU 37 -10.335 -2.858 -0.397 1006 HD11 LEU 37 HD11 LEU 37 -12.296 -1.145 1.011 1007 HD12 LEU 37 HD12 LEU 37 -12.953 -2.535 0.157 1008 HD13 LEU 37 HD13 LEU 37 -11.970 -1.355 -0.700 1009 HD21 LEU 37 HD21 LEU 37 -9.421 -1.079 0.832 1010 HD22 LEU 37 HD22 LEU 37 -9.151 -2.475 1.879 1011 HD23 LEU 37 HD23 LEU 37 -10.463 -1.355 2.222 1012 H GLN 38 H GLN 38 -13.946 -4.125 2.308 1013 HA GLN 38 HA GLN 38 -14.687 -1.384 2.381 1014 HB2 GLN 38 HB3 GLN 38 -17.008 -2.180 2.498 1015 HB3 GLN 38 HB2 GLN 38 -16.121 -3.065 1.258 1016 HG2 GLN 38 HG3 GLN 38 -15.824 -4.961 2.794 1017 HG3 GLN 38 HG2 GLN 38 -16.611 -4.084 4.092 1018 HE21 GLN 38 HE21 GLN 38 -17.159 -6.022 1.270 1019 HE22 GLN 38 HE22 GLN 38 -18.848 -5.959 1.337 1020 H THR 39 H THR 39 -14.649 -3.950 4.751 1021 HA THR 39 HA THR 39 -15.992 -2.640 6.822 1022 HB THR 39 HB THR 39 -13.846 -4.768 6.926 1023 HG1 THR 39 HG2 THR 39 -15.499 -5.557 5.799 1024 HG21 THR 39 HG21 THR 39 -15.658 -3.587 9.015 1025 HG22 THR 39 HG22 THR 39 -13.968 -4.092 9.111 1026 HG23 THR 39 HG23 THR 39 -15.237 -5.304 9.069 1027 H GLU 40 H GLU 40 -12.454 -2.974 6.246 1028 HA GLU 40 HA GLU 40 -11.832 -1.323 8.486 1029 HB2 GLU 40 HB3 GLU 40 -10.068 -2.209 6.191 1030 HB3 GLU 40 HB2 GLU 40 -9.521 -1.455 7.687 1031 HG2 GLU 40 HG3 GLU 40 -11.040 -4.076 7.533 1032 HG3 GLU 40 HG2 GLU 40 -9.294 -3.926 7.768 1033 H LEU 41 H LEU 41 -11.981 -0.711 5.007 1034 HA LEU 41 HA LEU 41 -11.293 2.107 5.520 1035 HB2 LEU 41 HB3 LEU 41 -11.091 0.347 3.130 1036 HB3 LEU 41 HB2 LEU 41 -11.276 2.040 2.857 1037 HG LEU 41 HG LEU 41 -9.357 2.473 4.480 1038 HD11 LEU 41 HD11 LEU 41 -7.801 0.379 4.594 1039 HD12 LEU 41 HD12 LEU 41 -9.301 -0.525 4.385 1040 HD13 LEU 41 HD13 LEU 41 -9.110 0.580 5.752 1041 HD21 LEU 41 HD21 LEU 41 -9.117 2.486 1.971 1042 HD22 LEU 41 HD22 LEU 41 -8.654 0.788 2.053 1043 HD23 LEU 41 HD23 LEU 41 -7.657 2.021 2.832 1044 H SER 42 H SER 42 -13.929 1.069 6.141 1045 HA SER 42 HA SER 42 -15.856 1.719 4.244 1046 HB2 SER 42 HB3 SER 42 -16.038 2.303 7.207 1047 HB3 SER 42 HB2 SER 42 -17.362 2.133 6.076 1048 HG SER 42 HG SER 42 -15.856 -0.047 5.790 1049 H GLY 43 H GLY 43 -13.987 3.829 6.390 1050 HA2 GLY 43 HA3 GLY 43 -15.376 6.223 5.861 1051 HA3 GLY 43 HA2 GLY 43 -13.713 6.095 6.433 1052 H PHE 44 H PHE 44 -12.446 4.831 4.430 1053 HA PHE 44 HA PHE 44 -12.074 6.854 2.450 1054 HB2 PHE 44 HB3 PHE 44 -11.044 4.076 2.831 1055 HB3 PHE 44 HB2 PHE 44 -10.871 4.809 1.241 1056 HD1 PHE 44 HD1 PHE 44 -9.886 5.001 4.799 1057 HD2 PHE 44 HD2 PHE 44 -9.430 6.743 0.903 1058 HE1 PHE 44 HE1 PHE 44 -7.893 6.288 5.588 1059 HE2 PHE 44 HE2 PHE 44 -7.454 8.019 1.710 1060 HZ PHE 44 HZ PHE 44 -6.699 7.779 4.047 1061 H LEU 45 H LEU 45 -13.643 3.721 2.445 1062 HA LEU 45 HA LEU 45 -14.562 3.750 -0.265 1063 HB2 LEU 45 HB3 LEU 45 -14.642 1.647 0.668 1064 HB3 LEU 45 HB2 LEU 45 -15.162 2.218 2.236 1065 HG LEU 45 HG LEU 45 -17.386 2.665 1.379 1066 HD11 LEU 45 HD11 LEU 45 -17.683 1.448 -1.049 1067 HD12 LEU 45 HD12 LEU 45 -16.068 2.113 -1.261 1068 HD13 LEU 45 HD13 LEU 45 -17.430 3.168 -0.844 1069 HD21 LEU 45 HD21 LEU 45 -16.872 0.420 2.246 1070 HD22 LEU 45 HD22 LEU 45 -16.393 -0.103 0.629 1071 HD23 LEU 45 HD23 LEU 45 -18.072 0.313 0.957 1072 H ASP 46 H ASP 46 -16.188 4.748 2.729 1073 HA ASP 46 HA ASP 46 -18.502 5.688 1.365 1074 HB2 ASP 46 HB3 ASP 46 -18.624 5.141 3.625 1075 HB3 ASP 46 HB2 ASP 46 -17.400 6.312 4.109 1076 H ALA 47 H ALA 47 -15.522 7.253 2.399 1077 HA ALA 47 HA ALA 47 -16.324 9.893 1.866 1078 HB1 ALA 47 HB1 ALA 47 -13.708 10.177 1.528 1079 HB2 ALA 47 HB2 ALA 47 -13.682 8.568 2.245 1080 HB3 ALA 47 HB3 ALA 47 -14.413 9.912 3.114 1081 H GLN 48 H GLN 48 -14.708 7.523 -0.219 1082 HA GLN 48 HA GLN 48 -15.104 9.398 -2.485 1083 HB2 GLN 48 HB3 GLN 48 -13.177 8.404 -3.556 1084 HB3 GLN 48 HB2 GLN 48 -12.717 8.997 -1.966 1085 HG2 GLN 48 HG3 GLN 48 -12.090 6.906 -1.306 1086 HG3 GLN 48 HG2 GLN 48 -13.645 6.245 -1.757 1087 HE21 GLN 48 HE21 GLN 48 -13.840 6.329 -4.372 1088 HE22 GLN 48 HE22 GLN 48 -12.542 5.575 -5.167 1089 H LYS 49 H LYS 49 -16.986 7.479 -1.452 1090 HA LYS 49 HA LYS 49 -17.077 5.091 -2.912 1091 HB2 LYS 49 HB3 LYS 49 -18.540 5.671 -0.918 1092 HB3 LYS 49 HB2 LYS 49 -19.493 6.670 -2.009 1093 HG2 LYS 49 HG3 LYS 49 -19.829 4.649 -3.483 1094 HG3 LYS 49 HG2 LYS 49 -18.948 3.739 -2.280 1095 HD2 LYS 49 HD3 LYS 49 -20.615 4.257 -0.544 1096 HD3 LYS 49 HD2 LYS 49 -21.520 5.215 -1.707 1097 HE2 LYS 49 HE2 LYS 49 -22.460 2.953 -1.470 1098 HE3 LYS 49 HE1 LYS 49 -21.915 3.280 -3.113 1099 HZ1 LYS 49 HZ1 LYS 49 -20.422 1.747 -1.035 1100 HZ2 LYS 49 HZ2 LYS 49 -19.825 2.104 -2.598 1101 HZ3 LYS 49 HZ3 LYS 49 -21.152 1.105 -2.403 1102 H ASP 50 H ASP 50 -18.408 8.270 -3.602 1103 HA ASP 50 HA ASP 50 -19.829 7.569 -5.950 1104 HB2 ASP 50 HB3 ASP 50 -20.298 9.648 -4.737 1105 HB3 ASP 50 HB2 ASP 50 -18.715 10.278 -5.167 1106 H VAL 51 H VAL 51 -16.505 8.275 -5.386 1107 HA VAL 51 HA VAL 51 -15.755 9.063 -7.977 1108 HB VAL 51 HB VAL 51 -14.138 7.624 -5.865 1109 HG11 VAL 51 HG11 VAL 51 -12.252 8.922 -7.004 1110 HG12 VAL 51 HG12 VAL 51 -13.344 9.101 -8.375 1111 HG13 VAL 51 HG13 VAL 51 -12.859 7.493 -7.817 1112 HG21 VAL 51 HG21 VAL 51 -15.142 9.727 -5.013 1113 HG22 VAL 51 HG22 VAL 51 -14.520 10.595 -6.406 1114 HG23 VAL 51 HG23 VAL 51 -13.406 9.922 -5.226 1115 H ASP 52 H ASP 52 -15.465 7.917 -9.773 1116 HA ASP 52 HA ASP 52 -16.403 5.287 -10.042 1117 HB2 ASP 52 HB3 ASP 52 -16.295 6.900 -11.907 1118 HB3 ASP 52 HB2 ASP 52 -14.542 6.803 -11.859 1119 H ALA 53 H ALA 53 -13.216 6.601 -9.611 1120 HA ALA 53 HA ALA 53 -11.669 4.366 -10.127 1121 HB1 ALA 53 HB1 ALA 53 -10.959 6.084 -7.772 1122 HB2 ALA 53 HB2 ALA 53 -10.919 6.775 -9.399 1123 HB3 ALA 53 HB3 ALA 53 -9.923 5.382 -9.004 1124 H VAL 54 H VAL 54 -13.776 5.024 -7.394 1125 HA VAL 54 HA VAL 54 -12.710 3.118 -5.608 1126 HB VAL 54 HB VAL 54 -14.721 4.931 -5.355 1127 HG11 VAL 54 HG11 VAL 54 -16.190 2.320 -5.810 1128 HG12 VAL 54 HG12 VAL 54 -16.368 3.829 -6.733 1129 HG13 VAL 54 HG13 VAL 54 -16.833 3.761 -5.054 1130 HG21 VAL 54 HG21 VAL 54 -14.192 2.377 -3.829 1131 HG22 VAL 54 HG22 VAL 54 -15.458 3.484 -3.322 1132 HG23 VAL 54 HG23 VAL 54 -13.792 4.032 -3.359 1133 H ASP 55 H ASP 55 -15.168 2.883 -8.122 1134 HA ASP 55 HA ASP 55 -15.634 0.070 -7.833 1135 HB2 ASP 55 HB3 ASP 55 -17.097 1.660 -9.218 1136 HB3 ASP 55 HB2 ASP 55 -15.782 1.592 -10.416 1137 H LYS 56 H LYS 56 -13.574 2.040 -9.843 1138 HA LYS 56 HA LYS 56 -12.583 -0.061 -11.390 1139 HB2 LYS 56 HB3 LYS 56 -11.244 2.582 -10.805 1140 HB3 LYS 56 HB2 LYS 56 -10.777 1.467 -12.069 1141 HG2 LYS 56 HG3 LYS 56 -13.501 2.809 -11.856 1142 HG3 LYS 56 HG2 LYS 56 -12.244 3.206 -13.024 1143 HD2 LYS 56 HD3 LYS 56 -12.378 0.648 -13.606 1144 HD3 LYS 56 HD2 LYS 56 -13.946 0.737 -12.853 1145 HE2 LYS 56 HE2 LYS 56 -13.111 2.624 -15.076 1146 HE3 LYS 56 HE1 LYS 56 -14.045 1.152 -15.350 1147 HZ1 LYS 56 HZ1 LYS 56 -15.594 2.834 -15.148 1148 HZ2 LYS 56 HZ2 LYS 56 -14.792 3.601 -13.888 1149 HZ3 LYS 56 HZ3 LYS 56 -15.644 2.171 -13.595 1150 H VAL 57 H VAL 57 -11.272 1.333 -8.409 1151 HA VAL 57 HA VAL 57 -8.955 -0.301 -8.397 1152 HB VAL 57 HB VAL 57 -10.529 0.852 -6.069 1153 HG11 VAL 57 HG11 VAL 57 -8.531 0.380 -4.724 1154 HG12 VAL 57 HG12 VAL 57 -7.708 -0.259 -6.149 1155 HG13 VAL 57 HG13 VAL 57 -9.085 -1.107 -5.490 1156 HG21 VAL 57 HG21 VAL 57 -9.553 2.559 -7.617 1157 HG22 VAL 57 HG22 VAL 57 -8.007 1.751 -7.480 1158 HG23 VAL 57 HG23 VAL 57 -8.711 2.543 -6.065 1159 H MET 58 H MET 58 -12.200 -0.710 -7.090 1160 HA MET 58 HA MET 58 -11.862 -3.290 -5.972 1161 HB2 MET 58 HB3 MET 58 -14.354 -2.104 -7.239 1162 HB3 MET 58 HB2 MET 58 -14.283 -3.421 -6.079 1163 HG2 MET 58 HG3 MET 58 -12.921 -0.938 -5.211 1164 HG3 MET 58 HG2 MET 58 -14.657 -0.804 -5.369 1165 HE1 MET 58 HE1 MET 58 -16.114 -3.604 -3.792 1166 HE2 MET 58 HE2 MET 58 -16.209 -2.085 -4.687 1167 HE3 MET 58 HE3 MET 58 -16.315 -2.061 -2.936 1168 H LYS 59 H LYS 59 -12.809 -2.112 -9.144 1169 HA LYS 59 HA LYS 59 -13.325 -4.605 -10.366 1170 HB2 LYS 59 HB3 LYS 59 -13.919 -2.170 -11.101 1171 HB3 LYS 59 HB2 LYS 59 -12.336 -2.201 -11.886 1172 HG2 LYS 59 HG3 LYS 59 -13.888 -2.929 -13.525 1173 HG3 LYS 59 HG2 LYS 59 -13.059 -4.367 -12.948 1174 HD2 LYS 59 HD3 LYS 59 -15.024 -5.288 -12.337 1175 HD3 LYS 59 HD2 LYS 59 -15.267 -4.008 -11.164 1176 HE2 LYS 59 HE2 LYS 59 -16.247 -4.104 -14.036 1177 HE3 LYS 59 HE1 LYS 59 -17.172 -3.996 -12.541 1178 HZ1 LYS 59 HZ1 LYS 59 -16.253 -1.695 -12.187 1179 HZ2 LYS 59 HZ2 LYS 59 -17.094 -1.886 -13.611 1180 HZ3 LYS 59 HZ3 LYS 59 -15.429 -1.857 -13.670 1181 H GLU 60 H GLU 60 -10.469 -2.536 -10.257 1182 HA GLU 60 HA GLU 60 -8.815 -4.098 -11.934 1183 HB2 GLU 60 HB3 GLU 60 -8.278 -2.051 -9.824 1184 HB3 GLU 60 HB2 GLU 60 -6.973 -2.757 -10.782 1185 HG2 GLU 60 HG3 GLU 60 -8.035 -1.958 -12.833 1186 HG3 GLU 60 HG2 GLU 60 -9.405 -1.330 -11.930 1187 H LEU 61 H LEU 61 -9.251 -4.037 -8.422 1188 HA LEU 61 HA LEU 61 -7.166 -5.974 -8.012 1189 HB2 LEU 61 HB3 LEU 61 -9.167 -4.644 -6.210 1190 HB3 LEU 61 HB2 LEU 61 -8.301 -6.059 -5.641 1191 HG LEU 61 HG LEU 61 -7.218 -3.769 -5.143 1192 HD11 LEU 61 HD11 LEU 61 -5.570 -5.190 -4.674 1193 HD12 LEU 61 HD12 LEU 61 -4.955 -4.890 -6.286 1194 HD13 LEU 61 HD13 LEU 61 -5.999 -6.273 -5.996 1195 HD21 LEU 61 HD21 LEU 61 -6.321 -4.005 -8.041 1196 HD22 LEU 61 HD22 LEU 61 -5.921 -2.744 -6.896 1197 HD23 LEU 61 HD23 LEU 61 -7.562 -2.865 -7.506 1198 H ASP 62 H ASP 62 -10.246 -6.252 -9.172 1199 HA ASP 62 HA ASP 62 -11.013 -8.769 -8.082 1200 HB2 ASP 62 HB3 ASP 62 -12.504 -7.205 -9.448 1201 HB3 ASP 62 HB2 ASP 62 -11.639 -7.780 -10.865 1202 H GLU 63 H GLU 63 -8.955 -7.709 -10.677 1203 HA GLU 63 HA GLU 63 -8.416 -10.185 -11.952 1204 HB2 GLU 63 HB3 GLU 63 -6.708 -7.722 -11.597 1205 HB3 GLU 63 HB2 GLU 63 -6.321 -9.060 -12.668 1206 HG2 GLU 63 HG3 GLU 63 -8.496 -8.711 -13.862 1207 HG3 GLU 63 HG2 GLU 63 -8.779 -7.363 -12.753 1208 H ASN 64 H ASN 64 -7.062 -8.553 -9.201 1209 HA ASN 64 HA ASN 64 -4.859 -10.251 -8.798 1210 HB2 ASN 64 HB3 ASN 64 -6.368 -8.332 -7.113 1211 HB3 ASN 64 HB2 ASN 64 -5.132 -9.357 -6.337 1212 HD21 ASN 64 HD21 ASN 64 -3.021 -9.384 -8.009 1213 HD22 ASN 64 HD22 ASN 64 -2.538 -7.828 -8.458 1214 H GLY 65 H GLY 65 -8.168 -10.825 -8.436 1215 HA2 GLY 65 HA3 GLY 65 -7.997 -12.898 -6.411 1216 HA3 GLY 65 HA2 GLY 65 -9.354 -12.589 -7.501 1217 H ASP 66 H ASP 66 -6.084 -12.961 -8.661 1218 HA ASP 66 HA ASP 66 -6.701 -14.874 -10.622 1219 HB2 ASP 66 HB3 ASP 66 -4.685 -13.310 -10.503 1220 HB3 ASP 66 HB2 ASP 66 -3.995 -14.445 -9.354 1221 H GLY 67 H GLY 67 -5.399 -15.113 -7.403 1222 HA2 GLY 67 HA3 GLY 67 -6.316 -17.854 -7.141 1223 HA3 GLY 67 HA2 GLY 67 -4.573 -17.622 -6.949 1224 H GLU 68 H GLU 68 -4.129 -15.515 -5.620 1225 HA GLU 68 HA GLU 68 -5.935 -15.214 -3.338 1226 HB2 GLU 68 HB3 GLU 68 -2.959 -15.316 -2.921 1227 HB3 GLU 68 HB2 GLU 68 -4.246 -15.493 -1.732 1228 HG2 GLU 68 HG3 GLU 68 -3.833 -17.713 -1.915 1229 HG3 GLU 68 HG2 GLU 68 -4.770 -17.630 -3.381 1230 H VAL 69 H VAL 69 -5.038 -13.219 -2.049 1231 HA VAL 69 HA VAL 69 -3.809 -11.346 -3.938 1232 HB VAL 69 HB VAL 69 -6.095 -10.655 -3.762 1233 HG11 VAL 69 HG11 VAL 69 -6.782 -11.951 -1.831 1234 HG12 VAL 69 HG12 VAL 69 -7.217 -10.264 -1.589 1235 HG13 VAL 69 HG13 VAL 69 -5.813 -10.937 -0.765 1236 HG21 VAL 69 HG21 VAL 69 -4.175 -9.029 -2.083 1237 HG22 VAL 69 HG22 VAL 69 -5.859 -8.532 -2.244 1238 HG23 VAL 69 HG23 VAL 69 -4.859 -8.690 -3.675 1239 H ASP 70 H ASP 70 -1.912 -10.662 -3.179 1240 HA ASP 70 HA ASP 70 -1.261 -11.481 -0.477 1241 HB2 ASP 70 HB3 ASP 70 0.928 -11.588 -1.025 1242 HB3 ASP 70 HB2 ASP 70 0.225 -11.873 -2.602 1243 H PHE 71 H PHE 71 0.574 -9.985 0.439 1244 HA PHE 71 HA PHE 71 -0.807 -7.805 1.543 1245 HB2 PHE 71 HB3 PHE 71 1.147 -8.948 2.613 1246 HB3 PHE 71 HB2 PHE 71 2.195 -8.128 1.455 1247 HD1 PHE 71 HD1 PHE 71 -0.578 -7.351 3.841 1248 HD2 PHE 71 HD2 PHE 71 3.112 -6.014 2.074 1249 HE1 PHE 71 HE1 PHE 71 -0.608 -5.359 5.272 1250 HE2 PHE 71 HE2 PHE 71 3.065 -4.016 3.541 1251 HZ PHE 71 HZ PHE 71 1.230 -3.682 5.118 1252 H GLN 72 H GLN 72 1.622 -8.007 -1.016 1253 HA GLN 72 HA GLN 72 1.896 -5.256 -1.492 1254 HB2 GLN 72 HB3 GLN 72 2.992 -7.572 -2.547 1255 HB3 GLN 72 HB2 GLN 72 2.085 -6.916 -3.904 1256 HG2 GLN 72 HG3 GLN 72 3.745 -4.974 -2.336 1257 HG3 GLN 72 HG2 GLN 72 4.582 -6.164 -3.316 1258 HE21 GLN 72 HE21 GLN 72 1.512 -4.275 -3.852 1259 HE22 GLN 72 HE22 GLN 72 1.993 -3.741 -5.379 1260 H GLU 73 H GLU 73 -0.299 -7.671 -2.835 1261 HA GLU 73 HA GLU 73 -1.683 -5.823 -4.508 1262 HB2 GLU 73 HB3 GLU 73 -2.376 -8.616 -3.563 1263 HB3 GLU 73 HB2 GLU 73 -3.368 -7.678 -4.684 1264 HG2 GLU 73 HG3 GLU 73 -1.560 -7.448 -6.247 1265 HG3 GLU 73 HG2 GLU 73 -0.422 -8.213 -5.151 1266 H TYR 74 H TYR 74 -2.100 -6.986 -1.253 1267 HA TYR 74 HA TYR 74 -4.649 -5.903 -0.710 1268 HB2 TYR 74 HB3 TYR 74 -3.670 -7.509 0.808 1269 HB3 TYR 74 HB2 TYR 74 -2.305 -6.434 1.112 1270 HD1 TYR 74 HD1 TYR 74 -6.058 -5.963 1.083 1271 HD2 TYR 74 HD2 TYR 74 -2.373 -5.564 3.276 1272 HE1 TYR 74 HE1 TYR 74 -7.280 -4.944 2.952 1273 HE2 TYR 74 HE2 TYR 74 -3.615 -4.545 5.160 1274 HH TYR 74 HH TYR 74 -6.958 -4.658 5.459 1275 H VAL 75 H VAL 75 -1.409 -4.455 -0.333 1276 HA VAL 75 HA VAL 75 -2.397 -2.148 0.896 1277 HB VAL 75 HB VAL 75 -0.214 -1.096 0.432 1278 HG11 VAL 75 HG11 VAL 75 -0.748 -2.858 2.291 1279 HG12 VAL 75 HG12 VAL 75 0.918 -2.414 2.000 1280 HG13 VAL 75 HG13 VAL 75 0.288 -3.922 1.349 1281 HG21 VAL 75 HG21 VAL 75 -0.053 -2.604 -1.817 1282 HG22 VAL 75 HG22 VAL 75 0.802 -3.664 -0.714 1283 HG23 VAL 75 HG23 VAL 75 1.365 -2.013 -0.976 1284 H VAL 76 H VAL 76 -1.876 -2.909 -2.503 1285 HA VAL 76 HA VAL 76 -2.225 -0.260 -3.405 1286 HB VAL 76 HB VAL 76 -2.685 -1.240 -5.612 1287 HG11 VAL 76 HG11 VAL 76 -0.365 -2.629 -4.281 1288 HG12 VAL 76 HG12 VAL 76 -0.379 -0.907 -4.687 1289 HG13 VAL 76 HG13 VAL 76 -0.496 -2.115 -5.964 1290 HG21 VAL 76 HG21 VAL 76 -2.257 -3.917 -4.297 1291 HG22 VAL 76 HG22 VAL 76 -2.707 -3.606 -5.967 1292 HG23 VAL 76 HG23 VAL 76 -3.869 -3.304 -4.682 1293 H LEU 77 H LEU 77 -4.512 -2.843 -2.738 1294 HA LEU 77 HA LEU 77 -6.775 -1.599 -3.868 1295 HB2 LEU 77 HB3 LEU 77 -6.806 -3.956 -3.191 1296 HB3 LEU 77 HB2 LEU 77 -6.559 -3.482 -1.524 1297 HG LEU 77 HG LEU 77 -8.717 -2.334 -1.441 1298 HD11 LEU 77 HD11 LEU 77 -10.272 -2.625 -3.421 1299 HD12 LEU 77 HD12 LEU 77 -8.864 -2.982 -4.402 1300 HD13 LEU 77 HD13 LEU 77 -9.011 -1.424 -3.552 1301 HD21 LEU 77 HD21 LEU 77 -10.212 -4.346 -2.063 1302 HD22 LEU 77 HD22 LEU 77 -8.945 -4.610 -0.867 1303 HD23 LEU 77 HD23 LEU 77 -8.713 -5.144 -2.534 1304 H VAL 78 H VAL 78 -5.491 -1.511 -0.574 1305 HA VAL 78 HA VAL 78 -7.408 0.460 0.242 1306 HB VAL 78 HB VAL 78 -6.032 0.723 2.289 1307 HG11 VAL 78 HG11 VAL 78 -7.019 -1.898 1.283 1308 HG12 VAL 78 HG12 VAL 78 -7.501 -0.962 2.704 1309 HG13 VAL 78 HG13 VAL 78 -6.041 -1.937 2.753 1310 HG21 VAL 78 HG21 VAL 78 -4.099 -0.789 2.618 1311 HG22 VAL 78 HG22 VAL 78 -3.761 0.349 1.321 1312 HG23 VAL 78 HG23 VAL 78 -4.229 -1.320 0.956 1313 H ALA 79 H ALA 79 -4.020 0.562 -0.783 1314 HA ALA 79 HA ALA 79 -3.626 3.322 -0.422 1315 HB1 ALA 79 HB1 ALA 79 -2.292 1.650 -2.529 1316 HB2 ALA 79 HB2 ALA 79 -1.795 1.647 -0.832 1317 HB3 ALA 79 HB3 ALA 79 -1.713 3.133 -1.790 1318 H ALA 80 H ALA 80 -4.659 1.536 -3.339 1319 HA ALA 80 HA ALA 80 -4.621 3.737 -5.017 1320 HB1 ALA 80 HB1 ALA 80 -6.186 2.475 -6.443 1321 HB2 ALA 80 HB2 ALA 80 -6.424 1.314 -5.133 1322 HB3 ALA 80 HB3 ALA 80 -4.840 1.487 -5.891 1323 H LEU 81 H LEU 81 -7.149 2.471 -2.907 1324 HA LEU 81 HA LEU 81 -9.134 4.453 -3.502 1325 HB2 LEU 81 HB3 LEU 81 -8.673 2.759 -1.032 1326 HB3 LEU 81 HB2 LEU 81 -10.080 3.781 -1.310 1327 HG LEU 81 HG LEU 81 -9.252 1.515 -3.160 1328 HD11 LEU 81 HD11 LEU 81 -9.944 0.535 -1.113 1329 HD12 LEU 81 HD12 LEU 81 -11.273 0.389 -2.257 1330 HD13 LEU 81 HD13 LEU 81 -11.338 1.615 -0.986 1331 HD21 LEU 81 HD21 LEU 81 -11.541 3.486 -3.092 1332 HD22 LEU 81 HD22 LEU 81 -11.740 1.907 -3.846 1333 HD23 LEU 81 HD23 LEU 81 -10.521 3.023 -4.456 1334 H THR 82 H THR 82 -6.517 4.145 -1.152 1335 HA THR 82 HA THR 82 -7.098 6.428 0.342 1336 HB THR 82 HB THR 82 -4.322 5.350 -0.159 1337 HG1 THR 82 HG2 THR 82 -6.015 3.755 0.550 1338 HG21 THR 82 HG21 THR 82 -5.252 6.398 2.468 1339 HG22 THR 82 HG22 THR 82 -4.931 7.578 1.204 1340 HG23 THR 82 HG23 THR 82 -3.663 6.471 1.725 1341 H VAL 83 H VAL 83 -4.859 6.031 -2.405 1342 HA VAL 83 HA VAL 83 -4.155 8.764 -2.502 1343 HB VAL 83 HB VAL 83 -2.801 7.016 -3.594 1344 HG11 VAL 83 HG11 VAL 83 -4.689 5.692 -4.445 1345 HG12 VAL 83 HG12 VAL 83 -3.470 6.043 -5.693 1346 HG13 VAL 83 HG13 VAL 83 -4.979 6.936 -5.666 1347 HG21 VAL 83 HG21 VAL 83 -3.780 8.945 -5.704 1348 HG22 VAL 83 HG22 VAL 83 -2.184 8.236 -5.538 1349 HG23 VAL 83 HG23 VAL 83 -2.726 9.453 -4.376 1350 H ALA 84 H ALA 84 -6.680 6.871 -4.109 1351 HA ALA 84 HA ALA 84 -7.660 8.865 -5.792 1352 HB1 ALA 84 HB1 ALA 84 -8.563 6.744 -6.196 1353 HB2 ALA 84 HB2 ALA 84 -9.908 7.595 -5.433 1354 HB3 ALA 84 HB3 ALA 84 -8.943 6.471 -4.496 1355 H MET 85 H MET 85 -8.716 7.973 -2.494 1356 HA MET 85 HA MET 85 -10.505 10.180 -2.247 1357 HB2 MET 85 HB3 MET 85 -10.601 8.146 -0.757 1358 HB3 MET 85 HB2 MET 85 -9.129 8.728 0.023 1359 HG2 MET 85 HG3 MET 85 -10.280 10.860 0.620 1360 HG3 MET 85 HG2 MET 85 -11.751 10.264 -0.114 1361 HE1 MET 85 HE1 MET 85 -8.965 9.697 2.288 1362 HE2 MET 85 HE2 MET 85 -9.693 8.974 3.716 1363 HE3 MET 85 HE3 MET 85 -10.059 10.640 3.319 1364 H ASN 86 H ASN 86 -7.121 9.661 -1.436 1365 HA ASN 86 HA ASN 86 -6.607 12.022 -0.022 1366 HB2 ASN 86 HB3 ASN 86 -4.999 10.226 -0.131 1367 HB3 ASN 86 HB2 ASN 86 -4.883 10.456 -1.881 1368 HD21 ASN 86 HD21 ASN 86 -2.644 11.068 -1.927 1369 HD22 ASN 86 HD22 ASN 86 -2.088 12.499 -1.209 1370 H ASN 87 H ASN 87 -6.593 11.301 -3.487 1371 HA ASN 87 HA ASN 87 -5.673 13.800 -4.417 1372 HB2 ASN 87 HB3 ASN 87 -6.267 11.482 -5.650 1373 HB3 ASN 87 HB2 ASN 87 -7.762 12.346 -5.972 1374 HD21 ASN 87 HD21 ASN 87 -6.863 14.988 -6.383 1375 HD22 ASN 87 HD22 ASN 87 -5.805 14.990 -7.704 1376 H PHE 88 H PHE 88 -8.878 12.554 -3.693 1377 HA PHE 88 HA PHE 88 -10.288 14.979 -4.274 1378 HB2 PHE 88 HB3 PHE 88 -11.062 12.419 -2.899 1379 HB3 PHE 88 HB2 PHE 88 -12.087 13.837 -2.773 1380 HD1 PHE 88 HD1 PHE 88 -12.968 14.975 -4.814 1381 HD2 PHE 88 HD2 PHE 88 -10.925 11.195 -5.013 1382 HE1 PHE 88 HE1 PHE 88 -13.858 14.615 -7.072 1383 HE2 PHE 88 HE2 PHE 88 -11.825 10.842 -7.291 1384 HZ PHE 88 HZ PHE 88 -13.289 12.536 -8.326 1385 H PHE 89 H PHE 89 -8.753 13.664 -1.422 1386 HA PHE 89 HA PHE 89 -9.927 15.074 0.583 1387 HB2 PHE 89 HB3 PHE 89 -7.849 13.439 0.444 1388 HB3 PHE 89 HB2 PHE 89 -6.936 14.937 0.549 1389 HD1 PHE 89 HD1 PHE 89 -7.340 16.483 2.534 1390 HD2 PHE 89 HD2 PHE 89 -8.976 12.539 2.239 1391 HE1 PHE 89 HE1 PHE 89 -7.786 16.485 4.982 1392 HE2 PHE 89 HE2 PHE 89 -9.432 12.517 4.641 1393 HZ PHE 89 HZ PHE 89 -8.834 14.508 6.049 1394 H TRP 90 H TRP 90 -7.234 16.097 -1.453 1395 HA TRP 90 HA TRP 90 -7.214 18.814 -0.440 1396 HB2 TRP 90 HB3 TRP 90 -5.773 17.804 -2.904 1397 HB3 TRP 90 HB2 TRP 90 -5.355 19.173 -1.880 1398 HD1 TRP 90 HD TRP 90 -5.011 15.457 -2.129 1399 HE1 TRP 90 HE1 TRP 90 -3.698 14.556 -0.141 1400 HE3 TRP 90 HE3 TRP 90 -4.794 19.673 0.716 1401 HZ2 TRP 90 HZ2 TRP 90 -2.624 15.520 2.353 1402 HZ3 TRP 90 HZ3 TRP 90 -3.611 19.663 2.894 1403 HH2 TRP 90 HH TRP 90 -2.525 17.579 3.712 1404 H GLU 91 H GLU 91 -8.328 17.133 -3.290 1405 HA GLU 91 HA GLU 91 -9.182 19.615 -4.572 1406 HB2 GLU 91 HB3 GLU 91 -9.327 16.742 -5.476 1407 HB3 GLU 91 HB2 GLU 91 -9.857 18.111 -6.438 1408 HG2 GLU 91 HG3 GLU 91 -7.630 19.117 -6.375 1409 HG3 GLU 91 HG2 GLU 91 -7.052 17.839 -5.317 1410 H ASN 92 H ASN 92 -10.581 17.995 -2.181 1411 HA ASN 92 HA ASN 92 -13.143 17.370 -3.049 1412 HB2 ASN 92 HB3 ASN 92 -12.547 16.662 -0.864 1413 HB3 ASN 92 HB2 ASN 92 -12.106 18.313 -0.409 1414 HD21 ASN 92 HD21 ASN 92 -15.088 16.947 -1.927 1415 HD22 ASN 92 HD22 ASN 92 -16.142 17.650 -0.807 1416 H SER 93 H SER 93 -14.514 18.618 -4.038 1417 HA SER 93 HA SER 93 -14.566 21.486 -3.423 1418 HB2 SER 93 HB3 SER 93 -14.490 19.973 -5.835 1419 HB3 SER 93 HB2 SER 93 -15.969 20.941 -5.825 1420 HG SER 93 HG SER 93 -14.767 22.692 -5.944
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