NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
568876 | 2mct | 19453 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 6.365 12.071 10.065 2 HA2 GLY 1 1HA GLY 1 4.567 12.818 8.650 3 HA3 GLY 1 2HA GLY 1 6.065 12.725 7.683 4 H SER 2 H SER 2 2.827 11.944 7.604 5 HA SER 2 HA SER 2 2.947 9.230 6.730 6 HB2 SER 2 1HB SER 2 0.507 10.762 6.066 7 HB3 SER 2 2HB SER 2 0.710 9.244 6.951 8 HG SER 2 HG SER 2 1.041 10.322 8.814 9 HA PRO 3 HA PRO 3 2.698 9.756 2.147 10 HB2 PRO 3 1HB PRO 3 0.389 8.197 1.752 11 HB3 PRO 3 2HB PRO 3 2.034 7.566 1.752 12 HG2 PRO 3 1HG PRO 3 0.060 7.598 3.999 13 HG3 PRO 3 2HG PRO 3 1.186 6.297 3.493 14 HD2 PRO 3 1HD PRO 3 1.693 7.870 5.617 15 HD3 PRO 3 2HD PRO 3 2.999 7.366 4.527 16 H ILE 4 H ILE 4 1.190 10.781 0.698 17 HA ILE 4 HA ILE 4 -1.164 12.121 1.932 18 HB ILE 4 HB ILE 4 0.131 12.730 -0.749 19 HG12 ILE 4 1HG1 ILE 4 0.546 14.100 1.914 20 HG13 ILE 4 2HG1 ILE 4 1.751 13.293 0.967 21 HG21 ILE 4 1HG2 ILE 4 -2.290 13.250 -0.515 22 HG22 ILE 4 2HG2 ILE 4 -1.932 14.240 0.923 23 HG23 ILE 4 3HG2 ILE 4 -1.327 14.716 -0.686 24 HD11 ILE 4 3HD1 ILE 4 2.094 15.627 0.671 25 HD12 ILE 4 1HD1 ILE 4 1.435 14.970 -0.850 26 HD13 ILE 4 2HD1 ILE 4 0.386 15.905 0.255 27 H LEU 5 H LEU 5 -2.667 10.430 1.886 28 HA LEU 5 HA LEU 5 -2.952 8.786 -0.573 29 HB2 LEU 5 1HB LEU 5 -4.163 8.695 2.218 30 HB3 LEU 5 2HB LEU 5 -4.894 7.860 0.871 31 HG LEU 5 HG LEU 5 -2.153 7.176 0.679 32 HD11 LEU 5 1HD1 LEU 5 -1.516 6.319 2.818 33 HD12 LEU 5 2HD1 LEU 5 -3.063 6.792 3.558 34 HD13 LEU 5 3HD1 LEU 5 -1.909 8.024 3.001 35 HD21 LEU 5 3HD2 LEU 5 -4.223 5.785 0.179 36 HD22 LEU 5 1HD2 LEU 5 -4.288 5.420 1.917 37 HD23 LEU 5 2HD2 LEU 5 -2.874 4.963 0.935 38 HA PRO 6 HA PRO 6 -6.688 11.182 -1.730 39 HB2 PRO 6 1HB PRO 6 -8.481 9.141 -2.239 40 HB3 PRO 6 2HB PRO 6 -7.259 9.649 -3.408 41 HG2 PRO 6 1HG PRO 6 -7.127 7.366 -1.440 42 HG3 PRO 6 2HG PRO 6 -6.727 7.355 -3.186 43 HD2 PRO 6 1HD PRO 6 -4.800 7.575 -1.347 44 HD3 PRO 6 2HD PRO 6 -4.715 8.538 -2.826 45 H LYS 7 H LYS 7 -9.073 11.410 -0.745 46 HA LYS 7 HA LYS 7 -9.137 11.011 2.000 47 HB2 LYS 7 1HB LYS 7 -11.678 10.949 0.308 48 HB3 LYS 7 2HB LYS 7 -11.427 11.544 1.940 49 HG2 LYS 7 1HG LYS 7 -9.654 13.112 0.544 50 HG3 LYS 7 2HG LYS 7 -10.925 12.861 -0.670 51 HD2 LYS 7 1HD LYS 7 -11.246 13.886 2.139 52 HD3 LYS 7 2HD LYS 7 -11.184 14.926 0.680 53 HE2 LYS 7 1HE LYS 7 -13.133 13.479 -0.178 54 HE3 LYS 7 2HE LYS 7 -13.271 12.871 1.461 55 HZ1 LYS 7 3HZ LYS 7 -13.642 15.187 2.193 56 HZ2 LYS 7 1HZ LYS 7 -14.800 14.573 1.188 57 HZ3 LYS 7 2HZ LYS 7 -13.749 15.652 0.599 58 H ALA 8 H ALA 8 -10.878 9.573 3.093 59 HA ALA 8 HA ALA 8 -10.807 6.776 2.050 60 HB1 ALA 8 1HB ALA 8 -10.824 7.116 4.501 61 HB2 ALA 8 2HB ALA 8 -12.354 8.020 4.384 62 HB3 ALA 8 3HB ALA 8 -12.308 6.302 3.943 63 H GLU 9 H GLU 9 -13.260 9.412 2.535 64 HA GLU 9 HA GLU 9 -15.285 7.792 1.532 65 HB2 GLU 9 1HB GLU 9 -16.666 9.741 1.684 66 HB3 GLU 9 2HB GLU 9 -15.580 9.678 3.051 67 HG2 GLU 9 1HG GLU 9 -14.413 11.570 2.423 68 HG3 GLU 9 2HG GLU 9 -14.529 11.237 0.720 69 H ASN 10 H ASN 10 -12.966 9.217 -0.454 70 HA ASN 10 HA ASN 10 -14.747 9.472 -2.811 71 HB2 ASN 10 1HB ASN 10 -12.986 10.688 -3.827 72 HB3 ASN 10 2HB ASN 10 -13.159 11.374 -2.217 73 HD21 ASN 10 1HD2 ASN 10 -11.565 8.518 -1.562 74 HD22 ASN 10 2HD2 ASN 10 -9.988 9.186 -1.486 75 H VAL 11 H VAL 11 -13.130 7.000 -1.281 76 HA VAL 11 HA VAL 11 -11.791 5.850 -3.610 77 HB VAL 11 HB VAL 11 -12.143 5.041 -0.715 78 HG11 VAL 11 1HG1 VAL 11 -10.688 3.446 -2.860 79 HG12 VAL 11 2HG1 VAL 11 -10.733 3.150 -1.104 80 HG13 VAL 11 3HG1 VAL 11 -12.206 2.971 -2.069 81 HG21 VAL 11 3HG2 VAL 11 -9.656 5.702 -2.348 82 HG22 VAL 11 1HG2 VAL 11 -10.439 6.781 -1.214 83 HG23 VAL 11 2HG2 VAL 11 -9.704 5.298 -0.623 84 H ASP 12 H ASP 12 -12.765 4.515 -4.936 85 HA ASP 12 HA ASP 12 -15.703 4.294 -4.844 86 HB2 ASP 12 1HB ASP 12 -13.794 4.704 -6.859 87 HB3 ASP 12 2HB ASP 12 -14.187 3.004 -7.050 88 H SER 13 H SER 13 -12.800 2.121 -5.232 89 HA SER 13 HA SER 13 -13.690 0.518 -3.019 90 HB2 SER 13 1HB SER 13 -13.026 -1.323 -5.235 91 HB3 SER 13 2HB SER 13 -14.184 -1.488 -3.937 92 HG SER 13 HG SER 13 -14.506 -0.185 -6.435 93 H ILE 14 H ILE 14 -11.869 -1.053 -2.409 94 HA ILE 14 HA ILE 14 -9.342 -0.451 -3.872 95 HB ILE 14 HB ILE 14 -9.525 -1.195 -0.958 96 HG12 ILE 14 1HG1 ILE 14 -8.933 1.502 -2.171 97 HG13 ILE 14 2HG1 ILE 14 -10.337 1.036 -1.202 98 HG21 ILE 14 1HG2 ILE 14 -7.103 -0.338 -2.592 99 HG22 ILE 14 2HG2 ILE 14 -7.099 -0.864 -0.897 100 HG23 ILE 14 3HG2 ILE 14 -7.477 -2.011 -2.160 101 HD11 ILE 14 3HD1 ILE 14 -8.804 2.361 0.138 102 HD12 ILE 14 1HD1 ILE 14 -8.942 0.712 0.783 103 HD13 ILE 14 2HD1 ILE 14 -7.502 1.211 -0.135 104 H CYS 15 H CYS 15 -8.475 -2.233 -4.765 105 HA CYS 15 HA CYS 15 -9.688 -4.879 -4.025 106 HB2 CYS 15 1HB CYS 15 -9.690 -3.712 -6.496 107 HB3 CYS 15 2HB CYS 15 -8.117 -4.531 -6.517 108 HG CYS 15 HG CYS 15 -9.991 -5.902 -7.721 109 H ILE 16 H ILE 16 -8.233 -6.406 -3.210 110 HA ILE 16 HA ILE 16 -5.329 -5.911 -3.521 111 HB ILE 16 HB ILE 16 -6.604 -6.882 -0.947 112 HG12 ILE 16 1HG1 ILE 16 -5.814 -4.130 -1.839 113 HG13 ILE 16 2HG1 ILE 16 -7.206 -4.563 -1.066 114 HG21 ILE 16 1HG2 ILE 16 -3.726 -6.095 -1.551 115 HG22 ILE 16 2HG2 ILE 16 -4.368 -6.689 0.003 116 HG23 ILE 16 3HG2 ILE 16 -4.333 -7.752 -1.389 117 HD11 ILE 16 3HD1 ILE 16 -5.877 -3.264 0.443 118 HD12 ILE 16 1HD1 ILE 16 -5.761 -4.922 1.070 119 HD13 ILE 16 2HD1 ILE 16 -4.426 -4.224 0.118 120 H ASP 17 H ASP 17 -4.860 -7.476 -4.919 121 HA ASP 17 HA ASP 17 -5.945 -10.256 -4.758 122 HB2 ASP 17 1HB ASP 17 -4.745 -8.658 -6.867 123 HB3 ASP 17 2HB ASP 17 -3.701 -10.038 -6.518 124 H PHE 18 H PHE 18 -5.006 -11.421 -3.140 125 HA PHE 18 HA PHE 18 -2.669 -10.508 -1.695 126 HB2 PHE 18 1HB PHE 18 -4.523 -12.921 -1.562 127 HB3 PHE 18 2HB PHE 18 -3.074 -12.867 -0.623 128 HD1 PHE 18 1HD PHE 18 -5.997 -10.424 -1.279 129 HD2 PHE 18 2HD PHE 18 -3.309 -12.251 1.593 130 HE1 PHE 18 1HE PHE 18 -6.894 -9.041 0.450 131 HE2 PHE 18 2HE PHE 18 -4.367 -10.950 3.380 132 HZ PHE 18 HZ PHE 18 -6.183 -9.318 2.836 133 H THR 19 H THR 19 -0.880 -12.400 -1.272 134 HA THR 19 HA THR 19 0.493 -12.747 -3.731 135 HB THR 19 HB THR 19 1.820 -14.436 -2.097 136 HG1 THR 19 1HG THR 19 1.534 -13.421 0.053 137 HG21 THR 19 3HG2 THR 19 3.044 -12.483 -1.241 138 HG22 THR 19 1HG2 THR 19 1.744 -11.414 -1.799 139 HG23 THR 19 2HG2 THR 19 2.711 -12.376 -2.961 140 H ASN 20 H ASN 20 -1.740 -14.772 -1.980 141 HA ASN 20 HA ASN 20 -1.160 -17.195 -3.502 142 HB2 ASN 20 1HB ASN 20 -2.726 -18.304 -2.066 143 HB3 ASN 20 2HB ASN 20 -1.614 -17.343 -1.115 144 HD21 ASN 20 1HD2 ASN 20 -3.430 -17.903 0.442 145 HD22 ASN 20 2HD2 ASN 20 -4.626 -16.650 0.690 146 H SER 21 H SER 21 -4.127 -17.984 -3.568 147 HA SER 21 HA SER 21 -4.670 -16.652 -6.164 148 HB2 SER 21 1HB SER 21 -6.259 -18.510 -6.471 149 HB3 SER 21 2HB SER 21 -4.562 -18.981 -6.371 150 HG SER 21 HG SER 21 -6.549 -19.968 -5.054 151 H ILE 22 H ILE 22 -5.363 -15.572 -3.218 152 HA ILE 22 HA ILE 22 -8.312 -15.418 -3.571 153 HB ILE 22 HB ILE 22 -6.655 -15.062 -1.048 154 HG12 ILE 22 1HG1 ILE 22 -8.172 -17.512 -2.101 155 HG13 ILE 22 2HG1 ILE 22 -6.439 -17.384 -1.828 156 HG21 ILE 22 1HG2 ILE 22 -9.666 -15.392 -1.441 157 HG22 ILE 22 2HG2 ILE 22 -8.832 -15.275 0.124 158 HG23 ILE 22 3HG2 ILE 22 -8.832 -13.898 -0.949 159 HD11 ILE 22 3HD1 ILE 22 -8.605 -17.525 0.271 160 HD12 ILE 22 1HD1 ILE 22 -7.293 -18.667 -0.045 161 HD13 ILE 22 2HD1 ILE 22 -6.914 -17.073 0.624 162 H GLN 23 H GLN 23 -9.322 -13.394 -3.209 163 HA GLN 23 HA GLN 23 -7.608 -11.009 -3.043 164 HB2 GLN 23 1HB GLN 23 -7.881 -11.192 -5.367 165 HB3 GLN 23 2HB GLN 23 -9.568 -11.692 -5.245 166 HG2 GLN 23 1HG GLN 23 -10.240 -9.411 -4.722 167 HG3 GLN 23 2HG GLN 23 -8.562 -8.892 -4.562 168 HE21 GLN 23 1HE2 GLN 23 -7.440 -8.270 -6.367 169 HE22 GLN 23 2HE2 GLN 23 -8.027 -8.410 -8.006 170 H LYS 24 H LYS 24 -8.696 -9.268 -2.123 171 HA LYS 24 HA LYS 24 -11.420 -9.724 -1.041 172 HB2 LYS 24 1HB LYS 24 -8.958 -9.624 0.457 173 HB3 LYS 24 2HB LYS 24 -9.759 -8.144 0.790 174 HG2 LYS 24 1HG LYS 24 -10.636 -10.995 1.181 175 HG3 LYS 24 2HG LYS 24 -10.242 -9.866 2.462 176 HD2 LYS 24 1HD LYS 24 -12.785 -10.021 0.838 177 HD3 LYS 24 2HD LYS 24 -12.558 -10.473 2.515 178 HE2 LYS 24 1HE LYS 24 -11.823 -7.833 2.588 179 HE3 LYS 24 2HE LYS 24 -12.987 -7.822 1.272 180 HZ1 LYS 24 3HZ LYS 24 -13.360 -8.511 4.083 181 HZ2 LYS 24 1HZ LYS 24 -14.509 -8.926 2.963 182 HZ3 LYS 24 2HZ LYS 24 -14.107 -7.349 3.230 183 H ILE 25 H ILE 25 -12.617 -7.840 -1.047 184 HA ILE 25 HA ILE 25 -11.354 -5.447 -2.319 185 HB ILE 25 HB ILE 25 -14.211 -6.346 -2.774 186 HG12 ILE 25 1HG1 ILE 25 -13.027 -6.338 -5.256 187 HG13 ILE 25 2HG1 ILE 25 -11.670 -6.892 -4.290 188 HG21 ILE 25 1HG2 ILE 25 -14.200 -4.527 -4.450 189 HG22 ILE 25 2HG2 ILE 25 -13.891 -3.897 -2.837 190 HG23 ILE 25 3HG2 ILE 25 -12.549 -4.098 -3.994 191 HD11 ILE 25 3HD1 ILE 25 -14.442 -8.179 -4.260 192 HD12 ILE 25 1HD1 ILE 25 -13.117 -8.686 -5.307 193 HD13 ILE 25 2HD1 ILE 25 -12.943 -8.842 -3.549 194 H TYR 26 H TYR 26 -11.622 -3.621 -1.232 195 HA TYR 26 HA TYR 26 -13.005 -3.731 1.410 196 HB2 TYR 26 1HB TYR 26 -10.734 -1.910 0.520 197 HB3 TYR 26 2HB TYR 26 -11.439 -1.967 2.099 198 HD1 TYR 26 1HD TYR 26 -9.391 -3.955 -0.353 199 HD2 TYR 26 2HD TYR 26 -10.571 -3.452 3.782 200 HE1 TYR 26 1HE TYR 26 -7.973 -5.848 0.303 201 HE2 TYR 26 2HE TYR 26 -9.128 -5.328 4.431 202 HH TYR 26 HH TYR 26 -7.756 -7.012 3.694 203 H ASP 27 H ASP 27 -15.047 -2.923 0.722 204 HA ASP 27 HA ASP 27 -15.104 -0.372 -0.783 205 HB2 ASP 27 1HB ASP 27 -16.946 -1.124 -2.069 206 HB3 ASP 27 2HB ASP 27 -15.723 -2.363 -2.140 207 H ASP 28 H ASP 28 -15.866 -1.890 2.142 208 HA ASP 28 HA ASP 28 -18.104 -0.153 2.942 209 HB2 ASP 28 1HB ASP 28 -16.058 -1.618 4.686 210 HB3 ASP 28 2HB ASP 28 -17.552 -0.878 5.203 211 H SER 29 H SER 29 -17.815 1.803 4.136 212 HA SER 29 HA SER 29 -15.580 3.412 4.226 213 HB2 SER 29 1HB SER 29 -17.690 2.971 6.393 214 HB3 SER 29 2HB SER 29 -16.473 4.255 6.432 215 HG SER 29 HG SER 29 -18.357 3.885 4.311 216 H GLU 30 H GLU 30 -16.404 1.012 6.789 217 HA GLU 30 HA GLU 30 -14.092 1.552 8.321 218 HB2 GLU 30 1HB GLU 30 -16.268 -0.544 8.194 219 HB3 GLU 30 2HB GLU 30 -14.841 -0.932 9.083 220 HG2 GLU 30 1HG GLU 30 -15.551 0.234 10.863 221 HG3 GLU 30 2HG GLU 30 -15.508 1.708 9.916 222 H SER 31 H SER 31 -14.571 -0.575 5.545 223 HA SER 31 HA SER 31 -12.240 -2.207 6.122 224 HB2 SER 31 1HB SER 31 -12.661 -3.255 4.028 225 HB3 SER 31 2HB SER 31 -14.201 -3.004 4.801 226 HG SER 31 HG SER 31 -14.312 -1.016 3.387 227 H ILE 32 H ILE 32 -12.989 0.539 3.966 228 HA ILE 32 HA ILE 32 -10.390 0.902 2.848 229 HB ILE 32 HB ILE 32 -12.863 2.660 3.191 230 HG12 ILE 32 1HG1 ILE 32 -11.730 1.391 0.659 231 HG13 ILE 32 2HG1 ILE 32 -12.906 0.572 1.667 232 HG21 ILE 32 1HG2 ILE 32 -10.293 3.235 1.669 233 HG22 ILE 32 2HG2 ILE 32 -11.794 4.193 1.516 234 HG23 ILE 32 3HG2 ILE 32 -10.933 4.129 3.052 235 HD11 ILE 32 3HD1 ILE 32 -14.025 1.649 -0.196 236 HD12 ILE 32 1HD1 ILE 32 -14.537 2.380 1.338 237 HD13 ILE 32 2HD1 ILE 32 -13.391 3.229 0.277 238 H GLN 33 H GLN 33 -12.064 2.541 5.601 239 HA GLN 33 HA GLN 33 -9.980 4.391 6.111 240 HB2 GLN 33 1HB GLN 33 -12.182 3.224 7.869 241 HB3 GLN 33 2HB GLN 33 -11.071 4.488 8.433 242 HG2 GLN 33 1HG GLN 33 -11.713 5.960 6.648 243 HG3 GLN 33 2HG GLN 33 -12.767 4.762 5.908 244 HE21 GLN 33 1HE2 GLN 33 -13.882 7.207 6.441 245 HE22 GLN 33 2HE2 GLN 33 -14.918 7.107 7.849 246 H LYS 34 H LYS 34 -10.445 1.101 7.303 247 HA LYS 34 HA LYS 34 -8.366 1.065 9.244 248 HB2 LYS 34 1HB LYS 34 -10.170 -0.614 8.992 249 HB3 LYS 34 2HB LYS 34 -9.457 -1.197 7.503 250 HG2 LYS 34 1HG LYS 34 -7.441 -1.125 9.617 251 HG3 LYS 34 2HG LYS 34 -8.873 -1.940 10.236 252 HD2 LYS 34 1HD LYS 34 -7.658 -2.645 7.538 253 HD3 LYS 34 2HD LYS 34 -7.083 -3.361 9.041 254 HE2 LYS 34 1HE LYS 34 -10.038 -3.415 8.515 255 HE3 LYS 34 2HE LYS 34 -9.011 -4.502 7.566 256 HZ1 LYS 34 3HZ LYS 34 -8.206 -5.513 9.534 257 HZ2 LYS 34 1HZ LYS 34 -9.812 -5.542 9.668 258 HZ3 LYS 34 2HZ LYS 34 -8.924 -4.441 10.524 259 H ILE 35 H ILE 35 -8.350 0.049 5.750 260 HA ILE 35 HA ILE 35 -5.607 -0.435 5.610 261 HB ILE 35 HB ILE 35 -7.371 0.707 3.398 262 HG12 ILE 35 1HG1 ILE 35 -6.486 -2.154 3.907 263 HG13 ILE 35 2HG1 ILE 35 -8.069 -1.568 4.345 264 HG21 ILE 35 1HG2 ILE 35 -5.025 1.082 2.869 265 HG22 ILE 35 2HG2 ILE 35 -4.578 -0.525 3.510 266 HG23 ILE 35 3HG2 ILE 35 -5.433 -0.389 2.002 267 HD11 ILE 35 3HD1 ILE 35 -8.805 -1.347 2.160 268 HD12 ILE 35 1HD1 ILE 35 -7.216 -1.221 1.435 269 HD13 ILE 35 2HD1 ILE 35 -7.714 -2.769 2.060 270 H LEU 36 H LEU 36 -7.337 2.701 4.852 271 HA LEU 36 HA LEU 36 -4.982 4.209 4.398 272 HB2 LEU 36 1HB LEU 36 -7.816 4.837 5.267 273 HB3 LEU 36 2HB LEU 36 -6.618 6.108 5.303 274 HG LEU 36 HG LEU 36 -6.347 4.733 2.761 275 HD11 LEU 36 1HD1 LEU 36 -8.574 4.001 2.930 276 HD12 LEU 36 2HD1 LEU 36 -8.540 5.327 1.765 277 HD13 LEU 36 3HD1 LEU 36 -9.159 5.616 3.409 278 HD21 LEU 36 3HD2 LEU 36 -7.478 7.488 3.427 279 HD22 LEU 36 1HD2 LEU 36 -6.783 6.981 1.881 280 HD23 LEU 36 2HD2 LEU 36 -5.734 7.104 3.318 281 H SER 37 H SER 37 -5.917 2.952 7.508 282 HA SER 37 HA SER 37 -4.302 4.911 8.985 283 HB2 SER 37 1HB SER 37 -6.316 3.463 9.861 284 HB3 SER 37 2HB SER 37 -5.098 2.195 10.066 285 HG SER 37 HG SER 37 -3.869 3.731 11.303 286 H GLU 38 H GLU 38 -3.966 1.324 8.423 287 HA GLU 38 HA GLU 38 -1.276 1.320 9.266 288 HB2 GLU 38 1HB GLU 38 -2.736 -0.700 7.524 289 HB3 GLU 38 2HB GLU 38 -1.257 -1.004 8.421 290 HG2 GLU 38 1HG GLU 38 -3.989 -0.366 9.615 291 HG3 GLU 38 2HG GLU 38 -3.208 -1.932 9.606 292 H ILE 39 H ILE 39 -2.664 1.853 6.038 293 HA ILE 39 HA ILE 39 -0.106 1.627 4.695 294 HB ILE 39 HB ILE 39 -2.838 2.720 3.999 295 HG12 ILE 39 1HG1 ILE 39 -2.581 0.343 3.978 296 HG13 ILE 39 2HG1 ILE 39 -2.817 0.908 2.346 297 HG21 ILE 39 1HG2 ILE 39 -0.483 2.844 2.144 298 HG22 ILE 39 2HG2 ILE 39 -2.206 2.993 1.711 299 HG23 ILE 39 3HG2 ILE 39 -1.481 4.192 2.778 300 HD11 ILE 39 3HD1 ILE 39 -1.159 -0.824 2.271 301 HD12 ILE 39 1HD1 ILE 39 -0.345 0.680 1.887 302 HD13 ILE 39 2HD1 ILE 39 -0.165 -0.062 3.496 303 H ALA 40 H ALA 40 -1.399 4.054 6.778 304 HA ALA 40 HA ALA 40 0.431 6.096 5.698 305 HB1 ALA 40 1HB ALA 40 -1.925 6.763 5.941 306 HB2 ALA 40 2HB ALA 40 -1.864 6.364 7.671 307 HB3 ALA 40 3HB ALA 40 -0.879 7.688 7.030 308 H THR 41 H THR 41 0.488 3.694 7.969 309 HA THR 41 HA THR 41 1.641 5.039 10.206 310 HB THR 41 HB THR 41 0.461 2.837 10.083 311 HG1 THR 41 1HG THR 41 1.162 2.456 11.946 312 HG21 THR 41 3HG2 THR 41 2.159 1.956 8.310 313 HG22 THR 41 1HG2 THR 41 1.481 0.875 9.534 314 HG23 THR 41 2HG2 THR 41 3.150 1.539 9.705 315 H GLY 42 H GLY 42 3.119 3.629 7.239 316 HA2 GLY 42 1HA GLY 42 5.789 3.564 8.286 317 HA3 GLY 42 2HA GLY 42 5.240 3.261 6.634 318 H LYS 43 H LYS 43 7.562 4.445 6.851 319 HA LYS 43 HA LYS 43 7.066 7.371 6.385 320 HB2 LYS 43 1HB LYS 43 9.541 6.190 7.645 321 HB3 LYS 43 2HB LYS 43 9.286 7.860 7.212 322 HG2 LYS 43 1HG LYS 43 7.383 8.070 8.724 323 HG3 LYS 43 2HG LYS 43 7.522 6.386 9.226 324 HD2 LYS 43 1HD LYS 43 9.738 8.425 9.617 325 HD3 LYS 43 2HD LYS 43 8.469 8.162 10.805 326 HE2 LYS 43 1HE LYS 43 10.394 6.006 9.825 327 HE3 LYS 43 2HE LYS 43 10.601 6.951 11.301 328 HZ1 LYS 43 3HZ LYS 43 8.370 5.084 10.763 329 HZ2 LYS 43 1HZ LYS 43 8.479 5.988 12.115 330 HZ3 LYS 43 2HZ LYS 43 9.588 4.838 11.781 331 H ARG 44 H ARG 44 7.105 7.472 4.160 332 HA ARG 44 HA ARG 44 8.666 5.762 2.464 333 HB2 ARG 44 1HB ARG 44 8.403 7.564 0.729 334 HB3 ARG 44 2HB ARG 44 6.997 6.770 1.335 335 HG2 ARG 44 1HG ARG 44 6.415 9.016 1.224 336 HG3 ARG 44 2HG ARG 44 6.652 8.799 2.923 337 HD2 ARG 44 1HD ARG 44 8.646 9.959 2.914 338 HD3 ARG 44 2HD ARG 44 8.892 9.728 1.146 339 HE ARG 44 HE ARG 44 6.600 11.271 1.357 340 HH11 ARG 44 1HH1 ARG 44 10.016 11.558 2.268 341 HH12 ARG 44 2HH1 ARG 44 10.066 13.284 2.048 342 HH21 ARG 44 1HH2 ARG 44 6.683 13.490 0.990 343 HH22 ARG 44 2HH2 ARG 44 8.071 14.434 1.407 344 H THR 45 H THR 45 9.490 8.160 4.350 345 HA THR 45 HA THR 45 11.513 9.053 5.135 346 HB THR 45 HB THR 45 13.540 7.861 4.805 347 HG1 THR 45 1HG THR 45 12.342 6.789 2.503 348 HG21 THR 45 3HG2 THR 45 11.589 6.601 5.973 349 HG22 THR 45 1HG2 THR 45 13.008 5.684 5.490 350 HG23 THR 45 2HG2 THR 45 11.564 5.595 4.492 351 H GLU 46 H GLU 46 13.757 10.105 4.027 352 HA GLU 46 HA GLU 46 12.622 11.921 2.034 353 HB2 GLU 46 1HB GLU 46 14.460 13.293 2.468 354 HB3 GLU 46 2HB GLU 46 13.730 12.751 3.981 355 HG2 GLU 46 1HG GLU 46 15.624 11.086 4.193 356 HG3 GLU 46 2HG GLU 46 16.356 11.813 2.771 357 H LYS 47 H LYS 47 13.825 9.025 1.569 358 HA LYS 47 HA LYS 47 15.873 9.354 -0.439 359 HB2 LYS 47 1HB LYS 47 13.893 7.051 0.076 360 HB3 LYS 47 2HB LYS 47 15.268 7.013 -1.031 361 HG2 LYS 47 1HG LYS 47 16.772 7.606 0.894 362 HG3 LYS 47 2HG LYS 47 15.389 7.389 1.949 363 HD2 LYS 47 1HD LYS 47 16.033 5.207 2.087 364 HD3 LYS 47 2HD LYS 47 15.369 5.000 0.465 365 HE2 LYS 47 1HE LYS 47 17.563 5.624 -0.526 366 HE3 LYS 47 2HE LYS 47 18.169 5.963 1.097 367 HZ1 LYS 47 3HZ LYS 47 17.590 3.314 -0.045 368 HZ2 LYS 47 1HZ LYS 47 17.728 3.567 1.590 369 HZ3 LYS 47 2HZ LYS 47 18.976 3.894 0.601 370 H GLN 48 H GLN 48 15.472 8.327 -2.685 371 HA GLN 48 HA GLN 48 13.119 9.700 -3.951 372 HB2 GLN 48 1HB GLN 48 15.796 9.060 -5.258 373 HB3 GLN 48 2HB GLN 48 14.398 9.859 -5.979 374 HG2 GLN 48 1HG GLN 48 14.699 11.626 -4.072 375 HG3 GLN 48 2HG GLN 48 16.293 10.908 -3.865 376 HE21 GLN 48 1HE2 GLN 48 17.676 12.427 -4.717 377 HE22 GLN 48 2HE2 GLN 48 17.324 13.372 -6.180 378 H SER 49 H SER 49 11.610 8.254 -4.544 379 HA SER 49 HA SER 49 12.296 5.476 -5.201 380 HB2 SER 49 1HB SER 49 9.734 7.066 -5.156 381 HB3 SER 49 2HB SER 49 9.841 5.334 -5.664 382 HG SER 49 HG SER 49 10.078 4.825 -3.668 383 H ILE 50 H ILE 50 13.767 5.809 -6.895 384 HA ILE 50 HA ILE 50 12.870 7.132 -9.384 385 HB ILE 50 HB ILE 50 15.157 6.621 -10.164 386 HG12 ILE 50 1HG1 ILE 50 15.895 5.798 -7.334 387 HG13 ILE 50 2HG1 ILE 50 15.471 4.589 -8.546 388 HG21 ILE 50 1HG2 ILE 50 16.239 8.344 -8.844 389 HG22 ILE 50 2HG2 ILE 50 14.533 8.751 -9.003 390 HG23 ILE 50 3HG2 ILE 50 15.129 8.074 -7.482 391 HD11 ILE 50 3HD1 ILE 50 17.708 6.628 -8.896 392 HD12 ILE 50 1HD1 ILE 50 17.912 4.945 -8.431 393 HD13 ILE 50 2HD1 ILE 50 17.264 5.328 -10.028 394 H GLN 51 H GLN 51 11.326 4.958 -8.501 395 HA GLN 51 HA GLN 51 11.650 2.885 -10.547 396 HB2 GLN 51 1HB GLN 51 10.897 1.342 -8.541 397 HB3 GLN 51 2HB GLN 51 12.591 1.720 -8.740 398 HG2 GLN 51 1HG GLN 51 12.507 3.426 -7.019 399 HG3 GLN 51 2HG GLN 51 10.751 3.313 -6.903 400 HE21 GLN 51 1HE2 GLN 51 10.444 0.511 -6.761 401 HE22 GLN 51 2HE2 GLN 51 11.040 0.014 -5.198 402 H ASP 52 H ASP 52 9.647 1.687 -10.659 403 HA ASP 52 HA ASP 52 7.222 3.149 -9.727 404 HB2 ASP 52 1HB ASP 52 7.722 2.033 -12.531 405 HB3 ASP 52 2HB ASP 52 6.153 2.643 -11.948 406 H TYR 53 H TYR 53 8.842 0.390 -9.369 407 HA TYR 53 HA TYR 53 6.531 -1.324 -8.942 408 HB2 TYR 53 1HB TYR 53 8.653 -1.731 -11.075 409 HB3 TYR 53 2HB TYR 53 8.074 -3.129 -10.191 410 HD1 TYR 53 1HD TYR 53 6.893 -0.292 -12.355 411 HD2 TYR 53 2HD TYR 53 5.983 -4.147 -10.645 412 HE1 TYR 53 1HE TYR 53 4.809 -0.342 -13.613 413 HE2 TYR 53 2HE TYR 53 3.914 -4.251 -11.944 414 HH TYR 53 HH TYR 53 2.757 -1.455 -13.858 415 HA PRO 54 HA PRO 54 9.438 -2.701 -5.765 416 HB2 PRO 54 1HB PRO 54 8.691 -5.289 -5.304 417 HB3 PRO 54 2HB PRO 54 7.605 -3.905 -4.928 418 HG2 PRO 54 1HG PRO 54 7.511 -5.653 -7.385 419 HG3 PRO 54 2HG PRO 54 6.202 -5.177 -6.271 420 HD2 PRO 54 1HD PRO 54 6.712 -3.840 -8.596 421 HD3 PRO 54 2HD PRO 54 6.089 -3.019 -7.158 422 H SER 55 H SER 55 11.197 -4.380 -5.397 423 HA SER 55 HA SER 55 12.112 -5.683 -7.872 424 HB2 SER 55 1HB SER 55 13.468 -4.032 -6.129 425 HB3 SER 55 2HB SER 55 14.284 -5.611 -6.139 426 HG SER 55 HG SER 55 14.965 -4.062 -7.761 427 H ALA 56 H ALA 56 10.328 -6.406 -5.212 428 HA ALA 56 HA ALA 56 11.377 -9.093 -4.718 429 HB1 ALA 56 1HB ALA 56 8.722 -7.753 -4.006 430 HB2 ALA 56 2HB ALA 56 9.247 -9.357 -3.473 431 HB3 ALA 56 3HB ALA 56 10.128 -7.924 -2.923 432 H GLU 57 H GLU 57 9.792 -10.850 -5.139 433 HA GLU 57 HA GLU 57 8.467 -10.598 -7.787 434 HB2 GLU 57 1HB GLU 57 9.203 -12.785 -8.322 435 HB3 GLU 57 2HB GLU 57 10.604 -11.818 -7.824 436 HG2 GLU 57 1HG GLU 57 9.228 -13.889 -6.065 437 HG3 GLU 57 2HG GLU 57 10.677 -14.163 -7.014 438 H GLU 58 H GLU 58 8.278 -11.538 -4.471 439 HA GLU 58 HA GLU 58 5.538 -12.691 -4.766 440 HB2 GLU 58 1HB GLU 58 7.629 -12.900 -2.561 441 HB3 GLU 58 2HB GLU 58 5.914 -13.379 -2.377 442 HG2 GLU 58 1HG GLU 58 6.071 -15.032 -4.079 443 HG3 GLU 58 2HG GLU 58 7.702 -14.534 -4.531 444 H TYR 59 H TYR 59 4.053 -11.066 -4.579 445 HA TYR 59 HA TYR 59 4.078 -9.270 -2.312 446 HB2 TYR 59 1HB TYR 59 3.828 -7.276 -3.805 447 HB3 TYR 59 2HB TYR 59 5.462 -7.920 -3.632 448 HD1 TYR 59 2HD TYR 59 2.602 -7.454 -5.926 449 HD2 TYR 59 1HD TYR 59 6.705 -8.675 -5.513 450 HE1 TYR 59 2HE TYR 59 2.746 -7.667 -8.367 451 HE2 TYR 59 1HE TYR 59 6.890 -8.898 -7.964 452 HH TYR 59 HH TYR 59 5.486 -9.382 -9.837 453 H GLY 60 H GLY 60 1.957 -7.968 -2.442 454 HA2 GLY 60 1HA GLY 60 -0.186 -9.415 -3.939 455 HA3 GLY 60 2HA GLY 60 -0.416 -8.339 -2.572 456 H THR 61 H THR 61 -1.771 -8.059 -5.069 457 HA THR 61 HA THR 61 -0.521 -5.664 -6.367 458 HB THR 61 HB THR 61 -2.895 -7.263 -7.409 459 HG1 THR 61 1HG THR 61 -0.511 -8.345 -7.251 460 HG21 THR 61 3HG2 THR 61 -2.436 -5.028 -8.401 461 HG22 THR 61 1HG2 THR 61 -2.175 -6.341 -9.570 462 HG23 THR 61 2HG2 THR 61 -0.789 -5.568 -8.786 463 H ILE 62 H ILE 62 -1.551 -3.685 -5.969 464 HA ILE 62 HA ILE 62 -4.241 -3.779 -4.705 465 HB ILE 62 HB ILE 62 -2.067 -1.788 -4.050 466 HG12 ILE 62 1HG1 ILE 62 -2.380 -3.178 -1.737 467 HG13 ILE 62 2HG1 ILE 62 -2.618 -4.494 -2.837 468 HG21 ILE 62 1HG2 ILE 62 -4.767 -2.358 -2.770 469 HG22 ILE 62 2HG2 ILE 62 -3.553 -1.239 -2.131 470 HG23 ILE 62 3HG2 ILE 62 -4.296 -0.904 -3.672 471 HD11 ILE 62 3HD1 ILE 62 -0.212 -4.208 -2.212 472 HD12 ILE 62 1HD1 ILE 62 -0.447 -3.993 -3.939 473 HD13 ILE 62 2HD1 ILE 62 -0.224 -2.562 -2.916 474 H ASN 63 H ASN 63 -5.741 -2.415 -5.507 475 HA ASN 63 HA ASN 63 -4.920 -0.103 -7.164 476 HB2 ASN 63 1HB ASN 63 -7.624 -0.963 -7.759 477 HB3 ASN 63 2HB ASN 63 -6.319 -0.625 -8.819 478 HD21 ASN 63 1HD2 ASN 63 -4.583 -2.743 -8.798 479 HD22 ASN 63 2HD2 ASN 63 -5.443 -4.264 -8.919 480 H ILE 64 H ILE 64 -5.409 1.669 -5.806 481 HA ILE 64 HA ILE 64 -7.862 1.508 -4.103 482 HB ILE 64 HB ILE 64 -5.812 3.753 -4.377 483 HG12 ILE 64 1HG1 ILE 64 -6.156 1.885 -2.017 484 HG13 ILE 64 2HG1 ILE 64 -4.846 1.797 -3.188 485 HG21 ILE 64 1HG2 ILE 64 -7.987 3.499 -2.256 486 HG22 ILE 64 2HG2 ILE 64 -7.029 4.926 -2.681 487 HG23 ILE 64 3HG2 ILE 64 -8.278 4.332 -3.775 488 HD11 ILE 64 3HD1 ILE 64 -5.419 4.137 -1.314 489 HD12 ILE 64 1HD1 ILE 64 -4.061 3.028 -1.242 490 HD13 ILE 64 2HD1 ILE 64 -4.186 4.153 -2.605 491 H GLU 65 H GLU 65 -9.461 1.517 -5.766 492 HA GLU 65 HA GLU 65 -9.248 3.385 -8.011 493 HB2 GLU 65 1HB GLU 65 -10.303 1.149 -8.191 494 HB3 GLU 65 2HB GLU 65 -11.570 1.652 -7.068 495 HG2 GLU 65 1HG GLU 65 -12.592 3.002 -8.592 496 HG3 GLU 65 2HG GLU 65 -11.085 3.495 -9.379 497 H ASN 66 H ASN 66 -9.923 5.490 -7.846 498 HA ASN 66 HA ASN 66 -11.804 6.351 -5.827 499 HB2 ASN 66 1HB ASN 66 -10.361 7.884 -4.653 500 HB3 ASN 66 2HB ASN 66 -9.692 6.264 -4.504 501 HD21 ASN 66 1HD2 ASN 66 -7.698 5.759 -5.749 502 HD22 ASN 66 2HD2 ASN 66 -6.672 7.077 -6.281 503 H ASN 67 H ASN 67 -12.921 8.036 -6.588 504 HA ASN 67 HA ASN 67 -13.683 9.602 -7.979 505 HB2 ASN 67 1HB ASN 67 -10.836 10.565 -8.397 506 HB3 ASN 67 2HB ASN 67 -12.336 11.466 -8.532 507 HD21 ASN 67 1HD2 ASN 67 -10.076 9.937 -6.156 508 HD22 ASN 67 2HD2 ASN 67 -10.716 10.845 -4.797 509 H GLY 68 H GLY 68 -13.177 7.022 -9.119 510 HA2 GLY 68 1HA GLY 68 -13.215 5.918 -11.110 511 HA3 GLY 68 2HA GLY 68 -13.251 7.471 -11.940 512 H GLY 69 H GLY 69 -10.509 7.806 -10.232 513 HA2 GLY 69 1HA GLY 69 -8.684 6.555 -12.241 514 HA3 GLY 69 2HA GLY 69 -8.271 7.812 -11.078 515 H MET 70 H MET 70 -6.502 5.947 -10.822 516 HA MET 70 HA MET 70 -7.223 4.903 -8.229 517 HB2 MET 70 1HB MET 70 -6.370 2.627 -8.633 518 HB3 MET 70 2HB MET 70 -7.745 2.946 -9.674 519 HG2 MET 70 1HG MET 70 -5.452 3.777 -11.152 520 HG3 MET 70 2HG MET 70 -4.993 2.284 -10.358 521 HE1 MET 70 3HE MET 70 -8.583 2.582 -13.334 522 HE2 MET 70 1HE MET 70 -8.771 3.068 -11.647 523 HE3 MET 70 2HE MET 70 -7.702 4.001 -12.728 524 H THR 71 H THR 71 -5.506 4.331 -6.949 525 HA THR 71 HA THR 71 -2.789 5.136 -7.887 526 HB THR 71 HB THR 71 -3.889 4.628 -5.081 527 HG1 THR 71 1HG THR 71 -4.194 6.747 -6.243 528 HG21 THR 71 3HG2 THR 71 -1.537 3.823 -5.306 529 HG22 THR 71 1HG2 THR 71 -1.575 5.309 -4.348 530 HG23 THR 71 2HG2 THR 71 -1.075 5.362 -6.052 531 H THR 72 H THR 72 -2.091 3.300 -8.985 532 HA THR 72 HA THR 72 -2.570 0.616 -7.925 533 HB THR 72 HB THR 72 -0.537 1.629 -9.957 534 HG1 THR 72 1HG THR 72 -2.140 0.931 -11.478 535 HG21 THR 72 3HG2 THR 72 -0.052 -0.623 -9.188 536 HG22 THR 72 1HG2 THR 72 -0.728 -0.729 -10.818 537 HG23 THR 72 2HG2 THR 72 -1.747 -1.093 -9.397 538 H MET 73 H MET 73 -0.946 -0.508 -6.697 539 HA MET 73 HA MET 73 1.690 0.564 -6.197 540 HB2 MET 73 1HB MET 73 1.402 0.687 -3.717 541 HB3 MET 73 2HB MET 73 0.673 1.960 -4.658 542 HG2 MET 73 1HG MET 73 -1.508 0.368 -4.429 543 HG3 MET 73 2HG MET 73 -0.644 -0.080 -2.976 544 HE1 MET 73 3HE MET 73 0.794 3.082 -2.696 545 HE2 MET 73 1HE MET 73 -0.316 3.739 -1.479 546 HE3 MET 73 2HE MET 73 0.325 2.084 -1.305 547 H PHE 74 H PHE 74 2.776 -1.056 -4.525 548 HA PHE 74 HA PHE 74 1.594 -3.753 -4.494 549 HB2 PHE 74 1HB PHE 74 4.390 -3.241 -5.553 550 HB3 PHE 74 2HB PHE 74 3.471 -4.742 -5.522 551 HD1 PHE 74 1HD PHE 74 3.757 -1.449 -7.270 552 HD2 PHE 74 2HD PHE 74 2.051 -5.421 -7.289 553 HE1 PHE 74 1HE PHE 74 3.058 -1.136 -9.609 554 HE2 PHE 74 2HE PHE 74 1.420 -5.131 -9.667 555 HZ PHE 74 HZ PHE 74 1.866 -2.966 -10.822 556 H TYR 75 H TYR 75 2.676 -4.976 -2.621 557 HA TYR 75 HA TYR 75 4.605 -3.364 -0.990 558 HB2 TYR 75 1HB TYR 75 2.698 -5.162 0.440 559 HB3 TYR 75 2HB TYR 75 3.542 -3.790 1.048 560 HD1 TYR 75 1HD TYR 75 2.689 -1.580 -0.683 561 HD2 TYR 75 2HD TYR 75 0.439 -4.955 0.728 562 HE1 TYR 75 1HE TYR 75 0.611 -0.233 -0.849 563 HE2 TYR 75 2HE TYR 75 -1.632 -3.661 0.510 564 HH TYR 75 HH TYR 75 -2.562 -1.695 -0.027 565 H TYR 76 H TYR 76 6.061 -4.780 0.412 566 HA TYR 76 HA TYR 76 5.877 -7.651 0.067 567 HB2 TYR 76 1HB TYR 76 8.088 -7.957 -1.011 568 HB3 TYR 76 2HB TYR 76 6.886 -7.255 -2.053 569 HD1 TYR 76 2HD TYR 76 6.959 -4.837 -2.623 570 HD2 TYR 76 1HD TYR 76 10.140 -6.739 -0.473 571 HE1 TYR 76 2HE TYR 76 8.415 -2.898 -3.121 572 HE2 TYR 76 1HE TYR 76 11.662 -4.858 -1.035 573 HH TYR 76 HH TYR 76 11.880 -2.911 -2.275 574 H GLU 77 H GLU 77 8.126 -8.673 0.995 575 HA GLU 77 HA GLU 77 9.035 -7.099 3.322 576 HB2 GLU 77 1HB GLU 77 7.862 -9.338 3.795 577 HB3 GLU 77 2HB GLU 77 9.230 -10.116 3.014 578 HG2 GLU 77 1HG GLU 77 10.765 -8.977 4.654 579 HG3 GLU 77 2HG GLU 77 9.371 -8.208 5.398 580 H GLU 78 H GLU 78 11.286 -6.751 3.418 581 HA GLU 78 HA GLU 78 12.988 -8.409 1.760 582 HB2 GLU 78 1HB GLU 78 12.599 -6.593 0.220 583 HB3 GLU 78 2HB GLU 78 12.996 -5.393 1.450 584 HG2 GLU 78 1HG GLU 78 14.823 -5.662 -0.150 585 HG3 GLU 78 2HG GLU 78 15.330 -6.090 1.477 586 H ASN 79 H ASN 79 14.725 -8.962 2.820 587 HA ASN 79 HA ASN 79 16.188 -9.300 4.485 588 HB2 ASN 79 1HB ASN 79 16.322 -6.385 3.851 589 HB3 ASN 79 2HB ASN 79 17.116 -6.870 5.331 590 HD21 ASN 79 1HD2 ASN 79 16.884 -8.279 1.993 591 HD22 ASN 79 2HD2 ASN 79 18.615 -8.506 1.851 592 H GLY 80 H GLY 80 13.238 -8.363 5.444 593 HA2 GLY 80 1HA GLY 80 12.526 -9.371 7.561 594 HA3 GLY 80 2HA GLY 80 13.927 -8.650 8.344 595 H LYS 81 H LYS 81 12.676 -6.324 6.143 596 HA LYS 81 HA LYS 81 10.687 -5.202 8.033 597 HB2 LYS 81 1HB LYS 81 12.995 -3.969 6.547 598 HB3 LYS 81 2HB LYS 81 11.456 -3.163 6.351 599 HG2 LYS 81 1HG LYS 81 12.581 -2.137 8.155 600 HG3 LYS 81 2HG LYS 81 11.195 -3.046 8.812 601 HD2 LYS 81 1HD LYS 81 12.961 -4.917 9.266 602 HD3 LYS 81 2HD LYS 81 14.147 -3.630 9.078 603 HE2 LYS 81 1HE LYS 81 13.127 -2.360 10.893 604 HE3 LYS 81 2HE LYS 81 11.740 -3.470 10.926 605 HZ1 LYS 81 3HZ LYS 81 14.495 -4.136 11.640 606 HZ2 LYS 81 1HZ LYS 81 13.262 -5.234 11.568 607 HZ3 LYS 81 2HZ LYS 81 13.232 -4.016 12.684 608 H TYR 82 H TYR 82 8.830 -4.147 6.866 609 HA TYR 82 HA TYR 82 8.508 -5.362 4.186 610 HB2 TYR 82 1HB TYR 82 6.418 -4.400 6.123 611 HB3 TYR 82 2HB TYR 82 6.143 -5.101 4.553 612 HD1 TYR 82 2HD TYR 82 7.271 -5.708 8.027 613 HD2 TYR 82 1HD TYR 82 6.225 -7.550 4.272 614 HE1 TYR 82 2HE TYR 82 7.144 -7.896 9.156 615 HE2 TYR 82 1HE TYR 82 6.115 -9.762 5.385 616 HH TYR 82 HH TYR 82 6.944 -10.165 8.837 617 H TYR 83 H TYR 83 7.401 -3.976 2.595 618 HA TYR 83 HA TYR 83 7.914 -1.105 2.949 619 HB2 TYR 83 1HB TYR 83 9.188 -2.773 0.766 620 HB3 TYR 83 2HB TYR 83 9.254 -1.025 0.919 621 HD1 TYR 83 1HD TYR 83 10.636 0.109 2.540 622 HD2 TYR 83 2HD TYR 83 10.548 -4.193 2.337 623 HE1 TYR 83 1HE TYR 83 12.692 -0.010 3.956 624 HE2 TYR 83 2HE TYR 83 12.534 -4.341 3.739 625 HH TYR 83 HH TYR 83 14.234 -3.083 4.878 626 H ILE 84 H ILE 84 6.985 0.209 1.246 627 HA ILE 84 HA ILE 84 4.796 -1.068 -0.303 628 HB ILE 84 HB ILE 84 4.690 1.458 1.386 629 HG12 ILE 84 1HG1 ILE 84 2.553 0.394 2.257 630 HG13 ILE 84 2HG1 ILE 84 3.089 -1.111 1.558 631 HG21 ILE 84 1HG2 ILE 84 3.636 2.139 -0.592 632 HG22 ILE 84 2HG2 ILE 84 2.771 0.625 -0.774 633 HG23 ILE 84 3HG2 ILE 84 2.335 1.754 0.526 634 HD11 ILE 84 3HD1 ILE 84 4.782 -1.373 3.126 635 HD12 ILE 84 1HD1 ILE 84 4.835 0.379 3.515 636 HD13 ILE 84 2HD1 ILE 84 3.458 -0.621 4.030 637 H GLU 85 H GLU 85 4.934 -0.635 -2.369 638 HA GLU 85 HA GLU 85 6.815 1.154 -3.557 639 HB2 GLU 85 1HB GLU 85 6.013 -1.156 -4.322 640 HB3 GLU 85 2HB GLU 85 4.492 -0.408 -4.744 641 HG2 GLU 85 1HG GLU 85 7.155 0.243 -6.009 642 HG3 GLU 85 2HG GLU 85 5.945 -0.866 -6.669 643 H CYS 86 H CYS 86 6.302 2.866 -5.056 644 HA CYS 86 HA CYS 86 3.932 4.026 -5.562 645 HB2 CYS 86 1HB CYS 86 4.891 4.673 -2.858 646 HB3 CYS 86 2HB CYS 86 4.899 6.158 -3.783 647 HG CYS 86 HG CYS 86 2.608 3.835 -3.433 648 HA PRO 87 HA PRO 87 7.009 6.446 -8.037 649 HB2 PRO 87 1HB PRO 87 5.928 8.890 -8.459 650 HB3 PRO 87 2HB PRO 87 5.162 7.454 -9.147 651 HG2 PRO 87 1HG PRO 87 4.491 8.904 -6.577 652 HG3 PRO 87 2HG PRO 87 3.365 8.350 -7.844 653 HD2 PRO 87 1HD PRO 87 3.831 6.910 -5.579 654 HD3 PRO 87 2HD PRO 87 3.439 6.157 -7.095 655 H TYR 88 H TYR 88 7.785 9.112 -7.698 656 HA TYR 88 HA TYR 88 9.951 8.879 -6.335 657 HB2 TYR 88 1HB TYR 88 8.309 11.446 -6.244 658 HB3 TYR 88 2HB TYR 88 10.059 11.315 -6.078 659 HD1 TYR 88 1HD TYR 88 11.467 10.505 -8.009 660 HD2 TYR 88 2HD TYR 88 7.262 11.455 -8.440 661 HE1 TYR 88 1HE TYR 88 11.719 10.507 -10.441 662 HE2 TYR 88 2HE TYR 88 7.535 11.515 -10.888 663 HH TYR 88 HH TYR 88 9.982 9.973 -12.407 664 H LYS 89 H LYS 89 7.065 8.831 -4.453 665 HA LYS 89 HA LYS 89 8.708 9.147 -2.060 666 HB2 LYS 89 1HB LYS 89 5.769 9.887 -2.069 667 HB3 LYS 89 2HB LYS 89 6.934 10.110 -0.775 668 HG2 LYS 89 1HG LYS 89 7.242 12.189 -1.425 669 HG3 LYS 89 2HG LYS 89 7.993 11.657 -2.889 670 HD2 LYS 89 1HD LYS 89 4.967 11.986 -2.558 671 HD3 LYS 89 2HD LYS 89 6.033 13.291 -3.145 672 HE2 LYS 89 1HE LYS 89 6.664 12.084 -5.082 673 HE3 LYS 89 2HE LYS 89 6.095 10.563 -4.414 674 HZ1 LYS 89 3HZ LYS 89 4.577 11.354 -6.092 675 HZ2 LYS 89 1HZ LYS 89 4.378 12.773 -5.342 676 HZ3 LYS 89 2HZ LYS 89 3.795 11.366 -4.669 677 H GLY 90 H GLY 90 8.472 6.738 -3.356 678 HA2 GLY 90 1HA GLY 90 6.664 5.178 -1.562 679 HA3 GLY 90 2HA GLY 90 7.053 4.789 -3.234 680 H ILE 91 H ILE 91 8.774 5.377 -0.136 681 HA ILE 91 HA ILE 91 9.999 2.720 -0.421 682 HB ILE 91 HB ILE 91 11.694 5.058 0.515 683 HG12 ILE 91 1HG1 ILE 91 11.420 3.948 -2.270 684 HG13 ILE 91 2HG1 ILE 91 11.535 5.605 -1.661 685 HG21 ILE 91 1HG2 ILE 91 13.508 3.546 0.576 686 HG22 ILE 91 2HG2 ILE 91 12.160 2.727 1.390 687 HG23 ILE 91 3HG2 ILE 91 12.568 2.278 -0.262 688 HD11 ILE 91 3HD1 ILE 91 13.807 3.584 -1.936 689 HD12 ILE 91 1HD1 ILE 91 13.484 4.996 -2.953 690 HD13 ILE 91 2HD1 ILE 91 13.957 5.226 -1.270 691 H TYR 92 H TYR 92 7.782 3.032 0.858 692 HA TYR 92 HA TYR 92 8.119 4.191 3.562 693 HB2 TYR 92 1HB TYR 92 5.757 2.474 2.806 694 HB3 TYR 92 2HB TYR 92 5.921 3.511 4.164 695 HD1 TYR 92 2HD TYR 92 5.505 3.542 0.416 696 HD2 TYR 92 1HD TYR 92 5.324 5.779 4.121 697 HE1 TYR 92 2HE TYR 92 4.529 5.467 -0.774 698 HE2 TYR 92 1HE TYR 92 4.519 7.770 2.857 699 HH TYR 92 HH TYR 92 4.086 7.796 -0.635 700 H GLU 93 H GLU 93 9.722 3.176 4.459 701 HA GLU 93 HA GLU 93 9.912 0.317 4.975 702 HB2 GLU 93 1HB GLU 93 11.839 1.848 4.952 703 HB3 GLU 93 2HB GLU 93 11.055 2.898 6.117 704 HG2 GLU 93 1HG GLU 93 11.290 0.251 7.296 705 HG3 GLU 93 2HG GLU 93 12.839 0.682 6.540 706 H ILE 94 H ILE 94 8.463 -0.705 6.209 707 HA ILE 94 HA ILE 94 7.482 0.567 8.716 708 HB ILE 94 HB ILE 94 5.540 -0.904 8.671 709 HG12 ILE 94 1HG1 ILE 94 6.446 -1.700 5.900 710 HG13 ILE 94 2HG1 ILE 94 6.359 -2.708 7.335 711 HG21 ILE 94 1HG2 ILE 94 5.674 0.861 6.200 712 HG22 ILE 94 2HG2 ILE 94 4.212 0.376 7.094 713 HG23 ILE 94 3HG2 ILE 94 5.411 1.386 7.891 714 HD11 ILE 94 3HD1 ILE 94 3.888 -2.469 7.368 715 HD12 ILE 94 1HD1 ILE 94 3.971 -1.505 5.904 716 HD13 ILE 94 2HD1 ILE 94 4.456 -3.198 5.863 717 H GLU 95 H GLU 95 7.317 -1.055 10.482 718 HA GLU 95 HA GLU 95 9.374 -3.170 10.138 719 HB2 GLU 95 1HB GLU 95 9.949 -2.986 12.449 720 HB3 GLU 95 2HB GLU 95 10.048 -1.420 11.662 721 HG2 GLU 95 1HG GLU 95 7.965 -0.677 12.744 722 HG3 GLU 95 2HG GLU 95 7.753 -2.275 13.480 723 H ASN 96 H ASN 96 6.185 -2.836 10.143 724 HA ASN 96 HA ASN 96 5.745 -5.553 11.306 725 HB2 ASN 96 1HB ASN 96 3.680 -3.304 11.042 726 HB3 ASN 96 2HB ASN 96 3.382 -4.870 11.761 727 HD21 ASN 96 1HD2 ASN 96 3.947 -5.238 13.936 728 HD22 ASN 96 2HD2 ASN 96 4.543 -3.956 14.957 729 H ASN 97 H ASN 97 3.856 -6.743 10.335 730 HA ASN 97 HA ASN 97 4.278 -6.849 7.445 731 HB2 ASN 97 1HB ASN 97 4.068 -8.908 8.810 732 HB3 ASN 97 2HB ASN 97 2.465 -8.388 9.366 733 HD21 ASN 97 1HD2 ASN 97 4.232 -8.977 6.249 734 HD22 ASN 97 2HD2 ASN 97 2.831 -9.648 5.437 735 H PHE 98 H PHE 98 2.611 -6.525 5.802 736 HA PHE 98 HA PHE 98 0.485 -4.665 6.545 737 HB2 PHE 98 1HB PHE 98 1.700 -4.492 4.394 738 HB3 PHE 98 2HB PHE 98 1.042 -6.052 3.899 739 HD1 PHE 98 2HD PHE 98 -0.005 -2.675 5.145 740 HD2 PHE 98 1HD PHE 98 -1.049 -6.084 2.734 741 HE1 PHE 98 2HE PHE 98 -2.042 -1.525 4.433 742 HE2 PHE 98 1HE PHE 98 -3.101 -4.950 1.999 743 HZ PHE 98 HZ PHE 98 -3.643 -2.657 2.856 744 H GLU 99 H GLU 99 0.540 -8.016 5.229 745 HA GLU 99 HA GLU 99 -2.249 -8.077 4.864 746 HB2 GLU 99 1HB GLU 99 -0.073 -10.148 4.700 747 HB3 GLU 99 2HB GLU 99 -1.776 -10.640 4.595 748 HG2 GLU 99 1HG GLU 99 -2.193 -9.119 2.732 749 HG3 GLU 99 2HG GLU 99 -0.557 -8.464 2.854 750 H ASP 100 H ASP 100 -0.503 -8.805 7.782 751 HA ASP 100 HA ASP 100 -2.684 -10.408 8.927 752 HB2 ASP 100 1HB ASP 100 -0.189 -10.643 9.466 753 HB3 ASP 100 2HB ASP 100 -0.326 -9.131 10.378 754 H MET 101 H MET 101 -2.027 -7.100 8.534 755 HA MET 101 HA MET 101 -3.400 -6.202 10.998 756 HB2 MET 101 1HB MET 101 -1.888 -4.721 8.807 757 HB3 MET 101 2HB MET 101 -2.579 -3.973 10.239 758 HG2 MET 101 1HG MET 101 -0.586 -6.248 10.498 759 HG3 MET 101 2HG MET 101 -0.078 -4.605 10.246 760 HE1 MET 101 3HE MET 101 1.208 -5.647 12.437 761 HE2 MET 101 1HE MET 101 1.117 -3.873 12.386 762 HE3 MET 101 2HE MET 101 0.812 -4.739 13.906 763 H ILE 102 H ILE 102 -4.099 -6.781 7.683 764 HA ILE 102 HA ILE 102 -6.237 -4.773 7.517 765 HB ILE 102 HB ILE 102 -6.630 -5.806 5.247 766 HG12 ILE 102 1HG1 ILE 102 -4.009 -7.214 5.907 767 HG13 ILE 102 2HG1 ILE 102 -5.544 -7.992 5.580 768 HG21 ILE 102 1HG2 ILE 102 -5.377 -3.683 5.710 769 HG22 ILE 102 2HG2 ILE 102 -3.873 -4.604 5.734 770 HG23 ILE 102 3HG2 ILE 102 -4.850 -4.529 4.244 771 HD11 ILE 102 3HD1 ILE 102 -5.343 -6.884 3.211 772 HD12 ILE 102 1HD1 ILE 102 -3.671 -6.559 3.688 773 HD13 ILE 102 2HD1 ILE 102 -4.239 -8.219 3.619 Start of MODEL 2 1 H1 GLY 1 H GLY 1 4.920 14.587 5.390 2 HA2 GLY 1 1HA GLY 1 6.848 12.531 4.450 3 HA3 GLY 1 2HA GLY 1 6.534 12.911 6.158 4 H SER 2 H SER 2 6.211 10.290 5.067 5 HA SER 2 HA SER 2 4.777 8.556 4.886 6 HB2 SER 2 1HB SER 2 2.724 10.207 6.364 7 HB3 SER 2 2HB SER 2 2.908 8.449 6.349 8 HG SER 2 HG SER 2 3.796 9.330 8.213 9 HA PRO 3 HA PRO 3 2.769 8.962 1.168 10 HB2 PRO 3 1HB PRO 3 0.500 7.413 1.021 11 HB3 PRO 3 2HB PRO 3 2.160 6.760 1.081 12 HG2 PRO 3 1HG PRO 3 0.203 7.090 3.335 13 HG3 PRO 3 2HG PRO 3 1.256 5.690 2.942 14 HD2 PRO 3 1HD PRO 3 1.906 7.521 4.863 15 HD3 PRO 3 2HD PRO 3 3.152 6.734 3.851 16 H ILE 4 H ILE 4 1.124 9.773 -0.161 17 HA ILE 4 HA ILE 4 -0.920 11.479 1.145 18 HB ILE 4 HB ILE 4 0.472 11.916 -1.522 19 HG12 ILE 4 1HG1 ILE 4 0.697 13.315 1.197 20 HG13 ILE 4 2HG1 ILE 4 1.965 12.416 0.365 21 HG21 ILE 4 1HG2 ILE 4 -0.845 13.984 -1.608 22 HG22 ILE 4 2HG2 ILE 4 -1.941 12.618 -1.467 23 HG23 ILE 4 3HG2 ILE 4 -1.601 13.621 -0.039 24 HD11 ILE 4 3HD1 ILE 4 2.447 14.727 0.140 25 HD12 ILE 4 1HD1 ILE 4 1.931 14.118 -1.450 26 HD13 ILE 4 2HD1 ILE 4 0.821 15.095 -0.471 27 H LEU 5 H LEU 5 -2.856 10.631 0.925 28 HA LEU 5 HA LEU 5 -3.518 8.713 -1.229 29 HB2 LEU 5 1HB LEU 5 -4.876 7.525 0.574 30 HB3 LEU 5 2HB LEU 5 -3.144 7.283 0.613 31 HG LEU 5 HG LEU 5 -4.123 9.511 2.343 32 HD11 LEU 5 1HD1 LEU 5 -5.950 8.013 2.733 33 HD12 LEU 5 2HD1 LEU 5 -4.891 8.010 4.139 34 HD13 LEU 5 3HD1 LEU 5 -4.844 6.636 3.005 35 HD21 LEU 5 3HD2 LEU 5 -1.736 8.578 2.320 36 HD22 LEU 5 1HD2 LEU 5 -2.387 7.091 3.038 37 HD23 LEU 5 2HD2 LEU 5 -2.507 8.625 3.912 38 HA PRO 6 HA PRO 6 -7.164 11.280 -1.545 39 HB2 PRO 6 1HB PRO 6 -9.148 9.524 -2.225 40 HB3 PRO 6 2HB PRO 6 -7.839 9.929 -3.333 41 HG2 PRO 6 1HG PRO 6 -8.009 7.551 -1.470 42 HG3 PRO 6 2HG PRO 6 -7.653 7.565 -3.236 43 HD2 PRO 6 1HD PRO 6 -5.656 7.475 -1.440 44 HD3 PRO 6 2HD PRO 6 -5.512 8.523 -2.877 45 H LYS 7 H LYS 7 -9.692 11.350 -0.638 46 HA LYS 7 HA LYS 7 -9.741 10.988 2.200 47 HB2 LYS 7 1HB LYS 7 -12.171 10.849 0.376 48 HB3 LYS 7 2HB LYS 7 -12.053 11.339 2.042 49 HG2 LYS 7 1HG LYS 7 -10.379 13.144 0.575 50 HG3 LYS 7 2HG LYS 7 -11.854 12.951 -0.377 51 HD2 LYS 7 1HD LYS 7 -11.649 13.615 2.554 52 HD3 LYS 7 2HD LYS 7 -11.970 14.813 1.273 53 HE2 LYS 7 1HE LYS 7 -14.065 13.537 0.683 54 HE3 LYS 7 2HE LYS 7 -13.741 12.457 2.044 55 HZ1 LYS 7 3HZ LYS 7 -14.448 15.305 2.163 56 HZ2 LYS 7 1HZ LYS 7 -13.911 14.441 3.486 57 HZ3 LYS 7 2HZ LYS 7 -15.295 14.016 2.751 58 H ALA 8 H ALA 8 -11.420 9.460 3.255 59 HA ALA 8 HA ALA 8 -11.340 6.758 2.157 60 HB1 ALA 8 1HB ALA 8 -11.534 7.371 4.646 61 HB2 ALA 8 2HB ALA 8 -13.177 7.931 4.313 62 HB3 ALA 8 3HB ALA 8 -12.736 6.224 4.043 63 H GLU 9 H GLU 9 -13.909 9.249 2.552 64 HA GLU 9 HA GLU 9 -15.808 7.436 1.506 65 HB2 GLU 9 1HB GLU 9 -17.400 9.236 1.681 66 HB3 GLU 9 2HB GLU 9 -16.235 9.406 3.007 67 HG2 GLU 9 1HG GLU 9 -14.946 11.030 1.477 68 HG3 GLU 9 2HG GLU 9 -16.309 10.971 0.387 69 H ASN 10 H ASN 10 -13.648 9.284 -0.324 70 HA ASN 10 HA ASN 10 -15.297 9.396 -2.789 71 HB2 ASN 10 1HB ASN 10 -13.499 10.652 -3.742 72 HB3 ASN 10 2HB ASN 10 -13.815 11.325 -2.145 73 HD21 ASN 10 1HD2 ASN 10 -12.141 8.482 -1.476 74 HD22 ASN 10 2HD2 ASN 10 -10.620 9.212 -1.212 75 H VAL 11 H VAL 11 -13.638 6.961 -1.199 76 HA VAL 11 HA VAL 11 -12.370 5.780 -3.586 77 HB VAL 11 HB VAL 11 -12.475 4.940 -0.647 78 HG11 VAL 11 1HG1 VAL 11 -10.823 3.247 -1.297 79 HG12 VAL 11 2HG1 VAL 11 -12.410 2.951 -1.999 80 HG13 VAL 11 3HG1 VAL 11 -11.107 3.611 -3.013 81 HG21 VAL 11 3HG2 VAL 11 -10.280 6.156 -2.396 82 HG22 VAL 11 1HG2 VAL 11 -11.047 6.822 -0.969 83 HG23 VAL 11 2HG2 VAL 11 -10.010 5.426 -0.782 84 H ASP 12 H ASP 12 -13.642 4.671 -4.857 85 HA ASP 12 HA ASP 12 -16.360 3.895 -4.081 86 HB2 ASP 12 1HB ASP 12 -15.538 4.656 -6.421 87 HB3 ASP 12 2HB ASP 12 -14.887 3.031 -6.590 88 H SER 13 H SER 13 -13.180 2.201 -4.771 89 HA SER 13 HA SER 13 -13.830 0.540 -2.499 90 HB2 SER 13 1HB SER 13 -13.375 -1.624 -3.690 91 HB3 SER 13 2HB SER 13 -14.925 -0.877 -4.089 92 HG SER 13 HG SER 13 -14.162 -0.251 -6.023 93 H ILE 14 H ILE 14 -11.966 -0.540 -1.642 94 HA ILE 14 HA ILE 14 -9.370 0.037 -2.999 95 HB ILE 14 HB ILE 14 -9.762 -1.037 -0.186 96 HG12 ILE 14 1HG1 ILE 14 -8.995 1.756 -1.099 97 HG13 ILE 14 2HG1 ILE 14 -10.505 1.293 -0.292 98 HG21 ILE 14 1HG2 ILE 14 -7.404 -0.826 0.102 99 HG22 ILE 14 2HG2 ILE 14 -7.626 -1.705 -1.393 100 HG23 ILE 14 3HG2 ILE 14 -7.213 0.022 -1.438 101 HD11 ILE 14 3HD1 ILE 14 -7.749 1.274 0.966 102 HD12 ILE 14 1HD1 ILE 14 -9.080 2.376 1.307 103 HD13 ILE 14 2HD1 ILE 14 -9.242 0.658 1.723 104 H CYS 15 H CYS 15 -8.297 -1.779 -3.784 105 HA CYS 15 HA CYS 15 -9.625 -4.435 -3.468 106 HB2 CYS 15 1HB CYS 15 -10.185 -3.350 -5.668 107 HB3 CYS 15 2HB CYS 15 -8.454 -3.328 -6.056 108 HG CYS 15 HG CYS 15 -9.903 -5.254 -7.220 109 H ILE 16 H ILE 16 -8.176 -5.718 -2.416 110 HA ILE 16 HA ILE 16 -5.282 -5.141 -2.756 111 HB ILE 16 HB ILE 16 -6.593 -6.355 -0.304 112 HG12 ILE 16 1HG1 ILE 16 -5.337 -3.602 -0.744 113 HG13 ILE 16 2HG1 ILE 16 -7.054 -3.919 -0.487 114 HG21 ILE 16 1HG2 ILE 16 -4.346 -6.329 0.661 115 HG22 ILE 16 2HG2 ILE 16 -4.308 -7.233 -0.831 116 HG23 ILE 16 3HG2 ILE 16 -3.685 -5.575 -0.807 117 HD11 ILE 16 3HD1 ILE 16 -6.596 -4.726 1.799 118 HD12 ILE 16 1HD1 ILE 16 -4.870 -4.366 1.578 119 HD13 ILE 16 2HD1 ILE 16 -6.038 -3.060 1.541 120 H ASP 17 H ASP 17 -4.338 -6.613 -3.897 121 HA ASP 17 HA ASP 17 -5.434 -9.357 -4.191 122 HB2 ASP 17 1HB ASP 17 -4.736 -7.887 -6.245 123 HB3 ASP 17 2HB ASP 17 -3.093 -8.186 -5.696 124 H PHE 18 H PHE 18 -4.475 -10.822 -2.889 125 HA PHE 18 HA PHE 18 -2.248 -10.079 -1.147 126 HB2 PHE 18 1HB PHE 18 -4.147 -12.419 -1.484 127 HB3 PHE 18 2HB PHE 18 -2.761 -12.582 -0.470 128 HD1 PHE 18 1HD PHE 18 -5.404 -9.874 -0.999 129 HD2 PHE 18 2HD PHE 18 -3.104 -12.219 1.806 130 HE1 PHE 18 1HE PHE 18 -6.653 -8.888 0.806 131 HE2 PHE 18 2HE PHE 18 -4.369 -11.183 3.670 132 HZ PHE 18 HZ PHE 18 -6.204 -9.558 3.192 133 H THR 19 H THR 19 -0.471 -11.868 -0.887 134 HA THR 19 HA THR 19 0.956 -12.182 -3.394 135 HB THR 19 HB THR 19 2.258 -13.959 -2.030 136 HG1 THR 19 1HG THR 19 0.663 -14.387 -0.441 137 HG21 THR 19 3HG2 THR 19 3.372 -12.250 -0.633 138 HG22 THR 19 1HG2 THR 19 2.033 -11.116 -0.962 139 HG23 THR 19 2HG2 THR 19 3.084 -11.698 -2.284 140 H ASN 20 H ASN 20 -1.044 -14.330 -1.472 141 HA ASN 20 HA ASN 20 -1.166 -16.567 -3.350 142 HB2 ASN 20 1HB ASN 20 -2.989 -17.299 -1.704 143 HB3 ASN 20 2HB ASN 20 -1.342 -17.233 -1.097 144 HD21 ASN 20 1HD2 ASN 20 -4.445 -16.540 -0.060 145 HD22 ASN 20 2HD2 ASN 20 -4.005 -15.241 1.032 146 H SER 21 H SER 21 -3.438 -17.102 -4.316 147 HA SER 21 HA SER 21 -3.657 -14.688 -5.904 148 HB2 SER 21 1HB SER 21 -4.478 -16.146 -7.617 149 HB3 SER 21 2HB SER 21 -3.056 -16.883 -6.855 150 HG SER 21 HG SER 21 -5.649 -17.538 -5.989 151 H ILE 22 H ILE 22 -4.971 -14.027 -3.728 152 HA ILE 22 HA ILE 22 -7.872 -14.443 -4.231 153 HB ILE 22 HB ILE 22 -6.600 -14.030 -1.518 154 HG12 ILE 22 1HG1 ILE 22 -7.302 -16.750 -2.678 155 HG13 ILE 22 2HG1 ILE 22 -5.671 -16.153 -2.327 156 HG21 ILE 22 1HG2 ILE 22 -8.790 -14.828 -0.715 157 HG22 ILE 22 2HG2 ILE 22 -9.071 -13.570 -1.905 158 HG23 ILE 22 3HG2 ILE 22 -9.262 -15.280 -2.367 159 HD11 ILE 22 3HD1 ILE 22 -7.823 -16.866 -0.333 160 HD12 ILE 22 1HD1 ILE 22 -6.185 -17.521 -0.499 161 HD13 ILE 22 2HD1 ILE 22 -6.438 -15.869 0.108 162 H GLN 23 H GLN 23 -8.910 -12.609 -4.239 163 HA GLN 23 HA GLN 23 -7.461 -10.061 -3.708 164 HB2 GLN 23 1HB GLN 23 -7.370 -10.580 -6.064 165 HB3 GLN 23 2HB GLN 23 -9.131 -10.699 -6.166 166 HG2 GLN 23 1HG GLN 23 -9.392 -8.376 -5.839 167 HG3 GLN 23 2HG GLN 23 -7.788 -8.180 -5.111 168 HE21 GLN 23 1HE2 GLN 23 -8.750 -9.763 -8.244 169 HE22 GLN 23 2HE2 GLN 23 -7.458 -8.950 -9.082 170 H LYS 24 H LYS 24 -8.447 -9.060 -2.201 171 HA LYS 24 HA LYS 24 -11.358 -9.583 -1.719 172 HB2 LYS 24 1HB LYS 24 -9.293 -9.994 0.065 173 HB3 LYS 24 2HB LYS 24 -9.714 -8.348 0.458 174 HG2 LYS 24 1HG LYS 24 -12.116 -10.016 0.229 175 HG3 LYS 24 2HG LYS 24 -10.953 -10.761 1.309 176 HD2 LYS 24 1HD LYS 24 -12.516 -9.420 2.566 177 HD3 LYS 24 2HD LYS 24 -10.905 -8.688 2.691 178 HE2 LYS 24 1HE LYS 24 -11.454 -7.015 1.031 179 HE3 LYS 24 2HE LYS 24 -12.910 -7.882 0.560 180 HZ1 LYS 24 3HZ LYS 24 -13.419 -5.989 1.857 181 HZ2 LYS 24 1HZ LYS 24 -12.527 -6.539 3.158 182 HZ3 LYS 24 2HZ LYS 24 -13.883 -7.325 2.679 183 H ILE 25 H ILE 25 -12.752 -7.807 -1.633 184 HA ILE 25 HA ILE 25 -11.552 -5.218 -2.424 185 HB ILE 25 HB ILE 25 -14.247 -6.346 -3.285 186 HG12 ILE 25 1HG1 ILE 25 -12.851 -6.057 -5.607 187 HG13 ILE 25 2HG1 ILE 25 -11.509 -6.435 -4.541 188 HG21 ILE 25 1HG2 ILE 25 -14.199 -4.402 -4.830 189 HG22 ILE 25 2HG2 ILE 25 -14.194 -3.883 -3.154 190 HG23 ILE 25 3HG2 ILE 25 -12.684 -3.849 -4.103 191 HD11 ILE 25 3HD1 ILE 25 -13.978 -8.153 -5.017 192 HD12 ILE 25 1HD1 ILE 25 -12.349 -8.418 -5.677 193 HD13 ILE 25 2HD1 ILE 25 -12.635 -8.592 -3.939 194 H TYR 26 H TYR 26 -12.229 -3.473 -1.376 195 HA TYR 26 HA TYR 26 -13.757 -3.829 1.162 196 HB2 TYR 26 1HB TYR 26 -11.205 -2.282 0.589 197 HB3 TYR 26 2HB TYR 26 -12.021 -2.300 2.115 198 HD1 TYR 26 2HD TYR 26 -10.062 -4.319 -0.307 199 HD2 TYR 26 1HD TYR 26 -11.459 -4.014 3.761 200 HE1 TYR 26 2HE TYR 26 -8.654 -6.246 0.338 201 HE2 TYR 26 1HE TYR 26 -10.061 -5.939 4.394 202 HH TYR 26 HH TYR 26 -8.640 -7.626 3.658 203 H ASP 27 H ASP 27 -15.603 -3.044 0.203 204 HA ASP 27 HA ASP 27 -15.585 -0.244 -0.866 205 HB2 ASP 27 1HB ASP 27 -17.461 -0.828 -2.204 206 HB3 ASP 27 2HB ASP 27 -16.251 -2.075 -2.485 207 H ASP 28 H ASP 28 -16.605 -2.431 1.608 208 HA ASP 28 HA ASP 28 -18.868 -1.022 2.674 209 HB2 ASP 28 1HB ASP 28 -17.169 -2.384 4.670 210 HB3 ASP 28 2HB ASP 28 -18.848 -2.636 4.259 211 H SER 29 H SER 29 -18.775 0.806 4.082 212 HA SER 29 HA SER 29 -16.632 2.512 3.812 213 HB2 SER 29 1HB SER 29 -19.015 3.016 4.573 214 HB3 SER 29 2HB SER 29 -18.504 2.575 6.210 215 HG SER 29 HG SER 29 -17.427 4.596 4.539 216 H GLU 30 H GLU 30 -17.192 0.331 6.603 217 HA GLU 30 HA GLU 30 -14.932 1.203 8.150 218 HB2 GLU 30 1HB GLU 30 -17.069 -0.181 8.815 219 HB3 GLU 30 2HB GLU 30 -16.212 -1.566 8.189 220 HG2 GLU 30 1HG GLU 30 -15.849 -1.504 10.547 221 HG3 GLU 30 2HG GLU 30 -14.317 -1.082 9.782 222 H SER 31 H SER 31 -15.369 -1.071 5.491 223 HA SER 31 HA SER 31 -13.046 -2.672 5.962 224 HB2 SER 31 1HB SER 31 -13.470 -3.720 3.955 225 HB3 SER 31 2HB SER 31 -15.053 -3.308 4.557 226 HG SER 31 HG SER 31 -15.017 -1.475 3.144 227 H ILE 32 H ILE 32 -13.799 0.193 3.974 228 HA ILE 32 HA ILE 32 -11.212 0.642 2.914 229 HB ILE 32 HB ILE 32 -13.496 2.599 3.393 230 HG12 ILE 32 1HG1 ILE 32 -12.847 1.082 0.835 231 HG13 ILE 32 2HG1 ILE 32 -14.104 0.565 1.950 232 HG21 ILE 32 1HG2 ILE 32 -11.479 2.868 1.151 233 HG22 ILE 32 2HG2 ILE 32 -12.466 4.112 1.936 234 HG23 ILE 32 3HG2 ILE 32 -11.047 3.421 2.756 235 HD11 ILE 32 3HD1 ILE 32 -15.108 1.803 0.132 236 HD12 ILE 32 1HD1 ILE 32 -15.294 2.716 1.639 237 HD13 ILE 32 2HD1 ILE 32 -14.075 3.203 0.439 238 H GLN 33 H GLN 33 -12.884 2.150 5.780 239 HA GLN 33 HA GLN 33 -11.041 4.095 6.343 240 HB2 GLN 33 1HB GLN 33 -12.882 2.586 8.170 241 HB3 GLN 33 2HB GLN 33 -11.724 3.739 8.827 242 HG2 GLN 33 1HG GLN 33 -12.861 5.161 6.677 243 HG3 GLN 33 2HG GLN 33 -14.212 4.241 7.313 244 HE21 GLN 33 1HE2 GLN 33 -11.376 5.990 8.876 245 HE22 GLN 33 2HE2 GLN 33 -12.416 6.815 10.018 246 H LYS 34 H LYS 34 -10.811 0.807 7.707 247 HA LYS 34 HA LYS 34 -8.588 1.242 9.377 248 HB2 LYS 34 1HB LYS 34 -10.132 -0.744 9.300 249 HB3 LYS 34 2HB LYS 34 -9.328 -1.242 7.820 250 HG2 LYS 34 1HG LYS 34 -7.382 -0.771 9.953 251 HG3 LYS 34 2HG LYS 34 -8.592 -1.944 10.454 252 HD2 LYS 34 1HD LYS 34 -7.116 -2.144 7.826 253 HD3 LYS 34 2HD LYS 34 -6.534 -2.814 9.358 254 HE2 LYS 34 1HE LYS 34 -7.685 -4.660 8.980 255 HE3 LYS 34 2HE LYS 34 -9.154 -3.730 9.243 256 HZ1 LYS 34 3HZ LYS 34 -8.767 -5.065 7.086 257 HZ2 LYS 34 1HZ LYS 34 -7.957 -3.763 6.572 258 HZ3 LYS 34 2HZ LYS 34 -9.570 -3.637 7.031 259 H ILE 35 H ILE 35 -8.712 0.249 5.937 260 HA ILE 35 HA ILE 35 -5.939 -0.305 5.692 261 HB ILE 35 HB ILE 35 -7.993 0.507 3.603 262 HG12 ILE 35 1HG1 ILE 35 -6.963 -2.252 4.389 263 HG13 ILE 35 2HG1 ILE 35 -8.471 -1.597 4.978 264 HG21 ILE 35 1HG2 ILE 35 -5.698 0.848 2.758 265 HG22 ILE 35 2HG2 ILE 35 -5.202 -0.756 3.344 266 HG23 ILE 35 3HG2 ILE 35 -6.340 -0.587 2.001 267 HD11 ILE 35 3HD1 ILE 35 -9.473 -1.557 2.816 268 HD12 ILE 35 1HD1 ILE 35 -7.962 -2.008 2.016 269 HD13 ILE 35 2HD1 ILE 35 -8.736 -3.154 3.099 270 H LEU 36 H LEU 36 -7.794 2.741 4.836 271 HA LEU 36 HA LEU 36 -5.498 4.261 4.124 272 HB2 LEU 36 1HB LEU 36 -7.884 5.277 5.685 273 HB3 LEU 36 2HB LEU 36 -6.825 6.236 4.694 274 HG LEU 36 HG LEU 36 -8.198 4.095 3.142 275 HD11 LEU 36 1HD1 LEU 36 -9.709 6.232 4.669 276 HD12 LEU 36 2HD1 LEU 36 -9.909 4.461 4.720 277 HD13 LEU 36 3HD1 LEU 36 -10.374 5.344 3.278 278 HD21 LEU 36 3HD2 LEU 36 -8.205 7.128 2.817 279 HD22 LEU 36 1HD2 LEU 36 -8.755 5.937 1.632 280 HD23 LEU 36 2HD2 LEU 36 -7.034 6.023 2.043 281 H SER 37 H SER 37 -6.711 3.276 7.283 282 HA SER 37 HA SER 37 -5.237 5.037 8.923 283 HB2 SER 37 1HB SER 37 -7.107 3.054 9.327 284 HB3 SER 37 2HB SER 37 -5.644 2.406 10.082 285 HG SER 37 HG SER 37 -5.988 3.728 11.604 286 H GLU 38 H GLU 38 -4.506 1.576 8.172 287 HA GLU 38 HA GLU 38 -1.818 1.876 9.166 288 HB2 GLU 38 1HB GLU 38 -2.902 -0.400 7.492 289 HB3 GLU 38 2HB GLU 38 -1.545 -0.428 8.604 290 HG2 GLU 38 1HG GLU 38 -4.494 -0.295 9.221 291 HG3 GLU 38 2HG GLU 38 -3.370 -1.545 9.713 292 H ILE 39 H ILE 39 -3.141 2.306 5.952 293 HA ILE 39 HA ILE 39 -0.647 2.013 4.559 294 HB ILE 39 HB ILE 39 -3.252 3.463 4.009 295 HG12 ILE 39 1HG1 ILE 39 -3.129 0.942 3.815 296 HG13 ILE 39 2HG1 ILE 39 -3.604 1.777 2.346 297 HG21 ILE 39 1HG2 ILE 39 -2.534 3.865 1.710 298 HG22 ILE 39 2HG2 ILE 39 -1.658 4.851 2.890 299 HG23 ILE 39 3HG2 ILE 39 -0.847 3.427 2.190 300 HD11 ILE 39 3HD1 ILE 39 -2.103 -0.078 1.858 301 HD12 ILE 39 1HD1 ILE 39 -1.316 1.427 1.401 302 HD13 ILE 39 2HD1 ILE 39 -0.836 0.607 2.896 303 H ALA 40 H ALA 40 -2.065 4.751 6.432 304 HA ALA 40 HA ALA 40 0.113 6.438 5.386 305 HB1 ALA 40 1HB ALA 40 -2.415 7.155 5.767 306 HB2 ALA 40 2HB ALA 40 -1.788 7.510 7.399 307 HB3 ALA 40 3HB ALA 40 -1.070 8.286 6.001 308 H THR 41 H THR 41 0.169 4.240 7.761 309 HA THR 41 HA THR 41 1.560 5.777 9.822 310 HB THR 41 HB THR 41 2.150 3.512 10.701 311 HG1 THR 41 1HG THR 41 1.093 1.752 9.697 312 HG21 THR 41 3HG2 THR 41 -0.116 2.874 11.369 313 HG22 THR 41 1HG2 THR 41 -0.814 3.851 10.063 314 HG23 THR 41 2HG2 THR 41 0.058 4.635 11.394 315 H GLY 42 H GLY 42 2.510 3.552 7.131 316 HA2 GLY 42 1HA GLY 42 5.229 3.497 7.636 317 HA3 GLY 42 2HA GLY 42 4.476 3.243 6.043 318 H LYS 43 H LYS 43 7.000 4.535 6.844 319 HA LYS 43 HA LYS 43 6.469 7.367 6.032 320 HB2 LYS 43 1HB LYS 43 8.648 6.435 7.906 321 HB3 LYS 43 2HB LYS 43 8.154 8.079 7.545 322 HG2 LYS 43 1HG LYS 43 5.836 7.536 8.408 323 HG3 LYS 43 2HG LYS 43 6.449 6.000 8.987 324 HD2 LYS 43 1HD LYS 43 7.849 8.447 9.992 325 HD3 LYS 43 2HD LYS 43 6.172 8.192 10.495 326 HE2 LYS 43 1HE LYS 43 6.815 5.806 11.140 327 HE3 LYS 43 2HE LYS 43 8.494 6.276 10.916 328 HZ1 LYS 43 3HZ LYS 43 6.581 7.372 12.883 329 HZ2 LYS 43 1HZ LYS 43 8.069 8.046 12.596 330 HZ3 LYS 43 2HZ LYS 43 7.970 6.522 13.165 331 H ARG 44 H ARG 44 7.027 7.410 3.968 332 HA ARG 44 HA ARG 44 9.100 5.907 2.704 333 HB2 ARG 44 1HB ARG 44 8.870 7.567 0.867 334 HB3 ARG 44 2HB ARG 44 7.462 6.635 1.303 335 HG2 ARG 44 1HG ARG 44 6.555 8.697 1.032 336 HG3 ARG 44 2HG ARG 44 6.741 8.719 2.752 337 HD2 ARG 44 1HD ARG 44 8.704 10.013 2.556 338 HD3 ARG 44 2HD ARG 44 8.762 9.823 0.758 339 HE ARG 44 HE ARG 44 6.319 11.052 1.453 340 HH11 ARG 44 1HH1 ARG 44 9.792 11.796 1.835 341 HH12 ARG 44 2HH1 ARG 44 9.547 13.522 1.596 342 HH21 ARG 44 1HH2 ARG 44 6.050 13.359 1.315 343 HH22 ARG 44 2HH2 ARG 44 7.493 14.365 1.249 344 H THR 45 H THR 45 9.187 8.390 4.630 345 HA THR 45 HA THR 45 10.836 9.648 5.666 346 HB THR 45 HB THR 45 12.946 8.790 5.913 347 HG1 THR 45 1HG THR 45 13.340 7.125 3.929 348 HG21 THR 45 3HG2 THR 45 11.264 7.003 6.527 349 HG22 THR 45 1HG2 THR 45 12.832 6.341 6.044 350 HG23 THR 45 2HG2 THR 45 11.461 6.259 4.935 351 H GLU 46 H GLU 46 13.160 10.960 4.896 352 HA GLU 46 HA GLU 46 12.138 12.707 2.834 353 HB2 GLU 46 1HB GLU 46 14.116 13.998 3.179 354 HB3 GLU 46 2HB GLU 46 13.430 13.492 4.716 355 HG2 GLU 46 1HG GLU 46 15.250 11.540 4.528 356 HG3 GLU 46 2HG GLU 46 16.021 12.642 3.384 357 H LYS 47 H LYS 47 13.727 9.694 2.594 358 HA LYS 47 HA LYS 47 15.591 10.129 0.462 359 HB2 LYS 47 1HB LYS 47 14.020 7.603 1.220 360 HB3 LYS 47 2HB LYS 47 15.465 7.669 0.225 361 HG2 LYS 47 1HG LYS 47 15.668 8.869 2.986 362 HG3 LYS 47 2HG LYS 47 15.514 7.132 2.849 363 HD2 LYS 47 1HD LYS 47 17.657 8.683 1.368 364 HD3 LYS 47 2HD LYS 47 17.839 8.046 3.016 365 HE2 LYS 47 1HE LYS 47 17.181 5.788 2.178 366 HE3 LYS 47 2HE LYS 47 17.264 6.396 0.515 367 HZ1 LYS 47 3HZ LYS 47 19.306 5.268 1.479 368 HZ2 LYS 47 1HZ LYS 47 19.547 6.636 2.360 369 HZ3 LYS 47 2HZ LYS 47 19.575 6.698 0.727 370 H GLN 48 H GLN 48 15.489 9.229 -1.697 371 HA GLN 48 HA GLN 48 12.835 9.389 -2.958 372 HB2 GLN 48 1HB GLN 48 13.888 10.320 -4.958 373 HB3 GLN 48 2HB GLN 48 13.819 11.300 -3.493 374 HG2 GLN 48 1HG GLN 48 15.856 11.836 -3.832 375 HG3 GLN 48 2HG GLN 48 16.297 10.249 -3.213 376 HE21 GLN 48 1HE2 GLN 48 16.582 8.521 -4.787 377 HE22 GLN 48 2HE2 GLN 48 17.326 8.928 -6.356 378 H SER 49 H SER 49 12.255 7.817 -3.995 379 HA SER 49 HA SER 49 13.721 5.331 -4.637 380 HB2 SER 49 1HB SER 49 11.447 5.086 -3.776 381 HB3 SER 49 2HB SER 49 10.802 6.263 -4.918 382 HG SER 49 HG SER 49 10.477 3.999 -5.541 383 H ILE 50 H ILE 50 13.698 4.660 -6.872 384 HA ILE 50 HA ILE 50 13.197 6.593 -8.999 385 HB ILE 50 HB ILE 50 15.419 6.169 -10.040 386 HG12 ILE 50 1HG1 ILE 50 16.131 4.948 -7.327 387 HG13 ILE 50 2HG1 ILE 50 15.994 4.086 -8.866 388 HG21 ILE 50 1HG2 ILE 50 16.619 7.854 -8.852 389 HG22 ILE 50 2HG2 ILE 50 14.913 8.252 -8.741 390 HG23 ILE 50 3HG2 ILE 50 15.740 7.518 -7.344 391 HD11 ILE 50 3HD1 ILE 50 18.301 4.423 -8.527 392 HD12 ILE 50 1HD1 ILE 50 17.829 5.639 -9.736 393 HD13 ILE 50 2HD1 ILE 50 18.081 6.116 -8.039 394 H GLN 51 H GLN 51 12.009 3.954 -7.967 395 HA GLN 51 HA GLN 51 12.319 2.381 -10.487 396 HB2 GLN 51 1HB GLN 51 11.377 0.479 -8.972 397 HB3 GLN 51 2HB GLN 51 13.045 0.859 -8.833 398 HG2 GLN 51 1HG GLN 51 12.706 2.204 -6.798 399 HG3 GLN 51 2HG GLN 51 10.962 2.060 -6.957 400 HE21 GLN 51 1HE2 GLN 51 10.472 -0.600 -7.329 401 HE22 GLN 51 2HE2 GLN 51 10.556 -1.113 -5.671 402 H ASP 52 H ASP 52 10.363 1.314 -11.044 403 HA ASP 52 HA ASP 52 7.905 2.889 -10.272 404 HB2 ASP 52 1HB ASP 52 8.551 1.322 -12.771 405 HB3 ASP 52 2HB ASP 52 6.935 1.913 -12.415 406 H TYR 53 H TYR 53 9.382 -0.346 -10.076 407 HA TYR 53 HA TYR 53 6.805 -1.574 -9.299 408 HB2 TYR 53 1HB TYR 53 8.440 -2.161 -11.785 409 HB3 TYR 53 2HB TYR 53 7.874 -3.530 -10.881 410 HD1 TYR 53 2HD TYR 53 6.597 -0.332 -12.406 411 HD2 TYR 53 1HD TYR 53 5.704 -4.384 -11.264 412 HE1 TYR 53 2HE TYR 53 4.303 -0.028 -13.226 413 HE2 TYR 53 1HE TYR 53 3.439 -4.143 -12.161 414 HH TYR 53 HH TYR 53 2.228 -1.016 -13.502 415 HA PRO 54 HA PRO 54 9.421 -3.631 -6.385 416 HB2 PRO 54 1HB PRO 54 8.189 -6.037 -5.979 417 HB3 PRO 54 2HB PRO 54 7.471 -4.470 -5.488 418 HG2 PRO 54 1HG PRO 54 6.838 -6.082 -7.935 419 HG3 PRO 54 2HG PRO 54 5.754 -5.304 -6.730 420 HD2 PRO 54 1HD PRO 54 6.444 -4.130 -9.146 421 HD3 PRO 54 2HD PRO 54 6.110 -3.181 -7.682 422 H SER 55 H SER 55 10.765 -5.546 -5.923 423 HA SER 55 HA SER 55 11.870 -6.801 -8.363 424 HB2 SER 55 1HB SER 55 13.975 -6.792 -6.868 425 HB3 SER 55 2HB SER 55 13.411 -5.274 -7.566 426 HG SER 55 HG SER 55 13.343 -4.532 -5.653 427 H ALA 56 H ALA 56 10.250 -7.557 -5.420 428 HA ALA 56 HA ALA 56 11.347 -10.284 -5.146 429 HB1 ALA 56 1HB ALA 56 10.351 -9.163 -3.179 430 HB2 ALA 56 2HB ALA 56 8.791 -9.039 -4.033 431 HB3 ALA 56 3HB ALA 56 9.449 -10.624 -3.587 432 H GLU 57 H GLU 57 9.996 -12.205 -5.535 433 HA GLU 57 HA GLU 57 8.434 -12.010 -8.034 434 HB2 GLU 57 1HB GLU 57 10.070 -13.998 -6.677 435 HB3 GLU 57 2HB GLU 57 8.460 -14.662 -6.893 436 HG2 GLU 57 1HG GLU 57 10.231 -13.492 -9.073 437 HG3 GLU 57 2HG GLU 57 9.975 -15.206 -8.758 438 H GLU 58 H GLU 58 7.986 -12.437 -4.548 439 HA GLU 58 HA GLU 58 5.064 -12.832 -4.960 440 HB2 GLU 58 1HB GLU 58 6.889 -13.779 -2.742 441 HB3 GLU 58 2HB GLU 58 5.121 -13.722 -2.625 442 HG2 GLU 58 1HG GLU 58 4.781 -15.440 -4.089 443 HG3 GLU 58 2HG GLU 58 6.188 -15.070 -5.073 444 H TYR 59 H TYR 59 4.293 -10.916 -4.992 445 HA TYR 59 HA TYR 59 4.424 -9.188 -2.658 446 HB2 TYR 59 1HB TYR 59 4.318 -7.171 -4.168 447 HB3 TYR 59 2HB TYR 59 5.879 -7.965 -4.141 448 HD1 TYR 59 1HD TYR 59 6.633 -9.368 -6.029 449 HD2 TYR 59 2HD TYR 59 3.085 -6.929 -6.263 450 HE1 TYR 59 1HE TYR 59 6.707 -9.523 -8.469 451 HE2 TYR 59 2HE TYR 59 3.182 -7.004 -8.730 452 HH TYR 59 HH TYR 59 5.508 -9.183 -10.379 453 H GLY 60 H GLY 60 2.443 -7.717 -2.845 454 HA2 GLY 60 1HA GLY 60 0.219 -8.963 -4.409 455 HA3 GLY 60 2HA GLY 60 0.007 -8.383 -2.754 456 H THR 61 H THR 61 -1.590 -7.238 -4.488 457 HA THR 61 HA THR 61 -0.385 -4.630 -5.334 458 HB THR 61 HB THR 61 -3.140 -5.535 -6.152 459 HG1 THR 61 1HG THR 61 -0.775 -6.611 -7.312 460 HG21 THR 61 3HG2 THR 61 -0.928 -4.020 -7.589 461 HG22 THR 61 1HG2 THR 61 -2.386 -3.336 -6.826 462 HG23 THR 61 2HG2 THR 61 -2.540 -4.367 -8.252 463 H ILE 62 H ILE 62 -1.281 -2.761 -4.436 464 HA ILE 62 HA ILE 62 -3.867 -3.023 -2.950 465 HB ILE 62 HB ILE 62 -1.782 -0.835 -2.626 466 HG12 ILE 62 1HG1 ILE 62 -2.447 -2.676 -0.332 467 HG13 ILE 62 2HG1 ILE 62 -1.223 -3.163 -1.496 468 HG21 ILE 62 1HG2 ILE 62 -4.022 -0.002 -2.227 469 HG22 ILE 62 2HG2 ILE 62 -4.415 -1.407 -1.200 470 HG23 ILE 62 3HG2 ILE 62 -3.228 -0.207 -0.655 471 HD11 ILE 62 3HD1 ILE 62 -0.436 -1.851 0.569 472 HD12 ILE 62 1HD1 ILE 62 0.220 -1.397 -1.022 473 HD13 ILE 62 2HD1 ILE 62 -1.041 -0.414 -0.257 474 H ASN 63 H ASN 63 -5.485 -1.929 -4.082 475 HA ASN 63 HA ASN 63 -4.697 0.223 -5.980 476 HB2 ASN 63 1HB ASN 63 -7.092 -1.620 -6.295 477 HB3 ASN 63 2HB ASN 63 -6.498 -0.405 -7.403 478 HD21 ASN 63 1HD2 ASN 63 -5.915 -3.641 -6.059 479 HD22 ASN 63 2HD2 ASN 63 -5.026 -4.209 -7.448 480 H ILE 64 H ILE 64 -6.043 2.070 -5.726 481 HA ILE 64 HA ILE 64 -8.365 1.892 -3.856 482 HB ILE 64 HB ILE 64 -6.537 4.290 -4.225 483 HG12 ILE 64 1HG1 ILE 64 -6.602 2.448 -1.812 484 HG13 ILE 64 2HG1 ILE 64 -5.288 2.532 -2.997 485 HG21 ILE 64 1HG2 ILE 64 -8.672 3.763 -2.133 486 HG22 ILE 64 2HG2 ILE 64 -7.819 5.284 -2.429 487 HG23 ILE 64 3HG2 ILE 64 -8.966 4.672 -3.625 488 HD11 ILE 64 3HD1 ILE 64 -4.608 3.886 -1.135 489 HD12 ILE 64 1HD1 ILE 64 -5.025 5.003 -2.440 490 HD13 ILE 64 2HD1 ILE 64 -6.140 4.741 -1.077 491 H GLU 65 H GLU 65 -9.910 1.645 -5.484 492 HA GLU 65 HA GLU 65 -9.929 3.237 -7.925 493 HB2 GLU 65 1HB GLU 65 -10.870 0.938 -7.812 494 HB3 GLU 65 2HB GLU 65 -12.054 1.472 -6.620 495 HG2 GLU 65 1HG GLU 65 -13.105 2.983 -8.148 496 HG3 GLU 65 2HG GLU 65 -11.780 2.829 -9.325 497 H ASN 66 H ASN 66 -10.301 5.288 -7.751 498 HA ASN 66 HA ASN 66 -12.238 6.423 -5.859 499 HB2 ASN 66 1HB ASN 66 -10.857 7.989 -4.902 500 HB3 ASN 66 2HB ASN 66 -10.048 6.448 -4.718 501 HD21 ASN 66 1HD2 ASN 66 -8.142 6.016 -6.195 502 HD22 ASN 66 2HD2 ASN 66 -7.179 7.420 -6.642 503 H ASN 67 H ASN 67 -11.141 8.933 -6.774 504 HA ASN 67 HA ASN 67 -13.202 9.980 -8.172 505 HB2 ASN 67 1HB ASN 67 -10.336 10.957 -7.885 506 HB3 ASN 67 2HB ASN 67 -11.684 11.934 -8.422 507 HD21 ASN 67 1HD2 ASN 67 -10.193 10.355 -5.643 508 HD22 ASN 67 2HD2 ASN 67 -11.192 11.159 -4.434 509 H GLY 68 H GLY 68 -12.697 7.869 -9.956 510 HA2 GLY 68 1HA GLY 68 -12.481 7.606 -12.271 511 HA3 GLY 68 2HA GLY 68 -12.051 9.344 -12.289 512 H GLY 69 H GLY 69 -10.389 7.140 -10.157 513 HA2 GLY 69 1HA GLY 69 -8.398 6.350 -11.981 514 HA3 GLY 69 2HA GLY 69 -7.755 7.684 -11.008 515 H MET 70 H MET 70 -6.453 5.394 -10.832 516 HA MET 70 HA MET 70 -7.266 4.100 -8.292 517 HB2 MET 70 1HB MET 70 -6.171 2.838 -10.811 518 HB3 MET 70 2HB MET 70 -6.038 2.065 -9.226 519 HG2 MET 70 1HG MET 70 -8.389 1.903 -8.947 520 HG3 MET 70 2HG MET 70 -8.711 3.028 -10.259 521 HE1 MET 70 3HE MET 70 -7.766 -0.669 -9.283 522 HE2 MET 70 1HE MET 70 -7.328 -1.367 -10.852 523 HE3 MET 70 2HE MET 70 -6.271 -0.148 -10.114 524 H THR 71 H THR 71 -5.905 4.772 -6.797 525 HA THR 71 HA THR 71 -3.030 5.136 -7.365 526 HB THR 71 HB THR 71 -4.694 5.200 -4.833 527 HG1 THR 71 1HG THR 71 -4.283 7.073 -6.279 528 HG21 THR 71 3HG2 THR 71 -2.689 4.020 -4.107 529 HG22 THR 71 1HG2 THR 71 -2.629 5.689 -3.544 530 HG23 THR 71 2HG2 THR 71 -1.659 5.201 -4.954 531 H THR 72 H THR 72 -2.052 3.341 -8.067 532 HA THR 72 HA THR 72 -2.541 0.888 -6.489 533 HB THR 72 HB THR 72 -1.650 1.160 -9.360 534 HG1 THR 72 1HG THR 72 -3.820 -0.368 -8.817 535 HG21 THR 72 3HG2 THR 72 -0.490 -0.790 -8.410 536 HG22 THR 72 1HG2 THR 72 -1.862 -1.367 -9.368 537 HG23 THR 72 2HG2 THR 72 -1.977 -1.314 -7.604 538 H MET 73 H MET 73 -0.814 -0.225 -5.677 539 HA MET 73 HA MET 73 1.955 0.602 -6.026 540 HB2 MET 73 1HB MET 73 2.265 0.845 -3.537 541 HB3 MET 73 2HB MET 73 1.523 2.193 -4.384 542 HG2 MET 73 1HG MET 73 -0.730 1.388 -3.573 543 HG3 MET 73 2HG MET 73 0.125 0.121 -2.688 544 HE1 MET 73 3HE MET 73 1.174 3.969 -3.119 545 HE2 MET 73 1HE MET 73 -0.592 4.026 -2.930 546 HE3 MET 73 2HE MET 73 0.465 4.643 -1.643 547 H PHE 74 H PHE 74 3.229 -1.035 -4.447 548 HA PHE 74 HA PHE 74 1.854 -3.636 -4.305 549 HB2 PHE 74 1HB PHE 74 4.651 -3.253 -5.463 550 HB3 PHE 74 2HB PHE 74 3.712 -4.724 -5.366 551 HD1 PHE 74 2HD PHE 74 1.716 -5.052 -6.862 552 HD2 PHE 74 1HD PHE 74 4.297 -1.634 -7.286 553 HE1 PHE 74 2HE PHE 74 0.981 -4.797 -9.193 554 HE2 PHE 74 1HE PHE 74 3.518 -1.338 -9.619 555 HZ PHE 74 HZ PHE 74 1.851 -2.918 -10.586 556 H TYR 75 H TYR 75 3.488 -5.167 -2.970 557 HA TYR 75 HA TYR 75 5.175 -3.725 -1.052 558 HB2 TYR 75 1HB TYR 75 3.854 -4.591 0.875 559 HB3 TYR 75 2HB TYR 75 3.053 -3.333 -0.044 560 HD1 TYR 75 2HD TYR 75 1.063 -3.851 -1.458 561 HD2 TYR 75 1HD TYR 75 2.929 -6.879 0.968 562 HE1 TYR 75 2HE TYR 75 -0.954 -5.310 -1.711 563 HE2 TYR 75 1HE TYR 75 0.927 -8.303 0.719 564 HH TYR 75 HH TYR 75 -1.692 -7.680 -1.486 565 H TYR 76 H TYR 76 6.703 -5.131 -0.139 566 HA TYR 76 HA TYR 76 6.264 -7.980 -0.047 567 HB2 TYR 76 1HB TYR 76 8.214 -8.673 -1.309 568 HB3 TYR 76 2HB TYR 76 6.981 -7.963 -2.297 569 HD1 TYR 76 1HD TYR 76 7.356 -5.728 -3.390 570 HD2 TYR 76 2HD TYR 76 10.377 -7.689 -1.045 571 HE1 TYR 76 1HE TYR 76 9.082 -4.025 -4.108 572 HE2 TYR 76 2HE TYR 76 12.093 -6.112 -1.876 573 HH TYR 76 HH TYR 76 11.731 -3.463 -2.511 574 H GLU 77 H GLU 77 8.088 -9.086 1.144 575 HA GLU 77 HA GLU 77 9.271 -7.369 3.241 576 HB2 GLU 77 1HB GLU 77 8.361 -9.668 3.748 577 HB3 GLU 77 2HB GLU 77 9.602 -10.361 2.701 578 HG2 GLU 77 1HG GLU 77 11.365 -9.271 4.174 579 HG3 GLU 77 2HG GLU 77 10.072 -8.737 5.248 580 H GLU 78 H GLU 78 11.397 -6.708 3.281 581 HA GLU 78 HA GLU 78 13.258 -7.990 1.414 582 HB2 GLU 78 1HB GLU 78 12.524 -5.984 0.274 583 HB3 GLU 78 2HB GLU 78 13.031 -4.969 1.634 584 HG2 GLU 78 1HG GLU 78 15.314 -5.353 1.242 585 HG3 GLU 78 2HG GLU 78 15.015 -6.910 0.472 586 H ASN 79 H ASN 79 14.562 -8.955 2.682 587 HA ASN 79 HA ASN 79 16.316 -9.347 3.972 588 HB2 ASN 79 1HB ASN 79 16.658 -6.591 3.355 589 HB3 ASN 79 2HB ASN 79 16.942 -6.720 5.076 590 HD21 ASN 79 1HD2 ASN 79 18.182 -7.415 1.904 591 HD22 ASN 79 2HD2 ASN 79 19.648 -8.187 2.420 592 H GLY 80 H GLY 80 13.560 -8.150 5.250 593 HA2 GLY 80 1HA GLY 80 12.978 -9.466 7.361 594 HA3 GLY 80 2HA GLY 80 14.359 -8.645 8.096 595 H LYS 81 H LYS 81 13.134 -6.180 6.141 596 HA LYS 81 HA LYS 81 10.971 -5.446 8.009 597 HB2 LYS 81 1HB LYS 81 13.261 -3.954 6.919 598 HB3 LYS 81 2HB LYS 81 11.746 -3.296 6.289 599 HG2 LYS 81 1HG LYS 81 12.189 -2.125 8.226 600 HG3 LYS 81 2HG LYS 81 10.850 -3.213 8.594 601 HD2 LYS 81 1HD LYS 81 12.022 -3.571 10.507 602 HD3 LYS 81 2HD LYS 81 12.844 -4.758 9.498 603 HE2 LYS 81 1HE LYS 81 14.567 -3.575 10.590 604 HE3 LYS 81 2HE LYS 81 14.558 -2.942 8.939 605 HZ1 LYS 81 3HZ LYS 81 13.331 -1.609 11.309 606 HZ2 LYS 81 1HZ LYS 81 13.342 -0.988 9.795 607 HZ3 LYS 81 2HZ LYS 81 14.752 -1.206 10.557 608 H TYR 82 H TYR 82 9.131 -4.241 6.786 609 HA TYR 82 HA TYR 82 8.743 -5.446 4.104 610 HB2 TYR 82 1HB TYR 82 6.670 -4.551 6.120 611 HB3 TYR 82 2HB TYR 82 6.407 -5.418 4.632 612 HD1 TYR 82 2HD TYR 82 6.905 -7.876 4.514 613 HD2 TYR 82 1HD TYR 82 7.469 -5.630 8.148 614 HE1 TYR 82 2HE TYR 82 7.140 -9.997 5.797 615 HE2 TYR 82 1HE TYR 82 7.695 -7.745 9.430 616 HH TYR 82 HH TYR 82 8.501 -10.494 8.374 617 H TYR 83 H TYR 83 7.700 -3.989 2.536 618 HA TYR 83 HA TYR 83 7.740 -1.156 3.243 619 HB2 TYR 83 1HB TYR 83 9.356 -2.117 0.873 620 HB3 TYR 83 2HB TYR 83 9.224 -0.492 1.459 621 HD1 TYR 83 2HD TYR 83 10.578 -3.880 2.440 622 HD2 TYR 83 1HD TYR 83 10.801 0.391 2.951 623 HE1 TYR 83 2HE TYR 83 12.609 -4.175 3.756 624 HE2 TYR 83 1HE TYR 83 12.871 0.125 4.290 625 HH TYR 83 HH TYR 83 14.773 -1.584 4.279 626 H ILE 84 H ILE 84 7.108 0.134 1.213 627 HA ILE 84 HA ILE 84 5.101 -1.338 -0.412 628 HB ILE 84 HB ILE 84 4.595 1.332 0.975 629 HG12 ILE 84 1HG1 ILE 84 2.612 -0.199 1.931 630 HG13 ILE 84 2HG1 ILE 84 3.761 -1.498 1.683 631 HG21 ILE 84 1HG2 ILE 84 2.735 -0.398 -0.711 632 HG22 ILE 84 2HG2 ILE 84 2.288 1.081 0.155 633 HG23 ILE 84 3HG2 ILE 84 3.420 1.178 -1.186 634 HD11 ILE 84 3HD1 ILE 84 4.369 1.027 3.295 635 HD12 ILE 84 1HD1 ILE 84 3.613 -0.414 3.970 636 HD13 ILE 84 2HD1 ILE 84 5.258 -0.523 3.320 637 H GLU 85 H GLU 85 4.992 -0.752 -2.471 638 HA GLU 85 HA GLU 85 7.037 0.874 -3.659 639 HB2 GLU 85 1HB GLU 85 5.041 -1.077 -4.509 640 HB3 GLU 85 2HB GLU 85 4.989 0.285 -5.602 641 HG2 GLU 85 1HG GLU 85 6.535 -1.463 -6.368 642 HG3 GLU 85 2HG GLU 85 7.373 0.060 -6.060 643 H CYS 86 H CYS 86 6.621 2.501 -5.326 644 HA CYS 86 HA CYS 86 4.324 4.016 -5.653 645 HB2 CYS 86 1HB CYS 86 5.932 4.719 -3.272 646 HB3 CYS 86 2HB CYS 86 5.794 6.082 -4.382 647 HG CYS 86 HG CYS 86 3.445 4.128 -3.200 648 HA PRO 87 HA PRO 87 7.523 5.946 -8.515 649 HB2 PRO 87 1HB PRO 87 6.778 8.552 -8.670 650 HB3 PRO 87 2HB PRO 87 5.809 7.286 -9.459 651 HG2 PRO 87 1HG PRO 87 5.363 8.544 -6.733 652 HG3 PRO 87 2HG PRO 87 4.166 8.318 -8.047 653 HD2 PRO 87 1HD PRO 87 4.400 6.588 -5.962 654 HD3 PRO 87 2HD PRO 87 3.965 6.041 -7.582 655 H TYR 88 H TYR 88 8.827 8.291 -8.040 656 HA TYR 88 HA TYR 88 10.749 7.888 -6.527 657 HB2 TYR 88 1HB TYR 88 9.545 10.669 -6.473 658 HB3 TYR 88 2HB TYR 88 11.242 10.246 -6.404 659 HD1 TYR 88 2HD TYR 88 12.395 9.249 -8.445 660 HD2 TYR 88 1HD TYR 88 8.436 10.968 -8.616 661 HE1 TYR 88 2HE TYR 88 12.661 9.605 -10.865 662 HE2 TYR 88 1HE TYR 88 8.725 11.385 -11.023 663 HH TYR 88 HH TYR 88 11.655 10.398 -12.814 664 H LYS 89 H LYS 89 7.873 8.088 -4.809 665 HA LYS 89 HA LYS 89 9.310 8.608 -2.236 666 HB2 LYS 89 1HB LYS 89 6.342 8.940 -2.726 667 HB3 LYS 89 2HB LYS 89 7.151 9.091 -1.177 668 HG2 LYS 89 1HG LYS 89 7.698 11.209 -1.550 669 HG3 LYS 89 2HG LYS 89 8.572 10.814 -3.001 670 HD2 LYS 89 1HD LYS 89 5.587 11.282 -2.851 671 HD3 LYS 89 2HD LYS 89 6.767 12.499 -3.373 672 HE2 LYS 89 1HE LYS 89 7.376 11.272 -5.311 673 HE3 LYS 89 2HE LYS 89 6.625 9.789 -4.701 674 HZ1 LYS 89 3HZ LYS 89 5.244 10.870 -6.398 675 HZ2 LYS 89 1HZ LYS 89 5.156 12.226 -5.495 676 HZ3 LYS 89 2HZ LYS 89 4.465 10.833 -4.940 677 H GLY 90 H GLY 90 8.897 6.057 -4.039 678 HA2 GLY 90 1HA GLY 90 7.563 4.452 -2.066 679 HA3 GLY 90 2HA GLY 90 8.220 3.881 -3.614 680 H ILE 91 H ILE 91 9.200 5.093 -0.390 681 HA ILE 91 HA ILE 91 10.842 2.690 -0.003 682 HB ILE 91 HB ILE 91 12.130 5.352 0.656 683 HG12 ILE 91 1HG1 ILE 91 12.543 3.755 -1.897 684 HG13 ILE 91 2HG1 ILE 91 12.019 5.443 -1.729 685 HG21 ILE 91 1HG2 ILE 91 13.420 2.632 0.191 686 HG22 ILE 91 2HG2 ILE 91 14.050 4.039 1.113 687 HG23 ILE 91 3HG2 ILE 91 12.723 3.040 1.751 688 HD11 ILE 91 3HD1 ILE 91 14.221 6.078 -0.866 689 HD12 ILE 91 1HD1 ILE 91 14.789 4.395 -1.029 690 HD13 ILE 91 2HD1 ILE 91 14.349 5.300 -2.459 691 H TYR 92 H TYR 92 8.420 3.129 0.955 692 HA TYR 92 HA TYR 92 8.398 4.311 3.667 693 HB2 TYR 92 1HB TYR 92 6.277 2.419 2.563 694 HB3 TYR 92 2HB TYR 92 6.148 3.506 3.921 695 HD1 TYR 92 1HD TYR 92 6.111 3.137 0.276 696 HD2 TYR 92 2HD TYR 92 5.465 5.851 3.540 697 HE1 TYR 92 1HE TYR 92 5.111 4.707 -1.274 698 HE2 TYR 92 2HE TYR 92 4.640 7.563 1.929 699 HH TYR 92 HH TYR 92 4.146 6.765 -1.518 700 H GLU 93 H GLU 93 9.727 3.367 4.974 701 HA GLU 93 HA GLU 93 9.857 0.413 5.126 702 HB2 GLU 93 1HB GLU 93 11.824 1.883 5.591 703 HB3 GLU 93 2HB GLU 93 10.935 2.654 6.888 704 HG2 GLU 93 1HG GLU 93 10.793 0.347 8.002 705 HG3 GLU 93 2HG GLU 93 11.936 -0.206 6.759 706 H ILE 94 H ILE 94 8.348 -0.672 6.183 707 HA ILE 94 HA ILE 94 7.016 0.572 8.516 708 HB ILE 94 HB ILE 94 5.139 -0.894 8.346 709 HG12 ILE 94 1HG1 ILE 94 6.262 -1.875 5.700 710 HG13 ILE 94 2HG1 ILE 94 6.160 -2.784 7.204 711 HG21 ILE 94 1HG2 ILE 94 5.080 1.332 7.328 712 HG22 ILE 94 2HG2 ILE 94 5.527 0.644 5.743 713 HG23 ILE 94 3HG2 ILE 94 3.984 0.216 6.523 714 HD11 ILE 94 3HD1 ILE 94 4.356 -3.502 5.799 715 HD12 ILE 94 1HD1 ILE 94 3.654 -2.553 7.126 716 HD13 ILE 94 2HD1 ILE 94 3.816 -1.849 5.513 717 H GLU 95 H GLU 95 6.858 -1.092 10.341 718 HA GLU 95 HA GLU 95 9.109 -3.037 10.080 719 HB2 GLU 95 1HB GLU 95 8.090 -1.632 12.576 720 HB3 GLU 95 2HB GLU 95 9.340 -2.874 12.514 721 HG2 GLU 95 1HG GLU 95 10.481 -1.278 10.749 722 HG3 GLU 95 2HG GLU 95 9.459 -0.042 11.487 723 H ASN 96 H ASN 96 5.966 -3.257 9.674 724 HA ASN 96 HA ASN 96 5.811 -5.922 10.939 725 HB2 ASN 96 1HB ASN 96 3.551 -3.848 11.027 726 HB3 ASN 96 2HB ASN 96 3.429 -5.525 11.520 727 HD21 ASN 96 1HD2 ASN 96 5.089 -2.466 12.374 728 HD22 ASN 96 2HD2 ASN 96 5.337 -2.928 14.059 729 H ASN 97 H ASN 97 4.261 -7.335 9.848 730 HA ASN 97 HA ASN 97 4.302 -7.018 6.992 731 HB2 ASN 97 1HB ASN 97 4.500 -9.212 8.125 732 HB3 ASN 97 2HB ASN 97 2.885 -9.028 8.800 733 HD21 ASN 97 1HD2 ASN 97 4.701 -9.793 5.912 734 HD22 ASN 97 2HD2 ASN 97 3.300 -10.214 4.937 735 H PHE 98 H PHE 98 2.733 -6.263 5.670 736 HA PHE 98 HA PHE 98 0.542 -4.761 6.743 737 HB2 PHE 98 1HB PHE 98 1.789 -4.013 4.828 738 HB3 PHE 98 2HB PHE 98 1.389 -5.458 3.920 739 HD1 PHE 98 2HD PHE 98 0.021 -2.253 5.267 740 HD2 PHE 98 1HD PHE 98 -0.699 -5.698 2.768 741 HE1 PHE 98 2HE PHE 98 -1.834 -1.039 4.136 742 HE2 PHE 98 1HE PHE 98 -2.575 -4.553 1.702 743 HZ PHE 98 HZ PHE 98 -3.177 -2.204 2.376 744 H GLU 99 H GLU 99 0.610 -7.943 4.953 745 HA GLU 99 HA GLU 99 -2.240 -7.988 4.569 746 HB2 GLU 99 1HB GLU 99 -0.128 -10.123 4.478 747 HB3 GLU 99 2HB GLU 99 -1.840 -10.519 4.300 748 HG2 GLU 99 1HG GLU 99 -2.108 -9.197 2.326 749 HG3 GLU 99 2HG GLU 99 -0.578 -8.369 2.577 750 H ASP 100 H ASP 100 -0.154 -8.932 7.200 751 HA ASP 100 HA ASP 100 -2.106 -10.279 8.825 752 HB2 ASP 100 1HB ASP 100 0.639 -9.065 9.294 753 HB3 ASP 100 2HB ASP 100 -0.330 -9.594 10.672 754 H MET 101 H MET 101 -1.732 -6.900 8.160 755 HA MET 101 HA MET 101 -3.123 -6.190 10.690 756 HB2 MET 101 1HB MET 101 -2.058 -4.185 10.772 757 HB3 MET 101 2HB MET 101 -0.811 -5.252 10.144 758 HG2 MET 101 1HG MET 101 -1.481 -4.396 7.821 759 HG3 MET 101 2HG MET 101 -2.341 -3.137 8.661 760 HE1 MET 101 3HE MET 101 -1.043 -1.474 10.430 761 HE2 MET 101 1HE MET 101 -0.179 -2.784 11.217 762 HE3 MET 101 2HE MET 101 0.720 -1.392 10.573 763 H ILE 102 H ILE 102 -3.999 -6.878 7.618 764 HA ILE 102 HA ILE 102 -6.013 -4.699 7.541 765 HB ILE 102 HB ILE 102 -6.436 -5.493 5.153 766 HG12 ILE 102 1HG1 ILE 102 -3.773 -6.887 5.484 767 HG13 ILE 102 2HG1 ILE 102 -5.303 -7.749 5.467 768 HG21 ILE 102 1HG2 ILE 102 -4.344 -4.288 4.325 769 HG22 ILE 102 2HG2 ILE 102 -5.245 -3.466 5.586 770 HG23 ILE 102 3HG2 ILE 102 -3.745 -4.313 6.001 771 HD11 ILE 102 3HD1 ILE 102 -4.272 -7.871 3.279 772 HD12 ILE 102 1HD1 ILE 102 -5.746 -6.887 3.159 773 HD13 ILE 102 2HD1 ILE 102 -4.125 -6.127 3.169 Start of MODEL 3 1 H1 GLY 1 H GLY 1 6.031 13.757 6.709 2 HA2 GLY 1 1HA GLY 1 5.093 11.905 8.831 3 HA3 GLY 1 2HA GLY 1 4.415 13.520 8.510 4 H SER 2 H SER 2 4.277 10.228 7.776 5 HA SER 2 HA SER 2 3.360 8.866 6.355 6 HB2 SER 2 1HB SER 2 0.828 9.440 6.170 7 HB3 SER 2 2HB SER 2 1.603 9.181 7.732 8 HG SER 2 HG SER 2 1.046 11.697 6.510 9 HA PRO 3 HA PRO 3 2.994 9.676 1.944 10 HB2 PRO 3 1HB PRO 3 0.779 8.048 1.298 11 HB3 PRO 3 2HB PRO 3 2.466 7.492 1.448 12 HG2 PRO 3 1HG PRO 3 0.248 7.341 3.452 13 HG3 PRO 3 2HG PRO 3 1.537 6.154 3.074 14 HD2 PRO 3 1HD PRO 3 1.693 7.702 5.254 15 HD3 PRO 3 2HD PRO 3 3.130 7.263 4.304 16 H ILE 4 H ILE 4 1.460 10.504 0.262 17 HA ILE 4 HA ILE 4 -0.803 12.079 1.321 18 HB ILE 4 HB ILE 4 0.329 11.942 -1.508 19 HG12 ILE 4 1HG1 ILE 4 2.187 12.583 -0.094 20 HG13 ILE 4 2HG1 ILE 4 1.655 13.879 -1.108 21 HG21 ILE 4 1HG2 ILE 4 -0.703 14.195 -1.714 22 HG22 ILE 4 2HG2 ILE 4 -1.888 12.913 -1.418 23 HG23 ILE 4 3HG2 ILE 4 -1.416 14.008 -0.090 24 HD11 ILE 4 3HD1 ILE 4 0.503 14.956 0.842 25 HD12 ILE 4 1HD1 ILE 4 1.054 13.597 1.871 26 HD13 ILE 4 2HD1 ILE 4 2.233 14.697 1.127 27 H LEU 5 H LEU 5 -2.374 10.454 1.743 28 HA LEU 5 HA LEU 5 -3.061 8.555 -0.435 29 HB2 LEU 5 1HB LEU 5 -4.591 7.601 1.331 30 HB3 LEU 5 2HB LEU 5 -2.880 7.301 1.516 31 HG LEU 5 HG LEU 5 -3.983 9.687 2.980 32 HD11 LEU 5 1HD1 LEU 5 -5.757 8.068 3.391 33 HD12 LEU 5 2HD1 LEU 5 -4.798 8.298 4.851 34 HD13 LEU 5 3HD1 LEU 5 -4.568 6.829 3.872 35 HD21 LEU 5 3HD2 LEU 5 -1.569 8.916 3.128 36 HD22 LEU 5 1HD2 LEU 5 -2.155 7.411 3.861 37 HD23 LEU 5 2HD2 LEU 5 -2.406 8.964 4.689 38 HA PRO 6 HA PRO 6 -6.731 11.000 -1.271 39 HB2 PRO 6 1HB PRO 6 -8.490 9.078 -2.181 40 HB3 PRO 6 2HB PRO 6 -7.108 9.641 -3.139 41 HG2 PRO 6 1HG PRO 6 -7.290 7.204 -1.348 42 HG3 PRO 6 2HG PRO 6 -6.731 7.280 -3.051 43 HD2 PRO 6 1HD PRO 6 -4.968 7.306 -1.042 44 HD3 PRO 6 2HD PRO 6 -4.735 8.360 -2.454 45 H LYS 7 H LYS 7 -8.980 11.407 -0.304 46 HA LYS 7 HA LYS 7 -9.267 10.685 2.367 47 HB2 LYS 7 1HB LYS 7 -11.412 11.505 0.332 48 HB3 LYS 7 2HB LYS 7 -11.461 11.697 2.089 49 HG2 LYS 7 1HG LYS 7 -9.095 13.018 1.455 50 HG3 LYS 7 2HG LYS 7 -10.079 13.342 0.020 51 HD2 LYS 7 1HD LYS 7 -10.916 13.751 2.852 52 HD3 LYS 7 2HD LYS 7 -10.195 15.048 1.904 53 HE2 LYS 7 1HE LYS 7 -12.704 13.682 0.925 54 HE3 LYS 7 2HE LYS 7 -12.795 14.945 2.158 55 HZ1 LYS 7 3HZ LYS 7 -11.705 15.236 -0.562 56 HZ2 LYS 7 1HZ LYS 7 -11.609 16.409 0.597 57 HZ3 LYS 7 2HZ LYS 7 -13.076 15.899 0.046 58 H ALA 8 H ALA 8 -11.191 9.515 3.326 59 HA ALA 8 HA ALA 8 -11.602 6.898 2.143 60 HB1 ALA 8 1HB ALA 8 -11.568 7.412 4.584 61 HB2 ALA 8 2HB ALA 8 -13.075 8.311 4.413 62 HB3 ALA 8 3HB ALA 8 -13.028 6.557 4.071 63 H GLU 9 H GLU 9 -13.645 9.851 2.509 64 HA GLU 9 HA GLU 9 -15.969 8.747 1.341 65 HB2 GLU 9 1HB GLU 9 -16.789 11.040 1.370 66 HB3 GLU 9 2HB GLU 9 -15.789 10.780 2.803 67 HG2 GLU 9 1HG GLU 9 -13.814 11.747 1.394 68 HG3 GLU 9 2HG GLU 9 -15.023 12.190 0.204 69 H ASN 10 H ASN 10 -13.128 9.765 -0.432 70 HA ASN 10 HA ASN 10 -14.701 10.147 -2.923 71 HB2 ASN 10 1HB ASN 10 -12.916 11.344 -3.747 72 HB3 ASN 10 2HB ASN 10 -12.968 11.894 -2.070 73 HD21 ASN 10 1HD2 ASN 10 -11.534 9.060 -1.391 74 HD22 ASN 10 2HD2 ASN 10 -9.932 9.590 -1.626 75 H VAL 11 H VAL 11 -13.430 7.635 -1.231 76 HA VAL 11 HA VAL 11 -12.218 6.168 -3.477 77 HB VAL 11 HB VAL 11 -12.415 5.746 -0.459 78 HG11 VAL 11 1HG1 VAL 11 -11.242 3.523 -0.952 79 HG12 VAL 11 2HG1 VAL 11 -12.998 3.585 -1.160 80 HG13 VAL 11 3HG1 VAL 11 -11.977 3.669 -2.577 81 HG21 VAL 11 3HG2 VAL 11 -10.485 7.027 -1.593 82 HG22 VAL 11 1HG2 VAL 11 -10.024 5.629 -0.598 83 HG23 VAL 11 2HG2 VAL 11 -10.069 5.498 -2.374 84 H ASP 12 H ASP 12 -13.357 4.717 -4.516 85 HA ASP 12 HA ASP 12 -16.212 4.239 -3.858 86 HB2 ASP 12 1HB ASP 12 -14.407 3.722 -6.214 87 HB3 ASP 12 2HB ASP 12 -15.787 2.666 -5.958 88 H SER 13 H SER 13 -13.290 2.211 -4.779 89 HA SER 13 HA SER 13 -13.900 0.418 -2.515 90 HB2 SER 13 1HB SER 13 -13.833 -1.297 -4.762 91 HB3 SER 13 2HB SER 13 -15.126 -1.081 -3.614 92 HG SER 13 HG SER 13 -16.090 0.421 -4.920 93 H ILE 14 H ILE 14 -12.110 -0.441 -1.776 94 HA ILE 14 HA ILE 14 -9.574 -0.097 -3.283 95 HB ILE 14 HB ILE 14 -10.174 -0.979 -0.423 96 HG12 ILE 14 1HG1 ILE 14 -8.874 1.541 -1.542 97 HG13 ILE 14 2HG1 ILE 14 -10.521 1.430 -0.902 98 HG21 ILE 14 1HG2 ILE 14 -7.707 -0.924 -0.087 99 HG22 ILE 14 2HG2 ILE 14 -8.162 -2.143 -1.272 100 HG23 ILE 14 3HG2 ILE 14 -7.483 -0.591 -1.830 101 HD11 ILE 14 3HD1 ILE 14 -9.545 0.790 1.335 102 HD12 ILE 14 1HD1 ILE 14 -7.941 1.198 0.667 103 HD13 ILE 14 2HD1 ILE 14 -9.184 2.439 0.778 104 H CYS 15 H CYS 15 -8.566 -1.874 -4.190 105 HA CYS 15 HA CYS 15 -9.762 -4.560 -3.661 106 HB2 CYS 15 1HB CYS 15 -10.021 -3.814 -6.072 107 HB3 CYS 15 2HB CYS 15 -8.241 -3.785 -6.181 108 HG CYS 15 HG CYS 15 -9.099 -5.976 -7.255 109 H ILE 16 H ILE 16 -8.319 -6.049 -2.922 110 HA ILE 16 HA ILE 16 -5.450 -5.480 -3.130 111 HB ILE 16 HB ILE 16 -6.763 -6.461 -0.568 112 HG12 ILE 16 1HG1 ILE 16 -5.599 -3.774 -1.404 113 HG13 ILE 16 2HG1 ILE 16 -7.207 -4.097 -0.759 114 HG21 ILE 16 1HG2 ILE 16 -4.567 -7.451 -1.119 115 HG22 ILE 16 2HG2 ILE 16 -3.852 -5.830 -1.215 116 HG23 ILE 16 3HG2 ILE 16 -4.489 -6.457 0.322 117 HD11 ILE 16 3HD1 ILE 16 -4.582 -4.145 0.736 118 HD12 ILE 16 1HD1 ILE 16 -5.870 -2.951 0.877 119 HD13 ILE 16 2HD1 ILE 16 -6.157 -4.611 1.455 120 H ASP 17 H ASP 17 -4.525 -7.104 -4.084 121 HA ASP 17 HA ASP 17 -5.975 -9.664 -4.503 122 HB2 ASP 17 1HB ASP 17 -5.571 -7.784 -6.353 123 HB3 ASP 17 2HB ASP 17 -3.965 -8.476 -6.433 124 H PHE 18 H PHE 18 -4.948 -11.054 -3.072 125 HA PHE 18 HA PHE 18 -2.459 -10.387 -1.864 126 HB2 PHE 18 1HB PHE 18 -4.255 -12.850 -1.849 127 HB3 PHE 18 2HB PHE 18 -2.729 -12.838 -1.005 128 HD1 PHE 18 1HD PHE 18 -5.994 -10.827 -1.130 129 HD2 PHE 18 2HD PHE 18 -2.541 -12.071 1.185 130 HE1 PHE 18 1HE PHE 18 -6.945 -9.791 0.867 131 HE2 PHE 18 2HE PHE 18 -3.523 -10.985 3.181 132 HZ PHE 18 HZ PHE 18 -5.714 -9.838 3.035 133 H THR 19 H THR 19 -0.612 -12.089 -1.690 134 HA THR 19 HA THR 19 0.756 -12.538 -4.116 135 HB THR 19 HB THR 19 1.857 -14.363 -2.528 136 HG1 THR 19 1HG THR 19 0.832 -14.584 -0.710 137 HG21 THR 19 3HG2 THR 19 1.825 -11.397 -1.858 138 HG22 THR 19 1HG2 THR 19 2.922 -12.236 -2.972 139 HG23 THR 19 2HG2 THR 19 3.019 -12.568 -1.235 140 H ASN 20 H ASN 20 -1.308 -14.545 -2.168 141 HA ASN 20 HA ASN 20 -1.399 -16.827 -4.048 142 HB2 ASN 20 1HB ASN 20 -3.217 -17.494 -2.114 143 HB3 ASN 20 2HB ASN 20 -1.515 -17.889 -2.062 144 HD21 ASN 20 1HD2 ASN 20 -4.010 -15.965 -0.438 145 HD22 ASN 20 2HD2 ASN 20 -2.902 -15.437 0.797 146 H SER 21 H SER 21 -3.865 -17.568 -4.475 147 HA SER 21 HA SER 21 -4.784 -15.187 -5.975 148 HB2 SER 21 1HB SER 21 -5.985 -16.904 -7.311 149 HB3 SER 21 2HB SER 21 -4.263 -16.649 -7.524 150 HG SER 21 HG SER 21 -5.247 -18.721 -5.839 151 H ILE 22 H ILE 22 -5.428 -14.595 -3.788 152 HA ILE 22 HA ILE 22 -8.277 -15.143 -3.344 153 HB ILE 22 HB ILE 22 -6.342 -14.465 -1.096 154 HG12 ILE 22 1HG1 ILE 22 -7.189 -17.288 -1.892 155 HG13 ILE 22 2HG1 ILE 22 -5.566 -16.602 -1.953 156 HG21 ILE 22 1HG2 ILE 22 -8.206 -15.224 0.297 157 HG22 ILE 22 2HG2 ILE 22 -8.826 -14.073 -0.871 158 HG23 ILE 22 3HG2 ILE 22 -9.071 -15.822 -1.142 159 HD11 ILE 22 3HD1 ILE 22 -5.681 -16.275 0.557 160 HD12 ILE 22 1HD1 ILE 22 -7.157 -17.252 0.542 161 HD13 ILE 22 2HD1 ILE 22 -5.633 -17.963 -0.007 162 H GLN 23 H GLN 23 -9.312 -13.165 -2.962 163 HA GLN 23 HA GLN 23 -7.755 -10.666 -3.150 164 HB2 GLN 23 1HB GLN 23 -8.102 -11.157 -5.487 165 HB3 GLN 23 2HB GLN 23 -9.804 -11.593 -5.202 166 HG2 GLN 23 1HG GLN 23 -10.109 -9.106 -4.531 167 HG3 GLN 23 2HG GLN 23 -8.489 -8.849 -5.193 168 HE21 GLN 23 1HE2 GLN 23 -8.193 -9.321 -7.581 169 HE22 GLN 23 2HE2 GLN 23 -9.613 -9.315 -8.595 170 H LYS 24 H LYS 24 -8.769 -9.038 -2.148 171 HA LYS 24 HA LYS 24 -11.561 -9.514 -1.206 172 HB2 LYS 24 1HB LYS 24 -9.476 -9.969 0.467 173 HB3 LYS 24 2HB LYS 24 -9.637 -8.267 0.756 174 HG2 LYS 24 1HG LYS 24 -12.257 -9.664 0.792 175 HG3 LYS 24 2HG LYS 24 -11.105 -10.473 1.818 176 HD2 LYS 24 1HD LYS 24 -12.397 -9.009 3.155 177 HD3 LYS 24 2HD LYS 24 -10.768 -8.312 3.084 178 HE2 LYS 24 1HE LYS 24 -11.453 -6.584 1.612 179 HE3 LYS 24 2HE LYS 24 -12.777 -7.554 0.975 180 HZ1 LYS 24 3HZ LYS 24 -13.999 -7.194 2.969 181 HZ2 LYS 24 1HZ LYS 24 -13.616 -5.775 2.272 182 HZ3 LYS 24 2HZ LYS 24 -12.802 -6.280 3.637 183 H ILE 25 H ILE 25 -12.841 -7.857 -1.762 184 HA ILE 25 HA ILE 25 -11.563 -5.241 -2.360 185 HB ILE 25 HB ILE 25 -14.385 -6.141 -3.017 186 HG12 ILE 25 1HG1 ILE 25 -13.256 -5.642 -5.445 187 HG13 ILE 25 2HG1 ILE 25 -11.813 -6.192 -4.605 188 HG21 ILE 25 1HG2 ILE 25 -14.214 -3.688 -2.663 189 HG22 ILE 25 2HG2 ILE 25 -12.852 -3.619 -3.822 190 HG23 ILE 25 3HG2 ILE 25 -14.471 -4.057 -4.349 191 HD11 ILE 25 3HD1 ILE 25 -14.455 -7.722 -4.784 192 HD12 ILE 25 1HD1 ILE 25 -13.058 -7.963 -5.840 193 HD13 ILE 25 2HD1 ILE 25 -12.919 -8.342 -4.112 194 H TYR 26 H TYR 26 -12.084 -3.495 -1.173 195 HA TYR 26 HA TYR 26 -13.836 -3.785 1.202 196 HB2 TYR 26 1HB TYR 26 -11.350 -2.058 1.153 197 HB3 TYR 26 2HB TYR 26 -12.362 -2.473 2.522 198 HD1 TYR 26 1HD TYR 26 -10.096 -4.123 -0.065 199 HD2 TYR 26 2HD TYR 26 -11.448 -4.050 4.030 200 HE1 TYR 26 1HE TYR 26 -8.555 -5.925 0.484 201 HE2 TYR 26 2HE TYR 26 -9.885 -5.877 4.587 202 HH TYR 26 HH TYR 26 -7.603 -7.226 2.200 203 H ASP 27 H ASP 27 -15.480 -3.131 -0.259 204 HA ASP 27 HA ASP 27 -15.496 -0.326 -1.223 205 HB2 ASP 27 1HB ASP 27 -17.802 -0.870 -1.895 206 HB3 ASP 27 2HB ASP 27 -16.679 -2.039 -2.575 207 H ASP 28 H ASP 28 -16.083 -2.264 1.572 208 HA ASP 28 HA ASP 28 -18.321 -0.840 2.613 209 HB2 ASP 28 1HB ASP 28 -16.911 -2.426 4.593 210 HB3 ASP 28 2HB ASP 28 -18.501 -2.595 3.979 211 H SER 29 H SER 29 -18.305 0.877 4.005 212 HA SER 29 HA SER 29 -16.200 2.542 4.331 213 HB2 SER 29 1HB SER 29 -18.856 2.509 5.175 214 HB3 SER 29 2HB SER 29 -17.977 2.636 6.701 215 HG SER 29 HG SER 29 -17.902 4.240 4.389 216 H GLU 30 H GLU 30 -17.201 0.191 6.851 217 HA GLU 30 HA GLU 30 -15.138 1.066 8.700 218 HB2 GLU 30 1HB GLU 30 -17.349 0.049 9.314 219 HB3 GLU 30 2HB GLU 30 -16.813 -1.495 8.634 220 HG2 GLU 30 1HG GLU 30 -15.053 -1.668 10.327 221 HG3 GLU 30 2HG GLU 30 -15.429 -0.047 10.931 222 H SER 31 H SER 31 -15.191 -1.046 5.981 223 HA SER 31 HA SER 31 -12.907 -2.681 6.696 224 HB2 SER 31 1HB SER 31 -14.514 -2.494 4.147 225 HB3 SER 31 2HB SER 31 -13.350 -3.745 4.580 226 HG SER 31 HG SER 31 -14.695 -4.077 6.523 227 H ILE 32 H ILE 32 -13.641 0.077 4.553 228 HA ILE 32 HA ILE 32 -10.971 0.451 3.561 229 HB ILE 32 HB ILE 32 -13.456 2.200 3.769 230 HG12 ILE 32 1HG1 ILE 32 -12.130 1.087 1.266 231 HG13 ILE 32 2HG1 ILE 32 -13.311 0.151 2.179 232 HG21 ILE 32 1HG2 ILE 32 -11.693 3.784 3.773 233 HG22 ILE 32 2HG2 ILE 32 -10.753 2.898 2.546 234 HG23 ILE 32 3HG2 ILE 32 -12.256 3.745 2.121 235 HD11 ILE 32 3HD1 ILE 32 -15.009 1.889 1.894 236 HD12 ILE 32 1HD1 ILE 32 -13.873 2.886 0.960 237 HD13 ILE 32 2HD1 ILE 32 -14.393 1.321 0.331 238 H GLN 33 H GLN 33 -12.840 1.971 6.280 239 HA GLN 33 HA GLN 33 -10.912 3.821 6.908 240 HB2 GLN 33 1HB GLN 33 -13.417 3.017 7.976 241 HB3 GLN 33 2HB GLN 33 -12.301 2.942 9.320 242 HG2 GLN 33 1HG GLN 33 -11.758 5.396 7.906 243 HG3 GLN 33 2HG GLN 33 -13.497 5.179 7.893 244 HE21 GLN 33 1HE2 GLN 33 -13.279 7.297 9.143 245 HE22 GLN 33 2HE2 GLN 33 -13.025 7.168 10.900 246 H LYS 34 H LYS 34 -10.787 0.453 7.717 247 HA LYS 34 HA LYS 34 -8.633 0.671 9.651 248 HB2 LYS 34 1HB LYS 34 -10.049 -1.388 9.419 249 HB3 LYS 34 2HB LYS 34 -9.402 -1.641 7.806 250 HG2 LYS 34 1HG LYS 34 -7.187 -1.211 9.619 251 HG3 LYS 34 2HG LYS 34 -8.266 -2.352 10.404 252 HD2 LYS 34 1HD LYS 34 -7.275 -2.652 7.538 253 HD3 LYS 34 2HD LYS 34 -6.454 -3.357 8.919 254 HE2 LYS 34 1HE LYS 34 -9.415 -3.920 8.541 255 HE3 LYS 34 2HE LYS 34 -8.250 -4.745 7.520 256 HZ1 LYS 34 3HZ LYS 34 -8.469 -6.153 9.231 257 HZ2 LYS 34 1HZ LYS 34 -8.496 -4.996 10.432 258 HZ3 LYS 34 2HZ LYS 34 -7.109 -5.401 9.617 259 H ILE 35 H ILE 35 -8.649 -0.402 6.210 260 HA ILE 35 HA ILE 35 -6.008 -0.557 5.772 261 HB ILE 35 HB ILE 35 -8.244 0.287 3.889 262 HG12 ILE 35 1HG1 ILE 35 -6.683 -2.314 4.196 263 HG13 ILE 35 2HG1 ILE 35 -8.237 -2.010 4.964 264 HG21 ILE 35 1HG2 ILE 35 -6.220 1.149 2.847 265 HG22 ILE 35 2HG2 ILE 35 -5.366 -0.384 3.156 266 HG23 ILE 35 3HG2 ILE 35 -6.690 -0.287 1.988 267 HD11 ILE 35 3HD1 ILE 35 -9.332 -1.776 2.783 268 HD12 ILE 35 1HD1 ILE 35 -7.797 -2.090 1.944 269 HD13 ILE 35 2HD1 ILE 35 -8.480 -3.330 2.957 270 H LEU 36 H LEU 36 -7.827 2.486 5.475 271 HA LEU 36 HA LEU 36 -5.788 4.126 4.426 272 HB2 LEU 36 1HB LEU 36 -8.053 4.623 6.356 273 HB3 LEU 36 2HB LEU 36 -7.052 5.938 5.749 274 HG LEU 36 HG LEU 36 -8.423 4.057 3.792 275 HD11 LEU 36 1HD1 LEU 36 -9.657 6.442 5.222 276 HD12 LEU 36 2HD1 LEU 36 -10.202 4.758 5.258 277 HD13 LEU 36 3HD1 LEU 36 -10.323 5.664 3.754 278 HD21 LEU 36 3HD2 LEU 36 -7.932 7.050 3.606 279 HD22 LEU 36 1HD2 LEU 36 -8.410 5.958 2.316 280 HD23 LEU 36 2HD2 LEU 36 -6.766 5.834 3.017 281 H SER 37 H SER 37 -5.837 2.675 7.594 282 HA SER 37 HA SER 37 -3.996 4.508 8.900 283 HB2 SER 37 1HB SER 37 -5.913 2.978 9.899 284 HB3 SER 37 2HB SER 37 -4.718 1.690 9.784 285 HG SER 37 HG SER 37 -4.823 2.914 11.777 286 H GLU 38 H GLU 38 -3.953 1.015 7.745 287 HA GLU 38 HA GLU 38 -1.158 0.740 8.124 288 HB2 GLU 38 1HB GLU 38 -3.055 -0.787 6.279 289 HB3 GLU 38 2HB GLU 38 -1.413 -1.253 6.714 290 HG2 GLU 38 1HG GLU 38 -2.669 -2.538 8.139 291 HG3 GLU 38 2HG GLU 38 -2.129 -1.187 9.156 292 H ILE 39 H ILE 39 -3.042 1.963 5.405 293 HA ILE 39 HA ILE 39 -0.944 2.187 3.473 294 HB ILE 39 HB ILE 39 -3.478 3.794 3.988 295 HG12 ILE 39 1HG1 ILE 39 -3.739 1.400 3.270 296 HG13 ILE 39 2HG1 ILE 39 -4.467 2.563 2.168 297 HG21 ILE 39 1HG2 ILE 39 -2.104 5.323 2.768 298 HG22 ILE 39 2HG2 ILE 39 -1.657 4.074 1.594 299 HG23 ILE 39 3HG2 ILE 39 -3.332 4.670 1.677 300 HD11 ILE 39 3HD1 ILE 39 -2.658 2.195 0.571 301 HD12 ILE 39 1HD1 ILE 39 -1.772 1.213 1.770 302 HD13 ILE 39 2HD1 ILE 39 -3.286 0.627 1.111 303 H ALA 40 H ALA 40 -1.763 4.173 6.304 304 HA ALA 40 HA ALA 40 0.063 6.310 5.413 305 HB1 ALA 40 1HB ALA 40 -1.033 7.650 7.147 306 HB2 ALA 40 2HB ALA 40 -2.272 6.873 6.133 307 HB3 ALA 40 3HB ALA 40 -1.897 6.216 7.745 308 H THR 41 H THR 41 0.148 3.589 7.499 309 HA THR 41 HA THR 41 1.435 4.607 9.718 310 HB THR 41 HB THR 41 0.344 2.362 9.355 311 HG1 THR 41 1HG THR 41 1.124 2.678 11.210 312 HG21 THR 41 3HG2 THR 41 3.133 1.448 8.651 313 HG22 THR 41 1HG2 THR 41 1.848 1.663 7.450 314 HG23 THR 41 2HG2 THR 41 1.646 0.472 8.743 315 H GLY 42 H GLY 42 2.874 3.542 6.632 316 HA2 GLY 42 1HA GLY 42 5.557 3.599 7.675 317 HA3 GLY 42 2HA GLY 42 5.021 3.303 6.005 318 H LYS 43 H LYS 43 7.277 4.757 6.743 319 HA LYS 43 HA LYS 43 6.585 7.468 5.681 320 HB2 LYS 43 1HB LYS 43 8.752 6.686 7.654 321 HB3 LYS 43 2HB LYS 43 8.574 8.289 6.937 322 HG2 LYS 43 1HG LYS 43 6.459 8.682 8.040 323 HG3 LYS 43 2HG LYS 43 6.341 6.996 8.598 324 HD2 LYS 43 1HD LYS 43 8.279 7.256 10.036 325 HD3 LYS 43 2HD LYS 43 8.535 8.914 9.437 326 HE2 LYS 43 1HE LYS 43 6.388 9.614 10.376 327 HE3 LYS 43 2HE LYS 43 6.027 7.979 10.910 328 HZ1 LYS 43 3HZ LYS 43 6.986 9.587 12.605 329 HZ2 LYS 43 1HZ LYS 43 8.448 9.364 11.869 330 HZ3 LYS 43 2HZ LYS 43 7.635 8.105 12.562 331 H ARG 44 H ARG 44 7.191 7.374 3.617 332 HA ARG 44 HA ARG 44 9.207 5.715 2.468 333 HB2 ARG 44 1HB ARG 44 8.929 7.203 0.462 334 HB3 ARG 44 2HB ARG 44 7.490 6.419 1.059 335 HG2 ARG 44 1HG ARG 44 6.808 8.576 0.623 336 HG3 ARG 44 2HG ARG 44 6.934 8.607 2.342 337 HD2 ARG 44 1HD ARG 44 8.926 9.801 2.288 338 HD3 ARG 44 2HD ARG 44 9.184 9.530 0.538 339 HE ARG 44 HE ARG 44 6.726 10.854 0.851 340 HH11 ARG 44 1HH1 ARG 44 10.182 11.518 1.372 341 HH12 ARG 44 2HH1 ARG 44 10.065 13.207 1.020 342 HH21 ARG 44 1HH2 ARG 44 6.531 13.089 0.462 343 HH22 ARG 44 2HH2 ARG 44 7.857 14.169 0.597 344 H THR 45 H THR 45 9.419 8.286 4.235 345 HA THR 45 HA THR 45 11.159 9.477 5.267 346 HB THR 45 HB THR 45 13.202 8.477 5.547 347 HG1 THR 45 1HG THR 45 14.194 7.096 4.134 348 HG21 THR 45 3HG2 THR 45 11.364 6.900 6.224 349 HG22 THR 45 1HG2 THR 45 12.901 6.113 5.865 350 HG23 THR 45 2HG2 THR 45 11.593 6.030 4.683 351 H GLU 46 H GLU 46 13.520 10.452 4.612 352 HA GLU 46 HA GLU 46 12.990 12.382 2.521 353 HB2 GLU 46 1HB GLU 46 15.204 11.833 4.529 354 HB3 GLU 46 2HB GLU 46 15.333 13.138 3.359 355 HG2 GLU 46 1HG GLU 46 12.825 12.982 5.043 356 HG3 GLU 46 2HG GLU 46 14.306 13.558 5.774 357 H LYS 47 H LYS 47 14.117 9.171 2.243 358 HA LYS 47 HA LYS 47 16.196 9.616 0.283 359 HB2 LYS 47 1HB LYS 47 14.371 7.182 0.776 360 HB3 LYS 47 2HB LYS 47 15.790 7.216 -0.259 361 HG2 LYS 47 1HG LYS 47 15.931 7.879 2.672 362 HG3 LYS 47 2HG LYS 47 16.051 6.232 2.083 363 HD2 LYS 47 1HD LYS 47 17.956 8.352 1.054 364 HD3 LYS 47 2HD LYS 47 18.190 7.617 2.637 365 HE2 LYS 47 1HE LYS 47 18.145 5.358 1.644 366 HE3 LYS 47 2HE LYS 47 17.988 6.059 0.024 367 HZ1 LYS 47 3HZ LYS 47 20.149 6.911 0.163 368 HZ2 LYS 47 1HZ LYS 47 20.283 5.415 0.818 369 HZ3 LYS 47 2HZ LYS 47 20.253 6.755 1.777 370 H GLN 48 H GLN 48 15.865 8.800 -1.958 371 HA GLN 48 HA GLN 48 13.258 9.694 -3.106 372 HB2 GLN 48 1HB GLN 48 14.443 10.562 -5.038 373 HB3 GLN 48 2HB GLN 48 14.875 11.373 -3.535 374 HG2 GLN 48 1HG GLN 48 17.028 10.303 -3.457 375 HG3 GLN 48 2HG GLN 48 16.602 9.260 -4.813 376 HE21 GLN 48 1HE2 GLN 48 16.163 12.828 -4.279 377 HE22 GLN 48 2HE2 GLN 48 16.882 13.264 -5.818 378 H SER 49 H SER 49 12.756 8.666 -5.279 379 HA SER 49 HA SER 49 13.380 5.805 -5.075 380 HB2 SER 49 1HB SER 49 10.557 6.860 -5.404 381 HB3 SER 49 2HB SER 49 11.116 5.347 -4.720 382 HG SER 49 HG SER 49 11.172 7.971 -3.654 383 H ILE 50 H ILE 50 13.511 4.867 -7.152 384 HA ILE 50 HA ILE 50 13.087 6.737 -9.445 385 HB ILE 50 HB ILE 50 15.280 6.155 -10.291 386 HG12 ILE 50 1HG1 ILE 50 15.845 4.736 -7.646 387 HG13 ILE 50 2HG1 ILE 50 15.551 3.912 -9.179 388 HG21 ILE 50 1HG2 ILE 50 16.543 7.604 -8.863 389 HG22 ILE 50 2HG2 ILE 50 14.864 8.147 -8.813 390 HG23 ILE 50 3HG2 ILE 50 15.538 7.222 -7.452 391 HD11 ILE 50 3HD1 ILE 50 17.504 5.208 -10.171 392 HD12 ILE 50 1HD1 ILE 50 17.881 5.738 -8.509 393 HD13 ILE 50 2HD1 ILE 50 17.921 4.022 -8.927 394 H GLN 51 H GLN 51 11.420 4.428 -8.647 395 HA GLN 51 HA GLN 51 11.535 2.960 -11.200 396 HB2 GLN 51 1HB GLN 51 11.263 0.798 -9.774 397 HB3 GLN 51 2HB GLN 51 12.874 1.478 -9.977 398 HG2 GLN 51 1HG GLN 51 12.789 2.491 -7.725 399 HG3 GLN 51 2HG GLN 51 11.078 2.023 -7.561 400 HE21 GLN 51 1HE2 GLN 51 10.685 0.091 -6.621 401 HE22 GLN 51 2HE2 GLN 51 11.863 -1.159 -6.315 402 H ASP 52 H ASP 52 9.684 1.555 -11.433 403 HA ASP 52 HA ASP 52 7.189 2.753 -10.240 404 HB2 ASP 52 1HB ASP 52 7.882 1.792 -12.990 405 HB3 ASP 52 2HB ASP 52 6.248 1.452 -12.418 406 H TYR 53 H TYR 53 9.148 -0.049 -9.987 407 HA TYR 53 HA TYR 53 6.898 -1.710 -9.116 408 HB2 TYR 53 1HB TYR 53 8.616 -2.120 -11.559 409 HB3 TYR 53 2HB TYR 53 8.373 -3.507 -10.564 410 HD1 TYR 53 2HD TYR 53 6.297 -0.824 -12.183 411 HD2 TYR 53 1HD TYR 53 6.625 -4.973 -11.040 412 HE1 TYR 53 2HE TYR 53 4.161 -1.220 -13.196 413 HE2 TYR 53 1HE TYR 53 4.467 -5.436 -12.119 414 HH TYR 53 HH TYR 53 2.333 -2.903 -13.230 415 HA PRO 54 HA PRO 54 9.799 -3.127 -6.143 416 HB2 PRO 54 1HB PRO 54 8.888 -5.625 -5.495 417 HB3 PRO 54 2HB PRO 54 7.935 -4.131 -5.197 418 HG2 PRO 54 1HG PRO 54 7.690 -6.025 -7.544 419 HG3 PRO 54 2HG PRO 54 6.393 -5.418 -6.465 420 HD2 PRO 54 1HD PRO 54 6.945 -4.249 -8.853 421 HD3 PRO 54 2HD PRO 54 6.467 -3.277 -7.430 422 H SER 55 H SER 55 11.301 -5.076 -5.523 423 HA SER 55 HA SER 55 12.501 -6.311 -7.935 424 HB2 SER 55 1HB SER 55 13.608 -4.588 -6.119 425 HB3 SER 55 2HB SER 55 14.144 -6.165 -5.503 426 HG SER 55 HG SER 55 14.371 -5.197 -8.186 427 H ALA 56 H ALA 56 10.863 -6.921 -4.950 428 HA ALA 56 HA ALA 56 11.565 -9.688 -4.578 429 HB1 ALA 56 1HB ALA 56 10.300 -8.337 -2.900 430 HB2 ALA 56 2HB ALA 56 8.928 -8.224 -4.030 431 HB3 ALA 56 3HB ALA 56 9.407 -9.797 -3.356 432 H GLU 57 H GLU 57 10.206 -11.483 -5.026 433 HA GLU 57 HA GLU 57 9.020 -11.437 -7.756 434 HB2 GLU 57 1HB GLU 57 9.631 -13.776 -7.824 435 HB3 GLU 57 2HB GLU 57 11.032 -12.767 -7.402 436 HG2 GLU 57 1HG GLU 57 10.799 -13.414 -5.023 437 HG3 GLU 57 2HG GLU 57 9.397 -14.414 -5.425 438 H GLU 58 H GLU 58 8.307 -11.694 -4.473 439 HA GLU 58 HA GLU 58 5.591 -12.829 -4.878 440 HB2 GLU 58 1HB GLU 58 7.604 -13.320 -2.660 441 HB3 GLU 58 2HB GLU 58 5.855 -13.599 -2.499 442 HG2 GLU 58 1HG GLU 58 5.833 -15.351 -4.030 443 HG3 GLU 58 2HG GLU 58 7.318 -14.865 -4.826 444 H TYR 59 H TYR 59 4.414 -11.050 -4.874 445 HA TYR 59 HA TYR 59 4.305 -9.284 -2.561 446 HB2 TYR 59 1HB TYR 59 4.296 -7.256 -4.007 447 HB3 TYR 59 2HB TYR 59 5.864 -8.022 -3.807 448 HD1 TYR 59 2HD TYR 59 3.086 -7.360 -6.169 449 HD2 TYR 59 1HD TYR 59 7.071 -8.940 -5.706 450 HE1 TYR 59 2HE TYR 59 3.429 -7.184 -8.605 451 HE2 TYR 59 1HE TYR 59 7.408 -8.816 -8.146 452 HH TYR 59 HH TYR 59 4.909 -8.114 -10.423 453 H GLY 60 H GLY 60 2.261 -8.014 -2.738 454 HA2 GLY 60 1HA GLY 60 0.122 -9.374 -4.367 455 HA3 GLY 60 2HA GLY 60 -0.142 -8.442 -2.883 456 H THR 61 H THR 61 -1.678 -7.781 -5.172 457 HA THR 61 HA THR 61 -0.404 -5.230 -6.106 458 HB THR 61 HB THR 61 -2.721 -6.725 -7.358 459 HG1 THR 61 1HG THR 61 -0.317 -7.611 -7.607 460 HG21 THR 61 3HG2 THR 61 -1.010 -4.403 -8.356 461 HG22 THR 61 1HG2 THR 61 -2.720 -4.333 -7.883 462 HG23 THR 61 2HG2 THR 61 -2.240 -5.245 -9.320 463 H ILE 62 H ILE 62 -1.396 -3.395 -5.418 464 HA ILE 62 HA ILE 62 -4.097 -3.586 -4.124 465 HB ILE 62 HB ILE 62 -1.824 -1.654 -3.624 466 HG12 ILE 62 1HG1 ILE 62 -2.044 -2.952 -1.268 467 HG13 ILE 62 2HG1 ILE 62 -2.532 -4.272 -2.292 468 HG21 ILE 62 1HG2 ILE 62 -3.128 -0.986 -1.641 469 HG22 ILE 62 2HG2 ILE 62 -3.977 -0.635 -3.146 470 HG23 ILE 62 3HG2 ILE 62 -4.463 -2.050 -2.168 471 HD11 ILE 62 3HD1 ILE 62 -0.084 -4.254 -1.788 472 HD12 ILE 62 1HD1 ILE 62 -0.355 -4.135 -3.514 473 HD13 ILE 62 2HD1 ILE 62 0.074 -2.679 -2.609 474 H ASN 63 H ASN 63 -5.667 -2.279 -4.953 475 HA ASN 63 HA ASN 63 -4.922 -0.028 -6.757 476 HB2 ASN 63 1HB ASN 63 -7.051 -2.149 -7.118 477 HB3 ASN 63 2HB ASN 63 -7.345 -0.509 -7.685 478 HD21 ASN 63 1HD2 ASN 63 -5.002 -3.187 -7.933 479 HD22 ASN 63 2HD2 ASN 63 -4.389 -2.730 -9.522 480 H ILE 64 H ILE 64 -5.985 1.887 -6.298 481 HA ILE 64 HA ILE 64 -8.187 1.778 -4.330 482 HB ILE 64 HB ILE 64 -6.143 4.033 -4.418 483 HG12 ILE 64 1HG1 ILE 64 -6.520 1.717 -2.432 484 HG13 ILE 64 2HG1 ILE 64 -5.138 1.943 -3.500 485 HG21 ILE 64 1HG2 ILE 64 -7.332 4.878 -2.473 486 HG22 ILE 64 2HG2 ILE 64 -8.500 4.636 -3.782 487 HG23 ILE 64 3HG2 ILE 64 -8.419 3.478 -2.466 488 HD11 ILE 64 3HD1 ILE 64 -5.884 3.562 -1.074 489 HD12 ILE 64 1HD1 ILE 64 -4.390 2.668 -1.404 490 HD13 ILE 64 2HD1 ILE 64 -4.725 4.173 -2.284 491 H GLU 65 H GLU 65 -9.706 1.740 -5.970 492 HA GLU 65 HA GLU 65 -9.952 3.685 -8.077 493 HB2 GLU 65 1HB GLU 65 -11.082 1.475 -8.079 494 HB3 GLU 65 2HB GLU 65 -12.095 1.992 -6.735 495 HG2 GLU 65 1HG GLU 65 -13.235 3.595 -7.964 496 HG3 GLU 65 2HG GLU 65 -11.963 3.757 -9.188 497 H ASN 66 H ASN 66 -10.022 5.794 -7.561 498 HA ASN 66 HA ASN 66 -11.957 6.754 -5.618 499 HB2 ASN 66 1HB ASN 66 -10.486 8.323 -4.531 500 HB3 ASN 66 2HB ASN 66 -9.849 6.721 -4.282 501 HD21 ASN 66 1HD2 ASN 66 -7.871 6.102 -5.648 502 HD22 ASN 66 2HD2 ASN 66 -6.824 7.389 -6.186 503 H ASN 67 H ASN 67 -12.993 8.470 -6.363 504 HA ASN 67 HA ASN 67 -13.842 9.922 -7.842 505 HB2 ASN 67 1HB ASN 67 -11.034 10.887 -8.427 506 HB3 ASN 67 2HB ASN 67 -12.538 11.773 -8.560 507 HD21 ASN 67 1HD2 ASN 67 -10.237 10.319 -6.183 508 HD22 ASN 67 2HD2 ASN 67 -10.831 11.241 -4.820 509 H GLY 68 H GLY 68 -13.217 7.267 -8.869 510 HA2 GLY 68 1HA GLY 68 -13.327 6.097 -10.834 511 HA3 GLY 68 2HA GLY 68 -13.641 7.611 -11.677 512 H GLY 69 H GLY 69 -10.678 7.529 -9.866 513 HA2 GLY 69 1HA GLY 69 -9.043 6.675 -12.193 514 HA3 GLY 69 2HA GLY 69 -8.493 7.865 -11.006 515 H MET 70 H MET 70 -6.996 5.504 -11.301 516 HA MET 70 HA MET 70 -7.325 4.723 -8.516 517 HB2 MET 70 1HB MET 70 -6.768 2.336 -8.937 518 HB3 MET 70 2HB MET 70 -8.424 2.819 -9.380 519 HG2 MET 70 1HG MET 70 -6.213 2.719 -11.436 520 HG3 MET 70 2HG MET 70 -7.071 1.281 -10.921 521 HE1 MET 70 3HE MET 70 -6.792 2.544 -13.914 522 HE2 MET 70 1HE MET 70 -7.602 0.985 -13.606 523 HE3 MET 70 2HE MET 70 -8.428 2.251 -14.550 524 H THR 71 H THR 71 -5.668 4.297 -7.447 525 HA THR 71 HA THR 71 -2.960 4.909 -8.508 526 HB THR 71 HB THR 71 -4.108 5.648 -6.120 527 HG1 THR 71 1HG THR 71 -1.456 4.582 -6.147 528 HG21 THR 71 3HG2 THR 71 -3.664 4.216 -4.327 529 HG22 THR 71 1HG2 THR 71 -2.814 3.042 -5.349 530 HG23 THR 71 2HG2 THR 71 -4.540 3.249 -5.538 531 H THR 72 H THR 72 -1.308 3.228 -8.234 532 HA THR 72 HA THR 72 -2.246 0.487 -7.594 533 HB THR 72 HB THR 72 -0.310 1.259 -9.801 534 HG1 THR 72 1HG THR 72 -2.997 0.416 -10.097 535 HG21 THR 72 3HG2 THR 72 0.084 -1.028 -8.948 536 HG22 THR 72 1HG2 THR 72 -0.621 -1.098 -10.566 537 HG23 THR 72 2HG2 THR 72 -1.639 -1.422 -9.144 538 H MET 73 H MET 73 -0.734 -0.646 -6.290 539 HA MET 73 HA MET 73 2.047 0.102 -6.173 540 HB2 MET 73 1HB MET 73 2.147 0.285 -3.723 541 HB3 MET 73 2HB MET 73 1.408 1.653 -4.500 542 HG2 MET 73 1HG MET 73 -0.154 -0.549 -3.152 543 HG3 MET 73 2HG MET 73 0.412 0.892 -2.345 544 HE1 MET 73 3HE MET 73 -1.632 3.795 -3.359 545 HE2 MET 73 1HE MET 73 -0.406 3.054 -2.302 546 HE3 MET 73 2HE MET 73 -0.033 3.349 -4.006 547 H PHE 74 H PHE 74 3.134 -1.459 -4.518 548 HA PHE 74 HA PHE 74 1.887 -4.091 -4.342 549 HB2 PHE 74 1HB PHE 74 4.665 -3.637 -5.537 550 HB3 PHE 74 2HB PHE 74 3.797 -5.138 -5.401 551 HD1 PHE 74 2HD PHE 74 1.833 -5.614 -6.962 552 HD2 PHE 74 1HD PHE 74 4.297 -2.080 -7.387 553 HE1 PHE 74 2HE PHE 74 1.043 -5.329 -9.281 554 HE2 PHE 74 1HE PHE 74 3.479 -1.803 -9.708 555 HZ PHE 74 HZ PHE 74 1.834 -3.413 -10.666 556 H TYR 75 H TYR 75 2.951 -5.248 -2.502 557 HA TYR 75 HA TYR 75 4.966 -3.655 -0.974 558 HB2 TYR 75 1HB TYR 75 2.929 -5.282 0.517 559 HB3 TYR 75 2HB TYR 75 3.902 -3.976 1.073 560 HD1 TYR 75 2HD TYR 75 3.198 -1.819 -0.888 561 HD2 TYR 75 1HD TYR 75 0.759 -4.713 1.147 562 HE1 TYR 75 2HE TYR 75 1.333 -0.244 -0.929 563 HE2 TYR 75 1HE TYR 75 -1.156 -3.153 1.028 564 HH TYR 75 HH TYR 75 -0.720 0.211 -0.110 565 H TYR 76 H TYR 76 6.312 -5.060 0.498 566 HA TYR 76 HA TYR 76 6.225 -7.936 0.121 567 HB2 TYR 76 1HB TYR 76 8.407 -8.111 -0.995 568 HB3 TYR 76 2HB TYR 76 7.167 -7.388 -1.993 569 HD1 TYR 76 1HD TYR 76 9.934 -6.400 0.412 570 HD2 TYR 76 2HD TYR 76 7.794 -5.415 -3.171 571 HE1 TYR 76 1HE TYR 76 11.388 -4.428 0.098 572 HE2 TYR 76 2HE TYR 76 9.411 -3.513 -3.590 573 HH TYR 76 HH TYR 76 12.315 -3.243 -1.517 574 H GLU 77 H GLU 77 8.314 -8.927 1.156 575 HA GLU 77 HA GLU 77 9.299 -7.301 3.449 576 HB2 GLU 77 1HB GLU 77 8.200 -9.566 3.891 577 HB3 GLU 77 2HB GLU 77 9.582 -10.299 3.080 578 HG2 GLU 77 1HG GLU 77 11.080 -9.145 4.770 579 HG3 GLU 77 2HG GLU 77 9.635 -8.541 5.580 580 H GLU 78 H GLU 78 11.558 -6.997 3.671 581 HA GLU 78 HA GLU 78 13.389 -8.203 1.720 582 HB2 GLU 78 1HB GLU 78 12.340 -6.128 0.794 583 HB3 GLU 78 2HB GLU 78 13.210 -5.193 1.975 584 HG2 GLU 78 1HG GLU 78 15.212 -5.412 0.883 585 HG3 GLU 78 2HG GLU 78 14.857 -7.054 0.355 586 H ASN 79 H ASN 79 14.945 -8.972 2.997 587 HA ASN 79 HA ASN 79 16.591 -9.201 4.484 588 HB2 ASN 79 1HB ASN 79 16.637 -6.322 3.961 589 HB3 ASN 79 2HB ASN 79 17.125 -6.650 5.610 590 HD21 ASN 79 1HD2 ASN 79 18.021 -6.922 2.254 591 HD22 ASN 79 2HD2 ASN 79 19.538 -7.718 2.510 592 H GLY 80 H GLY 80 13.594 -8.430 5.478 593 HA2 GLY 80 1HA GLY 80 12.843 -9.485 7.572 594 HA3 GLY 80 2HA GLY 80 14.252 -8.811 8.382 595 H LYS 81 H LYS 81 12.947 -6.449 6.149 596 HA LYS 81 HA LYS 81 10.977 -5.448 8.123 597 HB2 LYS 81 1HB LYS 81 13.139 -4.092 6.565 598 HB3 LYS 81 2HB LYS 81 11.533 -3.356 6.428 599 HG2 LYS 81 1HG LYS 81 12.600 -2.282 8.185 600 HG3 LYS 81 2HG LYS 81 11.336 -3.305 8.889 601 HD2 LYS 81 1HD LYS 81 13.676 -4.912 8.916 602 HD3 LYS 81 2HD LYS 81 14.254 -3.294 9.286 603 HE2 LYS 81 1HE LYS 81 12.289 -3.208 11.010 604 HE3 LYS 81 2HE LYS 81 12.156 -4.958 10.737 605 HZ1 LYS 81 3HZ LYS 81 14.413 -3.429 11.825 606 HZ2 LYS 81 1HZ LYS 81 14.600 -4.996 11.307 607 HZ3 LYS 81 2HZ LYS 81 13.575 -4.629 12.565 608 H TYR 82 H TYR 82 9.063 -4.532 7.128 609 HA TYR 82 HA TYR 82 8.535 -5.625 4.414 610 HB2 TYR 82 1HB TYR 82 6.676 -4.580 6.551 611 HB3 TYR 82 2HB TYR 82 6.196 -5.143 4.959 612 HD1 TYR 82 2HD TYR 82 6.411 -7.575 4.367 613 HD2 TYR 82 1HD TYR 82 7.246 -6.128 8.348 614 HE1 TYR 82 2HE TYR 82 6.275 -9.875 5.232 615 HE2 TYR 82 1HE TYR 82 7.066 -8.416 9.237 616 HH TYR 82 HH TYR 82 6.603 -11.262 7.063 617 H TYR 83 H TYR 83 7.673 -4.156 2.821 618 HA TYR 83 HA TYR 83 7.995 -1.296 3.390 619 HB2 TYR 83 1HB TYR 83 9.372 -2.708 1.079 620 HB3 TYR 83 2HB TYR 83 9.316 -0.976 1.301 621 HD1 TYR 83 1HD TYR 83 10.628 0.141 3.100 622 HD2 TYR 83 2HD TYR 83 10.820 -4.119 2.466 623 HE1 TYR 83 1HE TYR 83 12.565 0.006 4.642 624 HE2 TYR 83 2HE TYR 83 12.791 -4.268 3.872 625 HH TYR 83 HH TYR 83 13.878 -1.686 5.927 626 H ILE 84 H ILE 84 7.221 0.030 1.529 627 HA ILE 84 HA ILE 84 5.134 -1.298 -0.103 628 HB ILE 84 HB ILE 84 4.976 1.339 1.397 629 HG12 ILE 84 1HG1 ILE 84 2.678 0.399 2.000 630 HG13 ILE 84 2HG1 ILE 84 3.294 -1.175 1.489 631 HG21 ILE 84 1HG2 ILE 84 4.239 2.001 -0.725 632 HG22 ILE 84 2HG2 ILE 84 3.349 0.512 -0.986 633 HG23 ILE 84 3HG2 ILE 84 2.772 1.708 0.204 634 HD11 ILE 84 3HD1 ILE 84 3.307 -0.566 3.936 635 HD12 ILE 84 1HD1 ILE 84 4.739 -1.342 3.268 636 HD13 ILE 84 2HD1 ILE 84 4.742 0.426 3.582 637 H GLU 85 H GLU 85 5.450 -1.051 -2.226 638 HA GLU 85 HA GLU 85 7.492 0.694 -3.277 639 HB2 GLU 85 1HB GLU 85 6.898 -1.717 -4.013 640 HB3 GLU 85 2HB GLU 85 5.426 -1.030 -4.710 641 HG2 GLU 85 1HG GLU 85 7.163 -1.389 -6.386 642 HG3 GLU 85 2HG GLU 85 6.647 0.281 -6.275 643 H CYS 86 H CYS 86 7.065 2.363 -4.901 644 HA CYS 86 HA CYS 86 4.555 3.372 -5.627 645 HB2 CYS 86 1HB CYS 86 5.573 4.144 -2.957 646 HB3 CYS 86 2HB CYS 86 5.326 5.556 -3.982 647 HG CYS 86 HG CYS 86 3.275 3.066 -3.347 648 HA PRO 87 HA PRO 87 7.391 5.742 -8.225 649 HB2 PRO 87 1HB PRO 87 6.216 8.170 -8.615 650 HB3 PRO 87 2HB PRO 87 5.491 6.669 -9.237 651 HG2 PRO 87 1HG PRO 87 4.882 8.077 -6.617 652 HG3 PRO 87 2HG PRO 87 3.725 7.553 -7.877 653 HD2 PRO 87 1HD PRO 87 4.201 6.033 -5.722 654 HD3 PRO 87 2HD PRO 87 3.997 5.298 -7.317 655 H TYR 88 H TYR 88 8.232 8.366 -8.092 656 HA TYR 88 HA TYR 88 10.331 8.519 -6.655 657 HB2 TYR 88 1HB TYR 88 8.483 10.916 -6.886 658 HB3 TYR 88 2HB TYR 88 10.201 10.980 -6.555 659 HD1 TYR 88 1HD TYR 88 11.898 10.354 -8.249 660 HD2 TYR 88 2HD TYR 88 7.680 10.660 -9.179 661 HE1 TYR 88 1HE TYR 88 12.456 10.721 -10.594 662 HE2 TYR 88 2HE TYR 88 8.240 10.993 -11.557 663 HH TYR 88 HH TYR 88 11.614 11.208 -12.749 664 H LYS 89 H LYS 89 7.379 8.439 -4.901 665 HA LYS 89 HA LYS 89 8.943 8.841 -2.497 666 HB2 LYS 89 1HB LYS 89 5.942 9.472 -2.622 667 HB3 LYS 89 2HB LYS 89 7.008 9.672 -1.253 668 HG2 LYS 89 1HG LYS 89 7.281 11.766 -1.827 669 HG3 LYS 89 2HG LYS 89 8.214 11.276 -3.190 670 HD2 LYS 89 1HD LYS 89 5.213 11.820 -3.114 671 HD3 LYS 89 2HD LYS 89 6.458 12.855 -3.844 672 HE2 LYS 89 1HE LYS 89 7.040 11.034 -5.431 673 HE3 LYS 89 2HE LYS 89 5.779 10.017 -4.717 674 HZ1 LYS 89 3HZ LYS 89 4.172 11.790 -5.395 675 HZ2 LYS 89 1HZ LYS 89 4.911 11.038 -6.670 676 HZ3 LYS 89 2HZ LYS 89 5.425 12.511 -6.259 677 H GLY 90 H GLY 90 9.128 6.414 -3.442 678 HA2 GLY 90 1HA GLY 90 7.215 4.805 -1.821 679 HA3 GLY 90 2HA GLY 90 7.740 4.397 -3.451 680 H ILE 91 H ILE 91 9.141 5.132 -0.231 681 HA ILE 91 HA ILE 91 10.510 2.527 -0.279 682 HB ILE 91 HB ILE 91 12.039 5.042 0.482 683 HG12 ILE 91 1HG1 ILE 91 12.080 3.568 -2.175 684 HG13 ILE 91 2HG1 ILE 91 11.666 5.257 -1.870 685 HG21 ILE 91 1HG2 ILE 91 12.627 2.638 1.366 686 HG22 ILE 91 2HG2 ILE 91 13.174 2.333 -0.268 687 HG23 ILE 91 3HG2 ILE 91 13.917 3.654 0.682 688 HD11 ILE 91 3HD1 ILE 91 13.847 5.083 -2.882 689 HD12 ILE 91 1HD1 ILE 91 13.974 5.772 -1.244 690 HD13 ILE 91 2HD1 ILE 91 14.454 4.081 -1.563 691 H TYR 92 H TYR 92 8.281 2.847 0.979 692 HA TYR 92 HA TYR 92 8.445 4.177 3.611 693 HB2 TYR 92 1HB TYR 92 6.249 2.307 2.707 694 HB3 TYR 92 2HB TYR 92 6.219 3.386 4.067 695 HD1 TYR 92 1HD TYR 92 6.038 3.191 0.373 696 HD2 TYR 92 2HD TYR 92 5.566 5.718 3.827 697 HE1 TYR 92 1HE TYR 92 5.068 4.947 -1.043 698 HE2 TYR 92 2HE TYR 92 4.820 7.579 2.353 699 HH TYR 92 HH TYR 92 5.038 7.262 -1.079 700 H GLU 93 H GLU 93 9.827 3.315 4.962 701 HA GLU 93 HA GLU 93 10.004 0.413 5.402 702 HB2 GLU 93 1HB GLU 93 11.879 2.016 5.897 703 HB3 GLU 93 2HB GLU 93 10.846 2.839 7.043 704 HG2 GLU 93 1HG GLU 93 10.809 0.141 7.906 705 HG3 GLU 93 2HG GLU 93 12.444 0.381 7.315 706 H ILE 94 H ILE 94 8.461 -0.657 6.408 707 HA ILE 94 HA ILE 94 7.109 0.598 8.729 708 HB ILE 94 HB ILE 94 5.151 -0.735 8.481 709 HG12 ILE 94 1HG1 ILE 94 6.357 -1.895 5.947 710 HG13 ILE 94 2HG1 ILE 94 6.102 -2.729 7.477 711 HG21 ILE 94 1HG2 ILE 94 4.132 0.391 6.603 712 HG22 ILE 94 2HG2 ILE 94 5.321 1.446 7.361 713 HG23 ILE 94 3HG2 ILE 94 5.712 0.636 5.819 714 HD11 ILE 94 3HD1 ILE 94 3.656 -2.431 7.279 715 HD12 ILE 94 1HD1 ILE 94 3.881 -1.638 5.710 716 HD13 ILE 94 2HD1 ILE 94 4.343 -3.329 5.902 717 H GLU 95 H GLU 95 6.434 -1.311 10.283 718 HA GLU 95 HA GLU 95 8.821 -3.094 10.541 719 HB2 GLU 95 1HB GLU 95 6.979 -1.995 12.711 720 HB3 GLU 95 2HB GLU 95 8.492 -2.886 12.933 721 HG2 GLU 95 1HG GLU 95 9.701 -0.966 11.809 722 HG3 GLU 95 2HG GLU 95 8.175 -0.043 11.845 723 H ASN 96 H ASN 96 5.752 -3.436 9.506 724 HA ASN 96 HA ASN 96 5.226 -5.977 10.915 725 HB2 ASN 96 1HB ASN 96 3.265 -3.611 10.561 726 HB3 ASN 96 2HB ASN 96 2.772 -5.194 11.108 727 HD21 ASN 96 1HD2 ASN 96 5.662 -4.694 12.809 728 HD22 ASN 96 2HD2 ASN 96 4.879 -4.045 14.240 729 H ASN 97 H ASN 97 3.562 -7.277 9.760 730 HA ASN 97 HA ASN 97 3.892 -6.900 6.854 731 HB2 ASN 97 1HB ASN 97 4.050 -9.203 7.828 732 HB3 ASN 97 2HB ASN 97 2.379 -9.072 8.375 733 HD21 ASN 97 1HD2 ASN 97 4.396 -8.712 5.407 734 HD22 ASN 97 2HD2 ASN 97 3.190 -9.309 4.292 735 H PHE 98 H PHE 98 2.549 -5.548 5.849 736 HA PHE 98 HA PHE 98 0.186 -4.382 6.823 737 HB2 PHE 98 1HB PHE 98 1.567 -3.582 4.923 738 HB3 PHE 98 2HB PHE 98 1.061 -4.959 3.959 739 HD1 PHE 98 2HD PHE 98 -1.478 -5.210 3.418 740 HD2 PHE 98 1HD PHE 98 0.371 -1.546 4.744 741 HE1 PHE 98 2HE PHE 98 -3.366 -3.944 2.529 742 HE2 PHE 98 1HE PHE 98 -1.513 -0.267 3.781 743 HZ PHE 98 HZ PHE 98 -3.411 -1.450 2.700 744 H GLU 99 H GLU 99 0.607 -7.363 4.855 745 HA GLU 99 HA GLU 99 -2.175 -7.553 4.272 746 HB2 GLU 99 1HB GLU 99 0.224 -9.290 3.706 747 HB3 GLU 99 2HB GLU 99 -1.419 -9.770 3.232 748 HG2 GLU 99 1HG GLU 99 -1.743 -7.697 1.991 749 HG3 GLU 99 2HG GLU 99 -0.212 -7.053 2.537 750 H ASP 100 H ASP 100 -0.521 -8.497 7.071 751 HA ASP 100 HA ASP 100 -2.855 -10.182 7.867 752 HB2 ASP 100 1HB ASP 100 -0.345 -10.925 8.199 753 HB3 ASP 100 2HB ASP 100 -0.401 -9.850 9.584 754 H MET 101 H MET 101 -1.513 -7.004 8.193 755 HA MET 101 HA MET 101 -2.913 -6.337 10.679 756 HB2 MET 101 1HB MET 101 -1.683 -4.635 8.482 757 HB3 MET 101 2HB MET 101 -2.484 -3.979 9.912 758 HG2 MET 101 1HG MET 101 -0.211 -5.959 10.170 759 HG3 MET 101 2HG MET 101 0.099 -4.244 9.940 760 HE1 MET 101 3HE MET 101 0.263 -2.586 11.732 761 HE2 MET 101 1HE MET 101 -1.501 -2.461 11.533 762 HE3 MET 101 2HE MET 101 -0.786 -2.538 13.159 763 H ILE 102 H ILE 102 -3.560 -6.242 7.146 764 HA ILE 102 HA ILE 102 -6.233 -5.204 7.494 765 HB ILE 102 HB ILE 102 -6.662 -5.775 5.205 766 HG12 ILE 102 1HG1 ILE 102 -4.010 -7.225 5.337 767 HG13 ILE 102 2HG1 ILE 102 -5.594 -7.878 4.936 768 HG21 ILE 102 1HG2 ILE 102 -5.113 -4.194 4.235 769 HG22 ILE 102 2HG2 ILE 102 -5.398 -3.691 5.905 770 HG23 ILE 102 3HG2 ILE 102 -3.891 -4.519 5.481 771 HD11 ILE 102 3HD1 ILE 102 -3.926 -6.032 3.203 772 HD12 ILE 102 1HD1 ILE 102 -4.320 -7.728 2.913 773 HD13 ILE 102 2HD1 ILE 102 -5.606 -6.502 2.843 Start of MODEL 4 1 H1 GLY 1 H GLY 1 4.707 12.099 10.122 2 HA2 GLY 1 1HA GLY 1 4.496 13.435 7.482 3 HA3 GLY 1 2HA GLY 1 5.975 12.663 8.096 4 H SER 2 H SER 2 3.188 12.152 6.214 5 HA SER 2 HA SER 2 3.374 9.207 6.369 6 HB2 SER 2 1HB SER 2 0.859 10.924 6.158 7 HB3 SER 2 2HB SER 2 0.907 9.175 6.192 8 HG SER 2 HG SER 2 1.581 9.202 8.290 9 HA PRO 3 HA PRO 3 2.757 9.719 1.808 10 HB2 PRO 3 1HB PRO 3 0.689 7.936 1.343 11 HB3 PRO 3 2HB PRO 3 2.400 7.472 1.429 12 HG2 PRO 3 1HG PRO 3 0.346 7.283 3.579 13 HG3 PRO 3 2HG PRO 3 1.598 6.102 3.078 14 HD2 PRO 3 1HD PRO 3 1.943 7.700 5.248 15 HD3 PRO 3 2HD PRO 3 3.271 7.206 4.215 16 H ILE 4 H ILE 4 0.924 10.364 0.441 17 HA ILE 4 HA ILE 4 -1.130 11.970 1.847 18 HB ILE 4 HB ILE 4 0.179 12.346 -0.902 19 HG12 ILE 4 1HG1 ILE 4 0.676 13.767 1.740 20 HG13 ILE 4 2HG1 ILE 4 1.809 12.753 0.880 21 HG21 ILE 4 1HG2 ILE 4 -1.007 14.494 -0.927 22 HG22 ILE 4 2HG2 ILE 4 -2.157 13.179 -0.761 23 HG23 ILE 4 3HG2 ILE 4 -1.701 14.152 0.670 24 HD11 ILE 4 3HD1 ILE 4 1.852 14.337 -1.026 25 HD12 ILE 4 1HD1 ILE 4 0.855 15.465 -0.072 26 HD13 ILE 4 2HD1 ILE 4 2.461 15.003 0.503 27 H LEU 5 H LEU 5 -3.025 10.767 1.742 28 HA LEU 5 HA LEU 5 -3.410 8.940 -0.580 29 HB2 LEU 5 1HB LEU 5 -4.722 8.925 2.177 30 HB3 LEU 5 2HB LEU 5 -5.014 7.781 0.901 31 HG LEU 5 HG LEU 5 -3.659 6.575 2.242 32 HD11 LEU 5 1HD1 LEU 5 -1.417 6.345 1.181 33 HD12 LEU 5 2HD1 LEU 5 -1.631 7.872 0.351 34 HD13 LEU 5 3HD1 LEU 5 -2.706 6.502 -0.015 35 HD21 LEU 5 3HD2 LEU 5 -1.724 8.835 2.772 36 HD22 LEU 5 1HD2 LEU 5 -1.866 7.253 3.578 37 HD23 LEU 5 2HD2 LEU 5 -3.127 8.448 3.795 38 HA PRO 6 HA PRO 6 -7.176 11.144 -1.666 39 HB2 PRO 6 1HB PRO 6 -8.905 8.999 -2.212 40 HB3 PRO 6 2HB PRO 6 -7.680 9.613 -3.342 41 HG2 PRO 6 1HG PRO 6 -7.459 7.299 -1.420 42 HG3 PRO 6 2HG PRO 6 -7.022 7.349 -3.163 43 HD2 PRO 6 1HD PRO 6 -5.149 7.631 -1.301 44 HD3 PRO 6 2HD PRO 6 -5.115 8.695 -2.729 45 H LYS 7 H LYS 7 -9.637 11.228 -0.872 46 HA LYS 7 HA LYS 7 -9.950 10.874 1.895 47 HB2 LYS 7 1HB LYS 7 -12.288 10.654 0.009 48 HB3 LYS 7 2HB LYS 7 -12.138 11.450 1.541 49 HG2 LYS 7 1HG LYS 7 -10.368 12.868 -0.249 50 HG3 LYS 7 2HG LYS 7 -11.802 12.480 -1.179 51 HD2 LYS 7 1HD LYS 7 -12.326 14.556 -0.169 52 HD3 LYS 7 2HD LYS 7 -13.082 13.317 0.853 53 HE2 LYS 7 1HE LYS 7 -11.915 14.465 2.523 54 HE3 LYS 7 2HE LYS 7 -10.726 13.238 1.990 55 HZ1 LYS 7 3HZ LYS 7 -10.876 16.086 1.176 56 HZ2 LYS 7 1HZ LYS 7 -9.863 15.009 0.461 57 HZ3 LYS 7 2HZ LYS 7 -9.663 15.410 2.056 58 H ALA 8 H ALA 8 -11.577 9.247 2.881 59 HA ALA 8 HA ALA 8 -11.606 6.583 1.604 60 HB1 ALA 8 1HB ALA 8 -11.737 6.908 4.094 61 HB2 ALA 8 2HB ALA 8 -13.293 7.732 3.889 62 HB3 ALA 8 3HB ALA 8 -13.139 6.032 3.423 63 H GLU 9 H GLU 9 -14.061 9.183 2.242 64 HA GLU 9 HA GLU 9 -15.986 7.684 0.946 65 HB2 GLU 9 1HB GLU 9 -17.454 9.582 1.206 66 HB3 GLU 9 2HB GLU 9 -16.390 9.452 2.612 67 HG2 GLU 9 1HG GLU 9 -14.925 11.238 1.636 68 HG3 GLU 9 2HG GLU 9 -16.002 11.359 0.255 69 H ASN 10 H ASN 10 -13.634 9.609 -0.776 70 HA ASN 10 HA ASN 10 -15.326 9.802 -3.151 71 HB2 ASN 10 1HB ASN 10 -13.678 11.111 -4.089 72 HB3 ASN 10 2HB ASN 10 -13.714 11.631 -2.411 73 HD21 ASN 10 1HD2 ASN 10 -12.052 9.137 -1.558 74 HD22 ASN 10 2HD2 ASN 10 -10.479 9.482 -2.118 75 H VAL 11 H VAL 11 -13.777 7.247 -1.778 76 HA VAL 11 HA VAL 11 -12.467 6.136 -4.148 77 HB VAL 11 HB VAL 11 -13.037 5.187 -1.314 78 HG11 VAL 11 1HG1 VAL 11 -11.643 3.264 -1.644 79 HG12 VAL 11 2HG1 VAL 11 -13.045 3.176 -2.699 80 HG13 VAL 11 3HG1 VAL 11 -11.458 3.625 -3.371 81 HG21 VAL 11 3HG2 VAL 11 -10.405 5.796 -2.694 82 HG22 VAL 11 1HG2 VAL 11 -11.270 6.940 -1.688 83 HG23 VAL 11 2HG2 VAL 11 -10.708 5.448 -0.968 84 H ASP 12 H ASP 12 -13.379 4.516 -5.355 85 HA ASP 12 HA ASP 12 -16.324 4.145 -5.283 86 HB2 ASP 12 1HB ASP 12 -14.207 3.986 -7.318 87 HB3 ASP 12 2HB ASP 12 -15.142 2.487 -7.253 88 H SER 13 H SER 13 -13.290 2.129 -5.396 89 HA SER 13 HA SER 13 -14.135 0.616 -3.081 90 HB2 SER 13 1HB SER 13 -13.930 -1.609 -4.339 91 HB3 SER 13 2HB SER 13 -15.406 -0.695 -4.604 92 HG SER 13 HG SER 13 -14.314 0.208 -6.482 93 H ILE 14 H ILE 14 -12.350 -1.105 -2.610 94 HA ILE 14 HA ILE 14 -9.752 -0.363 -3.832 95 HB ILE 14 HB ILE 14 -10.198 -1.175 -0.939 96 HG12 ILE 14 1HG1 ILE 14 -9.610 1.566 -2.103 97 HG13 ILE 14 2HG1 ILE 14 -11.072 1.064 -1.246 98 HG21 ILE 14 1HG2 ILE 14 -7.989 -1.882 -1.902 99 HG22 ILE 14 2HG2 ILE 14 -7.637 -0.186 -2.266 100 HG23 ILE 14 3HG2 ILE 14 -7.819 -0.744 -0.594 101 HD11 ILE 14 3HD1 ILE 14 -9.742 0.698 0.821 102 HD12 ILE 14 1HD1 ILE 14 -8.318 1.344 -0.033 103 HD13 ILE 14 2HD1 ILE 14 -9.732 2.376 0.227 104 H CYS 15 H CYS 15 -8.517 -2.199 -4.362 105 HA CYS 15 HA CYS 15 -9.547 -4.824 -3.393 106 HB2 CYS 15 1HB CYS 15 -10.062 -4.481 -5.872 107 HB3 CYS 15 2HB CYS 15 -8.302 -4.507 -6.132 108 HG CYS 15 HG CYS 15 -9.276 -6.849 -6.740 109 H ILE 16 H ILE 16 -7.967 -6.168 -2.660 110 HA ILE 16 HA ILE 16 -5.130 -5.459 -2.998 111 HB ILE 16 HB ILE 16 -6.405 -6.241 -0.357 112 HG12 ILE 16 1HG1 ILE 16 -5.227 -3.641 -1.428 113 HG13 ILE 16 2HG1 ILE 16 -6.880 -3.901 -0.880 114 HG21 ILE 16 1HG2 ILE 16 -4.178 -6.054 0.620 115 HG22 ILE 16 2HG2 ILE 16 -4.161 -7.247 -0.672 116 HG23 ILE 16 3HG2 ILE 16 -3.486 -5.636 -0.964 117 HD11 ILE 16 3HD1 ILE 16 -4.428 -3.804 0.879 118 HD12 ILE 16 1HD1 ILE 16 -5.676 -2.577 0.724 119 HD13 ILE 16 2HD1 ILE 16 -6.083 -4.149 1.441 120 H ASP 17 H ASP 17 -4.543 -7.091 -4.288 121 HA ASP 17 HA ASP 17 -5.742 -9.808 -4.027 122 HB2 ASP 17 1HB ASP 17 -5.281 -8.493 -6.290 123 HB3 ASP 17 2HB ASP 17 -3.644 -9.090 -6.095 124 H PHE 18 H PHE 18 -4.647 -11.071 -2.545 125 HA PHE 18 HA PHE 18 -2.283 -10.164 -1.213 126 HB2 PHE 18 1HB PHE 18 -4.078 -12.621 -1.069 127 HB3 PHE 18 2HB PHE 18 -2.635 -12.608 -0.190 128 HD1 PHE 18 1HD PHE 18 -5.324 -9.941 -0.690 129 HD2 PHE 18 2HD PHE 18 -2.956 -12.277 2.072 130 HE1 PHE 18 1HE PHE 18 -6.312 -8.732 1.170 131 HE2 PHE 18 2HE PHE 18 -4.041 -11.101 3.964 132 HZ PHE 18 HZ PHE 18 -5.701 -9.298 3.533 133 H THR 19 H THR 19 -0.477 -11.990 -0.770 134 HA THR 19 HA THR 19 1.027 -12.504 -3.118 135 HB THR 19 HB THR 19 1.993 -14.391 -1.476 136 HG1 THR 19 1HG THR 19 0.305 -14.330 0.017 137 HG21 THR 19 3HG2 THR 19 3.214 -12.374 -2.038 138 HG22 THR 19 1HG2 THR 19 3.296 -12.631 -0.289 139 HG23 THR 19 2HG2 THR 19 2.185 -11.402 -0.953 140 H ASN 20 H ASN 20 -1.169 -14.545 -1.302 141 HA ASN 20 HA ASN 20 -1.146 -16.784 -3.168 142 HB2 ASN 20 1HB ASN 20 -2.931 -17.637 -1.531 143 HB3 ASN 20 2HB ASN 20 -1.302 -17.485 -0.910 144 HD21 ASN 20 1HD2 ASN 20 -4.088 -17.384 0.470 145 HD22 ASN 20 2HD2 ASN 20 -3.848 -15.961 1.477 146 H SER 21 H SER 21 -3.477 -17.505 -3.927 147 HA SER 21 HA SER 21 -4.220 -15.129 -5.494 148 HB2 SER 21 1HB SER 21 -5.359 -16.907 -6.922 149 HB3 SER 21 2HB SER 21 -3.605 -16.797 -6.928 150 HG SER 21 HG SER 21 -5.005 -18.659 -5.299 151 H ILE 22 H ILE 22 -5.129 -14.428 -3.402 152 HA ILE 22 HA ILE 22 -8.015 -14.888 -3.331 153 HB ILE 22 HB ILE 22 -6.359 -14.554 -0.806 154 HG12 ILE 22 1HG1 ILE 22 -7.214 -17.203 -2.080 155 HG13 ILE 22 2HG1 ILE 22 -5.584 -16.639 -1.722 156 HG21 ILE 22 1HG2 ILE 22 -8.848 -14.067 -0.911 157 HG22 ILE 22 2HG2 ILE 22 -9.112 -15.775 -1.336 158 HG23 ILE 22 3HG2 ILE 22 -8.430 -15.332 0.256 159 HD11 ILE 22 3HD1 ILE 22 -6.094 -18.257 -0.024 160 HD12 ILE 22 1HD1 ILE 22 -6.263 -16.683 0.774 161 HD13 ILE 22 2HD1 ILE 22 -7.694 -17.565 0.265 162 H GLN 23 H GLN 23 -8.877 -12.910 -3.195 163 HA GLN 23 HA GLN 23 -7.178 -10.603 -2.550 164 HB2 GLN 23 1HB GLN 23 -7.838 -9.699 -4.420 165 HB3 GLN 23 2HB GLN 23 -8.001 -11.329 -4.992 166 HG2 GLN 23 1HG GLN 23 -10.452 -11.184 -4.438 167 HG3 GLN 23 2HG GLN 23 -10.187 -9.465 -4.122 168 HE21 GLN 23 1HE2 GLN 23 -8.041 -10.053 -6.666 169 HE22 GLN 23 2HE2 GLN 23 -9.095 -9.470 -7.911 170 H LYS 24 H LYS 24 -8.319 -8.831 -1.680 171 HA LYS 24 HA LYS 24 -10.966 -9.457 -0.478 172 HB2 LYS 24 1HB LYS 24 -8.561 -9.356 0.970 173 HB3 LYS 24 2HB LYS 24 -9.219 -7.765 1.148 174 HG2 LYS 24 1HG LYS 24 -10.500 -10.417 1.863 175 HG3 LYS 24 2HG LYS 24 -9.881 -9.209 2.974 176 HD2 LYS 24 1HD LYS 24 -12.381 -8.956 1.265 177 HD3 LYS 24 2HD LYS 24 -12.294 -9.293 2.989 178 HE2 LYS 24 1HE LYS 24 -11.116 -7.051 3.285 179 HE3 LYS 24 2HE LYS 24 -11.507 -6.706 1.594 180 HZ1 LYS 24 3HZ LYS 24 -13.883 -7.214 2.303 181 HZ2 LYS 24 1HZ LYS 24 -13.269 -5.815 2.841 182 HZ3 LYS 24 2HZ LYS 24 -13.328 -7.076 3.866 183 H ILE 25 H ILE 25 -12.376 -7.870 -0.849 184 HA ILE 25 HA ILE 25 -11.401 -5.402 -2.205 185 HB ILE 25 HB ILE 25 -14.052 -6.879 -2.394 186 HG12 ILE 25 1HG1 ILE 25 -12.128 -6.281 -4.679 187 HG13 ILE 25 2HG1 ILE 25 -11.932 -7.732 -3.710 188 HG21 ILE 25 1HG2 ILE 25 -14.409 -4.424 -2.482 189 HG22 ILE 25 2HG2 ILE 25 -13.161 -4.273 -3.737 190 HG23 ILE 25 3HG2 ILE 25 -14.661 -5.143 -4.065 191 HD11 ILE 25 3HD1 ILE 25 -13.198 -8.200 -5.725 192 HD12 ILE 25 1HD1 ILE 25 -14.176 -8.503 -4.270 193 HD13 ILE 25 2HD1 ILE 25 -14.455 -7.046 -5.257 194 H TYR 26 H TYR 26 -12.003 -3.463 -1.195 195 HA TYR 26 HA TYR 26 -13.387 -3.771 1.444 196 HB2 TYR 26 1HB TYR 26 -11.122 -1.872 0.878 197 HB3 TYR 26 2HB TYR 26 -11.975 -2.099 2.398 198 HD1 TYR 26 1HD TYR 26 -9.780 -3.933 -0.093 199 HD2 TYR 26 2HD TYR 26 -11.062 -3.634 4.016 200 HE1 TYR 26 1HE TYR 26 -8.189 -5.671 0.567 201 HE2 TYR 26 2HE TYR 26 -9.565 -5.468 4.635 202 HH TYR 26 HH TYR 26 -7.990 -6.992 3.921 203 H ASP 27 H ASP 27 -15.330 -3.308 0.760 204 HA ASP 27 HA ASP 27 -15.946 -0.725 -0.550 205 HB2 ASP 27 1HB ASP 27 -17.771 -1.819 -1.644 206 HB3 ASP 27 2HB ASP 27 -16.309 -2.724 -1.997 207 H ASP 28 H ASP 28 -15.752 -1.800 2.372 208 HA ASP 28 HA ASP 28 -18.392 -0.758 3.284 209 HB2 ASP 28 1HB ASP 28 -16.382 -2.311 4.908 210 HB3 ASP 28 2HB ASP 28 -17.880 -1.647 5.492 211 H SER 29 H SER 29 -18.199 1.150 4.429 212 HA SER 29 HA SER 29 -16.018 2.867 4.005 213 HB2 SER 29 1HB SER 29 -18.234 3.701 4.463 214 HB3 SER 29 2HB SER 29 -18.252 2.945 6.056 215 HG SER 29 HG SER 29 -16.740 5.210 5.210 216 H GLU 30 H GLU 30 -16.743 1.062 7.036 217 HA GLU 30 HA GLU 30 -14.494 1.891 8.492 218 HB2 GLU 30 1HB GLU 30 -16.567 -0.156 8.747 219 HB3 GLU 30 2HB GLU 30 -15.009 -0.860 9.167 220 HG2 GLU 30 1HG GLU 30 -14.566 1.094 10.691 221 HG3 GLU 30 2HG GLU 30 -16.215 1.661 10.371 222 H SER 31 H SER 31 -14.840 -0.904 6.287 223 HA SER 31 HA SER 31 -12.246 -2.022 6.599 224 HB2 SER 31 1HB SER 31 -14.247 -2.067 4.317 225 HB3 SER 31 2HB SER 31 -12.872 -3.123 4.442 226 HG SER 31 HG SER 31 -13.726 -3.855 6.487 227 H ILE 32 H ILE 32 -13.470 0.565 4.444 228 HA ILE 32 HA ILE 32 -10.947 0.834 3.058 229 HB ILE 32 HB ILE 32 -13.386 2.624 3.346 230 HG12 ILE 32 1HG1 ILE 32 -12.169 1.162 0.957 231 HG13 ILE 32 2HG1 ILE 32 -13.445 0.498 1.964 232 HG21 ILE 32 1HG2 ILE 32 -11.647 4.198 3.168 233 HG22 ILE 32 2HG2 ILE 32 -10.702 3.214 2.053 234 HG23 ILE 32 3HG2 ILE 32 -12.207 4.022 1.511 235 HD11 ILE 32 3HD1 ILE 32 -13.677 2.988 0.231 236 HD12 ILE 32 1HD1 ILE 32 -14.420 1.410 -0.029 237 HD13 ILE 32 2HD1 ILE 32 -14.925 2.396 1.358 238 H GLN 33 H GLN 33 -12.435 2.664 5.840 239 HA GLN 33 HA GLN 33 -10.211 4.397 6.161 240 HB2 GLN 33 1HB GLN 33 -12.312 3.425 8.144 241 HB3 GLN 33 2HB GLN 33 -11.008 4.520 8.583 242 HG2 GLN 33 1HG GLN 33 -11.820 5.969 6.552 243 HG3 GLN 33 2HG GLN 33 -13.340 5.085 6.787 244 HE21 GLN 33 1HE2 GLN 33 -10.911 7.205 8.370 245 HE22 GLN 33 2HE2 GLN 33 -11.962 7.713 9.673 246 H LYS 34 H LYS 34 -10.691 1.136 7.402 247 HA LYS 34 HA LYS 34 -8.630 0.856 9.284 248 HB2 LYS 34 1HB LYS 34 -10.490 -0.751 8.309 249 HB3 LYS 34 2HB LYS 34 -9.285 -1.225 7.158 250 HG2 LYS 34 1HG LYS 34 -9.005 -1.429 10.199 251 HG3 LYS 34 2HG LYS 34 -9.588 -2.702 9.140 252 HD2 LYS 34 1HD LYS 34 -7.497 -3.420 9.101 253 HD3 LYS 34 2HD LYS 34 -7.222 -2.159 7.896 254 HE2 LYS 34 1HE LYS 34 -5.515 -1.680 9.365 255 HE3 LYS 34 2HE LYS 34 -6.780 -0.648 10.048 256 HZ1 LYS 34 3HZ LYS 34 -7.279 -2.675 11.499 257 HZ2 LYS 34 1HZ LYS 34 -5.924 -1.818 11.836 258 HZ3 LYS 34 2HZ LYS 34 -5.811 -3.246 11.009 259 H ILE 35 H ILE 35 -8.509 0.443 5.748 260 HA ILE 35 HA ILE 35 -5.706 0.001 5.630 261 HB ILE 35 HB ILE 35 -7.756 0.842 3.503 262 HG12 ILE 35 1HG1 ILE 35 -6.565 -1.883 4.158 263 HG13 ILE 35 2HG1 ILE 35 -8.151 -1.365 4.688 264 HG21 ILE 35 1HG2 ILE 35 -5.418 1.367 2.786 265 HG22 ILE 35 2HG2 ILE 35 -4.994 -0.334 3.061 266 HG23 ILE 35 3HG2 ILE 35 -6.166 0.126 1.812 267 HD11 ILE 35 3HD1 ILE 35 -7.430 -1.577 1.742 268 HD12 ILE 35 1HD1 ILE 35 -8.202 -2.814 2.707 269 HD13 ILE 35 2HD1 ILE 35 -9.017 -1.247 2.463 270 H LEU 36 H LEU 36 -7.601 3.030 4.805 271 HA LEU 36 HA LEU 36 -5.384 4.633 4.158 272 HB2 LEU 36 1HB LEU 36 -7.925 5.324 5.690 273 HB3 LEU 36 2HB LEU 36 -6.740 6.528 5.231 274 HG LEU 36 HG LEU 36 -7.312 4.980 2.878 275 HD11 LEU 36 1HD1 LEU 36 -9.725 5.621 2.626 276 HD12 LEU 36 2HD1 LEU 36 -9.728 6.093 4.345 277 HD13 LEU 36 3HD1 LEU 36 -9.438 4.412 3.878 278 HD21 LEU 36 3HD2 LEU 36 -6.560 7.406 3.110 279 HD22 LEU 36 1HD2 LEU 36 -8.316 7.757 3.367 280 HD23 LEU 36 2HD2 LEU 36 -7.752 7.027 1.859 281 H SER 37 H SER 37 -6.253 3.464 7.435 282 HA SER 37 HA SER 37 -4.486 5.168 8.888 283 HB2 SER 37 1HB SER 37 -6.409 2.932 9.227 284 HB3 SER 37 2HB SER 37 -5.015 2.811 10.252 285 HG SER 37 HG SER 37 -6.358 4.193 11.339 286 H GLU 38 H GLU 38 -4.250 1.581 8.196 287 HA GLU 38 HA GLU 38 -1.501 1.588 8.976 288 HB2 GLU 38 1HB GLU 38 -3.099 -0.466 7.401 289 HB3 GLU 38 2HB GLU 38 -1.523 -0.758 8.119 290 HG2 GLU 38 1HG GLU 38 -4.078 -0.114 9.646 291 HG3 GLU 38 2HG GLU 38 -3.371 -1.713 9.447 292 H ILE 39 H ILE 39 -2.820 2.603 6.016 293 HA ILE 39 HA ILE 39 -0.330 2.180 4.490 294 HB ILE 39 HB ILE 39 -2.995 3.533 4.023 295 HG12 ILE 39 1HG1 ILE 39 -2.886 1.093 3.681 296 HG13 ILE 39 2HG1 ILE 39 -3.244 1.956 2.203 297 HG21 ILE 39 1HG2 ILE 39 -1.605 5.071 3.011 298 HG22 ILE 39 2HG2 ILE 39 -0.639 3.819 2.184 299 HG23 ILE 39 3HG2 ILE 39 -2.343 4.102 1.740 300 HD11 ILE 39 3HD1 ILE 39 -0.837 1.685 1.480 301 HD12 ILE 39 1HD1 ILE 39 -0.549 0.709 2.927 302 HD13 ILE 39 2HD1 ILE 39 -1.697 0.161 1.697 303 H ALA 40 H ALA 40 -1.640 4.620 6.691 304 HA ALA 40 HA ALA 40 0.173 6.687 5.604 305 HB1 ALA 40 1HB ALA 40 -1.061 8.202 7.129 306 HB2 ALA 40 2HB ALA 40 -2.176 7.309 6.073 307 HB3 ALA 40 3HB ALA 40 -1.963 6.817 7.772 308 H THR 41 H THR 41 0.215 4.292 8.090 309 HA THR 41 HA THR 41 1.822 5.605 10.037 310 HB THR 41 HB THR 41 2.214 3.092 10.587 311 HG1 THR 41 1HG THR 41 1.168 1.656 9.429 312 HG21 THR 41 3HG2 THR 41 -0.642 4.185 10.418 313 HG22 THR 41 1HG2 THR 41 0.510 4.443 11.745 314 HG23 THR 41 2HG2 THR 41 -0.117 2.823 11.413 315 H GLY 42 H GLY 42 2.518 3.639 7.088 316 HA2 GLY 42 1HA GLY 42 5.273 3.261 7.563 317 HA3 GLY 42 2HA GLY 42 4.433 3.167 5.999 318 H LYS 43 H LYS 43 7.039 4.537 7.072 319 HA LYS 43 HA LYS 43 6.473 7.269 6.066 320 HB2 LYS 43 1HB LYS 43 7.924 6.137 8.398 321 HB3 LYS 43 2HB LYS 43 8.860 7.284 7.472 322 HG2 LYS 43 1HG LYS 43 6.863 8.874 7.588 323 HG3 LYS 43 2HG LYS 43 6.073 7.694 8.644 324 HD2 LYS 43 1HD LYS 43 6.966 9.181 10.183 325 HD3 LYS 43 2HD LYS 43 8.232 7.946 10.131 326 HE2 LYS 43 1HE LYS 43 9.410 9.391 8.372 327 HE3 LYS 43 2HE LYS 43 8.152 10.618 8.638 328 HZ1 LYS 43 3HZ LYS 43 10.185 9.656 10.525 329 HZ2 LYS 43 1HZ LYS 43 8.904 10.522 11.037 330 HZ3 LYS 43 2HZ LYS 43 9.983 11.192 9.976 331 H ARG 44 H ARG 44 7.065 7.339 3.960 332 HA ARG 44 HA ARG 44 9.040 5.788 2.692 333 HB2 ARG 44 1HB ARG 44 8.880 7.400 0.865 334 HB3 ARG 44 2HB ARG 44 7.346 6.843 1.438 335 HG2 ARG 44 1HG ARG 44 7.277 9.019 2.891 336 HG3 ARG 44 2HG ARG 44 8.642 9.570 1.872 337 HD2 ARG 44 1HD ARG 44 7.402 9.378 -0.087 338 HD3 ARG 44 2HD ARG 44 6.097 8.469 0.717 339 HE ARG 44 HE ARG 44 6.542 11.246 1.603 340 HH11 ARG 44 1HH1 ARG 44 4.543 9.015 -0.338 341 HH12 ARG 44 2HH1 ARG 44 3.306 10.156 -0.681 342 HH21 ARG 44 1HH2 ARG 44 4.924 12.725 1.271 343 HH22 ARG 44 2HH2 ARG 44 3.542 12.418 0.290 344 H THR 45 H THR 45 9.563 7.947 4.990 345 HA THR 45 HA THR 45 11.240 9.168 5.840 346 HB THR 45 HB THR 45 13.315 8.181 5.913 347 HG1 THR 45 1HG THR 45 14.120 6.848 4.262 348 HG21 THR 45 3HG2 THR 45 11.534 6.543 6.580 349 HG22 THR 45 1HG2 THR 45 13.035 5.788 6.047 350 HG23 THR 45 2HG2 THR 45 11.627 5.806 4.965 351 H GLU 46 H GLU 46 13.492 10.386 5.025 352 HA GLU 46 HA GLU 46 12.580 12.107 2.830 353 HB2 GLU 46 1HB GLU 46 14.738 12.413 4.923 354 HB3 GLU 46 2HB GLU 46 14.550 13.516 3.546 355 HG2 GLU 46 1HG GLU 46 12.160 13.900 4.181 356 HG3 GLU 46 2HG GLU 46 12.414 12.928 5.630 357 H LYS 47 H LYS 47 14.082 9.228 2.730 358 HA LYS 47 HA LYS 47 16.171 9.710 0.764 359 HB2 LYS 47 1HB LYS 47 14.470 7.241 1.412 360 HB3 LYS 47 2HB LYS 47 15.814 7.257 0.287 361 HG2 LYS 47 1HG LYS 47 16.149 8.038 3.173 362 HG3 LYS 47 2HG LYS 47 16.243 6.367 2.633 363 HD2 LYS 47 1HD LYS 47 18.023 8.490 1.416 364 HD3 LYS 47 2HD LYS 47 18.419 7.746 2.968 365 HE2 LYS 47 1HE LYS 47 18.353 5.515 2.009 366 HE3 LYS 47 2HE LYS 47 17.943 6.158 0.412 367 HZ1 LYS 47 3HZ LYS 47 20.437 6.911 1.828 368 HZ2 LYS 47 1HZ LYS 47 20.094 7.123 0.240 369 HZ3 LYS 47 2HZ LYS 47 20.354 5.623 0.843 370 H GLN 48 H GLN 48 15.838 8.735 -1.492 371 HA GLN 48 HA GLN 48 13.189 9.524 -2.631 372 HB2 GLN 48 1HB GLN 48 14.460 10.328 -4.596 373 HB3 GLN 48 2HB GLN 48 14.687 11.255 -3.101 374 HG2 GLN 48 1HG GLN 48 16.906 10.390 -2.779 375 HG3 GLN 48 2HG GLN 48 16.682 9.166 -4.038 376 HE21 GLN 48 1HE2 GLN 48 16.156 12.762 -3.876 377 HE22 GLN 48 2HE2 GLN 48 16.969 13.063 -5.397 378 H SER 49 H SER 49 12.248 8.125 -4.009 379 HA SER 49 HA SER 49 13.568 5.559 -4.652 380 HB2 SER 49 1HB SER 49 10.756 6.685 -4.991 381 HB3 SER 49 2HB SER 49 11.302 5.097 -5.679 382 HG SER 49 HG SER 49 11.018 4.264 -3.955 383 H ILE 50 H ILE 50 13.768 4.894 -6.906 384 HA ILE 50 HA ILE 50 13.502 6.938 -9.010 385 HB ILE 50 HB ILE 50 15.710 6.344 -9.906 386 HG12 ILE 50 1HG1 ILE 50 16.486 5.125 -7.238 387 HG13 ILE 50 2HG1 ILE 50 15.774 4.095 -8.465 388 HG21 ILE 50 1HG2 ILE 50 15.422 8.378 -8.506 389 HG22 ILE 50 2HG2 ILE 50 15.963 7.462 -7.089 390 HG23 ILE 50 3HG2 ILE 50 17.072 7.722 -8.447 391 HD11 ILE 50 3HD1 ILE 50 18.237 4.082 -8.577 392 HD12 ILE 50 1HD1 ILE 50 17.484 4.639 -10.079 393 HD13 ILE 50 2HD1 ILE 50 18.227 5.805 -8.964 394 H GLN 51 H GLN 51 11.829 4.715 -8.349 395 HA GLN 51 HA GLN 51 11.933 3.127 -10.801 396 HB2 GLN 51 1HB GLN 51 11.257 1.112 -9.256 397 HB3 GLN 51 2HB GLN 51 12.950 1.470 -9.504 398 HG2 GLN 51 1HG GLN 51 13.126 2.592 -7.344 399 HG3 GLN 51 2HG GLN 51 11.370 2.533 -7.126 400 HE21 GLN 51 1HE2 GLN 51 10.401 0.325 -6.909 401 HE22 GLN 51 2HE2 GLN 51 11.383 -1.006 -6.312 402 H ASP 52 H ASP 52 9.834 2.026 -11.014 403 HA ASP 52 HA ASP 52 7.549 3.538 -9.744 404 HB2 ASP 52 1HB ASP 52 8.088 2.693 -12.597 405 HB3 ASP 52 2HB ASP 52 6.434 2.797 -12.021 406 H TYR 53 H TYR 53 9.031 0.531 -9.706 407 HA TYR 53 HA TYR 53 6.580 -0.979 -9.150 408 HB2 TYR 53 1HB TYR 53 8.390 -1.352 -11.558 409 HB3 TYR 53 2HB TYR 53 7.804 -2.786 -10.758 410 HD1 TYR 53 2HD TYR 53 6.612 0.340 -12.438 411 HD2 TYR 53 1HD TYR 53 5.641 -3.654 -11.119 412 HE1 TYR 53 2HE TYR 53 4.508 0.440 -13.699 413 HE2 TYR 53 1HE TYR 53 3.543 -3.575 -12.396 414 HH TYR 53 HH TYR 53 1.961 -1.532 -13.289 415 HA PRO 54 HA PRO 54 9.513 -2.972 -6.411 416 HB2 PRO 54 1HB PRO 54 8.338 -5.390 -5.907 417 HB3 PRO 54 2HB PRO 54 7.531 -3.860 -5.437 418 HG2 PRO 54 1HG PRO 54 7.030 -5.462 -7.946 419 HG3 PRO 54 2HG PRO 54 5.875 -4.900 -6.681 420 HD2 PRO 54 1HD PRO 54 6.339 -3.438 -8.959 421 HD3 PRO 54 2HD PRO 54 6.101 -2.629 -7.384 422 H SER 55 H SER 55 10.839 -5.011 -6.138 423 HA SER 55 HA SER 55 11.520 -6.370 -8.682 424 HB2 SER 55 1HB SER 55 12.997 -4.589 -7.221 425 HB3 SER 55 2HB SER 55 13.628 -6.154 -6.668 426 HG SER 55 HG SER 55 14.718 -5.265 -8.388 427 H ALA 56 H ALA 56 9.951 -7.004 -5.855 428 HA ALA 56 HA ALA 56 11.124 -9.616 -5.194 429 HB1 ALA 56 1HB ALA 56 8.486 -8.315 -4.412 430 HB2 ALA 56 2HB ALA 56 9.087 -9.875 -3.818 431 HB3 ALA 56 3HB ALA 56 9.970 -8.393 -3.429 432 H GLU 57 H GLU 57 10.258 -11.626 -5.861 433 HA GLU 57 HA GLU 57 8.586 -11.631 -8.232 434 HB2 GLU 57 1HB GLU 57 10.462 -13.383 -7.017 435 HB3 GLU 57 2HB GLU 57 8.899 -14.205 -6.833 436 HG2 GLU 57 1HG GLU 57 8.468 -13.735 -9.290 437 HG3 GLU 57 2HG GLU 57 10.112 -13.071 -9.364 438 H GLU 58 H GLU 58 8.173 -11.975 -4.746 439 HA GLU 58 HA GLU 58 5.337 -12.819 -5.056 440 HB2 GLU 58 1HB GLU 58 7.436 -13.419 -2.950 441 HB3 GLU 58 2HB GLU 58 5.688 -13.610 -2.680 442 HG2 GLU 58 1HG GLU 58 5.478 -15.367 -4.167 443 HG3 GLU 58 2HG GLU 58 6.883 -14.910 -5.120 444 H TYR 59 H TYR 59 4.212 -11.032 -4.996 445 HA TYR 59 HA TYR 59 4.371 -9.230 -2.694 446 HB2 TYR 59 1HB TYR 59 4.037 -7.254 -4.149 447 HB3 TYR 59 2HB TYR 59 5.619 -7.993 -4.297 448 HD1 TYR 59 2HD TYR 59 2.227 -7.812 -5.943 449 HD2 TYR 59 1HD TYR 59 6.471 -8.437 -6.447 450 HE1 TYR 59 2HE TYR 59 1.937 -7.771 -8.367 451 HE2 TYR 59 1HE TYR 59 6.195 -8.377 -8.885 452 HH TYR 59 HH TYR 59 4.546 -8.456 -10.672 453 H GLY 60 H GLY 60 2.296 -7.746 -2.838 454 HA2 GLY 60 1HA GLY 60 -0.007 -9.141 -4.104 455 HA3 GLY 60 2HA GLY 60 -0.158 -8.391 -2.510 456 H THR 61 H THR 61 -1.760 -7.462 -4.550 457 HA THR 61 HA THR 61 -0.437 -5.009 -5.652 458 HB THR 61 HB THR 61 -2.543 -6.821 -6.910 459 HG1 THR 61 1HG THR 61 -0.825 -7.950 -7.264 460 HG21 THR 61 3HG2 THR 61 -2.776 -4.550 -7.763 461 HG22 THR 61 1HG2 THR 61 -1.966 -5.538 -8.992 462 HG23 THR 61 2HG2 THR 61 -1.022 -4.407 -7.997 463 H ILE 62 H ILE 62 -1.400 -3.121 -5.133 464 HA ILE 62 HA ILE 62 -4.006 -3.208 -3.692 465 HB ILE 62 HB ILE 62 -1.572 -1.467 -3.258 466 HG12 ILE 62 1HG1 ILE 62 -1.907 -2.931 -0.925 467 HG13 ILE 62 2HG1 ILE 62 -2.291 -4.127 -2.147 468 HG21 ILE 62 1HG2 ILE 62 -4.070 -1.714 -1.553 469 HG22 ILE 62 2HG2 ILE 62 -2.621 -0.744 -1.188 470 HG23 ILE 62 3HG2 ILE 62 -3.635 -0.324 -2.572 471 HD11 ILE 62 3HD1 ILE 62 0.257 -2.430 -2.100 472 HD12 ILE 62 1HD1 ILE 62 0.127 -4.123 -1.581 473 HD13 ILE 62 2HD1 ILE 62 -0.148 -3.702 -3.272 474 H ASN 63 H ASN 63 -5.547 -2.265 -4.845 475 HA ASN 63 HA ASN 63 -4.922 0.133 -6.541 476 HB2 ASN 63 1HB ASN 63 -7.198 -1.833 -6.967 477 HB3 ASN 63 2HB ASN 63 -6.682 -0.523 -8.023 478 HD21 ASN 63 1HD2 ASN 63 -6.746 -3.737 -7.892 479 HD22 ASN 63 2HD2 ASN 63 -5.213 -4.223 -8.510 480 H ILE 64 H ILE 64 -5.902 1.979 -5.740 481 HA ILE 64 HA ILE 64 -8.434 1.733 -4.171 482 HB ILE 64 HB ILE 64 -6.416 4.016 -4.240 483 HG12 ILE 64 1HG1 ILE 64 -7.004 2.119 -1.931 484 HG13 ILE 64 2HG1 ILE 64 -5.559 2.079 -2.943 485 HG21 ILE 64 1HG2 ILE 64 -7.830 5.079 -2.544 486 HG22 ILE 64 2HG2 ILE 64 -8.817 4.711 -3.946 487 HG23 ILE 64 3HG2 ILE 64 -8.912 3.673 -2.516 488 HD11 ILE 64 3HD1 ILE 64 -4.958 3.286 -0.989 489 HD12 ILE 64 1HD1 ILE 64 -5.118 4.497 -2.272 490 HD13 ILE 64 2HD1 ILE 64 -6.386 4.301 -1.046 491 H GLU 65 H GLU 65 -9.954 1.778 -5.846 492 HA GLU 65 HA GLU 65 -9.669 3.470 -8.218 493 HB2 GLU 65 1HB GLU 65 -10.850 1.252 -8.146 494 HB3 GLU 65 2HB GLU 65 -12.068 1.960 -7.082 495 HG2 GLU 65 1HG GLU 65 -13.201 2.765 -8.822 496 HG3 GLU 65 2HG GLU 65 -11.799 3.687 -9.392 497 H ASN 66 H ASN 66 -10.071 5.680 -8.074 498 HA ASN 66 HA ASN 66 -12.193 6.662 -6.340 499 HB2 ASN 66 1HB ASN 66 -10.920 8.326 -5.193 500 HB3 ASN 66 2HB ASN 66 -10.289 6.750 -4.790 501 HD21 ASN 66 1HD2 ASN 66 -8.110 6.111 -5.781 502 HD22 ASN 66 2HD2 ASN 66 -7.057 7.406 -6.305 503 H ASN 67 H ASN 67 -13.327 8.067 -7.436 504 HA ASN 67 HA ASN 67 -14.067 9.456 -9.018 505 HB2 ASN 67 1HB ASN 67 -11.387 10.830 -8.981 506 HB3 ASN 67 2HB ASN 67 -12.956 11.508 -9.342 507 HD21 ASN 67 1HD2 ASN 67 -10.795 10.412 -6.744 508 HD22 ASN 67 2HD2 ASN 67 -11.787 10.970 -5.405 509 H GLY 68 H GLY 68 -13.317 7.065 -10.117 510 HA2 GLY 68 1HA GLY 68 -13.073 6.084 -12.154 511 HA3 GLY 68 2HA GLY 68 -13.046 7.689 -12.879 512 H GLY 69 H GLY 69 -10.528 7.458 -10.598 513 HA2 GLY 69 1HA GLY 69 -8.563 6.352 -12.532 514 HA3 GLY 69 2HA GLY 69 -8.209 7.787 -11.539 515 H MET 70 H MET 70 -6.427 6.017 -10.882 516 HA MET 70 HA MET 70 -7.303 5.192 -8.250 517 HB2 MET 70 1HB MET 70 -6.527 2.902 -8.379 518 HB3 MET 70 2HB MET 70 -7.788 3.129 -9.572 519 HG2 MET 70 1HG MET 70 -4.804 3.164 -10.165 520 HG3 MET 70 2HG MET 70 -5.829 1.747 -10.301 521 HE1 MET 70 3HE MET 70 -8.004 2.356 -13.435 522 HE2 MET 70 1HE MET 70 -7.431 1.189 -12.229 523 HE3 MET 70 2HE MET 70 -8.472 2.546 -11.734 524 H THR 71 H THR 71 -5.556 4.418 -6.950 525 HA THR 71 HA THR 71 -2.833 5.329 -7.774 526 HB THR 71 HB THR 71 -4.061 4.967 -5.005 527 HG1 THR 71 1HG THR 71 -4.519 6.982 -6.250 528 HG21 THR 71 3HG2 THR 71 -1.268 5.907 -5.876 529 HG22 THR 71 1HG2 THR 71 -1.632 4.422 -4.975 530 HG23 THR 71 2HG2 THR 71 -1.864 6.015 -4.215 531 H THR 72 H THR 72 -1.478 3.659 -8.020 532 HA THR 72 HA THR 72 -2.332 0.917 -7.274 533 HB THR 72 HB THR 72 -0.118 1.750 -9.145 534 HG1 THR 72 1HG THR 72 -1.386 2.564 -10.403 535 HG21 THR 72 3HG2 THR 72 -0.140 -0.625 -8.607 536 HG22 THR 72 1HG2 THR 72 -0.715 -0.420 -10.272 537 HG23 THR 72 2HG2 THR 72 -1.881 -0.735 -8.979 538 H MET 73 H MET 73 -0.813 -0.279 -5.969 539 HA MET 73 HA MET 73 1.923 0.469 -5.935 540 HB2 MET 73 1HB MET 73 2.225 0.579 -3.466 541 HB3 MET 73 2HB MET 73 1.379 1.943 -4.154 542 HG2 MET 73 1HG MET 73 -0.788 0.954 -3.420 543 HG3 MET 73 2HG MET 73 0.125 -0.349 -2.657 544 HE1 MET 73 3HE MET 73 1.633 3.368 -2.335 545 HE2 MET 73 1HE MET 73 -0.066 3.563 -2.822 546 HE3 MET 73 2HE MET 73 0.458 4.039 -1.186 547 H PHE 74 H PHE 74 3.038 -1.205 -4.390 548 HA PHE 74 HA PHE 74 1.713 -3.798 -4.194 549 HB2 PHE 74 1HB PHE 74 4.477 -3.473 -5.378 550 HB3 PHE 74 2HB PHE 74 3.563 -4.939 -5.191 551 HD1 PHE 74 2HD PHE 74 3.948 -1.840 -7.282 552 HD2 PHE 74 1HD PHE 74 1.763 -5.537 -6.751 553 HE1 PHE 74 2HE PHE 74 3.149 -1.699 -9.584 554 HE2 PHE 74 1HE PHE 74 0.989 -5.400 -9.080 555 HZ PHE 74 HZ PHE 74 1.665 -3.488 -10.526 556 H TYR 75 H TYR 75 3.120 -5.159 -2.647 557 HA TYR 75 HA TYR 75 4.960 -3.585 -0.915 558 HB2 TYR 75 1HB TYR 75 3.832 -4.108 1.074 559 HB3 TYR 75 2HB TYR 75 2.481 -3.915 -0.004 560 HD1 TYR 75 2HD TYR 75 1.409 -6.052 -1.024 561 HD2 TYR 75 1HD TYR 75 4.447 -6.218 2.032 562 HE1 TYR 75 2HE TYR 75 0.835 -8.409 -0.569 563 HE2 TYR 75 1HE TYR 75 3.878 -8.570 2.478 564 HH TYR 75 HH TYR 75 0.934 -10.028 1.142 565 H TYR 76 H TYR 76 6.509 -5.045 0.206 566 HA TYR 76 HA TYR 76 6.319 -7.871 -0.134 567 HB2 TYR 76 1HB TYR 76 8.357 -8.307 -1.417 568 HB3 TYR 76 2HB TYR 76 7.084 -7.616 -2.349 569 HD1 TYR 76 1HD TYR 76 7.245 -5.285 -3.231 570 HD2 TYR 76 2HD TYR 76 10.449 -7.128 -1.007 571 HE1 TYR 76 1HE TYR 76 8.799 -3.372 -3.809 572 HE2 TYR 76 2HE TYR 76 11.984 -5.336 -1.675 573 HH TYR 76 HH TYR 76 11.657 -2.851 -2.213 574 H GLU 77 H GLU 77 8.664 -8.846 0.639 575 HA GLU 77 HA GLU 77 9.445 -7.395 3.137 576 HB2 GLU 77 1HB GLU 77 8.475 -9.721 3.334 577 HB3 GLU 77 2HB GLU 77 9.777 -10.307 2.307 578 HG2 GLU 77 1HG GLU 77 11.367 -9.258 4.129 579 HG3 GLU 77 2HG GLU 77 9.937 -9.260 5.156 580 H GLU 78 H GLU 78 11.557 -6.698 3.305 581 HA GLU 78 HA GLU 78 13.506 -7.635 1.305 582 HB2 GLU 78 1HB GLU 78 12.580 -5.591 0.395 583 HB3 GLU 78 2HB GLU 78 12.997 -4.686 1.844 584 HG2 GLU 78 1HG GLU 78 15.331 -4.870 1.447 585 HG3 GLU 78 2HG GLU 78 15.121 -6.229 0.346 586 H ASN 79 H ASN 79 14.891 -8.656 2.516 587 HA ASN 79 HA ASN 79 16.629 -9.026 3.843 588 HB2 ASN 79 1HB ASN 79 16.747 -6.189 3.493 589 HB3 ASN 79 2HB ASN 79 17.089 -6.504 5.187 590 HD21 ASN 79 1HD2 ASN 79 18.217 -6.702 1.953 591 HD22 ASN 79 2HD2 ASN 79 19.820 -7.263 2.286 592 H GLY 80 H GLY 80 13.686 -8.330 5.043 593 HA2 GLY 80 1HA GLY 80 13.169 -9.846 6.971 594 HA3 GLY 80 2HA GLY 80 14.444 -9.008 7.860 595 H LYS 81 H LYS 81 13.241 -6.388 6.308 596 HA LYS 81 HA LYS 81 10.943 -6.027 8.141 597 HB2 LYS 81 1HB LYS 81 13.071 -4.212 7.163 598 HB3 LYS 81 2HB LYS 81 11.470 -3.639 6.713 599 HG2 LYS 81 1HG LYS 81 11.858 -2.679 8.755 600 HG3 LYS 81 2HG LYS 81 10.717 -3.981 9.096 601 HD2 LYS 81 1HD LYS 81 12.252 -4.104 10.866 602 HD3 LYS 81 2HD LYS 81 12.851 -5.364 9.769 603 HE2 LYS 81 1HE LYS 81 14.515 -3.774 8.849 604 HE3 LYS 81 2HE LYS 81 13.831 -2.470 9.826 605 HZ1 LYS 81 3HZ LYS 81 15.218 -4.856 10.832 606 HZ2 LYS 81 1HZ LYS 81 14.497 -3.690 11.798 607 HZ3 LYS 81 2HZ LYS 81 15.773 -3.298 10.828 608 H TYR 82 H TYR 82 9.208 -4.667 6.964 609 HA TYR 82 HA TYR 82 8.815 -5.703 4.194 610 HB2 TYR 82 1HB TYR 82 6.726 -5.098 6.311 611 HB3 TYR 82 2HB TYR 82 6.381 -5.440 4.625 612 HD1 TYR 82 1HD TYR 82 7.943 -6.866 7.718 613 HD2 TYR 82 2HD TYR 82 6.120 -7.757 3.887 614 HE1 TYR 82 1HE TYR 82 7.855 -9.234 8.315 615 HE2 TYR 82 2HE TYR 82 6.048 -10.113 4.470 616 HH TYR 82 HH TYR 82 6.829 -11.738 6.022 617 H TYR 83 H TYR 83 7.759 -4.151 2.791 618 HA TYR 83 HA TYR 83 7.729 -1.415 3.709 619 HB2 TYR 83 1HB TYR 83 9.427 -2.108 1.280 620 HB3 TYR 83 2HB TYR 83 9.185 -0.542 1.952 621 HD1 TYR 83 2HD TYR 83 10.715 -3.892 2.761 622 HD2 TYR 83 1HD TYR 83 10.693 0.327 3.543 623 HE1 TYR 83 2HE TYR 83 12.668 -4.195 4.135 624 HE2 TYR 83 1HE TYR 83 12.659 0.019 5.087 625 HH TYR 83 HH TYR 83 14.442 -3.016 5.319 626 H ILE 84 H ILE 84 6.965 -0.011 1.788 627 HA ILE 84 HA ILE 84 5.139 -1.490 -0.042 628 HB ILE 84 HB ILE 84 4.614 1.117 1.437 629 HG12 ILE 84 1HG1 ILE 84 2.414 -0.483 1.878 630 HG13 ILE 84 2HG1 ILE 84 3.661 -1.710 1.820 631 HG21 ILE 84 1HG2 ILE 84 3.719 1.377 -0.785 632 HG22 ILE 84 2HG2 ILE 84 2.922 -0.215 -0.704 633 HG23 ILE 84 3HG2 ILE 84 2.404 1.128 0.348 634 HD11 ILE 84 3HD1 ILE 84 3.760 0.793 3.572 635 HD12 ILE 84 1HD1 ILE 84 3.129 -0.769 4.085 636 HD13 ILE 84 2HD1 ILE 84 4.848 -0.611 3.654 637 H GLU 85 H GLU 85 5.125 -0.753 -2.141 638 HA GLU 85 HA GLU 85 7.453 0.820 -2.975 639 HB2 GLU 85 1HB GLU 85 7.266 -0.350 -4.974 640 HB3 GLU 85 2HB GLU 85 6.467 -1.466 -3.910 641 HG2 GLU 85 1HG GLU 85 5.062 -1.405 -5.654 642 HG3 GLU 85 2HG GLU 85 4.281 -0.207 -4.613 643 H CYS 86 H CYS 86 6.925 2.287 -5.026 644 HA CYS 86 HA CYS 86 4.665 3.576 -5.544 645 HB2 CYS 86 1HB CYS 86 5.714 4.551 -3.007 646 HB3 CYS 86 2HB CYS 86 5.772 5.864 -4.156 647 HG CYS 86 HG CYS 86 3.360 3.787 -3.378 648 HA PRO 87 HA PRO 87 7.772 5.601 -8.349 649 HB2 PRO 87 1HB PRO 87 6.811 8.101 -8.711 650 HB3 PRO 87 2HB PRO 87 6.028 6.648 -9.396 651 HG2 PRO 87 1HG PRO 87 5.280 8.101 -6.854 652 HG3 PRO 87 2HG PRO 87 4.225 7.565 -8.209 653 HD2 PRO 87 1HD PRO 87 4.546 6.141 -5.950 654 HD3 PRO 87 2HD PRO 87 4.270 5.375 -7.512 655 H TYR 88 H TYR 88 8.691 8.234 -8.014 656 HA TYR 88 HA TYR 88 10.809 8.156 -6.552 657 HB2 TYR 88 1HB TYR 88 9.145 10.655 -6.554 658 HB3 TYR 88 2HB TYR 88 10.899 10.543 -6.605 659 HD1 TYR 88 1HD TYR 88 12.047 9.812 -8.728 660 HD2 TYR 88 2HD TYR 88 7.793 10.529 -8.548 661 HE1 TYR 88 1HE TYR 88 11.985 10.064 -11.188 662 HE2 TYR 88 2HE TYR 88 7.717 10.764 -10.994 663 HH TYR 88 HH TYR 88 10.717 10.627 -12.979 664 H LYS 89 H LYS 89 7.877 8.010 -4.821 665 HA LYS 89 HA LYS 89 9.012 8.918 -2.349 666 HB2 LYS 89 1HB LYS 89 6.499 9.352 -1.947 667 HB3 LYS 89 2HB LYS 89 7.639 10.516 -2.660 668 HG2 LYS 89 1HG LYS 89 6.527 9.434 -4.944 669 HG3 LYS 89 2HG LYS 89 5.419 8.871 -3.703 670 HD2 LYS 89 1HD LYS 89 4.611 11.010 -4.699 671 HD3 LYS 89 2HD LYS 89 5.180 11.400 -3.038 672 HE2 LYS 89 1HE LYS 89 7.463 11.937 -4.023 673 HE3 LYS 89 2HE LYS 89 6.826 11.570 -5.629 674 HZ1 LYS 89 3HZ LYS 89 6.083 13.851 -3.912 675 HZ2 LYS 89 1HZ LYS 89 5.186 13.369 -5.253 676 HZ3 LYS 89 2HZ LYS 89 6.708 13.869 -5.418 677 H GLY 90 H GLY 90 9.063 6.276 -3.524 678 HA2 GLY 90 1HA GLY 90 7.234 4.822 -1.726 679 HA3 GLY 90 2HA GLY 90 7.861 4.244 -3.283 680 H ILE 91 H ILE 91 9.170 5.261 -0.077 681 HA ILE 91 HA ILE 91 10.610 2.656 0.020 682 HB ILE 91 HB ILE 91 11.961 5.168 1.010 683 HG12 ILE 91 1HG1 ILE 91 12.109 4.128 -1.868 684 HG13 ILE 91 2HG1 ILE 91 11.619 5.735 -1.299 685 HG21 ILE 91 1HG2 ILE 91 13.159 2.631 -0.168 686 HG22 ILE 91 2HG2 ILE 91 13.875 3.770 1.014 687 HG23 ILE 91 3HG2 ILE 91 12.557 2.672 1.469 688 HD11 ILE 91 3HD1 ILE 91 14.448 4.666 -0.928 689 HD12 ILE 91 1HD1 ILE 91 13.882 5.575 -2.295 690 HD13 ILE 91 2HD1 ILE 91 13.831 6.324 -0.687 691 H TYR 92 H TYR 92 8.223 2.862 1.199 692 HA TYR 92 HA TYR 92 8.387 4.010 3.910 693 HB2 TYR 92 1HB TYR 92 6.114 2.247 2.907 694 HB3 TYR 92 2HB TYR 92 6.090 3.402 4.203 695 HD1 TYR 92 1HD TYR 92 5.963 2.944 0.533 696 HD2 TYR 92 2HD TYR 92 5.519 5.717 3.778 697 HE1 TYR 92 1HE TYR 92 4.910 4.529 -0.990 698 HE2 TYR 92 2HE TYR 92 4.612 7.401 2.257 699 HH TYR 92 HH TYR 92 3.956 6.545 -1.193 700 H GLU 93 H GLU 93 9.623 3.035 5.304 701 HA GLU 93 HA GLU 93 9.714 0.136 5.679 702 HB2 GLU 93 1HB GLU 93 11.578 1.703 6.299 703 HB3 GLU 93 2HB GLU 93 10.483 2.514 7.374 704 HG2 GLU 93 1HG GLU 93 10.319 0.030 8.475 705 HG3 GLU 93 2HG GLU 93 11.856 -0.149 7.650 706 H ILE 94 H ILE 94 8.102 -0.936 6.495 707 HA ILE 94 HA ILE 94 6.512 0.153 8.759 708 HB ILE 94 HB ILE 94 4.740 -1.419 8.281 709 HG12 ILE 94 1HG1 ILE 94 6.352 -2.322 5.900 710 HG13 ILE 94 2HG1 ILE 94 6.010 -3.241 7.357 711 HG21 ILE 94 1HG2 ILE 94 4.690 0.839 7.304 712 HG22 ILE 94 2HG2 ILE 94 5.392 0.197 5.799 713 HG23 ILE 94 3HG2 ILE 94 3.790 -0.350 6.354 714 HD11 ILE 94 3HD1 ILE 94 3.557 -3.099 6.827 715 HD12 ILE 94 1HD1 ILE 94 4.007 -2.422 5.245 716 HD13 ILE 94 2HD1 ILE 94 4.525 -4.047 5.679 717 H GLU 95 H GLU 95 5.785 -2.120 10.008 718 HA GLU 95 HA GLU 95 8.406 -3.237 10.762 719 HB2 GLU 95 1HB GLU 95 7.335 -3.804 12.885 720 HB3 GLU 95 2HB GLU 95 7.253 -2.103 12.479 721 HG2 GLU 95 1HG GLU 95 4.797 -2.946 11.545 722 HG3 GLU 95 2HG GLU 95 5.059 -4.086 12.855 723 H ASN 96 H ASN 96 5.264 -4.512 9.697 724 HA ASN 96 HA ASN 96 6.438 -7.167 9.325 725 HB2 ASN 96 1HB ASN 96 4.438 -6.611 11.504 726 HB3 ASN 96 2HB ASN 96 4.344 -8.132 10.638 727 HD21 ASN 96 1HD2 ASN 96 6.294 -9.633 10.647 728 HD22 ASN 96 2HD2 ASN 96 7.349 -9.497 12.035 729 H ASN 97 H ASN 97 4.457 -8.670 8.437 730 HA ASN 97 HA ASN 97 3.872 -7.425 6.020 731 HB2 ASN 97 1HB ASN 97 4.000 -9.932 6.468 732 HB3 ASN 97 2HB ASN 97 2.323 -9.833 7.010 733 HD21 ASN 97 1HD2 ASN 97 3.646 -11.103 4.525 734 HD22 ASN 97 2HD2 ASN 97 2.664 -10.489 3.208 735 H PHE 98 H PHE 98 2.529 -5.942 5.538 736 HA PHE 98 HA PHE 98 0.477 -4.814 7.016 737 HB2 PHE 98 1HB PHE 98 1.698 -3.682 5.224 738 HB3 PHE 98 2HB PHE 98 1.212 -4.855 4.082 739 HD1 PHE 98 1HD PHE 98 -1.102 -5.030 3.246 740 HD2 PHE 98 2HD PHE 98 0.221 -1.763 5.743 741 HE1 PHE 98 1HE PHE 98 -2.898 -3.634 2.348 742 HE2 PHE 98 2HE PHE 98 -1.604 -0.361 4.859 743 HZ PHE 98 HZ PHE 98 -3.146 -1.275 3.123 744 H GLU 99 H GLU 99 0.231 -7.556 4.673 745 HA GLU 99 HA GLU 99 -2.575 -7.439 4.484 746 HB2 GLU 99 1HB GLU 99 -0.391 -9.241 3.598 747 HB3 GLU 99 2HB GLU 99 -1.966 -9.998 3.726 748 HG2 GLU 99 1HG GLU 99 -3.009 -8.343 2.323 749 HG3 GLU 99 2HG GLU 99 -1.668 -7.278 2.423 750 H ASP 100 H ASP 100 -0.737 -8.432 7.149 751 HA ASP 100 HA ASP 100 -2.927 -10.153 8.209 752 HB2 ASP 100 1HB ASP 100 -0.458 -10.809 8.358 753 HB3 ASP 100 2HB ASP 100 -0.284 -9.515 9.539 754 H MET 101 H MET 101 -1.827 -6.839 8.295 755 HA MET 101 HA MET 101 -3.164 -6.343 10.898 756 HB2 MET 101 1HB MET 101 -2.172 -4.219 10.980 757 HB3 MET 101 2HB MET 101 -0.915 -5.357 10.512 758 HG2 MET 101 1HG MET 101 -1.075 -4.639 8.213 759 HG3 MET 101 2HG MET 101 -2.290 -3.448 8.634 760 HE1 MET 101 3HE MET 101 2.178 -3.336 9.946 761 HE2 MET 101 1HE MET 101 1.209 -4.811 9.715 762 HE3 MET 101 2HE MET 101 1.803 -3.891 8.315 763 H ILE 102 H ILE 102 -4.007 -6.361 7.610 764 HA ILE 102 HA ILE 102 -5.995 -4.226 7.878 765 HB ILE 102 HB ILE 102 -6.430 -4.629 5.481 766 HG12 ILE 102 1HG1 ILE 102 -4.142 -6.624 5.702 767 HG13 ILE 102 2HG1 ILE 102 -5.808 -7.013 5.345 768 HG21 ILE 102 1HG2 ILE 102 -4.813 -2.930 6.334 769 HG22 ILE 102 2HG2 ILE 102 -3.505 -4.105 6.155 770 HG23 ILE 102 3HG2 ILE 102 -4.397 -3.547 4.732 771 HD11 ILE 102 3HD1 ILE 102 -4.731 -7.022 3.243 772 HD12 ILE 102 1HD1 ILE 102 -5.581 -5.467 3.287 773 HD13 ILE 102 2HD1 ILE 102 -3.831 -5.540 3.585 Start of MODEL 5 1 H1 GLY 1 H GLY 1 5.876 15.255 6.785 2 HA2 GLY 1 1HA GLY 1 5.663 13.024 7.797 3 HA3 GLY 1 2HA GLY 1 4.453 14.161 8.434 4 H SER 2 H SER 2 4.910 11.149 7.014 5 HA SER 2 HA SER 2 3.713 9.482 6.357 6 HB2 SER 2 1HB SER 2 1.387 9.247 6.874 7 HB3 SER 2 2HB SER 2 2.233 10.008 8.205 8 HG SER 2 HG SER 2 1.395 12.014 6.945 9 HA PRO 3 HA PRO 3 2.854 10.125 2.108 10 HB2 PRO 3 1HB PRO 3 0.973 8.195 1.382 11 HB3 PRO 3 2HB PRO 3 2.698 7.902 1.642 12 HG2 PRO 3 1HG PRO 3 0.402 7.489 3.522 13 HG3 PRO 3 2HG PRO 3 1.819 6.422 3.230 14 HD2 PRO 3 1HD PRO 3 1.658 8.040 5.379 15 HD3 PRO 3 2HD PRO 3 3.201 7.712 4.582 16 H ILE 4 H ILE 4 1.169 10.429 0.407 17 HA ILE 4 HA ILE 4 -1.219 11.891 1.399 18 HB ILE 4 HB ILE 4 0.332 12.405 -1.159 19 HG12 ILE 4 1HG1 ILE 4 0.346 13.874 1.523 20 HG13 ILE 4 2HG1 ILE 4 1.707 13.028 0.792 21 HG21 ILE 4 1HG2 ILE 4 -1.919 13.951 0.228 22 HG22 ILE 4 2HG2 ILE 4 -1.139 14.371 -1.309 23 HG23 ILE 4 3HG2 ILE 4 -2.126 12.925 -1.207 24 HD11 ILE 4 3HD1 ILE 4 2.049 15.368 0.496 25 HD12 ILE 4 1HD1 ILE 4 1.730 14.623 -1.080 26 HD13 ILE 4 2HD1 ILE 4 0.470 15.585 -0.267 27 H LEU 5 H LEU 5 -3.056 10.738 0.972 28 HA LEU 5 HA LEU 5 -3.309 9.132 -1.458 29 HB2 LEU 5 1HB LEU 5 -4.433 7.410 -0.087 30 HB3 LEU 5 2HB LEU 5 -2.693 7.514 -0.047 31 HG LEU 5 HG LEU 5 -3.992 6.904 1.976 32 HD11 LEU 5 1HD1 LEU 5 -1.552 7.396 1.963 33 HD12 LEU 5 2HD1 LEU 5 -2.337 7.669 3.505 34 HD13 LEU 5 3HD1 LEU 5 -1.924 9.057 2.484 35 HD21 LEU 5 3HD2 LEU 5 -5.655 8.682 2.060 36 HD22 LEU 5 1HD2 LEU 5 -4.395 9.889 2.344 37 HD23 LEU 5 2HD2 LEU 5 -4.704 8.634 3.545 38 HA PRO 6 HA PRO 6 -7.357 10.874 -1.869 39 HB2 PRO 6 1HB PRO 6 -9.011 8.582 -2.173 40 HB3 PRO 6 2HB PRO 6 -8.111 9.396 -3.476 41 HG2 PRO 6 1HG PRO 6 -7.268 7.050 -1.747 42 HG3 PRO 6 2HG PRO 6 -7.213 7.173 -3.517 43 HD2 PRO 6 1HD PRO 6 -4.999 7.636 -2.089 44 HD3 PRO 6 2HD PRO 6 -5.415 8.857 -3.314 45 H LYS 7 H LYS 7 -9.572 11.139 -0.802 46 HA LYS 7 HA LYS 7 -9.583 10.682 1.988 47 HB2 LYS 7 1HB LYS 7 -12.059 10.921 0.254 48 HB3 LYS 7 2HB LYS 7 -11.906 11.244 1.979 49 HG2 LYS 7 1HG LYS 7 -11.347 13.373 1.610 50 HG3 LYS 7 2HG LYS 7 -9.956 12.895 0.683 51 HD2 LYS 7 1HD LYS 7 -11.152 14.145 -0.881 52 HD3 LYS 7 2HD LYS 7 -11.547 12.432 -1.191 53 HE2 LYS 7 1HE LYS 7 -13.670 12.618 -0.136 54 HE3 LYS 7 2HE LYS 7 -13.290 14.201 0.531 55 HZ1 LYS 7 3HZ LYS 7 -13.421 15.210 -1.554 56 HZ2 LYS 7 1HZ LYS 7 -14.769 14.297 -1.353 57 HZ3 LYS 7 2HZ LYS 7 -13.622 13.806 -2.391 58 H ALA 8 H ALA 8 -10.968 9.087 3.204 59 HA ALA 8 HA ALA 8 -11.251 6.468 1.939 60 HB1 ALA 8 1HB ALA 8 -10.912 6.695 4.381 61 HB2 ALA 8 2HB ALA 8 -12.426 7.630 4.520 62 HB3 ALA 8 3HB ALA 8 -12.480 5.930 4.027 63 H GLU 9 H GLU 9 -13.296 9.434 2.321 64 HA GLU 9 HA GLU 9 -15.649 7.815 1.890 65 HB2 GLU 9 1HB GLU 9 -16.873 9.872 1.980 66 HB3 GLU 9 2HB GLU 9 -15.717 9.754 3.316 67 HG2 GLU 9 1HG GLU 9 -14.216 11.348 2.192 68 HG3 GLU 9 2HG GLU 9 -15.284 11.394 0.794 69 H ASN 10 H ASN 10 -13.505 9.505 -0.314 70 HA ASN 10 HA ASN 10 -15.514 9.588 -2.441 71 HB2 ASN 10 1HB ASN 10 -13.984 10.844 -3.649 72 HB3 ASN 10 2HB ASN 10 -13.783 11.411 -1.996 73 HD21 ASN 10 1HD2 ASN 10 -12.078 8.586 -1.738 74 HD22 ASN 10 2HD2 ASN 10 -10.574 9.126 -2.388 75 H VAL 11 H VAL 11 -13.808 7.084 -1.163 76 HA VAL 11 HA VAL 11 -12.757 5.898 -3.613 77 HB VAL 11 HB VAL 11 -13.089 5.062 -0.724 78 HG11 VAL 11 1HG1 VAL 11 -11.960 2.969 -1.162 79 HG12 VAL 11 2HG1 VAL 11 -13.520 3.000 -1.982 80 HG13 VAL 11 3HG1 VAL 11 -12.019 3.243 -2.916 81 HG21 VAL 11 3HG2 VAL 11 -10.619 4.980 -0.888 82 HG22 VAL 11 1HG2 VAL 11 -10.717 5.465 -2.594 83 HG23 VAL 11 2HG2 VAL 11 -11.241 6.569 -1.362 84 H ASP 12 H ASP 12 -13.648 4.461 -4.846 85 HA ASP 12 HA ASP 12 -16.558 3.983 -4.896 86 HB2 ASP 12 1HB ASP 12 -14.176 3.499 -6.667 87 HB3 ASP 12 2HB ASP 12 -15.589 2.466 -6.874 88 H SER 13 H SER 13 -13.546 1.928 -5.120 89 HA SER 13 HA SER 13 -14.122 0.822 -2.533 90 HB2 SER 13 1HB SER 13 -14.162 -1.647 -3.421 91 HB3 SER 13 2HB SER 13 -15.638 -0.698 -3.235 92 HG SER 13 HG SER 13 -15.536 -1.871 -5.179 93 H ILE 14 H ILE 14 -12.375 -0.443 -1.644 94 HA ILE 14 HA ILE 14 -9.819 -0.155 -3.123 95 HB ILE 14 HB ILE 14 -10.349 -1.209 -0.321 96 HG12 ILE 14 1HG1 ILE 14 -9.408 1.558 -1.165 97 HG13 ILE 14 2HG1 ILE 14 -10.948 1.145 -0.392 98 HG21 ILE 14 1HG2 ILE 14 -7.701 -0.340 -1.553 99 HG22 ILE 14 2HG2 ILE 14 -7.947 -1.073 0.045 100 HG23 ILE 14 3HG2 ILE 14 -8.220 -2.022 -1.391 101 HD11 ILE 14 3HD1 ILE 14 -9.560 2.052 1.294 102 HD12 ILE 14 1HD1 ILE 14 -9.657 0.310 1.609 103 HD13 ILE 14 2HD1 ILE 14 -8.196 1.025 0.874 104 H CYS 15 H CYS 15 -8.760 -2.009 -3.840 105 HA CYS 15 HA CYS 15 -9.898 -4.671 -3.187 106 HB2 CYS 15 1HB CYS 15 -10.625 -4.148 -5.501 107 HB3 CYS 15 2HB CYS 15 -8.936 -3.825 -5.953 108 HG CYS 15 HG CYS 15 -9.440 -6.131 -6.907 109 H ILE 16 H ILE 16 -8.282 -5.970 -2.395 110 HA ILE 16 HA ILE 16 -5.477 -5.157 -2.875 111 HB ILE 16 HB ILE 16 -6.577 -6.201 -0.253 112 HG12 ILE 16 1HG1 ILE 16 -5.555 -3.451 -1.106 113 HG13 ILE 16 2HG1 ILE 16 -7.197 -3.857 -0.596 114 HG21 ILE 16 1HG2 ILE 16 -4.284 -7.013 -0.827 115 HG22 ILE 16 2HG2 ILE 16 -3.747 -5.323 -0.924 116 HG23 ILE 16 3HG2 ILE 16 -4.336 -6.002 0.611 117 HD11 ILE 16 3HD1 ILE 16 -6.034 -2.641 1.142 118 HD12 ILE 16 1HD1 ILE 16 -6.433 -4.288 1.685 119 HD13 ILE 16 2HD1 ILE 16 -4.764 -3.856 1.216 120 H ASP 17 H ASP 17 -4.617 -6.661 -4.093 121 HA ASP 17 HA ASP 17 -5.745 -9.404 -4.266 122 HB2 ASP 17 1HB ASP 17 -4.505 -7.583 -6.187 123 HB3 ASP 17 2HB ASP 17 -3.667 -9.106 -6.137 124 H PHE 18 H PHE 18 -4.624 -10.895 -3.037 125 HA PHE 18 HA PHE 18 -2.360 -10.077 -1.449 126 HB2 PHE 18 1HB PHE 18 -4.076 -12.541 -1.718 127 HB3 PHE 18 2HB PHE 18 -2.602 -12.609 -0.815 128 HD1 PHE 18 1HD PHE 18 -5.665 -10.352 -1.077 129 HD2 PHE 18 2HD PHE 18 -2.639 -12.078 1.485 130 HE1 PHE 18 1HE PHE 18 -6.672 -9.251 0.860 131 HE2 PHE 18 2HE PHE 18 -3.714 -11.021 3.436 132 HZ PHE 18 HZ PHE 18 -5.737 -9.601 3.144 133 H THR 19 H THR 19 -0.393 -11.693 -1.375 134 HA THR 19 HA THR 19 0.998 -11.804 -3.843 135 HB THR 19 HB THR 19 2.197 -13.737 -2.373 136 HG1 THR 19 1HG THR 19 1.842 -13.053 -0.117 137 HG21 THR 19 3HG2 THR 19 3.478 -11.938 -1.194 138 HG22 THR 19 1HG2 THR 19 2.294 -10.749 -1.799 139 HG23 THR 19 2HG2 THR 19 3.306 -11.693 -2.931 140 H ASN 20 H ASN 20 -0.869 -14.237 -2.068 141 HA ASN 20 HA ASN 20 -0.661 -16.190 -4.258 142 HB2 ASN 20 1HB ASN 20 -2.020 -17.668 -2.990 143 HB3 ASN 20 2HB ASN 20 -0.788 -17.006 -1.946 144 HD21 ASN 20 1HD2 ASN 20 -3.102 -14.479 -2.145 145 HD22 ASN 20 2HD2 ASN 20 -3.852 -14.941 -0.613 146 H SER 21 H SER 21 -2.942 -17.150 -4.967 147 HA SER 21 HA SER 21 -3.556 -15.327 -6.987 148 HB2 SER 21 1HB SER 21 -4.778 -17.352 -7.745 149 HB3 SER 21 2HB SER 21 -3.067 -17.525 -7.426 150 HG SER 21 HG SER 21 -5.200 -18.533 -5.831 151 H ILE 22 H ILE 22 -4.721 -14.331 -4.487 152 HA ILE 22 HA ILE 22 -7.651 -14.586 -4.771 153 HB ILE 22 HB ILE 22 -6.020 -14.705 -2.190 154 HG12 ILE 22 1HG1 ILE 22 -7.219 -17.036 -3.762 155 HG13 ILE 22 2HG1 ILE 22 -5.506 -16.733 -3.498 156 HG21 ILE 22 1HG2 ILE 22 -8.069 -15.451 -1.116 157 HG22 ILE 22 2HG2 ILE 22 -8.409 -13.972 -1.982 158 HG23 ILE 22 3HG2 ILE 22 -8.911 -15.525 -2.683 159 HD11 ILE 22 3HD1 ILE 22 -5.783 -17.117 -1.068 160 HD12 ILE 22 1HD1 ILE 22 -7.478 -17.560 -1.359 161 HD13 ILE 22 2HD1 ILE 22 -6.195 -18.529 -2.072 162 H GLN 23 H GLN 23 -8.648 -12.658 -4.100 163 HA GLN 23 HA GLN 23 -7.036 -10.462 -3.048 164 HB2 GLN 23 1HB GLN 23 -7.918 -9.196 -4.670 165 HB3 GLN 23 2HB GLN 23 -7.928 -10.675 -5.571 166 HG2 GLN 23 1HG GLN 23 -10.401 -10.862 -4.671 167 HG3 GLN 23 2HG GLN 23 -10.196 -9.131 -4.349 168 HE21 GLN 23 1HE2 GLN 23 -8.434 -8.807 -6.978 169 HE22 GLN 23 2HE2 GLN 23 -9.624 -9.044 -8.219 170 H LYS 24 H LYS 24 -8.366 -8.897 -1.846 171 HA LYS 24 HA LYS 24 -11.049 -9.858 -1.030 172 HB2 LYS 24 1HB LYS 24 -9.071 -9.981 0.831 173 HB3 LYS 24 2HB LYS 24 -9.487 -8.296 1.000 174 HG2 LYS 24 1HG LYS 24 -11.917 -9.881 1.043 175 HG3 LYS 24 2HG LYS 24 -10.737 -10.618 2.093 176 HD2 LYS 24 1HD LYS 24 -12.171 -9.255 3.385 177 HD3 LYS 24 2HD LYS 24 -10.588 -8.474 3.383 178 HE2 LYS 24 1HE LYS 24 -11.325 -6.748 1.933 179 HE3 LYS 24 2HE LYS 24 -12.648 -7.726 1.305 180 HZ1 LYS 24 3HZ LYS 24 -13.875 -7.379 3.290 181 HZ2 LYS 24 1HZ LYS 24 -13.381 -5.912 2.813 182 HZ3 LYS 24 2HZ LYS 24 -12.621 -6.692 4.067 183 H ILE 25 H ILE 25 -12.586 -8.148 -1.049 184 HA ILE 25 HA ILE 25 -11.547 -5.517 -2.005 185 HB ILE 25 HB ILE 25 -14.286 -6.701 -2.576 186 HG12 ILE 25 1HG1 ILE 25 -13.144 -6.593 -5.016 187 HG13 ILE 25 2HG1 ILE 25 -11.670 -6.859 -4.099 188 HG21 ILE 25 1HG2 ILE 25 -12.829 -4.311 -3.796 189 HG22 ILE 25 2HG2 ILE 25 -14.444 -4.891 -4.202 190 HG23 ILE 25 3HG2 ILE 25 -14.153 -4.205 -2.604 191 HD11 ILE 25 3HD1 ILE 25 -12.616 -8.960 -3.187 192 HD12 ILE 25 1HD1 ILE 25 -14.172 -8.595 -3.970 193 HD13 ILE 25 2HD1 ILE 25 -12.730 -8.956 -4.936 194 H TYR 26 H TYR 26 -12.122 -3.769 -0.933 195 HA TYR 26 HA TYR 26 -13.675 -4.070 1.582 196 HB2 TYR 26 1HB TYR 26 -11.250 -2.286 1.286 197 HB3 TYR 26 2HB TYR 26 -12.162 -2.626 2.736 198 HD1 TYR 26 1HD TYR 26 -10.062 -4.335 0.096 199 HD2 TYR 26 2HD TYR 26 -11.063 -4.173 4.312 200 HE1 TYR 26 1HE TYR 26 -8.515 -6.172 0.573 201 HE2 TYR 26 2HE TYR 26 -9.546 -6.016 4.747 202 HH TYR 26 HH TYR 26 -8.069 -7.563 3.853 203 H ASP 27 H ASP 27 -15.424 -3.552 0.200 204 HA ASP 27 HA ASP 27 -15.730 -0.717 -0.581 205 HB2 ASP 27 1HB ASP 27 -17.957 -1.392 -1.260 206 HB3 ASP 27 2HB ASP 27 -16.795 -2.500 -1.978 207 H ASP 28 H ASP 28 -15.933 -2.868 2.144 208 HA ASP 28 HA ASP 28 -18.213 -1.762 3.437 209 HB2 ASP 28 1HB ASP 28 -16.246 -2.868 5.289 210 HB3 ASP 28 2HB ASP 28 -17.884 -3.307 4.994 211 H SER 29 H SER 29 -18.353 0.180 4.454 212 HA SER 29 HA SER 29 -16.489 2.151 4.212 213 HB2 SER 29 1HB SER 29 -18.896 2.423 4.778 214 HB3 SER 29 2HB SER 29 -18.546 1.925 6.446 215 HG SER 29 HG SER 29 -17.520 4.179 5.043 216 H GLU 30 H GLU 30 -16.920 0.176 7.186 217 HA GLU 30 HA GLU 30 -14.802 1.563 8.575 218 HB2 GLU 30 1HB GLU 30 -16.868 0.442 9.492 219 HB3 GLU 30 2HB GLU 30 -16.025 -1.109 9.305 220 HG2 GLU 30 1HG GLU 30 -14.401 -0.458 10.968 221 HG3 GLU 30 2HG GLU 30 -14.851 1.245 10.846 222 H SER 31 H SER 31 -14.763 -0.900 6.245 223 HA SER 31 HA SER 31 -12.166 -2.171 6.921 224 HB2 SER 31 1HB SER 31 -14.185 -2.492 4.703 225 HB3 SER 31 2HB SER 31 -12.701 -3.379 4.838 226 HG SER 31 HG SER 31 -14.517 -3.274 6.990 227 H ILE 32 H ILE 32 -13.575 0.214 4.616 228 HA ILE 32 HA ILE 32 -11.063 0.894 3.380 229 HB ILE 32 HB ILE 32 -13.609 2.533 3.756 230 HG12 ILE 32 1HG1 ILE 32 -12.613 0.998 1.318 231 HG13 ILE 32 2HG1 ILE 32 -13.820 0.381 2.428 232 HG21 ILE 32 1HG2 ILE 32 -11.465 3.896 3.248 233 HG22 ILE 32 2HG2 ILE 32 -11.445 3.070 1.687 234 HG23 ILE 32 3HG2 ILE 32 -12.820 4.084 2.130 235 HD11 ILE 32 3HD1 ILE 32 -14.134 2.851 0.674 236 HD12 ILE 32 1HD1 ILE 32 -14.936 1.289 0.488 237 HD13 ILE 32 2HD1 ILE 32 -15.315 2.302 1.893 238 H GLN 33 H GLN 33 -12.926 2.383 6.076 239 HA GLN 33 HA GLN 33 -11.044 4.373 6.770 240 HB2 GLN 33 1HB GLN 33 -13.317 2.981 8.168 241 HB3 GLN 33 2HB GLN 33 -12.312 4.069 9.087 242 HG2 GLN 33 1HG GLN 33 -13.395 5.035 6.425 243 HG3 GLN 33 2HG GLN 33 -14.492 4.906 7.793 244 HE21 GLN 33 1HE2 GLN 33 -14.653 7.356 7.462 245 HE22 GLN 33 2HE2 GLN 33 -13.479 8.308 8.346 246 H LYS 34 H LYS 34 -11.158 0.880 7.899 247 HA LYS 34 HA LYS 34 -9.008 1.159 9.679 248 HB2 LYS 34 1HB LYS 34 -10.410 -0.765 9.654 249 HB3 LYS 34 2HB LYS 34 -10.121 -1.105 7.959 250 HG2 LYS 34 1HG LYS 34 -9.008 -2.604 9.665 251 HG3 LYS 34 2HG LYS 34 -7.973 -1.983 8.377 252 HD2 LYS 34 1HD LYS 34 -6.752 -0.644 9.723 253 HD3 LYS 34 2HD LYS 34 -8.081 -0.355 10.907 254 HE2 LYS 34 1HE LYS 34 -7.953 -2.677 11.650 255 HE3 LYS 34 2HE LYS 34 -6.554 -2.928 10.597 256 HZ1 LYS 34 3HZ LYS 34 -5.721 -2.414 12.762 257 HZ2 LYS 34 1HZ LYS 34 -6.717 -1.143 12.962 258 HZ3 LYS 34 2HZ LYS 34 -5.490 -1.043 11.874 259 H ILE 35 H ILE 35 -8.938 -0.049 6.255 260 HA ILE 35 HA ILE 35 -6.231 -0.228 6.188 261 HB ILE 35 HB ILE 35 -8.288 0.382 3.972 262 HG12 ILE 35 1HG1 ILE 35 -6.774 -2.163 4.640 263 HG13 ILE 35 2HG1 ILE 35 -8.349 -1.797 5.284 264 HG21 ILE 35 1HG2 ILE 35 -5.362 -0.375 3.539 265 HG22 ILE 35 2HG2 ILE 35 -6.595 -0.370 2.265 266 HG23 ILE 35 3HG2 ILE 35 -6.185 1.130 3.034 267 HD11 ILE 35 3HD1 ILE 35 -7.893 -2.011 2.276 268 HD12 ILE 35 1HD1 ILE 35 -8.365 -3.329 3.322 269 HD13 ILE 35 2HD1 ILE 35 -9.418 -1.897 3.160 270 H LEU 36 H LEU 36 -8.129 2.743 5.159 271 HA LEU 36 HA LEU 36 -5.936 4.190 4.271 272 HB2 LEU 36 1HB LEU 36 -8.707 4.707 5.337 273 HB3 LEU 36 2HB LEU 36 -7.643 6.090 5.279 274 HG LEU 36 HG LEU 36 -9.111 5.516 3.251 275 HD11 LEU 36 1HD1 LEU 36 -6.987 6.271 1.762 276 HD12 LEU 36 2HD1 LEU 36 -6.197 6.355 3.325 277 HD13 LEU 36 3HD1 LEU 36 -7.659 7.324 3.025 278 HD21 LEU 36 3HD2 LEU 36 -6.848 3.695 2.395 279 HD22 LEU 36 1HD2 LEU 36 -8.296 4.163 1.494 280 HD23 LEU 36 2HD2 LEU 36 -8.459 3.162 2.941 281 H SER 37 H SER 37 -6.629 3.437 7.649 282 HA SER 37 HA SER 37 -4.859 5.504 8.646 283 HB2 SER 37 1HB SER 37 -6.697 3.679 9.765 284 HB3 SER 37 2HB SER 37 -5.120 3.134 10.322 285 HG SER 37 HG SER 37 -5.884 4.698 11.704 286 H GLU 38 H GLU 38 -4.559 1.932 8.033 287 HA GLU 38 HA GLU 38 -1.807 1.925 8.773 288 HB2 GLU 38 1HB GLU 38 -3.047 -0.257 7.104 289 HB3 GLU 38 2HB GLU 38 -1.840 -0.328 8.379 290 HG2 GLU 38 1HG GLU 38 -4.812 -0.105 8.639 291 HG3 GLU 38 2HG GLU 38 -3.745 -1.377 9.242 292 H ILE 39 H ILE 39 -3.357 2.572 5.744 293 HA ILE 39 HA ILE 39 -1.098 2.257 3.968 294 HB ILE 39 HB ILE 39 -3.640 3.901 3.955 295 HG12 ILE 39 1HG1 ILE 39 -3.766 1.392 3.629 296 HG13 ILE 39 2HG1 ILE 39 -4.498 2.394 2.373 297 HG21 ILE 39 1HG2 ILE 39 -1.627 3.822 1.710 298 HG22 ILE 39 2HG2 ILE 39 -3.326 4.365 1.559 299 HG23 ILE 39 3HG2 ILE 39 -2.208 5.235 2.615 300 HD11 ILE 39 3HD1 ILE 39 -1.826 0.961 2.149 301 HD12 ILE 39 1HD1 ILE 39 -3.367 0.431 1.459 302 HD13 ILE 39 2HD1 ILE 39 -2.611 1.908 0.865 303 H ALA 40 H ALA 40 -1.802 4.539 6.522 304 HA ALA 40 HA ALA 40 0.073 6.549 5.400 305 HB1 ALA 40 1HB ALA 40 -1.331 8.230 6.356 306 HB2 ALA 40 2HB ALA 40 -2.449 7.077 5.584 307 HB3 ALA 40 3HB ALA 40 -2.198 7.024 7.335 308 H THR 41 H THR 41 0.299 4.191 7.503 309 HA THR 41 HA THR 41 1.148 5.700 9.872 310 HB THR 41 HB THR 41 -0.044 3.595 10.090 311 HG1 THR 41 1HG THR 41 1.093 3.106 11.882 312 HG21 THR 41 3HG2 THR 41 1.025 1.480 9.842 313 HG22 THR 41 1HG2 THR 41 2.554 2.244 9.334 314 HG23 THR 41 2HG2 THR 41 1.117 2.329 8.289 315 H GLY 42 H GLY 42 2.709 3.955 7.207 316 HA2 GLY 42 1HA GLY 42 5.311 3.802 8.294 317 HA3 GLY 42 2HA GLY 42 4.791 3.458 6.643 318 H LYS 43 H LYS 43 7.236 4.424 7.005 319 HA LYS 43 HA LYS 43 7.071 7.332 6.267 320 HB2 LYS 43 1HB LYS 43 9.341 6.089 7.812 321 HB3 LYS 43 2HB LYS 43 9.058 7.773 7.506 322 HG2 LYS 43 1HG LYS 43 7.012 7.734 8.914 323 HG3 LYS 43 2HG LYS 43 7.272 6.033 9.281 324 HD2 LYS 43 1HD LYS 43 9.364 8.147 9.927 325 HD3 LYS 43 2HD LYS 43 8.022 7.750 11.013 326 HE2 LYS 43 1HE LYS 43 8.694 5.357 10.994 327 HE3 LYS 43 2HE LYS 43 10.088 5.757 9.974 328 HZ1 LYS 43 3HZ LYS 43 9.597 6.858 12.663 329 HZ2 LYS 43 1HZ LYS 43 10.967 7.090 11.764 330 HZ3 LYS 43 2HZ LYS 43 10.586 5.596 12.354 331 H ARG 44 H ARG 44 7.296 7.147 4.117 332 HA ARG 44 HA ARG 44 9.289 5.556 2.756 333 HB2 ARG 44 1HB ARG 44 8.811 7.015 0.811 334 HB3 ARG 44 2HB ARG 44 7.443 6.162 1.448 335 HG2 ARG 44 1HG ARG 44 6.637 8.239 1.073 336 HG3 ARG 44 2HG ARG 44 6.852 8.305 2.800 337 HD2 ARG 44 1HD ARG 44 8.606 9.798 2.612 338 HD3 ARG 44 2HD ARG 44 9.030 9.233 0.956 339 HE ARG 44 HE ARG 44 6.438 10.407 0.933 340 HH11 ARG 44 1HH1 ARG 44 9.905 11.167 1.064 341 HH12 ARG 44 2HH1 ARG 44 9.761 12.561 0.008 342 HH21 ARG 44 1HH2 ARG 44 6.215 12.419 -0.105 343 HH22 ARG 44 2HH2 ARG 44 7.605 13.245 -0.749 344 H THR 45 H THR 45 9.441 8.147 4.553 345 HA THR 45 HA THR 45 11.140 9.557 5.270 346 HB THR 45 HB THR 45 13.196 8.588 5.546 347 HG1 THR 45 1HG THR 45 14.098 7.101 4.070 348 HG21 THR 45 3HG2 THR 45 11.694 6.045 4.753 349 HG22 THR 45 1HG2 THR 45 11.456 6.930 6.275 350 HG23 THR 45 2HG2 THR 45 13.028 6.230 5.905 351 H GLU 46 H GLU 46 13.461 10.628 4.238 352 HA GLU 46 HA GLU 46 12.518 12.108 1.884 353 HB2 GLU 46 1HB GLU 46 14.345 13.515 2.234 354 HB3 GLU 46 2HB GLU 46 13.573 13.214 3.789 355 HG2 GLU 46 1HG GLU 46 15.427 11.594 4.340 356 HG3 GLU 46 2HG GLU 46 16.193 12.004 2.795 357 H LYS 47 H LYS 47 13.946 9.127 2.147 358 HA LYS 47 HA LYS 47 16.166 9.330 0.396 359 HB2 LYS 47 1HB LYS 47 14.335 6.967 1.061 360 HB3 LYS 47 2HB LYS 47 15.736 6.839 0.042 361 HG2 LYS 47 1HG LYS 47 16.502 8.290 2.449 362 HG3 LYS 47 2HG LYS 47 15.676 6.816 2.898 363 HD2 LYS 47 1HD LYS 47 17.926 6.797 0.869 364 HD3 LYS 47 2HD LYS 47 18.225 6.757 2.620 365 HE2 LYS 47 1HE LYS 47 16.819 4.788 2.884 366 HE3 LYS 47 2HE LYS 47 16.442 4.759 1.156 367 HZ1 LYS 47 3HZ LYS 47 19.199 4.519 2.198 368 HZ2 LYS 47 1HZ LYS 47 18.695 4.221 0.669 369 HZ3 LYS 47 2HZ LYS 47 18.225 3.228 1.905 370 H GLN 48 H GLN 48 16.364 8.231 -1.737 371 HA GLN 48 HA GLN 48 14.412 9.471 -3.582 372 HB2 GLN 48 1HB GLN 48 17.311 8.554 -3.823 373 HB3 GLN 48 2HB GLN 48 16.352 9.055 -5.216 374 HG2 GLN 48 1HG GLN 48 16.254 10.977 -2.952 375 HG3 GLN 48 2HG GLN 48 17.868 10.731 -3.591 376 HE21 GLN 48 1HE2 GLN 48 15.135 12.658 -3.932 377 HE22 GLN 48 2HE2 GLN 48 15.407 13.164 -5.589 378 H SER 49 H SER 49 13.134 8.179 -4.860 379 HA SER 49 HA SER 49 13.574 5.232 -4.686 380 HB2 SER 49 1HB SER 49 10.796 6.220 -4.960 381 HB3 SER 49 2HB SER 49 11.465 4.885 -4.044 382 HG SER 49 HG SER 49 11.524 7.657 -3.388 383 H ILE 50 H ILE 50 14.845 6.257 -6.665 384 HA ILE 50 HA ILE 50 13.401 7.023 -9.014 385 HB ILE 50 HB ILE 50 15.686 6.907 -10.044 386 HG12 ILE 50 1HG1 ILE 50 16.644 6.045 -7.268 387 HG13 ILE 50 2HG1 ILE 50 16.494 4.959 -8.651 388 HG21 ILE 50 1HG2 ILE 50 16.564 8.784 -8.762 389 HG22 ILE 50 2HG2 ILE 50 14.809 8.896 -8.839 390 HG23 ILE 50 3HG2 ILE 50 15.591 8.344 -7.347 391 HD11 ILE 50 3HD1 ILE 50 18.796 5.683 -8.384 392 HD12 ILE 50 1HD1 ILE 50 18.132 6.300 -9.905 393 HD13 ILE 50 2HD1 ILE 50 18.330 7.383 -8.503 394 H GLN 51 H GLN 51 13.167 4.129 -7.752 395 HA GLN 51 HA GLN 51 13.516 2.372 -10.029 396 HB2 GLN 51 1HB GLN 51 12.159 0.857 -8.456 397 HB3 GLN 51 2HB GLN 51 13.766 1.334 -7.955 398 HG2 GLN 51 1HG GLN 51 12.787 3.081 -6.438 399 HG3 GLN 51 2HG GLN 51 11.174 2.594 -6.943 400 HE21 GLN 51 1HE2 GLN 51 11.399 -0.275 -6.788 401 HE22 GLN 51 2HE2 GLN 51 11.744 -0.649 -5.094 402 H ASP 52 H ASP 52 11.668 1.274 -10.780 403 HA ASP 52 HA ASP 52 9.073 2.803 -10.782 404 HB2 ASP 52 1HB ASP 52 10.549 1.630 -13.151 405 HB3 ASP 52 2HB ASP 52 8.804 1.803 -13.170 406 H TYR 53 H TYR 53 10.661 -0.150 -10.013 407 HA TYR 53 HA TYR 53 8.065 -1.431 -9.558 408 HB2 TYR 53 1HB TYR 53 10.257 -2.527 -11.348 409 HB3 TYR 53 2HB TYR 53 9.192 -3.616 -10.508 410 HD1 TYR 53 2HD TYR 53 6.652 -3.434 -10.821 411 HD2 TYR 53 1HD TYR 53 9.490 -1.416 -13.369 412 HE1 TYR 53 2HE TYR 53 4.881 -3.052 -12.479 413 HE2 TYR 53 1HE TYR 53 7.733 -1.020 -15.037 414 HH TYR 53 HH TYR 53 4.326 -1.812 -14.284 415 HA PRO 54 HA PRO 54 10.199 -2.987 -5.872 416 HB2 PRO 54 1HB PRO 54 8.942 -5.449 -5.567 417 HB3 PRO 54 2HB PRO 54 8.244 -3.889 -5.074 418 HG2 PRO 54 1HG PRO 54 7.500 -5.542 -7.335 419 HG3 PRO 54 2HG PRO 54 6.577 -4.321 -6.428 420 HD2 PRO 54 1HD PRO 54 7.822 -4.045 -8.964 421 HD3 PRO 54 2HD PRO 54 7.114 -2.732 -8.000 422 H SER 55 H SER 55 11.527 -4.905 -5.085 423 HA SER 55 HA SER 55 13.084 -6.007 -7.335 424 HB2 SER 55 1HB SER 55 14.760 -6.340 -5.620 425 HB3 SER 55 2HB SER 55 14.173 -4.673 -5.555 426 HG SER 55 HG SER 55 14.227 -5.512 -3.459 427 H ALA 56 H ALA 56 10.626 -7.028 -5.151 428 HA ALA 56 HA ALA 56 11.509 -9.847 -4.943 429 HB1 ALA 56 1HB ALA 56 9.214 -10.206 -4.014 430 HB2 ALA 56 2HB ALA 56 10.161 -9.017 -3.127 431 HB3 ALA 56 3HB ALA 56 8.875 -8.479 -4.253 432 H GLU 57 H GLU 57 10.693 -11.577 -6.158 433 HA GLU 57 HA GLU 57 9.405 -10.869 -8.670 434 HB2 GLU 57 1HB GLU 57 11.124 -12.971 -7.767 435 HB3 GLU 57 2HB GLU 57 9.562 -13.743 -8.125 436 HG2 GLU 57 1HG GLU 57 9.557 -12.345 -10.287 437 HG3 GLU 57 2HG GLU 57 11.235 -11.952 -9.896 438 H GLU 58 H GLU 58 8.315 -11.732 -5.469 439 HA GLU 58 HA GLU 58 5.637 -12.371 -6.514 440 HB2 GLU 58 1HB GLU 58 5.389 -14.025 -4.793 441 HB3 GLU 58 2HB GLU 58 6.676 -14.363 -5.971 442 HG2 GLU 58 1HG GLU 58 8.166 -13.216 -4.004 443 HG3 GLU 58 2HG GLU 58 6.865 -13.932 -3.035 444 H TYR 59 H TYR 59 4.640 -10.643 -6.187 445 HA TYR 59 HA TYR 59 4.357 -9.522 -3.475 446 HB2 TYR 59 1HB TYR 59 4.232 -7.291 -4.430 447 HB3 TYR 59 2HB TYR 59 5.833 -8.008 -4.485 448 HD1 TYR 59 1HD TYR 59 2.970 -6.717 -6.458 449 HD2 TYR 59 2HD TYR 59 6.950 -8.388 -6.594 450 HE1 TYR 59 1HE TYR 59 3.275 -5.779 -8.698 451 HE2 TYR 59 2HE TYR 59 7.207 -7.596 -8.907 452 HH TYR 59 HH TYR 59 6.259 -6.358 -10.648 453 H GLY 60 H GLY 60 2.359 -7.976 -3.633 454 HA2 GLY 60 1HA GLY 60 0.313 -8.773 -5.566 455 HA3 GLY 60 2HA GLY 60 -0.074 -8.929 -3.860 456 H THR 61 H THR 61 -1.669 -7.272 -4.492 457 HA THR 61 HA THR 61 -0.634 -4.684 -5.437 458 HB THR 61 HB THR 61 -3.305 -5.909 -6.113 459 HG1 THR 61 1HG THR 61 -2.365 -7.119 -7.785 460 HG21 THR 61 3HG2 THR 61 -2.929 -4.877 -8.271 461 HG22 THR 61 1HG2 THR 61 -1.252 -4.477 -7.844 462 HG23 THR 61 2HG2 THR 61 -2.611 -3.681 -7.014 463 H ILE 62 H ILE 62 -1.607 -2.809 -4.642 464 HA ILE 62 HA ILE 62 -4.185 -3.056 -3.155 465 HB ILE 62 HB ILE 62 -2.010 -0.954 -2.910 466 HG12 ILE 62 1HG1 ILE 62 -3.025 -2.615 -0.582 467 HG13 ILE 62 2HG1 ILE 62 -1.755 -3.250 -1.616 468 HG21 ILE 62 1HG2 ILE 62 -4.737 -1.094 -1.538 469 HG22 ILE 62 2HG2 ILE 62 -3.463 0.075 -1.137 470 HG23 ILE 62 3HG2 ILE 62 -4.204 0.117 -2.728 471 HD11 ILE 62 3HD1 ILE 62 -0.272 -1.412 -1.138 472 HD12 ILE 62 1HD1 ILE 62 -1.526 -0.560 -0.212 473 HD13 ILE 62 2HD1 ILE 62 -0.878 -2.095 0.378 474 H ASN 63 H ASN 63 -5.840 -2.001 -4.219 475 HA ASN 63 HA ASN 63 -5.210 0.010 -6.305 476 HB2 ASN 63 1HB ASN 63 -7.667 -1.793 -6.336 477 HB3 ASN 63 2HB ASN 63 -7.069 -0.734 -7.583 478 HD21 ASN 63 1HD2 ASN 63 -6.377 -3.785 -5.842 479 HD22 ASN 63 2HD2 ASN 63 -5.721 -4.598 -7.251 480 H ILE 64 H ILE 64 -6.219 1.959 -5.692 481 HA ILE 64 HA ILE 64 -8.621 1.746 -3.920 482 HB ILE 64 HB ILE 64 -6.652 4.068 -4.021 483 HG12 ILE 64 1HG1 ILE 64 -7.020 1.915 -1.893 484 HG13 ILE 64 2HG1 ILE 64 -5.617 2.185 -2.934 485 HG21 ILE 64 1HG2 ILE 64 -9.159 3.483 -2.374 486 HG22 ILE 64 2HG2 ILE 64 -8.087 4.871 -2.105 487 HG23 ILE 64 3HG2 ILE 64 -8.967 4.720 -3.624 488 HD11 ILE 64 3HD1 ILE 64 -5.273 4.422 -1.865 489 HD12 ILE 64 1HD1 ILE 64 -6.559 4.010 -0.700 490 HD13 ILE 64 2HD1 ILE 64 -5.082 3.040 -0.767 491 H GLU 65 H GLU 65 -10.121 1.598 -5.593 492 HA GLU 65 HA GLU 65 -9.987 3.407 -7.863 493 HB2 GLU 65 1HB GLU 65 -10.925 1.121 -8.050 494 HB3 GLU 65 2HB GLU 65 -12.218 1.555 -6.926 495 HG2 GLU 65 1HG GLU 65 -13.211 3.029 -8.414 496 HG3 GLU 65 2HG GLU 65 -11.744 3.273 -9.371 497 H ASN 66 H ASN 66 -10.732 5.438 -7.853 498 HA ASN 66 HA ASN 66 -12.799 6.370 -6.033 499 HB2 ASN 66 1HB ASN 66 -11.475 8.001 -4.892 500 HB3 ASN 66 2HB ASN 66 -10.752 6.434 -4.592 501 HD21 ASN 66 1HD2 ASN 66 -8.619 5.902 -5.814 502 HD22 ASN 66 2HD2 ASN 66 -7.646 7.321 -6.167 503 H ASN 67 H ASN 67 -13.894 7.960 -7.039 504 HA ASN 67 HA ASN 67 -14.539 9.505 -8.528 505 HB2 ASN 67 1HB ASN 67 -11.686 10.516 -8.523 506 HB3 ASN 67 2HB ASN 67 -13.149 11.417 -8.867 507 HD21 ASN 67 1HD2 ASN 67 -11.022 10.209 -6.318 508 HD22 ASN 67 2HD2 ASN 67 -11.923 10.937 -5.013 509 H GLY 68 H GLY 68 -13.626 6.934 -9.807 510 HA2 GLY 68 1HA GLY 68 -13.694 6.316 -12.038 511 HA3 GLY 68 2HA GLY 68 -13.440 7.971 -12.530 512 H GLY 69 H GLY 69 -11.053 6.827 -10.230 513 HA2 GLY 69 1HA GLY 69 -9.239 5.849 -12.343 514 HA3 GLY 69 2HA GLY 69 -8.747 7.279 -11.407 515 H MET 70 H MET 70 -7.118 5.085 -11.179 516 HA MET 70 HA MET 70 -7.679 4.095 -8.440 517 HB2 MET 70 1HB MET 70 -6.864 2.468 -10.856 518 HB3 MET 70 2HB MET 70 -6.449 1.946 -9.218 519 HG2 MET 70 1HG MET 70 -8.648 1.708 -8.541 520 HG3 MET 70 2HG MET 70 -9.306 2.654 -9.886 521 HE1 MET 70 3HE MET 70 -9.477 0.367 -12.838 522 HE2 MET 70 1HE MET 70 -10.296 1.677 -11.958 523 HE3 MET 70 2HE MET 70 -8.605 1.861 -12.438 524 H THR 71 H THR 71 -6.111 4.509 -7.109 525 HA THR 71 HA THR 71 -3.295 4.895 -8.020 526 HB THR 71 HB THR 71 -4.633 5.039 -5.267 527 HG1 THR 71 1HG THR 71 -4.980 6.973 -6.104 528 HG21 THR 71 3HG2 THR 71 -2.451 5.888 -4.455 529 HG22 THR 71 1HG2 THR 71 -1.716 5.541 -6.035 530 HG23 THR 71 2HG2 THR 71 -2.311 4.216 -5.013 531 H THR 72 H THR 72 -2.361 3.080 -8.590 532 HA THR 72 HA THR 72 -2.814 0.571 -7.171 533 HB THR 72 HB THR 72 -0.572 1.216 -9.070 534 HG1 THR 72 1HG THR 72 -2.852 0.275 -10.301 535 HG21 THR 72 3HG2 THR 72 -0.620 -1.055 -8.073 536 HG22 THR 72 1HG2 THR 72 -0.948 -1.158 -9.804 537 HG23 THR 72 2HG2 THR 72 -2.284 -1.288 -8.638 538 H MET 73 H MET 73 -1.114 -0.321 -5.813 539 HA MET 73 HA MET 73 1.518 0.685 -5.934 540 HB2 MET 73 1HB MET 73 1.829 0.876 -3.424 541 HB3 MET 73 2HB MET 73 1.153 2.246 -4.290 542 HG2 MET 73 1HG MET 73 -1.136 1.531 -3.498 543 HG3 MET 73 2HG MET 73 -0.327 0.268 -2.565 544 HE1 MET 73 3HE MET 73 -1.104 4.087 -2.925 545 HE2 MET 73 1HE MET 73 -0.034 4.820 -1.710 546 HE3 MET 73 2HE MET 73 0.655 4.107 -3.183 547 H PHE 74 H PHE 74 2.960 -0.923 -4.750 548 HA PHE 74 HA PHE 74 1.627 -3.574 -4.371 549 HB2 PHE 74 1HB PHE 74 4.461 -3.182 -5.347 550 HB3 PHE 74 2HB PHE 74 3.487 -4.630 -5.390 551 HD1 PHE 74 2HD PHE 74 1.143 -4.246 -6.852 552 HD2 PHE 74 1HD PHE 74 4.985 -2.411 -7.464 553 HE1 PHE 74 2HE PHE 74 0.616 -3.915 -9.234 554 HE2 PHE 74 1HE PHE 74 4.456 -2.094 -9.859 555 HZ PHE 74 HZ PHE 74 2.252 -2.827 -10.752 556 H TYR 75 H TYR 75 3.165 -5.070 -2.952 557 HA TYR 75 HA TYR 75 4.891 -3.653 -0.998 558 HB2 TYR 75 1HB TYR 75 3.632 -4.737 0.916 559 HB3 TYR 75 2HB TYR 75 2.727 -3.528 0.023 560 HD1 TYR 75 1HD TYR 75 3.155 -7.221 0.464 561 HD2 TYR 75 2HD TYR 75 0.714 -4.072 -1.193 562 HE1 TYR 75 1HE TYR 75 1.494 -8.891 -0.241 563 HE2 TYR 75 2HE TYR 75 -0.952 -5.752 -1.916 564 HH TYR 75 HH TYR 75 -1.478 -8.068 -2.058 565 H TYR 76 H TYR 76 6.334 -5.324 0.140 566 HA TYR 76 HA TYR 76 6.027 -8.097 -0.409 567 HB2 TYR 76 1HB TYR 76 8.093 -8.615 -1.501 568 HB3 TYR 76 2HB TYR 76 7.059 -7.721 -2.536 569 HD1 TYR 76 1HD TYR 76 7.529 -5.282 -2.943 570 HD2 TYR 76 2HD TYR 76 10.364 -7.885 -1.018 571 HE1 TYR 76 1HE TYR 76 9.353 -3.571 -3.262 572 HE2 TYR 76 2HE TYR 76 12.169 -6.341 -1.555 573 HH TYR 76 HH TYR 76 12.670 -4.168 -2.129 574 H GLU 77 H GLU 77 8.699 -8.915 0.397 575 HA GLU 77 HA GLU 77 9.213 -7.373 2.888 576 HB2 GLU 77 1HB GLU 77 8.146 -9.511 3.531 577 HB3 GLU 77 2HB GLU 77 9.270 -10.391 2.513 578 HG2 GLU 77 1HG GLU 77 11.120 -9.194 4.062 579 HG3 GLU 77 2HG GLU 77 9.764 -9.028 5.166 580 H GLU 78 H GLU 78 11.248 -6.615 2.906 581 HA GLU 78 HA GLU 78 13.253 -7.957 1.182 582 HB2 GLU 78 1HB GLU 78 12.574 -5.602 0.419 583 HB3 GLU 78 2HB GLU 78 13.425 -5.012 1.826 584 HG2 GLU 78 1HG GLU 78 15.470 -5.396 0.940 585 HG3 GLU 78 2HG GLU 78 15.034 -7.030 0.454 586 H ASN 79 H ASN 79 14.604 -9.011 2.378 587 HA ASN 79 HA ASN 79 16.091 -9.643 3.911 588 HB2 ASN 79 1HB ASN 79 16.500 -6.826 3.674 589 HB3 ASN 79 2HB ASN 79 16.584 -7.172 5.393 590 HD21 ASN 79 1HD2 ASN 79 17.876 -8.102 2.190 591 HD22 ASN 79 2HD2 ASN 79 19.433 -8.576 2.742 592 H GLY 80 H GLY 80 13.102 -8.780 4.846 593 HA2 GLY 80 1HA GLY 80 12.229 -10.114 6.763 594 HA3 GLY 80 2HA GLY 80 13.505 -9.409 7.740 595 H LYS 81 H LYS 81 12.885 -6.717 6.013 596 HA LYS 81 HA LYS 81 10.634 -5.875 7.763 597 HB2 LYS 81 1HB LYS 81 13.004 -4.538 6.597 598 HB3 LYS 81 2HB LYS 81 11.505 -3.751 6.093 599 HG2 LYS 81 1HG LYS 81 12.374 -2.746 8.040 600 HG3 LYS 81 2HG LYS 81 10.778 -3.431 8.356 601 HD2 LYS 81 1HD LYS 81 11.841 -5.347 9.541 602 HD3 LYS 81 2HD LYS 81 13.447 -4.675 9.132 603 HE2 LYS 81 1HE LYS 81 12.743 -2.540 10.317 604 HE3 LYS 81 2HE LYS 81 11.275 -3.381 10.851 605 HZ1 LYS 81 3HZ LYS 81 13.106 -3.425 12.472 606 HZ2 LYS 81 1HZ LYS 81 14.020 -4.297 11.415 607 HZ3 LYS 81 2HZ LYS 81 12.633 -4.945 12.016 608 H TYR 82 H TYR 82 8.894 -4.727 6.787 609 HA TYR 82 HA TYR 82 8.196 -5.672 4.058 610 HB2 TYR 82 1HB TYR 82 6.586 -4.617 6.415 611 HB3 TYR 82 2HB TYR 82 5.893 -5.050 4.877 612 HD1 TYR 82 1HD TYR 82 6.449 -7.590 4.069 613 HD2 TYR 82 2HD TYR 82 6.673 -6.200 8.148 614 HE1 TYR 82 1HE TYR 82 6.017 -9.870 4.855 615 HE2 TYR 82 2HE TYR 82 6.357 -8.498 8.956 616 HH TYR 82 HH TYR 82 5.633 -11.220 6.686 617 H TYR 83 H TYR 83 7.632 -4.139 2.471 618 HA TYR 83 HA TYR 83 7.681 -1.329 3.256 619 HB2 TYR 83 1HB TYR 83 9.378 -2.363 0.956 620 HB3 TYR 83 2HB TYR 83 9.232 -0.725 1.501 621 HD1 TYR 83 1HD TYR 83 10.611 -4.058 2.401 622 HD2 TYR 83 2HD TYR 83 10.670 0.188 3.116 623 HE1 TYR 83 1HE TYR 83 12.619 -4.333 3.775 624 HE2 TYR 83 2HE TYR 83 12.677 -0.058 4.542 625 HH TYR 83 HH TYR 83 14.298 -3.209 5.075 626 H ILE 84 H ILE 84 7.058 0.019 1.328 627 HA ILE 84 HA ILE 84 4.933 -1.383 -0.293 628 HB ILE 84 HB ILE 84 4.546 1.318 1.038 629 HG12 ILE 84 1HG1 ILE 84 2.590 -0.173 2.115 630 HG13 ILE 84 2HG1 ILE 84 3.733 -1.486 1.855 631 HG21 ILE 84 1HG2 ILE 84 3.339 1.083 -1.108 632 HG22 ILE 84 2HG2 ILE 84 2.619 -0.441 -0.536 633 HG23 ILE 84 3HG2 ILE 84 2.235 1.101 0.243 634 HD11 ILE 84 3HD1 ILE 84 4.280 1.091 3.413 635 HD12 ILE 84 1HD1 ILE 84 3.816 -0.460 4.115 636 HD13 ILE 84 2HD1 ILE 84 5.373 -0.315 3.298 637 H GLU 85 H GLU 85 5.001 -1.033 -2.430 638 HA GLU 85 HA GLU 85 7.073 0.673 -3.571 639 HB2 GLU 85 1HB GLU 85 6.554 -1.507 -4.509 640 HB3 GLU 85 2HB GLU 85 4.886 -1.040 -4.802 641 HG2 GLU 85 1HG GLU 85 7.163 0.501 -6.083 642 HG3 GLU 85 2HG GLU 85 6.684 -1.055 -6.736 643 H CYS 86 H CYS 86 6.588 2.289 -5.222 644 HA CYS 86 HA CYS 86 4.258 3.778 -5.473 645 HB2 CYS 86 1HB CYS 86 5.821 4.243 -3.020 646 HB3 CYS 86 2HB CYS 86 5.753 5.741 -3.960 647 HG CYS 86 HG CYS 86 3.334 3.660 -3.128 648 HA PRO 87 HA PRO 87 7.322 5.662 -8.349 649 HB2 PRO 87 1HB PRO 87 6.602 8.281 -8.514 650 HB3 PRO 87 2HB PRO 87 5.584 6.979 -9.199 651 HG2 PRO 87 1HG PRO 87 5.288 8.341 -6.505 652 HG3 PRO 87 2HG PRO 87 4.032 8.030 -7.753 653 HD2 PRO 87 1HD PRO 87 4.431 6.399 -5.602 654 HD3 PRO 87 2HD PRO 87 3.874 5.789 -7.161 655 H TYR 88 H TYR 88 8.605 8.056 -8.021 656 HA TYR 88 HA TYR 88 10.779 7.838 -6.675 657 HB2 TYR 88 1HB TYR 88 9.077 10.335 -6.889 658 HB3 TYR 88 2HB TYR 88 10.785 10.365 -6.473 659 HD1 TYR 88 2HD TYR 88 8.395 9.740 -9.256 660 HD2 TYR 88 1HD TYR 88 12.542 9.950 -8.071 661 HE1 TYR 88 2HE TYR 88 9.082 9.833 -11.640 662 HE2 TYR 88 1HE TYR 88 13.219 10.135 -10.422 663 HH TYR 88 HH TYR 88 11.089 9.449 -13.043 664 H LYS 89 H LYS 89 8.005 7.797 -4.710 665 HA LYS 89 HA LYS 89 9.329 8.446 -2.203 666 HB2 LYS 89 1HB LYS 89 6.992 9.022 -1.640 667 HB3 LYS 89 2HB LYS 89 8.125 10.188 -2.359 668 HG2 LYS 89 1HG LYS 89 6.612 9.083 -4.541 669 HG3 LYS 89 2HG LYS 89 5.640 9.032 -3.132 670 HD2 LYS 89 1HD LYS 89 5.257 11.151 -4.374 671 HD3 LYS 89 2HD LYS 89 6.106 11.579 -2.869 672 HE2 LYS 89 1HE LYS 89 8.295 11.461 -4.104 673 HE3 LYS 89 2HE LYS 89 7.429 10.993 -5.570 674 HZ1 LYS 89 3HZ LYS 89 7.360 13.615 -4.241 675 HZ2 LYS 89 1HZ LYS 89 6.325 13.195 -5.477 676 HZ3 LYS 89 2HZ LYS 89 7.951 13.235 -5.709 677 H GLY 90 H GLY 90 9.199 5.955 -3.657 678 HA2 GLY 90 1HA GLY 90 7.484 4.362 -1.844 679 HA3 GLY 90 2HA GLY 90 8.052 3.841 -3.442 680 H ILE 91 H ILE 91 9.392 4.908 -0.285 681 HA ILE 91 HA ILE 91 10.744 2.307 0.007 682 HB ILE 91 HB ILE 91 12.294 4.837 0.531 683 HG12 ILE 91 1HG1 ILE 91 12.341 3.039 -1.927 684 HG13 ILE 91 2HG1 ILE 91 11.997 4.765 -1.825 685 HG21 ILE 91 1HG2 ILE 91 13.415 2.046 0.091 686 HG22 ILE 91 2HG2 ILE 91 14.107 3.419 1.001 687 HG23 ILE 91 3HG2 ILE 91 12.765 2.458 1.651 688 HD11 ILE 91 3HD1 ILE 91 14.728 3.540 -1.301 689 HD12 ILE 91 1HD1 ILE 91 14.212 4.363 -2.754 690 HD13 ILE 91 2HD1 ILE 91 14.314 5.274 -1.228 691 H TYR 92 H TYR 92 8.459 2.716 1.135 692 HA TYR 92 HA TYR 92 8.532 4.064 3.773 693 HB2 TYR 92 1HB TYR 92 6.330 2.199 2.820 694 HB3 TYR 92 2HB TYR 92 6.282 3.289 4.186 695 HD1 TYR 92 2HD TYR 92 6.212 3.008 0.526 696 HD2 TYR 92 1HD TYR 92 5.488 5.574 3.899 697 HE1 TYR 92 2HE TYR 92 5.188 4.635 -0.967 698 HE2 TYR 92 1HE TYR 92 4.638 7.316 2.383 699 HH TYR 92 HH TYR 92 4.183 6.607 -1.130 700 H GLU 93 H GLU 93 9.696 3.127 5.214 701 HA GLU 93 HA GLU 93 9.671 0.144 5.361 702 HB2 GLU 93 1HB GLU 93 11.719 1.552 6.073 703 HB3 GLU 93 2HB GLU 93 10.750 2.175 7.388 704 HG2 GLU 93 1HG GLU 93 10.554 -0.199 8.252 705 HG3 GLU 93 2HG GLU 93 11.602 -0.711 6.920 706 H ILE 94 H ILE 94 8.074 -0.811 6.437 707 HA ILE 94 HA ILE 94 6.849 0.603 8.701 708 HB ILE 94 HB ILE 94 4.904 -0.855 8.639 709 HG12 ILE 94 1HG1 ILE 94 5.993 -1.846 5.982 710 HG13 ILE 94 2HG1 ILE 94 5.828 -2.759 7.474 711 HG21 ILE 94 1HG2 ILE 94 5.162 0.772 6.088 712 HG22 ILE 94 2HG2 ILE 94 3.649 0.316 6.915 713 HG23 ILE 94 3HG2 ILE 94 4.779 1.397 7.714 714 HD11 ILE 94 3HD1 ILE 94 3.506 -1.715 5.818 715 HD12 ILE 94 1HD1 ILE 94 4.047 -3.390 5.993 716 HD13 ILE 94 2HD1 ILE 94 3.370 -2.522 7.380 717 H GLU 95 H GLU 95 6.486 -0.983 10.470 718 HA GLU 95 HA GLU 95 8.637 -3.025 10.487 719 HB2 GLU 95 1HB GLU 95 7.596 -1.148 12.663 720 HB3 GLU 95 2HB GLU 95 8.782 -2.434 12.916 721 HG2 GLU 95 1HG GLU 95 10.257 -1.354 11.187 722 HG3 GLU 95 2HG GLU 95 9.144 0.012 11.148 723 H ASN 96 H ASN 96 5.666 -3.384 9.918 724 HA ASN 96 HA ASN 96 5.665 -5.921 11.151 725 HB2 ASN 96 1HB ASN 96 4.430 -4.291 12.840 726 HB3 ASN 96 2HB ASN 96 3.050 -4.565 11.783 727 HD21 ASN 96 1HD2 ASN 96 2.725 -5.302 14.278 728 HD22 ASN 96 2HD2 ASN 96 2.832 -7.021 14.518 729 H ASN 97 H ASN 97 3.648 -7.169 10.464 730 HA ASN 97 HA ASN 97 3.703 -7.068 7.578 731 HB2 ASN 97 1HB ASN 97 3.462 -9.243 8.769 732 HB3 ASN 97 2HB ASN 97 1.894 -8.735 9.370 733 HD21 ASN 97 1HD2 ASN 97 3.203 -8.295 5.951 734 HD22 ASN 97 2HD2 ASN 97 2.051 -9.436 5.306 735 H PHE 98 H PHE 98 2.504 -5.808 6.265 736 HA PHE 98 HA PHE 98 0.319 -4.226 7.078 737 HB2 PHE 98 1HB PHE 98 1.779 -3.763 5.097 738 HB3 PHE 98 2HB PHE 98 1.198 -5.227 4.351 739 HD1 PHE 98 1HD PHE 98 0.263 -1.716 5.209 740 HD2 PHE 98 2HD PHE 98 -0.949 -5.392 3.314 741 HE1 PHE 98 1HE PHE 98 -1.500 -0.487 3.966 742 HE2 PHE 98 2HE PHE 98 -2.634 -4.212 2.056 743 HZ PHE 98 HZ PHE 98 -2.942 -1.723 2.338 744 H GLU 99 H GLU 99 0.483 -7.417 5.435 745 HA GLU 99 HA GLU 99 -2.267 -7.545 4.839 746 HB2 GLU 99 1HB GLU 99 -0.047 -9.605 4.963 747 HB3 GLU 99 2HB GLU 99 -1.692 -9.999 4.434 748 HG2 GLU 99 1HG GLU 99 -1.639 -8.345 2.720 749 HG3 GLU 99 2HG GLU 99 -0.094 -7.681 3.202 750 H ASP 100 H ASP 100 -0.539 -8.582 7.798 751 HA ASP 100 HA ASP 100 -3.196 -9.369 8.862 752 HB2 ASP 100 1HB ASP 100 -0.836 -10.732 9.033 753 HB3 ASP 100 2HB ASP 100 -0.887 -9.915 10.594 754 H MET 101 H MET 101 -2.162 -6.542 8.424 755 HA MET 101 HA MET 101 -3.261 -5.713 11.037 756 HB2 MET 101 1HB MET 101 -2.326 -3.627 11.037 757 HB3 MET 101 2HB MET 101 -1.023 -4.730 10.603 758 HG2 MET 101 1HG MET 101 -1.153 -4.080 8.318 759 HG3 MET 101 2HG MET 101 -2.370 -2.873 8.681 760 HE1 MET 101 3HE MET 101 0.886 -0.679 8.098 761 HE2 MET 101 1HE MET 101 1.089 -2.334 7.498 762 HE3 MET 101 2HE MET 101 -0.463 -1.498 7.280 763 H ILE 102 H ILE 102 -3.595 -5.512 7.545 764 HA ILE 102 HA ILE 102 -5.692 -3.549 7.618 765 HB ILE 102 HB ILE 102 -6.045 -4.300 5.225 766 HG12 ILE 102 1HG1 ILE 102 -3.418 -5.559 4.908 767 HG13 ILE 102 2HG1 ILE 102 -4.444 -6.577 5.903 768 HG21 ILE 102 1HG2 ILE 102 -4.615 -2.391 5.987 769 HG22 ILE 102 2HG2 ILE 102 -3.216 -3.485 6.054 770 HG23 ILE 102 3HG2 ILE 102 -4.031 -3.158 4.504 771 HD11 ILE 102 3HD1 ILE 102 -5.080 -5.524 3.128 772 HD12 ILE 102 1HD1 ILE 102 -4.657 -7.193 3.562 773 HD13 ILE 102 2HD1 ILE 102 -6.175 -6.486 4.146 Start of MODEL 6 1 H1 GLY 1 H GLY 1 3.721 14.867 6.868 2 HA2 GLY 1 1HA GLY 1 5.620 12.603 7.175 3 HA3 GLY 1 2HA GLY 1 4.495 13.149 8.439 4 H SER 2 H SER 2 4.502 10.468 7.401 5 HA SER 2 HA SER 2 3.526 8.889 6.267 6 HB2 SER 2 1HB SER 2 1.013 8.907 6.240 7 HB3 SER 2 2HB SER 2 1.823 9.148 7.791 8 HG SER 2 HG SER 2 1.322 11.531 6.688 9 HA PRO 3 HA PRO 3 2.985 9.690 1.876 10 HB2 PRO 3 1HB PRO 3 0.937 7.950 1.121 11 HB3 PRO 3 2HB PRO 3 2.641 7.497 1.314 12 HG2 PRO 3 1HG PRO 3 0.402 7.155 3.239 13 HG3 PRO 3 2HG PRO 3 1.746 6.018 2.833 14 HD2 PRO 3 1HD PRO 3 1.805 7.495 5.098 15 HD3 PRO 3 2HD PRO 3 3.250 7.122 4.169 16 H ILE 4 H ILE 4 1.121 10.121 0.274 17 HA ILE 4 HA ILE 4 -0.896 11.896 1.550 18 HB ILE 4 HB ILE 4 0.507 12.239 -1.128 19 HG12 ILE 4 1HG1 ILE 4 0.814 13.690 1.556 20 HG13 ILE 4 2HG1 ILE 4 2.029 12.680 0.776 21 HG21 ILE 4 1HG2 ILE 4 -1.843 13.046 -1.101 22 HG22 ILE 4 2HG2 ILE 4 -1.509 13.994 0.370 23 HG23 ILE 4 3HG2 ILE 4 -0.712 14.387 -1.170 24 HD11 ILE 4 3HD1 ILE 4 2.647 14.960 0.473 25 HD12 ILE 4 1HD1 ILE 4 2.189 14.284 -1.097 26 HD13 ILE 4 2HD1 ILE 4 1.078 15.377 -0.229 27 H LEU 5 H LEU 5 -2.756 10.781 1.520 28 HA LEU 5 HA LEU 5 -3.377 8.934 -0.725 29 HB2 LEU 5 1HB LEU 5 -4.605 7.584 1.046 30 HB3 LEU 5 2HB LEU 5 -2.865 7.487 1.053 31 HG LEU 5 HG LEU 5 -4.029 9.584 2.844 32 HD11 LEU 5 1HD1 LEU 5 -4.608 7.955 4.616 33 HD12 LEU 5 2HD1 LEU 5 -4.458 6.630 3.440 34 HD13 LEU 5 3HD1 LEU 5 -5.693 7.902 3.234 35 HD21 LEU 5 3HD2 LEU 5 -1.570 8.901 2.697 36 HD22 LEU 5 1HD2 LEU 5 -2.037 7.335 3.385 37 HD23 LEU 5 2HD2 LEU 5 -2.269 8.835 4.318 38 HA PRO 6 HA PRO 6 -7.179 11.071 -1.156 39 HB2 PRO 6 1HB PRO 6 -8.867 9.125 -2.138 40 HB3 PRO 6 2HB PRO 6 -7.451 9.710 -3.041 41 HG2 PRO 6 1HG PRO 6 -7.662 7.273 -1.267 42 HG3 PRO 6 2HG PRO 6 -7.088 7.364 -2.971 43 HD2 PRO 6 1HD PRO 6 -5.351 7.410 -0.936 44 HD3 PRO 6 2HD PRO 6 -5.105 8.483 -2.336 45 H LYS 7 H LYS 7 -9.532 11.380 -0.262 46 HA LYS 7 HA LYS 7 -9.686 10.753 2.430 47 HB2 LYS 7 1HB LYS 7 -12.042 11.277 0.552 48 HB3 LYS 7 2HB LYS 7 -11.923 11.600 2.274 49 HG2 LYS 7 1HG LYS 7 -9.811 13.107 1.251 50 HG3 LYS 7 2HG LYS 7 -11.001 13.180 -0.067 51 HD2 LYS 7 1HD LYS 7 -11.560 13.730 2.828 52 HD3 LYS 7 2HD LYS 7 -11.115 15.020 1.704 53 HE2 LYS 7 1HE LYS 7 -13.102 14.839 0.445 54 HE3 LYS 7 2HE LYS 7 -13.500 13.247 1.088 55 HZ1 LYS 7 3HZ LYS 7 -13.443 15.546 2.923 56 HZ2 LYS 7 1HZ LYS 7 -14.381 14.176 2.998 57 HZ3 LYS 7 2HZ LYS 7 -14.726 15.343 1.950 58 H ALA 8 H ALA 8 -10.754 9.150 3.628 59 HA ALA 8 HA ALA 8 -11.277 6.636 2.475 60 HB1 ALA 8 1HB ALA 8 -12.354 6.115 4.654 61 HB2 ALA 8 2HB ALA 8 -10.818 6.978 4.888 62 HB3 ALA 8 3HB ALA 8 -12.366 7.839 5.065 63 H GLU 9 H GLU 9 -13.335 9.433 2.364 64 HA GLU 9 HA GLU 9 -15.743 7.786 1.886 65 HB2 GLU 9 1HB GLU 9 -16.952 9.852 1.921 66 HB3 GLU 9 2HB GLU 9 -15.778 9.904 3.248 67 HG2 GLU 9 1HG GLU 9 -14.214 11.164 1.654 68 HG3 GLU 9 2HG GLU 9 -15.556 11.255 0.512 69 H ASN 10 H ASN 10 -13.314 9.590 -0.093 70 HA ASN 10 HA ASN 10 -15.155 9.593 -2.398 71 HB2 ASN 10 1HB ASN 10 -13.779 11.129 -3.386 72 HB3 ASN 10 2HB ASN 10 -13.689 11.605 -1.667 73 HD21 ASN 10 1HD2 ASN 10 -11.635 9.152 -1.320 74 HD22 ASN 10 2HD2 ASN 10 -10.225 9.935 -1.944 75 H VAL 11 H VAL 11 -13.190 7.528 -0.988 76 HA VAL 11 HA VAL 11 -12.155 5.951 -3.140 77 HB VAL 11 HB VAL 11 -12.575 5.828 -0.132 78 HG11 VAL 11 1HG1 VAL 11 -11.030 3.547 -0.790 79 HG12 VAL 11 2HG1 VAL 11 -12.637 3.600 -0.073 80 HG13 VAL 11 3HG1 VAL 11 -12.461 3.443 -1.814 81 HG21 VAL 11 3HG2 VAL 11 -10.153 5.729 -0.068 82 HG22 VAL 11 1HG2 VAL 11 -10.079 5.556 -1.833 83 HG23 VAL 11 2HG2 VAL 11 -10.617 7.069 -1.131 84 H ASP 12 H ASP 12 -13.410 4.924 -4.444 85 HA ASP 12 HA ASP 12 -16.235 4.287 -4.012 86 HB2 ASP 12 1HB ASP 12 -15.481 4.949 -6.233 87 HB3 ASP 12 2HB ASP 12 -14.217 3.730 -6.233 88 H SER 13 H SER 13 -13.146 2.367 -4.745 89 HA SER 13 HA SER 13 -13.868 0.580 -2.551 90 HB2 SER 13 1HB SER 13 -13.934 -1.427 -4.093 91 HB3 SER 13 2HB SER 13 -15.366 -0.396 -4.016 92 HG SER 13 HG SER 13 -14.883 0.507 -5.945 93 H ILE 14 H ILE 14 -12.146 -1.083 -2.214 94 HA ILE 14 HA ILE 14 -9.515 -0.349 -3.423 95 HB ILE 14 HB ILE 14 -10.280 -0.871 -0.528 96 HG12 ILE 14 1HG1 ILE 14 -8.558 1.304 -1.785 97 HG13 ILE 14 2HG1 ILE 14 -10.285 1.454 -1.552 98 HG21 ILE 14 1HG2 ILE 14 -8.335 -2.289 -0.918 99 HG22 ILE 14 2HG2 ILE 14 -7.474 -0.968 -1.738 100 HG23 ILE 14 3HG2 ILE 14 -7.821 -0.890 -0.001 101 HD11 ILE 14 3HD1 ILE 14 -8.217 1.196 0.651 102 HD12 ILE 14 1HD1 ILE 14 -9.213 2.590 0.241 103 HD13 ILE 14 2HD1 ILE 14 -9.980 1.140 0.916 104 H CYS 15 H CYS 15 -8.434 -2.015 -4.199 105 HA CYS 15 HA CYS 15 -9.581 -4.754 -3.878 106 HB2 CYS 15 1HB CYS 15 -9.831 -3.708 -6.204 107 HB3 CYS 15 2HB CYS 15 -8.052 -3.725 -6.304 108 HG CYS 15 HG CYS 15 -9.062 -5.687 -7.652 109 H ILE 16 H ILE 16 -8.128 -6.210 -3.070 110 HA ILE 16 HA ILE 16 -5.242 -5.579 -3.079 111 HB ILE 16 HB ILE 16 -6.759 -6.545 -0.625 112 HG12 ILE 16 1HG1 ILE 16 -5.587 -3.864 -1.427 113 HG13 ILE 16 2HG1 ILE 16 -7.240 -4.218 -0.927 114 HG21 ILE 16 1HG2 ILE 16 -3.809 -5.905 -0.993 115 HG22 ILE 16 2HG2 ILE 16 -4.590 -6.397 0.528 116 HG23 ILE 16 3HG2 ILE 16 -4.502 -7.526 -0.820 117 HD11 ILE 16 3HD1 ILE 16 -4.776 -4.115 0.804 118 HD12 ILE 16 1HD1 ILE 16 -6.113 -2.977 0.789 119 HD13 ILE 16 2HD1 ILE 16 -6.385 -4.631 1.399 120 H ASP 17 H ASP 17 -4.788 -7.035 -4.586 121 HA ASP 17 HA ASP 17 -5.689 -9.849 -4.401 122 HB2 ASP 17 1HB ASP 17 -4.149 -8.196 -6.376 123 HB3 ASP 17 2HB ASP 17 -3.808 -9.917 -6.291 124 H PHE 18 H PHE 18 -4.589 -11.051 -2.968 125 HA PHE 18 HA PHE 18 -2.317 -10.067 -1.430 126 HB2 PHE 18 1HB PHE 18 -4.015 -12.597 -1.480 127 HB3 PHE 18 2HB PHE 18 -2.597 -12.482 -0.488 128 HD1 PHE 18 1HD PHE 18 -5.776 -10.485 -1.125 129 HD2 PHE 18 2HD PHE 18 -2.801 -11.778 1.729 130 HE1 PHE 18 1HE PHE 18 -7.023 -9.390 0.677 131 HE2 PHE 18 2HE PHE 18 -4.117 -10.753 3.551 132 HZ PHE 18 HZ PHE 18 -6.239 -9.562 3.049 133 H THR 19 H THR 19 -0.520 -12.012 -1.114 134 HA THR 19 HA THR 19 1.024 -12.122 -3.466 135 HB THR 19 HB THR 19 2.254 -13.935 -2.083 136 HG1 THR 19 1HG THR 19 1.074 -14.713 -0.563 137 HG21 THR 19 3HG2 THR 19 2.979 -11.613 -2.042 138 HG22 THR 19 1HG2 THR 19 3.084 -12.308 -0.421 139 HG23 THR 19 2HG2 THR 19 1.747 -11.204 -0.820 140 H ASN 20 H ASN 20 -1.175 -14.710 -2.036 141 HA ASN 20 HA ASN 20 -0.566 -16.581 -4.083 142 HB2 ASN 20 1HB ASN 20 -1.214 -16.995 -1.670 143 HB3 ASN 20 2HB ASN 20 -2.815 -16.351 -2.042 144 HD21 ASN 20 1HD2 ASN 20 -3.826 -18.371 -1.575 145 HD22 ASN 20 2HD2 ASN 20 -3.724 -19.629 -2.822 146 H SER 21 H SER 21 -2.999 -17.520 -4.940 147 HA SER 21 HA SER 21 -3.582 -15.818 -7.126 148 HB2 SER 21 1HB SER 21 -5.043 -17.696 -7.719 149 HB3 SER 21 2HB SER 21 -3.483 -18.275 -7.134 150 HG SER 21 HG SER 21 -6.033 -18.451 -6.020 151 H ILE 22 H ILE 22 -4.530 -14.993 -4.206 152 HA ILE 22 HA ILE 22 -7.478 -14.962 -4.496 153 HB ILE 22 HB ILE 22 -5.662 -14.939 -2.051 154 HG12 ILE 22 1HG1 ILE 22 -5.523 -17.097 -3.247 155 HG13 ILE 22 2HG1 ILE 22 -6.178 -17.178 -1.626 156 HG21 ILE 22 1HG2 ILE 22 -7.705 -15.626 -0.764 157 HG22 ILE 22 2HG2 ILE 22 -7.716 -13.974 -1.357 158 HG23 ILE 22 3HG2 ILE 22 -8.679 -15.213 -2.193 159 HD11 ILE 22 3HD1 ILE 22 -7.892 -17.248 -4.121 160 HD12 ILE 22 1HD1 ILE 22 -7.309 -18.694 -3.269 161 HD13 ILE 22 2HD1 ILE 22 -8.423 -17.583 -2.456 162 H GLN 23 H GLN 23 -8.535 -13.094 -3.785 163 HA GLN 23 HA GLN 23 -7.024 -10.746 -3.048 164 HB2 GLN 23 1HB GLN 23 -7.828 -9.735 -4.827 165 HB3 GLN 23 2HB GLN 23 -7.770 -11.285 -5.590 166 HG2 GLN 23 1HG GLN 23 -10.245 -11.528 -4.971 167 HG3 GLN 23 2HG GLN 23 -10.159 -9.815 -4.495 168 HE21 GLN 23 1HE2 GLN 23 -8.334 -9.026 -6.867 169 HE22 GLN 23 2HE2 GLN 23 -9.466 -8.965 -8.145 170 H LYS 24 H LYS 24 -8.423 -9.092 -2.087 171 HA LYS 24 HA LYS 24 -11.211 -9.838 -1.459 172 HB2 LYS 24 1HB LYS 24 -9.269 -9.984 0.480 173 HB3 LYS 24 2HB LYS 24 -9.706 -8.300 0.623 174 HG2 LYS 24 1HG LYS 24 -11.554 -10.711 0.811 175 HG3 LYS 24 2HG LYS 24 -10.818 -9.866 2.164 176 HD2 LYS 24 1HD LYS 24 -12.891 -8.637 0.312 177 HD3 LYS 24 2HD LYS 24 -13.224 -9.420 1.853 178 HE2 LYS 24 1HE LYS 24 -11.710 -7.752 2.992 179 HE3 LYS 24 2HE LYS 24 -11.577 -6.899 1.449 180 HZ1 LYS 24 3HZ LYS 24 -14.123 -7.406 2.858 181 HZ2 LYS 24 1HZ LYS 24 -13.888 -6.479 1.510 182 HZ3 LYS 24 2HZ LYS 24 -13.267 -6.016 2.972 183 H ILE 25 H ILE 25 -12.596 -8.020 -1.735 184 HA ILE 25 HA ILE 25 -11.292 -5.436 -2.337 185 HB ILE 25 HB ILE 25 -14.004 -6.425 -3.290 186 HG12 ILE 25 1HG1 ILE 25 -12.691 -5.887 -5.587 187 HG13 ILE 25 2HG1 ILE 25 -11.287 -6.305 -4.615 188 HG21 ILE 25 1HG2 ILE 25 -12.515 -3.829 -3.906 189 HG22 ILE 25 2HG2 ILE 25 -14.050 -4.338 -4.596 190 HG23 ILE 25 3HG2 ILE 25 -13.975 -3.979 -2.885 191 HD11 ILE 25 3HD1 ILE 25 -12.209 -8.191 -5.936 192 HD12 ILE 25 1HD1 ILE 25 -12.257 -8.554 -4.202 193 HD13 ILE 25 2HD1 ILE 25 -13.743 -8.062 -5.053 194 H TYR 26 H TYR 26 -12.001 -3.706 -1.169 195 HA TYR 26 HA TYR 26 -13.704 -4.225 1.237 196 HB2 TYR 26 1HB TYR 26 -11.413 -2.249 0.962 197 HB3 TYR 26 2HB TYR 26 -12.344 -2.561 2.404 198 HD1 TYR 26 2HD TYR 26 -9.988 -4.025 -0.061 199 HD2 TYR 26 1HD TYR 26 -11.577 -4.427 3.961 200 HE1 TYR 26 2HE TYR 26 -8.526 -5.939 0.335 201 HE2 TYR 26 1HE TYR 26 -10.018 -6.282 4.366 202 HH TYR 26 HH TYR 26 -7.661 -7.416 1.979 203 H ASP 27 H ASP 27 -15.643 -3.330 0.779 204 HA ASP 27 HA ASP 27 -15.891 -0.762 -0.667 205 HB2 ASP 27 1HB ASP 27 -16.078 -2.513 -2.371 206 HB3 ASP 27 2HB ASP 27 -17.271 -3.378 -1.400 207 H ASP 28 H ASP 28 -15.779 -1.179 1.972 208 HA ASP 28 HA ASP 28 -18.501 -1.008 3.045 209 HB2 ASP 28 1HB ASP 28 -16.512 -2.452 4.744 210 HB3 ASP 28 2HB ASP 28 -18.224 -2.590 4.676 211 H SER 29 H SER 29 -18.474 0.879 4.261 212 HA SER 29 HA SER 29 -16.364 2.667 4.139 213 HB2 SER 29 1HB SER 29 -18.830 3.051 4.653 214 HB3 SER 29 2HB SER 29 -18.452 2.655 6.343 215 HG SER 29 HG SER 29 -17.422 4.758 4.744 216 H GLU 30 H GLU 30 -17.051 0.383 6.801 217 HA GLU 30 HA GLU 30 -15.013 1.500 8.537 218 HB2 GLU 30 1HB GLU 30 -17.134 0.561 9.278 219 HB3 GLU 30 2HB GLU 30 -16.702 -1.013 8.639 220 HG2 GLU 30 1HG GLU 30 -14.889 0.282 10.671 221 HG3 GLU 30 2HG GLU 30 -16.436 -0.344 11.213 222 H SER 31 H SER 31 -15.177 -1.160 6.198 223 HA SER 31 HA SER 31 -12.608 -2.447 6.618 224 HB2 SER 31 1HB SER 31 -14.407 -2.198 4.206 225 HB3 SER 31 2HB SER 31 -12.880 -3.018 4.277 226 HG SER 31 HG SER 31 -14.557 -3.738 6.339 227 H ILE 32 H ILE 32 -13.706 0.384 4.744 228 HA ILE 32 HA ILE 32 -11.163 0.953 3.561 229 HB ILE 32 HB ILE 32 -13.647 2.686 4.011 230 HG12 ILE 32 1HG1 ILE 32 -12.501 1.443 1.553 231 HG13 ILE 32 2HG1 ILE 32 -13.660 0.541 2.481 232 HG21 ILE 32 1HG2 ILE 32 -11.128 3.197 2.354 233 HG22 ILE 32 2HG2 ILE 32 -12.608 4.172 2.275 234 HG23 ILE 32 3HG2 ILE 32 -11.661 4.134 3.758 235 HD11 ILE 32 3HD1 ILE 32 -14.688 1.672 0.496 236 HD12 ILE 32 1HD1 ILE 32 -15.444 2.082 2.053 237 HD13 ILE 32 2HD1 ILE 32 -14.366 3.242 1.269 238 H GLN 33 H GLN 33 -12.888 2.475 6.348 239 HA GLN 33 HA GLN 33 -10.862 4.227 7.144 240 HB2 GLN 33 1HB GLN 33 -13.111 2.785 8.535 241 HB3 GLN 33 2HB GLN 33 -11.902 3.539 9.554 242 HG2 GLN 33 1HG GLN 33 -12.818 5.342 7.371 243 HG3 GLN 33 2HG GLN 33 -14.113 4.799 8.430 244 HE21 GLN 33 1HE2 GLN 33 -10.638 6.026 8.786 245 HE22 GLN 33 2HE2 GLN 33 -11.025 6.941 10.202 246 H LYS 34 H LYS 34 -11.169 0.743 7.953 247 HA LYS 34 HA LYS 34 -8.941 0.668 9.717 248 HB2 LYS 34 1HB LYS 34 -10.802 -1.060 9.349 249 HB3 LYS 34 2HB LYS 34 -9.868 -1.648 7.988 250 HG2 LYS 34 1HG LYS 34 -8.224 -1.302 10.429 251 HG3 LYS 34 2HG LYS 34 -9.612 -2.337 10.732 252 HD2 LYS 34 1HD LYS 34 -7.748 -2.769 8.385 253 HD3 LYS 34 2HD LYS 34 -7.452 -3.450 10.004 254 HE2 LYS 34 1HE LYS 34 -10.137 -3.956 8.755 255 HE3 LYS 34 2HE LYS 34 -8.719 -4.811 8.138 256 HZ1 LYS 34 3HZ LYS 34 -9.725 -4.944 10.915 257 HZ2 LYS 34 1HZ LYS 34 -8.263 -5.535 10.440 258 HZ3 LYS 34 2HZ LYS 34 -9.606 -6.151 9.815 259 H ILE 35 H ILE 35 -9.027 -0.263 6.181 260 HA ILE 35 HA ILE 35 -6.302 -0.601 5.926 261 HB ILE 35 HB ILE 35 -8.499 0.276 3.978 262 HG12 ILE 35 1HG1 ILE 35 -6.930 -2.294 4.382 263 HG13 ILE 35 2HG1 ILE 35 -8.547 -1.981 4.953 264 HG21 ILE 35 1HG2 ILE 35 -6.951 -0.201 2.072 265 HG22 ILE 35 2HG2 ILE 35 -6.489 1.198 2.989 266 HG23 ILE 35 3HG2 ILE 35 -5.612 -0.339 3.228 267 HD11 ILE 35 3HD1 ILE 35 -7.787 -2.162 2.009 268 HD12 ILE 35 1HD1 ILE 35 -8.608 -3.360 2.979 269 HD13 ILE 35 2HD1 ILE 35 -9.398 -1.792 2.652 270 H LEU 36 H LEU 36 -8.123 2.466 5.402 271 HA LEU 36 HA LEU 36 -5.993 3.948 4.330 272 HB2 LEU 36 1HB LEU 36 -8.463 4.710 5.905 273 HB3 LEU 36 2HB LEU 36 -7.349 5.926 5.350 274 HG LEU 36 HG LEU 36 -9.560 5.008 4.006 275 HD11 LEU 36 1HD1 LEU 36 -8.833 6.369 2.131 276 HD12 LEU 36 2HD1 LEU 36 -7.158 6.315 2.708 277 HD13 LEU 36 3HD1 LEU 36 -8.411 7.151 3.651 278 HD21 LEU 36 3HD2 LEU 36 -8.552 2.899 3.215 279 HD22 LEU 36 1HD2 LEU 36 -7.209 3.808 2.474 280 HD23 LEU 36 2HD2 LEU 36 -8.867 4.017 1.897 281 H SER 37 H SER 37 -6.305 2.907 7.636 282 HA SER 37 HA SER 37 -4.482 4.825 8.792 283 HB2 SER 37 1HB SER 37 -6.185 2.622 9.615 284 HB3 SER 37 2HB SER 37 -4.554 2.328 10.172 285 HG SER 37 HG SER 37 -5.875 3.677 11.597 286 H GLU 38 H GLU 38 -4.077 1.315 7.753 287 HA GLU 38 HA GLU 38 -1.260 1.478 8.194 288 HB2 GLU 38 1HB GLU 38 -2.479 -0.487 6.265 289 HB3 GLU 38 2HB GLU 38 -1.062 -0.678 7.295 290 HG2 GLU 38 1HG GLU 38 -3.985 -0.702 8.028 291 HG3 GLU 38 2HG GLU 38 -2.833 -2.036 8.133 292 H ILE 39 H ILE 39 -3.255 2.087 5.353 293 HA ILE 39 HA ILE 39 -1.242 2.311 3.372 294 HB ILE 39 HB ILE 39 -3.788 3.912 3.801 295 HG12 ILE 39 1HG1 ILE 39 -4.085 1.453 3.427 296 HG13 ILE 39 2HG1 ILE 39 -4.835 2.465 2.195 297 HG21 ILE 39 1HG2 ILE 39 -2.483 5.248 2.294 298 HG22 ILE 39 2HG2 ILE 39 -2.065 3.821 1.317 299 HG23 ILE 39 3HG2 ILE 39 -3.745 4.424 1.370 300 HD11 ILE 39 3HD1 ILE 39 -2.193 0.996 1.888 301 HD12 ILE 39 1HD1 ILE 39 -3.761 0.418 1.302 302 HD13 ILE 39 2HD1 ILE 39 -3.054 1.882 0.609 303 H ALA 40 H ALA 40 -1.782 4.311 6.212 304 HA ALA 40 HA ALA 40 0.034 6.418 5.182 305 HB1 ALA 40 1HB ALA 40 -1.245 7.965 6.472 306 HB2 ALA 40 2HB ALA 40 -2.466 6.927 5.699 307 HB3 ALA 40 3HB ALA 40 -2.028 6.665 7.394 308 H THR 41 H THR 41 0.247 3.744 7.168 309 HA THR 41 HA THR 41 1.226 5.075 9.531 310 HB THR 41 HB THR 41 -0.049 2.896 9.348 311 HG1 THR 41 1HG THR 41 0.733 2.304 11.246 312 HG21 THR 41 3HG2 THR 41 1.562 1.772 7.752 313 HG22 THR 41 1HG2 THR 41 1.208 0.845 9.223 314 HG23 THR 41 2HG2 THR 41 2.742 1.729 9.074 315 H GLY 42 H GLY 42 2.788 3.879 6.561 316 HA2 GLY 42 1HA GLY 42 5.441 3.793 7.758 317 HA3 GLY 42 2HA GLY 42 4.983 3.492 6.075 318 H LYS 43 H LYS 43 7.226 4.932 6.713 319 HA LYS 43 HA LYS 43 6.556 7.653 5.669 320 HB2 LYS 43 1HB LYS 43 8.501 6.756 7.807 321 HB3 LYS 43 2HB LYS 43 8.873 8.160 6.805 322 HG2 LYS 43 1HG LYS 43 6.731 9.245 7.451 323 HG3 LYS 43 2HG LYS 43 6.325 7.863 8.457 324 HD2 LYS 43 1HD LYS 43 7.154 9.588 9.897 325 HD3 LYS 43 2HD LYS 43 8.378 8.312 9.839 326 HE2 LYS 43 1HE LYS 43 9.623 9.653 8.104 327 HE3 LYS 43 2HE LYS 43 8.413 10.936 8.255 328 HZ1 LYS 43 3HZ LYS 43 10.141 9.980 10.453 329 HZ2 LYS 43 1HZ LYS 43 9.104 11.242 10.544 330 HZ3 LYS 43 2HZ LYS 43 10.427 11.340 9.562 331 H ARG 44 H ARG 44 7.279 7.780 3.649 332 HA ARG 44 HA ARG 44 9.115 5.981 2.405 333 HB2 ARG 44 1HB ARG 44 9.068 7.573 0.512 334 HB3 ARG 44 2HB ARG 44 7.515 7.028 1.086 335 HG2 ARG 44 1HG ARG 44 7.625 9.347 2.507 336 HG3 ARG 44 2HG ARG 44 8.726 9.791 1.175 337 HD2 ARG 44 1HD ARG 44 7.007 8.898 -0.404 338 HD3 ARG 44 2HD ARG 44 5.911 8.643 0.947 339 HE ARG 44 HE ARG 44 6.663 11.386 0.901 340 HH11 ARG 44 1HH1 ARG 44 4.612 8.936 -0.695 341 HH12 ARG 44 2HH1 ARG 44 3.496 10.063 -1.366 342 HH21 ARG 44 1HH2 ARG 44 5.255 12.957 -0.218 343 HH22 ARG 44 2HH2 ARG 44 4.086 12.363 -1.351 344 H THR 45 H THR 45 9.782 8.133 4.663 345 HA THR 45 HA THR 45 11.487 9.276 5.475 346 HB THR 45 HB THR 45 13.530 8.243 5.606 347 HG1 THR 45 1HG THR 45 14.473 6.977 4.160 348 HG21 THR 45 3HG2 THR 45 11.761 5.894 4.814 349 HG22 THR 45 1HG2 THR 45 11.685 6.742 6.373 350 HG23 THR 45 2HG2 THR 45 13.156 5.887 5.904 351 H GLU 46 H GLU 46 13.840 10.238 4.708 352 HA GLU 46 HA GLU 46 13.168 12.216 2.642 353 HB2 GLU 46 1HB GLU 46 15.435 11.843 4.629 354 HB3 GLU 46 2HB GLU 46 15.363 13.182 3.487 355 HG2 GLU 46 1HG GLU 46 13.151 12.640 5.514 356 HG3 GLU 46 2HG GLU 46 14.547 13.647 5.841 357 H LYS 47 H LYS 47 14.296 9.089 2.330 358 HA LYS 47 HA LYS 47 16.441 9.588 0.410 359 HB2 LYS 47 1HB LYS 47 14.684 7.143 1.016 360 HB3 LYS 47 2HB LYS 47 15.943 7.161 -0.204 361 HG2 LYS 47 1HG LYS 47 16.507 7.820 2.697 362 HG3 LYS 47 2HG LYS 47 16.542 6.177 2.084 363 HD2 LYS 47 1HD LYS 47 18.258 8.304 0.757 364 HD3 LYS 47 2HD LYS 47 18.732 7.574 2.298 365 HE2 LYS 47 1HE LYS 47 18.613 5.335 1.339 366 HE3 LYS 47 2HE LYS 47 18.156 5.979 -0.239 367 HZ1 LYS 47 3HZ LYS 47 20.672 6.818 1.068 368 HZ2 LYS 47 1HZ LYS 47 20.325 6.819 -0.543 369 HZ3 LYS 47 2HZ LYS 47 20.591 5.417 0.241 370 H GLN 48 H GLN 48 16.109 8.869 -1.871 371 HA GLN 48 HA GLN 48 13.478 9.696 -2.965 372 HB2 GLN 48 1HB GLN 48 14.730 10.408 -4.979 373 HB3 GLN 48 2HB GLN 48 15.072 11.371 -3.540 374 HG2 GLN 48 1HG GLN 48 17.228 10.161 -3.231 375 HG3 GLN 48 2HG GLN 48 16.828 9.127 -4.613 376 HE21 GLN 48 1HE2 GLN 48 16.500 12.684 -4.210 377 HE22 GLN 48 2HE2 GLN 48 17.453 13.084 -5.626 378 H SER 49 H SER 49 12.990 8.564 -5.089 379 HA SER 49 HA SER 49 13.762 5.751 -4.869 380 HB2 SER 49 1HB SER 49 10.902 6.496 -5.349 381 HB3 SER 49 2HB SER 49 11.605 5.180 -4.386 382 HG SER 49 HG SER 49 11.343 7.926 -3.734 383 H ILE 50 H ILE 50 13.401 4.671 -6.960 384 HA ILE 50 HA ILE 50 13.449 6.522 -9.276 385 HB ILE 50 HB ILE 50 15.664 5.686 -9.927 386 HG12 ILE 50 1HG1 ILE 50 16.265 4.597 -7.184 387 HG13 ILE 50 2HG1 ILE 50 15.323 3.564 -8.249 388 HG21 ILE 50 1HG2 ILE 50 15.870 6.937 -7.155 389 HG22 ILE 50 2HG2 ILE 50 17.035 7.027 -8.483 390 HG23 ILE 50 3HG2 ILE 50 15.467 7.824 -8.630 391 HD11 ILE 50 3HD1 ILE 50 17.010 3.624 -9.977 392 HD12 ILE 50 1HD1 ILE 50 17.991 4.767 -9.038 393 HD13 ILE 50 2HD1 ILE 50 17.731 3.122 -8.429 394 H GLN 51 H GLN 51 11.750 4.176 -8.311 395 HA GLN 51 HA GLN 51 12.078 2.396 -10.678 396 HB2 GLN 51 1HB GLN 51 11.362 0.532 -8.901 397 HB3 GLN 51 2HB GLN 51 13.037 0.918 -9.215 398 HG2 GLN 51 1HG GLN 51 13.163 2.342 -7.237 399 HG3 GLN 51 2HG GLN 51 11.439 2.143 -6.938 400 HE21 GLN 51 1HE2 GLN 51 10.756 -0.299 -6.735 401 HE22 GLN 51 2HE2 GLN 51 11.756 -1.151 -5.575 402 H ASP 52 H ASP 52 10.162 1.068 -10.988 403 HA ASP 52 HA ASP 52 7.631 2.543 -10.309 404 HB2 ASP 52 1HB ASP 52 8.866 1.816 -12.853 405 HB3 ASP 52 2HB ASP 52 7.311 1.034 -12.716 406 H TYR 53 H TYR 53 9.207 -0.299 -9.587 407 HA TYR 53 HA TYR 53 6.770 -1.818 -9.078 408 HB2 TYR 53 1HB TYR 53 8.931 -2.602 -11.067 409 HB3 TYR 53 2HB TYR 53 8.146 -3.853 -10.149 410 HD1 TYR 53 1HD TYR 53 7.668 -1.308 -12.758 411 HD2 TYR 53 2HD TYR 53 5.726 -4.389 -10.445 412 HE1 TYR 53 1HE TYR 53 5.701 -1.235 -14.284 413 HE2 TYR 53 2HE TYR 53 3.818 -4.366 -11.993 414 HH TYR 53 HH TYR 53 2.762 -2.605 -13.703 415 HA PRO 54 HA PRO 54 9.312 -2.974 -5.611 416 HB2 PRO 54 1HB PRO 54 8.533 -5.504 -4.948 417 HB3 PRO 54 2HB PRO 54 7.435 -4.094 -4.820 418 HG2 PRO 54 1HG PRO 54 7.578 -6.088 -7.078 419 HG3 PRO 54 2HG PRO 54 6.143 -5.524 -6.147 420 HD2 PRO 54 1HD PRO 54 6.868 -4.436 -8.544 421 HD3 PRO 54 2HD PRO 54 6.133 -3.450 -7.257 422 H SER 55 H SER 55 10.886 -4.836 -4.843 423 HA SER 55 HA SER 55 12.458 -5.849 -7.147 424 HB2 SER 55 1HB SER 55 14.262 -5.851 -5.377 425 HB3 SER 55 2HB SER 55 13.650 -4.260 -5.850 426 HG SER 55 HG SER 55 13.822 -4.493 -3.571 427 H ALA 56 H ALA 56 10.219 -6.913 -4.877 428 HA ALA 56 HA ALA 56 11.513 -9.483 -4.231 429 HB1 ALA 56 1HB ALA 56 9.486 -9.876 -2.899 430 HB2 ALA 56 2HB ALA 56 10.199 -8.302 -2.512 431 HB3 ALA 56 3HB ALA 56 8.753 -8.403 -3.558 432 H GLU 57 H GLU 57 10.471 -11.502 -4.683 433 HA GLU 57 HA GLU 57 9.134 -11.567 -7.337 434 HB2 GLU 57 1HB GLU 57 11.022 -13.281 -5.900 435 HB3 GLU 57 2HB GLU 57 9.621 -14.213 -6.420 436 HG2 GLU 57 1HG GLU 57 11.259 -12.424 -8.245 437 HG3 GLU 57 2HG GLU 57 11.485 -14.169 -8.074 438 H GLU 58 H GLU 58 8.244 -11.723 -4.021 439 HA GLU 58 HA GLU 58 5.554 -12.711 -4.792 440 HB2 GLU 58 1HB GLU 58 7.301 -13.649 -2.520 441 HB3 GLU 58 2HB GLU 58 5.549 -13.515 -2.268 442 HG2 GLU 58 1HG GLU 58 5.020 -15.008 -4.014 443 HG3 GLU 58 2HG GLU 58 6.652 -14.966 -4.689 444 H TYR 59 H TYR 59 4.314 -10.974 -4.734 445 HA TYR 59 HA TYR 59 4.273 -9.221 -2.409 446 HB2 TYR 59 1HB TYR 59 4.337 -7.199 -3.868 447 HB3 TYR 59 2HB TYR 59 5.861 -8.063 -3.795 448 HD1 TYR 59 1HD TYR 59 2.917 -7.285 -5.920 449 HD2 TYR 59 2HD TYR 59 6.867 -9.007 -5.772 450 HE1 TYR 59 1HE TYR 59 3.047 -7.179 -8.386 451 HE2 TYR 59 2HE TYR 59 7.007 -8.926 -8.235 452 HH TYR 59 HH TYR 59 5.470 -8.820 -10.163 453 H GLY 60 H GLY 60 2.271 -7.916 -2.429 454 HA2 GLY 60 1HA GLY 60 0.058 -9.096 -4.043 455 HA3 GLY 60 2HA GLY 60 -0.100 -8.247 -2.495 456 H THR 61 H THR 61 -1.663 -7.392 -4.491 457 HA THR 61 HA THR 61 -0.405 -5.034 -5.800 458 HB THR 61 HB THR 61 -2.327 -7.134 -6.904 459 HG1 THR 61 1HG THR 61 -0.551 -7.797 -8.082 460 HG21 THR 61 3HG2 THR 61 -2.791 -4.993 -7.967 461 HG22 THR 61 1HG2 THR 61 -1.841 -5.959 -9.097 462 HG23 THR 61 2HG2 THR 61 -1.062 -4.655 -8.172 463 H ILE 62 H ILE 62 -1.441 -3.150 -5.309 464 HA ILE 62 HA ILE 62 -4.130 -3.333 -4.044 465 HB ILE 62 HB ILE 62 -1.884 -1.438 -3.333 466 HG12 ILE 62 1HG1 ILE 62 -2.082 -2.943 -1.113 467 HG13 ILE 62 2HG1 ILE 62 -2.511 -4.191 -2.258 468 HG21 ILE 62 1HG2 ILE 62 -3.273 -1.012 -1.313 469 HG22 ILE 62 2HG2 ILE 62 -4.068 -0.527 -2.810 470 HG23 ILE 62 3HG2 ILE 62 -4.548 -2.032 -2.003 471 HD11 ILE 62 3HD1 ILE 62 -0.355 -3.880 -3.434 472 HD12 ILE 62 1HD1 ILE 62 0.007 -2.438 -2.479 473 HD13 ILE 62 2HD1 ILE 62 -0.048 -4.053 -1.711 474 H ASN 63 H ASN 63 -5.654 -2.138 -4.959 475 HA ASN 63 HA ASN 63 -4.929 0.352 -6.460 476 HB2 ASN 63 1HB ASN 63 -6.974 -1.804 -7.048 477 HB3 ASN 63 2HB ASN 63 -7.319 -0.131 -7.482 478 HD21 ASN 63 1HD2 ASN 63 -5.044 -2.827 -8.063 479 HD22 ASN 63 2HD2 ASN 63 -4.417 -2.143 -9.558 480 H ILE 64 H ILE 64 -6.154 2.166 -6.000 481 HA ILE 64 HA ILE 64 -8.277 1.978 -3.938 482 HB ILE 64 HB ILE 64 -6.204 4.233 -4.128 483 HG12 ILE 64 1HG1 ILE 64 -6.440 1.921 -2.127 484 HG13 ILE 64 2HG1 ILE 64 -5.125 2.240 -3.250 485 HG21 ILE 64 1HG2 ILE 64 -7.309 5.053 -2.083 486 HG22 ILE 64 2HG2 ILE 64 -8.490 4.883 -3.392 487 HG23 ILE 64 3HG2 ILE 64 -8.426 3.671 -2.114 488 HD11 ILE 64 3HD1 ILE 64 -5.831 3.832 -0.777 489 HD12 ILE 64 1HD1 ILE 64 -4.352 2.924 -1.133 490 HD13 ILE 64 2HD1 ILE 64 -4.704 4.420 -2.026 491 H GLU 65 H GLU 65 -9.890 1.983 -5.471 492 HA GLU 65 HA GLU 65 -9.862 3.713 -7.837 493 HB2 GLU 65 1HB GLU 65 -10.768 1.393 -7.838 494 HB3 GLU 65 2HB GLU 65 -11.992 1.861 -6.669 495 HG2 GLU 65 1HG GLU 65 -13.280 2.879 -8.199 496 HG3 GLU 65 2HG GLU 65 -11.912 3.655 -9.014 497 H ASN 66 H ASN 66 -10.257 5.862 -7.472 498 HA ASN 66 HA ASN 66 -12.406 6.629 -5.602 499 HB2 ASN 66 1HB ASN 66 -11.080 8.360 -4.559 500 HB3 ASN 66 2HB ASN 66 -10.368 6.805 -4.225 501 HD21 ASN 66 1HD2 ASN 66 -8.276 6.239 -5.522 502 HD22 ASN 66 2HD2 ASN 66 -7.328 7.607 -6.052 503 H ASN 67 H ASN 67 -13.609 8.205 -6.370 504 HA ASN 67 HA ASN 67 -14.523 9.751 -7.688 505 HB2 ASN 67 1HB ASN 67 -11.705 10.745 -8.225 506 HB3 ASN 67 2HB ASN 67 -13.202 11.638 -8.398 507 HD21 ASN 67 1HD2 ASN 67 -10.839 10.408 -6.063 508 HD22 ASN 67 2HD2 ASN 67 -11.564 11.206 -4.677 509 H GLY 68 H GLY 68 -13.000 7.286 -9.269 510 HA2 GLY 68 1HA GLY 68 -13.773 6.740 -11.499 511 HA3 GLY 68 2HA GLY 68 -13.563 8.411 -11.995 512 H GLY 69 H GLY 69 -10.982 7.189 -9.977 513 HA2 GLY 69 1HA GLY 69 -9.366 6.150 -12.151 514 HA3 GLY 69 2HA GLY 69 -8.797 7.695 -11.473 515 H MET 70 H MET 70 -6.975 5.842 -10.966 516 HA MET 70 HA MET 70 -7.376 5.110 -8.174 517 HB2 MET 70 1HB MET 70 -6.715 2.743 -8.583 518 HB3 MET 70 2HB MET 70 -8.322 3.140 -9.201 519 HG2 MET 70 1HG MET 70 -5.826 3.008 -10.930 520 HG3 MET 70 2HG MET 70 -6.927 1.682 -10.636 521 HE1 MET 70 3HE MET 70 -7.364 1.197 -13.167 522 HE2 MET 70 1HE MET 70 -7.825 2.454 -14.332 523 HE3 MET 70 2HE MET 70 -6.206 2.483 -13.600 524 H THR 71 H THR 71 -5.640 4.623 -7.063 525 HA THR 71 HA THR 71 -2.954 5.314 -8.090 526 HB THR 71 HB THR 71 -3.988 5.783 -5.647 527 HG1 THR 71 1HG THR 71 -1.783 6.209 -6.176 528 HG21 THR 71 3HG2 THR 71 -3.549 4.161 -3.994 529 HG22 THR 71 1HG2 THR 71 -2.795 3.042 -5.142 530 HG23 THR 71 2HG2 THR 71 -4.527 3.362 -5.249 531 H THR 72 H THR 72 -1.262 3.522 -7.735 532 HA THR 72 HA THR 72 -2.243 0.836 -7.327 533 HB THR 72 HB THR 72 -0.727 1.616 -9.844 534 HG1 THR 72 1HG THR 72 -3.305 1.262 -9.289 535 HG21 THR 72 3HG2 THR 72 -1.391 -1.183 -8.813 536 HG22 THR 72 1HG2 THR 72 0.239 -0.486 -8.979 537 HG23 THR 72 2HG2 THR 72 -0.730 -0.790 -10.419 538 H MET 73 H MET 73 -0.686 -0.378 -6.240 539 HA MET 73 HA MET 73 2.083 0.388 -6.046 540 HB2 MET 73 1HB MET 73 2.058 0.564 -3.545 541 HB3 MET 73 2HB MET 73 1.334 1.905 -4.392 542 HG2 MET 73 1HG MET 73 -0.951 0.869 -3.922 543 HG3 MET 73 2HG MET 73 -0.097 -0.266 -2.878 544 HE1 MET 73 3HE MET 73 0.535 3.716 -3.356 545 HE2 MET 73 1HE MET 73 -1.196 3.369 -3.554 546 HE3 MET 73 2HE MET 73 -0.628 4.276 -2.135 547 H PHE 74 H PHE 74 3.156 -1.278 -4.523 548 HA PHE 74 HA PHE 74 1.733 -3.845 -4.272 549 HB2 PHE 74 1HB PHE 74 4.522 -3.499 -5.449 550 HB3 PHE 74 2HB PHE 74 3.643 -4.998 -5.249 551 HD1 PHE 74 2HD PHE 74 1.722 -5.558 -6.782 552 HD2 PHE 74 1HD PHE 74 4.112 -2.017 -7.356 553 HE1 PHE 74 2HE PHE 74 0.970 -5.426 -9.128 554 HE2 PHE 74 1HE PHE 74 3.329 -1.872 -9.697 555 HZ PHE 74 HZ PHE 74 1.751 -3.575 -10.592 556 H TYR 75 H TYR 75 2.717 -5.146 -2.464 557 HA TYR 75 HA TYR 75 4.785 -3.700 -0.882 558 HB2 TYR 75 1HB TYR 75 2.662 -5.254 0.540 559 HB3 TYR 75 2HB TYR 75 3.744 -4.052 1.165 560 HD1 TYR 75 1HD TYR 75 3.144 -1.775 -0.762 561 HD2 TYR 75 2HD TYR 75 0.566 -4.532 1.297 562 HE1 TYR 75 1HE TYR 75 1.337 -0.120 -0.857 563 HE2 TYR 75 2HE TYR 75 -1.253 -2.872 1.207 564 HH TYR 75 HH TYR 75 -0.796 0.329 -0.357 565 H TYR 76 H TYR 76 6.133 -5.076 0.421 566 HA TYR 76 HA TYR 76 6.125 -7.961 -0.055 567 HB2 TYR 76 1HB TYR 76 8.387 -7.845 -1.120 568 HB3 TYR 76 2HB TYR 76 7.066 -7.296 -2.123 569 HD1 TYR 76 1HD TYR 76 6.672 -4.870 -2.519 570 HD2 TYR 76 2HD TYR 76 10.280 -6.332 -0.629 571 HE1 TYR 76 1HE TYR 76 7.716 -2.627 -2.773 572 HE2 TYR 76 2HE TYR 76 11.347 -4.170 -0.991 573 HH TYR 76 HH TYR 76 11.005 -1.975 -1.504 574 H GLU 77 H GLU 77 8.444 -8.758 0.814 575 HA GLU 77 HA GLU 77 9.237 -7.213 3.212 576 HB2 GLU 77 1HB GLU 77 8.180 -9.529 3.574 577 HB3 GLU 77 2HB GLU 77 9.615 -10.204 2.794 578 HG2 GLU 77 1HG GLU 77 11.057 -9.208 4.532 579 HG3 GLU 77 2HG GLU 77 9.672 -8.360 5.224 580 H GLU 78 H GLU 78 11.507 -6.890 3.429 581 HA GLU 78 HA GLU 78 13.262 -8.128 1.447 582 HB2 GLU 78 1HB GLU 78 12.753 -6.063 0.320 583 HB3 GLU 78 2HB GLU 78 13.122 -5.127 1.765 584 HG2 GLU 78 1HG GLU 78 14.997 -5.055 0.192 585 HG3 GLU 78 2HG GLU 78 15.469 -5.794 1.701 586 H ASN 79 H ASN 79 14.687 -9.099 2.582 587 HA ASN 79 HA ASN 79 16.168 -9.754 4.098 588 HB2 ASN 79 1HB ASN 79 16.569 -6.787 4.259 589 HB3 ASN 79 2HB ASN 79 17.188 -7.711 5.602 590 HD21 ASN 79 1HD2 ASN 79 17.285 -7.635 1.998 591 HD22 ASN 79 2HD2 ASN 79 18.956 -7.967 1.891 592 H GLY 80 H GLY 80 13.402 -8.356 5.162 593 HA2 GLY 80 1HA GLY 80 12.498 -9.729 7.165 594 HA3 GLY 80 2HA GLY 80 13.904 -9.135 8.023 595 H LYS 81 H LYS 81 12.848 -6.434 6.140 596 HA LYS 81 HA LYS 81 10.678 -5.750 8.033 597 HB2 LYS 81 1HB LYS 81 12.941 -4.157 6.880 598 HB3 LYS 81 2HB LYS 81 11.357 -3.452 6.595 599 HG2 LYS 81 1HG LYS 81 12.001 -2.531 8.543 600 HG3 LYS 81 2HG LYS 81 10.834 -3.744 9.054 601 HD2 LYS 81 1HD LYS 81 12.540 -3.952 10.633 602 HD3 LYS 81 2HD LYS 81 12.989 -5.230 9.483 603 HE2 LYS 81 1HE LYS 81 14.544 -3.632 8.349 604 HE3 LYS 81 2HE LYS 81 14.045 -2.363 9.474 605 HZ1 LYS 81 3HZ LYS 81 14.940 -3.747 11.268 606 HZ2 LYS 81 1HZ LYS 81 16.086 -3.281 10.158 607 HZ3 LYS 81 2HZ LYS 81 15.511 -4.828 10.133 608 H TYR 82 H TYR 82 8.872 -4.574 6.947 609 HA TYR 82 HA TYR 82 8.449 -5.644 4.227 610 HB2 TYR 82 1HB TYR 82 6.474 -4.524 6.219 611 HB3 TYR 82 2HB TYR 82 6.098 -5.221 4.653 612 HD1 TYR 82 2HD TYR 82 6.610 -7.729 4.261 613 HD2 TYR 82 1HD TYR 82 6.826 -5.881 8.162 614 HE1 TYR 82 2HE TYR 82 6.555 -9.968 5.326 615 HE2 TYR 82 1HE TYR 82 6.770 -8.110 9.218 616 HH TYR 82 HH TYR 82 6.317 -11.118 7.358 617 H TYR 83 H TYR 83 7.785 -4.261 2.541 618 HA TYR 83 HA TYR 83 8.152 -1.362 2.977 619 HB2 TYR 83 1HB TYR 83 9.683 -3.024 0.955 620 HB3 TYR 83 2HB TYR 83 9.678 -1.270 1.005 621 HD1 TYR 83 1HD TYR 83 10.914 -4.344 2.606 622 HD2 TYR 83 2HD TYR 83 10.905 -0.039 2.775 623 HE1 TYR 83 1HE TYR 83 12.847 -4.430 4.063 624 HE2 TYR 83 2HE TYR 83 12.839 -0.092 4.328 625 HH TYR 83 HH TYR 83 14.627 -3.101 5.017 626 H ILE 84 H ILE 84 7.564 -0.121 1.097 627 HA ILE 84 HA ILE 84 5.360 -1.355 -0.483 628 HB ILE 84 HB ILE 84 5.357 1.096 1.320 629 HG12 ILE 84 1HG1 ILE 84 3.055 -0.327 1.822 630 HG13 ILE 84 2HG1 ILE 84 4.136 -1.621 1.335 631 HG21 ILE 84 1HG2 ILE 84 2.988 1.471 0.471 632 HG22 ILE 84 2HG2 ILE 84 4.314 1.972 -0.593 633 HG23 ILE 84 3HG2 ILE 84 3.453 0.478 -0.933 634 HD11 ILE 84 3HD1 ILE 84 5.779 -0.569 3.112 635 HD12 ILE 84 1HD1 ILE 84 4.279 0.164 3.719 636 HD13 ILE 84 2HD1 ILE 84 4.423 -1.609 3.560 637 H GLU 85 H GLU 85 5.259 -0.834 -2.513 638 HA GLU 85 HA GLU 85 7.264 0.764 -3.831 639 HB2 GLU 85 1HB GLU 85 6.185 -1.476 -4.486 640 HB3 GLU 85 2HB GLU 85 4.728 -0.569 -4.886 641 HG2 GLU 85 1HG GLU 85 7.422 -0.089 -6.191 642 HG3 GLU 85 2HG GLU 85 6.275 -1.289 -6.762 643 H CYS 86 H CYS 86 6.803 2.557 -5.272 644 HA CYS 86 HA CYS 86 4.395 3.833 -5.697 645 HB2 CYS 86 1HB CYS 86 5.702 4.584 -3.199 646 HB3 CYS 86 2HB CYS 86 5.856 5.932 -4.328 647 HG CYS 86 HG CYS 86 3.241 4.361 -3.101 648 HA PRO 87 HA PRO 87 7.421 5.778 -8.685 649 HB2 PRO 87 1HB PRO 87 6.658 8.417 -8.822 650 HB3 PRO 87 2HB PRO 87 5.694 7.109 -9.542 651 HG2 PRO 87 1HG PRO 87 5.331 8.360 -6.803 652 HG3 PRO 87 2HG PRO 87 4.107 8.132 -8.103 653 HD2 PRO 87 1HD PRO 87 4.296 6.359 -6.116 654 HD3 PRO 87 2HD PRO 87 4.066 5.816 -7.786 655 H TYR 88 H TYR 88 8.697 8.199 -8.439 656 HA TYR 88 HA TYR 88 10.783 7.997 -6.978 657 HB2 TYR 88 1HB TYR 88 9.367 10.665 -7.289 658 HB3 TYR 88 2HB TYR 88 11.076 10.448 -7.000 659 HD1 TYR 88 1HD TYR 88 8.400 10.151 -9.549 660 HD2 TYR 88 2HD TYR 88 12.625 9.800 -8.736 661 HE1 TYR 88 1HE TYR 88 8.878 10.201 -11.979 662 HE2 TYR 88 2HE TYR 88 13.105 9.872 -11.149 663 HH TYR 88 HH TYR 88 12.225 10.098 -13.271 664 H LYS 89 H LYS 89 7.948 8.174 -5.239 665 HA LYS 89 HA LYS 89 9.338 8.866 -2.725 666 HB2 LYS 89 1HB LYS 89 6.448 9.575 -3.230 667 HB3 LYS 89 2HB LYS 89 7.521 10.060 -1.907 668 HG2 LYS 89 1HG LYS 89 7.750 11.037 -4.758 669 HG3 LYS 89 2HG LYS 89 7.034 11.854 -3.392 670 HD2 LYS 89 1HD LYS 89 8.938 12.551 -2.505 671 HD3 LYS 89 2HD LYS 89 9.809 11.049 -2.810 672 HE2 LYS 89 1HE LYS 89 10.538 11.670 -4.900 673 HE3 LYS 89 2HE LYS 89 9.120 12.677 -5.226 674 HZ1 LYS 89 3HZ LYS 89 9.961 14.355 -3.844 675 HZ2 LYS 89 1HZ LYS 89 11.179 13.928 -4.865 676 HZ3 LYS 89 2HZ LYS 89 11.188 13.438 -3.271 677 H GLY 90 H GLY 90 9.336 6.314 -3.729 678 HA2 GLY 90 1HA GLY 90 7.419 4.899 -1.944 679 HA3 GLY 90 2HA GLY 90 7.946 4.331 -3.533 680 H ILE 91 H ILE 91 9.605 5.405 -0.478 681 HA ILE 91 HA ILE 91 10.731 2.654 -0.283 682 HB ILE 91 HB ILE 91 12.362 5.114 0.409 683 HG12 ILE 91 1HG1 ILE 91 12.264 3.558 -2.193 684 HG13 ILE 91 2HG1 ILE 91 12.066 5.290 -1.914 685 HG21 ILE 91 1HG2 ILE 91 12.822 2.743 1.443 686 HG22 ILE 91 2HG2 ILE 91 13.401 2.318 -0.160 687 HG23 ILE 91 3HG2 ILE 91 14.171 3.647 0.726 688 HD11 ILE 91 3HD1 ILE 91 14.677 3.745 -1.626 689 HD12 ILE 91 1HD1 ILE 91 14.236 4.840 -2.927 690 HD13 ILE 91 2HD1 ILE 91 14.457 5.482 -1.285 691 H TYR 92 H TYR 92 8.512 2.912 0.926 692 HA TYR 92 HA TYR 92 8.717 4.171 3.571 693 HB2 TYR 92 1HB TYR 92 6.534 2.261 2.736 694 HB3 TYR 92 2HB TYR 92 6.501 3.423 4.024 695 HD1 TYR 92 1HD TYR 92 6.405 3.033 0.310 696 HD2 TYR 92 2HD TYR 92 5.731 5.647 3.676 697 HE1 TYR 92 1HE TYR 92 5.245 4.608 -1.150 698 HE2 TYR 92 2HE TYR 92 4.727 7.314 2.198 699 HH TYR 92 HH TYR 92 4.067 6.505 -1.253 700 H GLU 93 H GLU 93 9.701 3.193 5.227 701 HA GLU 93 HA GLU 93 9.938 0.210 5.236 702 HB2 GLU 93 1HB GLU 93 11.977 1.607 5.787 703 HB3 GLU 93 2HB GLU 93 11.086 2.347 7.103 704 HG2 GLU 93 1HG GLU 93 10.774 -0.043 8.051 705 HG3 GLU 93 2HG GLU 93 11.940 -0.556 6.824 706 H ILE 94 H ILE 94 8.101 -0.714 6.105 707 HA ILE 94 HA ILE 94 6.881 0.613 8.455 708 HB ILE 94 HB ILE 94 4.925 -0.703 8.254 709 HG12 ILE 94 1HG1 ILE 94 5.986 -1.847 5.653 710 HG13 ILE 94 2HG1 ILE 94 5.794 -2.692 7.188 711 HG21 ILE 94 1HG2 ILE 94 5.014 1.501 7.253 712 HG22 ILE 94 2HG2 ILE 94 5.451 0.805 5.670 713 HG23 ILE 94 3HG2 ILE 94 3.863 0.475 6.410 714 HD11 ILE 94 3HD1 ILE 94 3.917 -3.269 5.782 715 HD12 ILE 94 1HD1 ILE 94 3.337 -2.276 7.137 716 HD13 ILE 94 2HD1 ILE 94 3.495 -1.564 5.538 717 H GLU 95 H GLU 95 6.274 -1.295 10.073 718 HA GLU 95 HA GLU 95 8.656 -3.090 10.118 719 HB2 GLU 95 1HB GLU 95 8.902 -2.623 12.487 720 HB3 GLU 95 2HB GLU 95 9.034 -1.170 11.500 721 HG2 GLU 95 1HG GLU 95 6.546 -0.738 12.098 722 HG3 GLU 95 2HG GLU 95 6.764 -1.962 13.353 723 H ASN 96 H ASN 96 5.236 -2.927 10.240 724 HA ASN 96 HA ASN 96 5.254 -5.793 11.013 725 HB2 ASN 96 1HB ASN 96 3.031 -3.793 11.608 726 HB3 ASN 96 2HB ASN 96 2.997 -5.503 11.981 727 HD21 ASN 96 1HD2 ASN 96 6.031 -5.245 12.857 728 HD22 ASN 96 2HD2 ASN 96 5.910 -4.645 14.459 729 H ASN 97 H ASN 97 3.824 -7.083 9.891 730 HA ASN 97 HA ASN 97 3.827 -6.476 7.111 731 HB2 ASN 97 1HB ASN 97 4.107 -8.769 8.034 732 HB3 ASN 97 2HB ASN 97 2.463 -8.732 8.640 733 HD21 ASN 97 1HD2 ASN 97 4.422 -9.234 5.796 734 HD22 ASN 97 2HD2 ASN 97 3.064 -9.527 4.694 735 H PHE 98 H PHE 98 2.303 -5.585 5.832 736 HA PHE 98 HA PHE 98 0.048 -4.232 6.880 737 HB2 PHE 98 1HB PHE 98 1.283 -3.526 4.890 738 HB3 PHE 98 2HB PHE 98 0.818 -4.984 4.033 739 HD1 PHE 98 2HD PHE 98 -1.611 -5.369 3.426 740 HD2 PHE 98 1HD PHE 98 -0.100 -1.559 4.756 741 HE1 PHE 98 2HE PHE 98 -3.600 -4.277 2.531 742 HE2 PHE 98 1HE PHE 98 -2.073 -0.429 3.756 743 HZ PHE 98 HZ PHE 98 -3.865 -1.794 2.679 744 H GLU 99 H GLU 99 0.270 -7.425 5.189 745 HA GLU 99 HA GLU 99 -2.571 -7.703 4.846 746 HB2 GLU 99 1HB GLU 99 -0.228 -9.570 4.505 747 HB3 GLU 99 2HB GLU 99 -1.899 -10.137 4.372 748 HG2 GLU 99 1HG GLU 99 -2.401 -8.581 2.602 749 HG3 GLU 99 2HG GLU 99 -0.880 -7.735 2.810 750 H ASP 100 H ASP 100 -0.297 -8.523 7.399 751 HA ASP 100 HA ASP 100 -2.228 -10.106 8.908 752 HB2 ASP 100 1HB ASP 100 0.452 -8.853 9.616 753 HB3 ASP 100 2HB ASP 100 -0.500 -9.750 10.786 754 H MET 101 H MET 101 -1.719 -6.716 8.529 755 HA MET 101 HA MET 101 -2.938 -5.970 11.118 756 HB2 MET 101 1HB MET 101 -2.054 -4.328 8.715 757 HB3 MET 101 2HB MET 101 -2.744 -3.648 10.173 758 HG2 MET 101 1HG MET 101 -0.248 -5.341 10.353 759 HG3 MET 101 2HG MET 101 -0.177 -3.673 9.809 760 HE1 MET 101 3HE MET 101 -1.472 -5.945 12.815 761 HE2 MET 101 1HE MET 101 0.304 -5.902 12.711 762 HE3 MET 101 2HE MET 101 -0.523 -5.163 14.097 763 H ILE 102 H ILE 102 -3.976 -6.578 7.790 764 HA ILE 102 HA ILE 102 -6.401 -4.915 8.090 765 HB ILE 102 HB ILE 102 -6.917 -5.679 5.750 766 HG12 ILE 102 1HG1 ILE 102 -4.131 -6.841 5.877 767 HG13 ILE 102 2HG1 ILE 102 -5.590 -7.814 5.845 768 HG21 ILE 102 1HG2 ILE 102 -4.199 -4.347 6.101 769 HG22 ILE 102 2HG2 ILE 102 -5.304 -4.169 4.727 770 HG23 ILE 102 3HG2 ILE 102 -5.756 -3.533 6.329 771 HD11 ILE 102 3HD1 ILE 102 -4.557 -6.022 3.610 772 HD12 ILE 102 1HD1 ILE 102 -4.583 -7.784 3.645 773 HD13 ILE 102 2HD1 ILE 102 -6.105 -6.886 3.575 Start of MODEL 7 1 H1 GLY 1 H GLY 1 6.833 10.387 9.446 2 HA2 GLY 1 1HA GLY 1 5.242 12.554 8.189 3 HA3 GLY 1 2HA GLY 1 6.808 11.986 7.590 4 H SER 2 H SER 2 3.469 10.844 8.308 5 HA SER 2 HA SER 2 3.424 8.522 6.757 6 HB2 SER 2 1HB SER 2 0.886 9.271 6.667 7 HB3 SER 2 2HB SER 2 1.647 8.829 8.196 8 HG SER 2 HG SER 2 1.586 11.547 7.368 9 HA PRO 3 HA PRO 3 3.032 10.034 2.472 10 HB2 PRO 3 1HB PRO 3 0.970 8.391 1.511 11 HB3 PRO 3 2HB PRO 3 2.668 7.959 1.633 12 HG2 PRO 3 1HG PRO 3 0.431 7.344 3.517 13 HG3 PRO 3 2HG PRO 3 1.770 6.264 2.998 14 HD2 PRO 3 1HD PRO 3 1.752 7.532 5.405 15 HD3 PRO 3 2HD PRO 3 3.257 7.256 4.495 16 H ILE 4 H ILE 4 1.121 10.520 0.815 17 HA ILE 4 HA ILE 4 -1.112 11.938 2.166 18 HB ILE 4 HB ILE 4 -0.010 12.464 -0.632 19 HG12 ILE 4 1HG1 ILE 4 0.413 14.116 1.879 20 HG13 ILE 4 2HG1 ILE 4 1.661 13.217 1.016 21 HG21 ILE 4 1HG2 ILE 4 -2.032 13.967 1.102 22 HG22 ILE 4 2HG2 ILE 4 -1.558 14.401 -0.553 23 HG23 ILE 4 3HG2 ILE 4 -2.436 12.907 -0.273 24 HD11 ILE 4 3HD1 ILE 4 1.911 15.502 0.435 25 HD12 ILE 4 1HD1 ILE 4 1.260 14.671 -0.992 26 HD13 ILE 4 2HD1 ILE 4 0.208 15.685 0.029 27 H LEU 5 H LEU 5 -2.960 10.669 1.929 28 HA LEU 5 HA LEU 5 -3.286 9.014 -0.494 29 HB2 LEU 5 1HB LEU 5 -4.344 8.859 2.376 30 HB3 LEU 5 2HB LEU 5 -5.198 8.083 1.076 31 HG LEU 5 HG LEU 5 -3.934 6.461 2.125 32 HD11 LEU 5 1HD1 LEU 5 -2.494 5.562 0.280 33 HD12 LEU 5 2HD1 LEU 5 -2.489 7.128 -0.491 34 HD13 LEU 5 3HD1 LEU 5 -4.004 6.229 -0.325 35 HD21 LEU 5 3HD2 LEU 5 -2.249 7.914 3.221 36 HD22 LEU 5 1HD2 LEU 5 -1.318 7.898 1.708 37 HD23 LEU 5 2HD2 LEU 5 -1.625 6.387 2.606 38 HA PRO 6 HA PRO 6 -6.747 11.649 -1.548 39 HB2 PRO 6 1HB PRO 6 -8.768 9.926 -2.245 40 HB3 PRO 6 2HB PRO 6 -7.357 10.148 -3.276 41 HG2 PRO 6 1HG PRO 6 -7.782 7.982 -1.214 42 HG3 PRO 6 2HG PRO 6 -7.314 7.808 -2.931 43 HD2 PRO 6 1HD PRO 6 -5.458 7.797 -1.019 44 HD3 PRO 6 2HD PRO 6 -5.141 8.673 -2.525 45 H LYS 7 H LYS 7 -9.321 11.786 -0.911 46 HA LYS 7 HA LYS 7 -9.762 11.500 1.912 47 HB2 LYS 7 1HB LYS 7 -11.861 11.311 -0.284 48 HB3 LYS 7 2HB LYS 7 -12.096 11.747 1.373 49 HG2 LYS 7 1HG LYS 7 -10.208 13.605 0.057 50 HG3 LYS 7 2HG LYS 7 -11.706 13.466 -0.852 51 HD2 LYS 7 1HD LYS 7 -11.562 13.984 2.123 52 HD3 LYS 7 2HD LYS 7 -11.666 15.293 0.911 53 HE2 LYS 7 1HE LYS 7 -13.815 14.515 0.114 54 HE3 LYS 7 2HE LYS 7 -13.666 13.012 1.026 55 HZ1 LYS 7 3HZ LYS 7 -14.275 15.705 2.020 56 HZ2 LYS 7 1HZ LYS 7 -13.695 14.540 3.066 57 HZ3 LYS 7 2HZ LYS 7 -15.096 14.328 2.286 58 H ALA 8 H ALA 8 -11.433 9.843 2.758 59 HA ALA 8 HA ALA 8 -11.133 7.121 1.595 60 HB1 ALA 8 1HB ALA 8 -12.905 8.089 3.905 61 HB2 ALA 8 2HB ALA 8 -12.368 6.435 3.539 62 HB3 ALA 8 3HB ALA 8 -11.216 7.651 4.135 63 H GLU 9 H GLU 9 -13.704 9.571 2.264 64 HA GLU 9 HA GLU 9 -15.668 7.931 1.182 65 HB2 GLU 9 1HB GLU 9 -17.144 9.873 1.221 66 HB3 GLU 9 2HB GLU 9 -16.137 9.797 2.673 67 HG2 GLU 9 1HG GLU 9 -14.643 11.510 1.783 68 HG3 GLU 9 2HG GLU 9 -15.508 11.541 0.246 69 H ASN 10 H ASN 10 -13.448 9.935 -0.675 70 HA ASN 10 HA ASN 10 -15.075 9.927 -3.093 71 HB2 ASN 10 1HB ASN 10 -13.281 11.053 -4.141 72 HB3 ASN 10 2HB ASN 10 -13.397 11.738 -2.525 73 HD21 ASN 10 1HD2 ASN 10 -11.906 8.825 -1.892 74 HD22 ASN 10 2HD2 ASN 10 -10.336 9.502 -1.735 75 H VAL 11 H VAL 11 -13.599 7.389 -1.556 76 HA VAL 11 HA VAL 11 -12.297 6.226 -3.919 77 HB VAL 11 HB VAL 11 -12.413 5.158 -1.062 78 HG11 VAL 11 1HG1 VAL 11 -10.713 3.628 -1.843 79 HG12 VAL 11 2HG1 VAL 11 -11.994 3.546 -3.047 80 HG13 VAL 11 3HG1 VAL 11 -10.574 4.483 -3.412 81 HG21 VAL 11 3HG2 VAL 11 -10.028 5.821 -0.928 82 HG22 VAL 11 1HG2 VAL 11 -10.191 6.778 -2.408 83 HG23 VAL 11 2HG2 VAL 11 -11.138 7.165 -0.977 84 H ASP 12 H ASP 12 -13.392 4.898 -5.112 85 HA ASP 12 HA ASP 12 -16.256 4.375 -4.767 86 HB2 ASP 12 1HB ASP 12 -15.326 4.930 -6.990 87 HB3 ASP 12 2HB ASP 12 -14.179 3.597 -6.840 88 H SER 13 H SER 13 -13.148 2.438 -5.157 89 HA SER 13 HA SER 13 -14.047 0.751 -2.939 90 HB2 SER 13 1HB SER 13 -13.824 -1.334 -4.501 91 HB3 SER 13 2HB SER 13 -15.339 -0.430 -4.467 92 HG SER 13 HG SER 13 -14.845 0.557 -6.399 93 H ILE 14 H ILE 14 -12.381 -0.718 -2.208 94 HA ILE 14 HA ILE 14 -9.663 -0.164 -3.329 95 HB ILE 14 HB ILE 14 -10.480 -0.990 -0.518 96 HG12 ILE 14 1HG1 ILE 14 -9.249 1.580 -1.595 97 HG13 ILE 14 2HG1 ILE 14 -10.896 1.380 -0.982 98 HG21 ILE 14 1HG2 ILE 14 -8.341 -2.078 -1.233 99 HG22 ILE 14 2HG2 ILE 14 -7.679 -0.475 -1.610 100 HG23 ILE 14 3HG2 ILE 14 -8.091 -0.918 0.051 101 HD11 ILE 14 3HD1 ILE 14 -8.332 1.247 0.644 102 HD12 ILE 14 1HD1 ILE 14 -9.637 2.425 0.724 103 HD13 ILE 14 2HD1 ILE 14 -9.931 0.759 1.255 104 H CYS 15 H CYS 15 -8.512 -1.947 -3.942 105 HA CYS 15 HA CYS 15 -9.808 -4.621 -3.712 106 HB2 CYS 15 1HB CYS 15 -9.991 -3.203 -6.008 107 HB3 CYS 15 2HB CYS 15 -8.378 -3.905 -6.266 108 HG CYS 15 HG CYS 15 -10.375 -5.203 -7.432 109 H ILE 16 H ILE 16 -8.388 -5.711 -2.415 110 HA ILE 16 HA ILE 16 -5.470 -5.192 -2.723 111 HB ILE 16 HB ILE 16 -6.868 -6.453 -0.350 112 HG12 ILE 16 1HG1 ILE 16 -5.909 -3.605 -0.869 113 HG13 ILE 16 2HG1 ILE 16 -7.522 -4.116 -0.411 114 HG21 ILE 16 1HG2 ILE 16 -4.568 -7.205 -0.725 115 HG22 ILE 16 2HG2 ILE 16 -4.008 -5.516 -0.669 116 HG23 ILE 16 3HG2 ILE 16 -4.721 -6.298 0.763 117 HD11 ILE 16 3HD1 ILE 16 -6.472 -3.047 1.467 118 HD12 ILE 16 1HD1 ILE 16 -6.656 -4.772 1.849 119 HD13 ILE 16 2HD1 ILE 16 -5.069 -4.101 1.384 120 H ASP 17 H ASP 17 -4.645 -6.577 -4.073 121 HA ASP 17 HA ASP 17 -5.692 -9.317 -4.474 122 HB2 ASP 17 1HB ASP 17 -5.320 -7.685 -6.396 123 HB3 ASP 17 2HB ASP 17 -3.599 -7.734 -6.000 124 H PHE 18 H PHE 18 -4.629 -10.846 -3.207 125 HA PHE 18 HA PHE 18 -2.306 -10.039 -1.659 126 HB2 PHE 18 1HB PHE 18 -4.186 -12.408 -1.767 127 HB3 PHE 18 2HB PHE 18 -2.768 -12.454 -0.802 128 HD1 PHE 18 1HD PHE 18 -5.423 -9.750 -1.325 129 HD2 PHE 18 2HD PHE 18 -3.269 -12.279 1.434 130 HE1 PHE 18 1HE PHE 18 -6.676 -8.793 0.497 131 HE2 PHE 18 2HE PHE 18 -4.536 -11.277 3.309 132 HZ PHE 18 HZ PHE 18 -6.260 -9.540 2.874 133 H THR 19 H THR 19 -0.491 -11.742 -1.348 134 HA THR 19 HA THR 19 0.973 -12.263 -3.714 135 HB THR 19 HB THR 19 1.976 -14.059 -1.945 136 HG1 THR 19 1HG THR 19 0.656 -13.934 -0.269 137 HG21 THR 19 3HG2 THR 19 3.236 -12.169 -2.735 138 HG22 THR 19 1HG2 THR 19 3.379 -12.275 -0.974 139 HG23 THR 19 2HG2 THR 19 2.313 -11.050 -1.698 140 H ASN 20 H ASN 20 -1.120 -14.256 -1.709 141 HA ASN 20 HA ASN 20 -1.191 -16.572 -3.506 142 HB2 ASN 20 1HB ASN 20 -2.910 -17.356 -1.859 143 HB3 ASN 20 2HB ASN 20 -1.313 -17.141 -1.173 144 HD21 ASN 20 1HD2 ASN 20 -4.184 -17.035 -0.007 145 HD22 ASN 20 2HD2 ASN 20 -4.153 -15.522 0.923 146 H SER 21 H SER 21 -3.386 -17.031 -4.551 147 HA SER 21 HA SER 21 -3.695 -14.483 -5.928 148 HB2 SER 21 1HB SER 21 -4.536 -15.871 -7.762 149 HB3 SER 21 2HB SER 21 -2.926 -16.305 -7.197 150 HG SER 21 HG SER 21 -5.021 -17.778 -6.061 151 H ILE 22 H ILE 22 -5.009 -13.960 -3.837 152 HA ILE 22 HA ILE 22 -7.902 -14.464 -4.313 153 HB ILE 22 HB ILE 22 -6.578 -14.133 -1.612 154 HG12 ILE 22 1HG1 ILE 22 -7.242 -16.804 -2.936 155 HG13 ILE 22 2HG1 ILE 22 -5.635 -16.199 -2.507 156 HG21 ILE 22 1HG2 ILE 22 -9.226 -15.397 -2.461 157 HG22 ILE 22 2HG2 ILE 22 -8.724 -15.008 -0.797 158 HG23 ILE 22 3HG2 ILE 22 -9.058 -13.702 -1.918 159 HD11 ILE 22 3HD1 ILE 22 -6.201 -17.749 -0.807 160 HD12 ILE 22 1HD1 ILE 22 -6.456 -16.153 -0.068 161 HD13 ILE 22 2HD1 ILE 22 -7.838 -17.105 -0.633 162 H GLN 23 H GLN 23 -9.036 -12.681 -4.185 163 HA GLN 23 HA GLN 23 -7.624 -10.090 -3.686 164 HB2 GLN 23 1HB GLN 23 -7.565 -10.686 -6.051 165 HB3 GLN 23 2HB GLN 23 -9.343 -10.684 -6.107 166 HG2 GLN 23 1HG GLN 23 -9.315 -8.284 -5.456 167 HG3 GLN 23 2HG GLN 23 -7.561 -8.316 -5.339 168 HE21 GLN 23 1HE2 GLN 23 -8.544 -10.215 -8.062 169 HE22 GLN 23 2HE2 GLN 23 -8.555 -8.912 -9.232 170 H LYS 24 H LYS 24 -8.549 -9.137 -2.170 171 HA LYS 24 HA LYS 24 -11.455 -9.613 -1.595 172 HB2 LYS 24 1HB LYS 24 -9.315 -10.003 0.075 173 HB3 LYS 24 2HB LYS 24 -9.689 -8.346 0.469 174 HG2 LYS 24 1HG LYS 24 -12.131 -9.969 0.398 175 HG3 LYS 24 2HG LYS 24 -10.914 -10.761 1.371 176 HD2 LYS 24 1HD LYS 24 -12.336 -9.458 2.781 177 HD3 LYS 24 2HD LYS 24 -10.727 -8.718 2.804 178 HE2 LYS 24 1HE LYS 24 -11.434 -6.970 1.306 179 HE3 LYS 24 2HE LYS 24 -12.868 -7.867 0.828 180 HZ1 LYS 24 3HZ LYS 24 -13.847 -7.447 2.945 181 HZ2 LYS 24 1HZ LYS 24 -13.401 -6.060 2.254 182 HZ3 LYS 24 2HZ LYS 24 -12.503 -6.670 3.512 183 H ILE 25 H ILE 25 -12.874 -7.901 -1.773 184 HA ILE 25 HA ILE 25 -11.746 -5.271 -2.509 185 HB ILE 25 HB ILE 25 -14.489 -6.497 -2.959 186 HG12 ILE 25 1HG1 ILE 25 -12.631 -5.623 -5.167 187 HG13 ILE 25 2HG1 ILE 25 -12.303 -7.173 -4.404 188 HG21 ILE 25 1HG2 ILE 25 -14.931 -4.473 -4.343 189 HG22 ILE 25 2HG2 ILE 25 -14.673 -4.047 -2.659 190 HG23 ILE 25 3HG2 ILE 25 -13.377 -3.778 -3.843 191 HD11 ILE 25 3HD1 ILE 25 -14.585 -7.942 -4.960 192 HD12 ILE 25 1HD1 ILE 25 -14.883 -6.399 -5.795 193 HD13 ILE 25 2HD1 ILE 25 -13.620 -7.508 -6.384 194 H TYR 26 H TYR 26 -12.219 -3.542 -1.220 195 HA TYR 26 HA TYR 26 -13.800 -3.976 1.273 196 HB2 TYR 26 1HB TYR 26 -11.318 -2.233 1.082 197 HB3 TYR 26 2HB TYR 26 -12.292 -2.545 2.498 198 HD1 TYR 26 1HD TYR 26 -10.192 -4.225 -0.093 199 HD2 TYR 26 2HD TYR 26 -11.399 -4.291 4.081 200 HE1 TYR 26 1HE TYR 26 -8.759 -6.137 0.311 201 HE2 TYR 26 2HE TYR 26 -9.894 -6.209 4.452 202 HH TYR 26 HH TYR 26 -7.589 -7.333 2.110 203 H ASP 27 H ASP 27 -15.525 -3.390 0.046 204 HA ASP 27 HA ASP 27 -15.816 -0.624 -0.934 205 HB2 ASP 27 1HB ASP 27 -17.939 -1.462 -1.761 206 HB3 ASP 27 2HB ASP 27 -16.669 -2.559 -2.285 207 H ASP 28 H ASP 28 -15.974 -2.380 1.979 208 HA ASP 28 HA ASP 28 -18.351 -1.047 3.036 209 HB2 ASP 28 1HB ASP 28 -16.723 -2.218 5.115 210 HB3 ASP 28 2HB ASP 28 -18.368 -2.565 4.631 211 H SER 29 H SER 29 -18.284 0.828 4.205 212 HA SER 29 HA SER 29 -16.177 2.608 3.778 213 HB2 SER 29 1HB SER 29 -18.572 3.140 4.270 214 HB3 SER 29 2HB SER 29 -18.273 2.791 5.972 215 HG SER 29 HG SER 29 -17.272 4.881 4.326 216 H GLU 30 H GLU 30 -16.849 0.708 6.743 217 HA GLU 30 HA GLU 30 -14.793 1.951 8.306 218 HB2 GLU 30 1HB GLU 30 -16.834 1.000 9.150 219 HB3 GLU 30 2HB GLU 30 -16.391 -0.623 8.609 220 HG2 GLU 30 1HG GLU 30 -14.578 -0.738 10.186 221 HG3 GLU 30 2HG GLU 30 -14.768 0.972 10.625 222 H SER 31 H SER 31 -14.887 -0.991 6.332 223 HA SER 31 HA SER 31 -12.307 -2.182 6.699 224 HB2 SER 31 1HB SER 31 -14.011 -1.915 4.243 225 HB3 SER 31 2HB SER 31 -12.718 -3.026 4.542 226 HG SER 31 HG SER 31 -14.913 -3.718 4.867 227 H ILE 32 H ILE 32 -13.457 0.340 4.427 228 HA ILE 32 HA ILE 32 -10.942 0.835 3.236 229 HB ILE 32 HB ILE 32 -13.477 2.493 3.525 230 HG12 ILE 32 1HG1 ILE 32 -12.387 1.323 0.963 231 HG13 ILE 32 2HG1 ILE 32 -13.264 0.295 2.083 232 HG21 ILE 32 1HG2 ILE 32 -11.952 4.204 3.232 233 HG22 ILE 32 2HG2 ILE 32 -10.835 3.252 2.280 234 HG23 ILE 32 3HG2 ILE 32 -12.361 3.845 1.550 235 HD11 ILE 32 3HD1 ILE 32 -15.261 1.666 1.960 236 HD12 ILE 32 1HD1 ILE 32 -14.422 2.877 0.991 237 HD13 ILE 32 2HD1 ILE 32 -14.728 1.256 0.312 238 H GLN 33 H GLN 33 -12.556 2.523 6.006 239 HA GLN 33 HA GLN 33 -10.523 4.434 6.403 240 HB2 GLN 33 1HB GLN 33 -12.702 3.287 8.127 241 HB3 GLN 33 2HB GLN 33 -11.356 4.071 8.943 242 HG2 GLN 33 1HG GLN 33 -11.823 5.988 7.094 243 HG3 GLN 33 2HG GLN 33 -13.440 5.288 7.185 244 HE21 GLN 33 1HE2 GLN 33 -10.788 6.805 9.098 245 HE22 GLN 33 2HE2 GLN 33 -11.826 7.288 10.434 246 H LYS 34 H LYS 34 -10.725 1.120 7.818 247 HA LYS 34 HA LYS 34 -8.386 1.414 9.401 248 HB2 LYS 34 1HB LYS 34 -10.086 -0.464 9.526 249 HB3 LYS 34 2HB LYS 34 -9.338 -1.181 8.111 250 HG2 LYS 34 1HG LYS 34 -7.279 -0.455 10.047 251 HG3 LYS 34 2HG LYS 34 -8.543 -1.323 10.903 252 HD2 LYS 34 1HD LYS 34 -7.356 -2.403 8.327 253 HD3 LYS 34 2HD LYS 34 -6.550 -2.623 9.871 254 HE2 LYS 34 1HE LYS 34 -9.425 -3.280 10.065 255 HE3 LYS 34 2HE LYS 34 -8.608 -4.248 8.827 256 HZ1 LYS 34 3HZ LYS 34 -7.014 -4.981 10.423 257 HZ2 LYS 34 1HZ LYS 34 -8.510 -5.346 10.946 258 HZ3 LYS 34 2HZ LYS 34 -7.664 -4.097 11.628 259 H ILE 35 H ILE 35 -8.743 0.029 6.056 260 HA ILE 35 HA ILE 35 -6.045 -0.431 5.644 261 HB ILE 35 HB ILE 35 -8.249 0.333 3.678 262 HG12 ILE 35 1HG1 ILE 35 -6.975 -2.352 4.337 263 HG13 ILE 35 2HG1 ILE 35 -8.414 -1.810 5.154 264 HG21 ILE 35 1HG2 ILE 35 -5.452 -0.805 3.157 265 HG22 ILE 35 2HG2 ILE 35 -6.729 -0.679 1.936 266 HG23 ILE 35 3HG2 ILE 35 -6.068 0.776 2.634 267 HD11 ILE 35 3HD1 ILE 35 -8.716 -3.347 3.179 268 HD12 ILE 35 1HD1 ILE 35 -9.759 -1.898 3.254 269 HD13 ILE 35 2HD1 ILE 35 -8.402 -1.980 2.124 270 H LEU 36 H LEU 36 -7.827 2.678 4.944 271 HA LEU 36 HA LEU 36 -5.582 4.083 3.936 272 HB2 LEU 36 1HB LEU 36 -7.945 4.963 5.639 273 HB3 LEU 36 2HB LEU 36 -6.760 6.120 5.069 274 HG LEU 36 HG LEU 36 -7.894 4.366 2.926 275 HD11 LEU 36 1HD1 LEU 36 -9.883 4.793 4.292 276 HD12 LEU 36 2HD1 LEU 36 -9.942 5.744 2.810 277 HD13 LEU 36 3HD1 LEU 36 -9.479 6.508 4.366 278 HD21 LEU 36 3HD2 LEU 36 -7.931 6.520 1.705 279 HD22 LEU 36 1HD2 LEU 36 -6.340 6.303 2.470 280 HD23 LEU 36 2HD2 LEU 36 -7.560 7.399 3.184 281 H SER 37 H SER 37 -6.107 3.130 7.413 282 HA SER 37 HA SER 37 -4.018 4.881 8.343 283 HB2 SER 37 1HB SER 37 -5.355 2.437 9.583 284 HB3 SER 37 2HB SER 37 -4.280 3.577 10.358 285 HG SER 37 HG SER 37 -6.200 4.329 10.864 286 H GLU 38 H GLU 38 -4.338 1.314 7.604 287 HA GLU 38 HA GLU 38 -1.604 0.780 8.208 288 HB2 GLU 38 1HB GLU 38 -3.189 -0.847 6.203 289 HB3 GLU 38 2HB GLU 38 -1.931 -1.382 7.307 290 HG2 GLU 38 1HG GLU 38 -4.837 -0.787 7.848 291 HG3 GLU 38 2HG GLU 38 -3.943 -2.262 8.150 292 H ILE 39 H ILE 39 -3.041 1.982 5.292 293 HA ILE 39 HA ILE 39 -0.661 1.659 3.625 294 HB ILE 39 HB ILE 39 -3.377 2.985 3.388 295 HG12 ILE 39 1HG1 ILE 39 -3.266 0.473 3.272 296 HG13 ILE 39 2HG1 ILE 39 -3.917 1.222 1.840 297 HG21 ILE 39 1HG2 ILE 39 -1.276 3.058 1.252 298 HG22 ILE 39 2HG2 ILE 39 -3.027 3.263 0.969 299 HG23 ILE 39 3HG2 ILE 39 -2.184 4.373 2.052 300 HD11 ILE 39 3HD1 ILE 39 -1.873 0.839 0.591 301 HD12 ILE 39 1HD1 ILE 39 -1.038 0.239 2.041 302 HD13 ILE 39 2HD1 ILE 39 -2.386 -0.671 1.355 303 H ALA 40 H ALA 40 -1.400 3.748 6.166 304 HA ALA 40 HA ALA 40 0.339 5.880 5.097 305 HB1 ALA 40 1HB ALA 40 -2.026 6.237 6.953 306 HB2 ALA 40 2HB ALA 40 -1.010 7.523 6.260 307 HB3 ALA 40 3HB ALA 40 -2.061 6.552 5.202 308 H THR 41 H THR 41 0.432 3.445 7.312 309 HA THR 41 HA THR 41 1.461 4.868 9.595 310 HB THR 41 HB THR 41 2.494 2.610 10.166 311 HG1 THR 41 1HG THR 41 1.801 0.873 8.955 312 HG21 THR 41 3HG2 THR 41 0.262 3.305 10.993 313 HG22 THR 41 1HG2 THR 41 0.386 1.558 10.741 314 HG23 THR 41 2HG2 THR 41 -0.488 2.554 9.566 315 H GLY 42 H GLY 42 2.913 3.788 6.554 316 HA2 GLY 42 1HA GLY 42 5.554 3.637 7.607 317 HA3 GLY 42 2HA GLY 42 5.088 3.506 5.915 318 H LYS 43 H LYS 43 7.431 4.632 6.794 319 HA LYS 43 HA LYS 43 7.213 7.485 6.090 320 HB2 LYS 43 1HB LYS 43 9.712 7.349 6.929 321 HB3 LYS 43 2HB LYS 43 8.372 7.583 7.966 322 HG2 LYS 43 1HG LYS 43 8.422 5.075 8.501 323 HG3 LYS 43 2HG LYS 43 9.721 4.876 7.350 324 HD2 LYS 43 1HD LYS 43 11.207 6.174 8.858 325 HD3 LYS 43 2HD LYS 43 9.843 6.383 9.994 326 HE2 LYS 43 1HE LYS 43 9.581 3.904 10.111 327 HE3 LYS 43 2HE LYS 43 10.943 3.708 8.985 328 HZ1 LYS 43 3HZ LYS 43 12.410 4.559 10.605 329 HZ2 LYS 43 1HZ LYS 43 11.536 3.386 11.314 330 HZ3 LYS 43 2HZ LYS 43 11.164 4.908 11.672 331 H ARG 44 H ARG 44 7.220 7.421 3.936 332 HA ARG 44 HA ARG 44 9.003 5.926 2.232 333 HB2 ARG 44 1HB ARG 44 8.479 7.729 0.552 334 HB3 ARG 44 2HB ARG 44 7.177 6.758 1.133 335 HG2 ARG 44 1HG ARG 44 6.304 8.887 1.193 336 HG3 ARG 44 2HG ARG 44 6.696 8.716 2.858 337 HD2 ARG 44 1HD ARG 44 8.509 10.164 2.671 338 HD3 ARG 44 2HD ARG 44 8.634 9.938 0.895 339 HE ARG 44 HE ARG 44 6.130 11.113 1.413 340 HH11 ARG 44 1HH1 ARG 44 9.505 12.032 1.958 341 HH12 ARG 44 2HH1 ARG 44 9.272 13.686 1.473 342 HH21 ARG 44 1HH2 ARG 44 5.783 13.201 0.878 343 HH22 ARG 44 2HH2 ARG 44 7.012 14.418 0.954 344 H THR 45 H THR 45 9.450 8.396 4.336 345 HA THR 45 HA THR 45 11.286 9.569 5.035 346 HB THR 45 HB THR 45 13.506 8.712 4.578 347 HG1 THR 45 1HG THR 45 12.289 7.641 2.307 348 HG21 THR 45 3HG2 THR 45 11.853 7.280 5.929 349 HG22 THR 45 1HG2 THR 45 13.303 6.502 5.299 350 HG23 THR 45 2HG2 THR 45 11.743 6.250 4.472 351 H GLU 46 H GLU 46 13.372 10.818 4.077 352 HA GLU 46 HA GLU 46 12.518 12.232 1.592 353 HB2 GLU 46 1HB GLU 46 14.400 12.958 3.856 354 HB3 GLU 46 2HB GLU 46 14.414 13.750 2.275 355 HG2 GLU 46 1HG GLU 46 11.782 13.967 2.637 356 HG3 GLU 46 2HG GLU 46 12.214 13.734 4.334 357 H LYS 47 H LYS 47 14.042 9.363 2.004 358 HA LYS 47 HA LYS 47 16.054 9.765 -0.051 359 HB2 LYS 47 1HB LYS 47 14.245 7.356 0.466 360 HB3 LYS 47 2HB LYS 47 15.680 7.450 -0.548 361 HG2 LYS 47 1HG LYS 47 16.845 8.196 1.711 362 HG3 LYS 47 2HG LYS 47 15.493 7.388 2.435 363 HD2 LYS 47 1HD LYS 47 17.080 5.615 2.232 364 HD3 LYS 47 2HD LYS 47 15.912 5.357 0.973 365 HE2 LYS 47 1HE LYS 47 17.986 4.959 -0.080 366 HE3 LYS 47 2HE LYS 47 17.499 6.561 -0.636 367 HZ1 LYS 47 3HZ LYS 47 19.696 6.764 -0.094 368 HZ2 LYS 47 1HZ LYS 47 19.599 5.881 1.282 369 HZ3 LYS 47 2HZ LYS 47 18.979 7.399 1.256 370 H GLN 48 H GLN 48 15.844 9.565 -2.158 371 HA GLN 48 HA GLN 48 13.248 10.054 -3.496 372 HB2 GLN 48 1HB GLN 48 16.069 9.680 -4.607 373 HB3 GLN 48 2HB GLN 48 14.657 10.165 -5.542 374 HG2 GLN 48 1HG GLN 48 15.127 11.871 -3.174 375 HG3 GLN 48 2HG GLN 48 16.502 11.850 -4.271 376 HE21 GLN 48 1HE2 GLN 48 13.164 12.795 -3.723 377 HE22 GLN 48 2HE2 GLN 48 12.934 13.692 -5.212 378 H SER 49 H SER 49 12.069 8.335 -4.125 379 HA SER 49 HA SER 49 13.291 5.690 -4.671 380 HB2 SER 49 1HB SER 49 11.039 5.530 -3.777 381 HB3 SER 49 2HB SER 49 10.412 6.702 -4.943 382 HG SER 49 HG SER 49 10.209 4.329 -5.452 383 H ILE 50 H ILE 50 13.600 5.103 -6.774 384 HA ILE 50 HA ILE 50 12.841 6.845 -8.985 385 HB ILE 50 HB ILE 50 15.076 6.607 -10.012 386 HG12 ILE 50 1HG1 ILE 50 16.021 5.649 -7.275 387 HG13 ILE 50 2HG1 ILE 50 15.818 4.616 -8.698 388 HG21 ILE 50 1HG2 ILE 50 16.113 8.457 -8.877 389 HG22 ILE 50 2HG2 ILE 50 14.368 8.674 -8.744 390 HG23 ILE 50 3HG2 ILE 50 15.291 8.084 -7.352 391 HD11 ILE 50 3HD1 ILE 50 17.772 6.922 -8.411 392 HD12 ILE 50 1HD1 ILE 50 18.132 5.193 -8.510 393 HD13 ILE 50 2HD1 ILE 50 17.470 6.031 -9.926 394 H GLN 51 H GLN 51 12.157 4.029 -7.650 395 HA GLN 51 HA GLN 51 12.786 2.258 -9.924 396 HB2 GLN 51 1HB GLN 51 11.459 0.603 -8.437 397 HB3 GLN 51 2HB GLN 51 13.089 1.019 -7.993 398 HG2 GLN 51 1HG GLN 51 12.222 2.640 -6.313 399 HG3 GLN 51 2HG GLN 51 10.574 2.208 -6.788 400 HE21 GLN 51 1HE2 GLN 51 10.705 -0.539 -6.892 401 HE22 GLN 51 2HE2 GLN 51 10.537 -0.906 -5.221 402 H ASP 52 H ASP 52 11.016 1.013 -10.815 403 HA ASP 52 HA ASP 52 8.438 2.511 -10.877 404 HB2 ASP 52 1HB ASP 52 10.141 1.751 -13.083 405 HB3 ASP 52 2HB ASP 52 8.617 0.886 -13.218 406 H TYR 53 H TYR 53 9.862 -0.472 -9.930 407 HA TYR 53 HA TYR 53 7.248 -1.628 -9.388 408 HB2 TYR 53 1HB TYR 53 9.204 -2.833 -11.387 409 HB3 TYR 53 2HB TYR 53 8.093 -3.847 -10.495 410 HD1 TYR 53 2HD TYR 53 5.547 -3.113 -10.489 411 HD2 TYR 53 1HD TYR 53 8.456 -1.988 -13.465 412 HE1 TYR 53 2HE TYR 53 3.721 -2.483 -12.006 413 HE2 TYR 53 1HE TYR 53 6.665 -1.372 -14.999 414 HH TYR 53 HH TYR 53 3.486 -0.794 -14.025 415 HA PRO 54 HA PRO 54 9.786 -3.549 -6.191 416 HB2 PRO 54 1HB PRO 54 8.516 -5.932 -5.712 417 HB3 PRO 54 2HB PRO 54 7.824 -4.349 -5.256 418 HG2 PRO 54 1HG PRO 54 7.167 -5.970 -7.702 419 HG3 PRO 54 2HG PRO 54 6.059 -5.214 -6.502 420 HD2 PRO 54 1HD PRO 54 6.715 -3.996 -8.851 421 HD3 PRO 54 2HD PRO 54 6.482 -3.055 -7.351 422 H SER 55 H SER 55 11.596 -4.843 -6.149 423 HA SER 55 HA SER 55 12.374 -6.379 -8.428 424 HB2 SER 55 1HB SER 55 13.611 -5.235 -6.268 425 HB3 SER 55 2HB SER 55 13.823 -6.966 -5.940 426 HG SER 55 HG SER 55 14.642 -7.110 -8.125 427 H ALA 56 H ALA 56 10.684 -7.231 -5.424 428 HA ALA 56 HA ALA 56 11.445 -9.986 -5.280 429 HB1 ALA 56 1HB ALA 56 9.506 -10.192 -3.753 430 HB2 ALA 56 2HB ALA 56 10.442 -8.739 -3.378 431 HB3 ALA 56 3HB ALA 56 8.910 -8.604 -4.275 432 H GLU 57 H GLU 57 10.313 -11.834 -5.737 433 HA GLU 57 HA GLU 57 8.626 -11.820 -8.144 434 HB2 GLU 57 1HB GLU 57 10.057 -13.811 -6.384 435 HB3 GLU 57 2HB GLU 57 8.678 -14.387 -7.341 436 HG2 GLU 57 1HG GLU 57 9.718 -13.457 -9.397 437 HG3 GLU 57 2HG GLU 57 11.120 -12.940 -8.441 438 H GLU 58 H GLU 58 8.308 -12.196 -4.610 439 HA GLU 58 HA GLU 58 5.455 -12.969 -4.922 440 HB2 GLU 58 1HB GLU 58 7.472 -13.741 -2.797 441 HB3 GLU 58 2HB GLU 58 5.695 -13.859 -2.625 442 HG2 GLU 58 1HG GLU 58 5.517 -15.367 -4.510 443 HG3 GLU 58 2HG GLU 58 7.198 -15.130 -4.954 444 H TYR 59 H TYR 59 4.558 -11.169 -5.009 445 HA TYR 59 HA TYR 59 4.387 -9.386 -2.731 446 HB2 TYR 59 1HB TYR 59 4.345 -7.374 -4.173 447 HB3 TYR 59 2HB TYR 59 5.936 -8.138 -4.171 448 HD1 TYR 59 1HD TYR 59 2.811 -7.493 -6.112 449 HD2 TYR 59 2HD TYR 59 6.862 -8.936 -6.220 450 HE1 TYR 59 1HE TYR 59 2.703 -7.542 -8.572 451 HE2 TYR 59 2HE TYR 59 6.819 -8.898 -8.681 452 HH TYR 59 HH TYR 59 5.236 -8.983 -10.506 453 H GLY 60 H GLY 60 2.452 -8.010 -3.151 454 HA2 GLY 60 1HA GLY 60 0.528 -9.050 -5.178 455 HA3 GLY 60 2HA GLY 60 -0.045 -8.904 -3.514 456 H THR 61 H THR 61 -1.547 -7.399 -4.935 457 HA THR 61 HA THR 61 -0.304 -4.741 -5.450 458 HB THR 61 HB THR 61 -2.576 -6.084 -6.964 459 HG1 THR 61 1HG THR 61 -1.075 -6.719 -8.450 460 HG21 THR 61 3HG2 THR 61 -0.738 -3.763 -7.654 461 HG22 THR 61 1HG2 THR 61 -2.461 -3.659 -7.251 462 HG23 THR 61 2HG2 THR 61 -1.953 -4.475 -8.740 463 H ILE 62 H ILE 62 -1.200 -3.084 -4.380 464 HA ILE 62 HA ILE 62 -3.933 -3.381 -3.205 465 HB ILE 62 HB ILE 62 -1.864 -1.249 -2.583 466 HG12 ILE 62 1HG1 ILE 62 -2.041 -2.679 -0.243 467 HG13 ILE 62 2HG1 ILE 62 -2.186 -3.991 -1.403 468 HG21 ILE 62 1HG2 ILE 62 -4.373 -2.055 -1.068 469 HG22 ILE 62 2HG2 ILE 62 -3.295 -0.697 -0.727 470 HG23 ILE 62 3HG2 ILE 62 -4.270 -0.678 -2.185 471 HD11 ILE 62 3HD1 ILE 62 -0.008 -3.239 -2.438 472 HD12 ILE 62 1HD1 ILE 62 0.090 -1.965 -1.198 473 HD13 ILE 62 2HD1 ILE 62 0.135 -3.662 -0.717 474 H ASN 63 H ASN 63 -5.531 -2.152 -4.144 475 HA ASN 63 HA ASN 63 -4.794 -0.090 -6.172 476 HB2 ASN 63 1HB ASN 63 -7.125 -2.057 -6.327 477 HB3 ASN 63 2HB ASN 63 -6.654 -0.848 -7.509 478 HD21 ASN 63 1HD2 ASN 63 -5.782 -4.013 -6.109 479 HD22 ASN 63 2HD2 ASN 63 -4.839 -4.520 -7.497 480 H ILE 64 H ILE 64 -6.002 1.806 -5.915 481 HA ILE 64 HA ILE 64 -8.351 1.789 -4.065 482 HB ILE 64 HB ILE 64 -6.128 3.866 -4.339 483 HG12 ILE 64 1HG1 ILE 64 -6.883 2.414 -1.787 484 HG13 ILE 64 2HG1 ILE 64 -5.723 1.729 -2.889 485 HG21 ILE 64 1HG2 ILE 64 -7.332 5.118 -2.546 486 HG22 ILE 64 2HG2 ILE 64 -8.378 4.909 -3.945 487 HG23 ILE 64 3HG2 ILE 64 -8.577 3.864 -2.534 488 HD11 ILE 64 3HD1 ILE 64 -4.466 2.930 -1.245 489 HD12 ILE 64 1HD1 ILE 64 -4.356 3.837 -2.752 490 HD13 ILE 64 2HD1 ILE 64 -5.448 4.394 -1.456 491 H GLU 65 H GLU 65 -9.913 1.765 -5.720 492 HA GLU 65 HA GLU 65 -9.635 3.505 -8.043 493 HB2 GLU 65 1HB GLU 65 -10.833 1.365 -8.276 494 HB3 GLU 65 2HB GLU 65 -12.029 1.868 -7.071 495 HG2 GLU 65 1HG GLU 65 -12.773 3.694 -8.389 496 HG3 GLU 65 2HG GLU 65 -11.389 3.628 -9.473 497 H ASN 66 H ASN 66 -9.803 5.648 -7.649 498 HA ASN 66 HA ASN 66 -12.047 6.617 -6.020 499 HB2 ASN 66 1HB ASN 66 -10.720 8.166 -4.767 500 HB3 ASN 66 2HB ASN 66 -10.049 6.557 -4.523 501 HD21 ASN 66 1HD2 ASN 66 -7.976 6.007 -5.659 502 HD22 ASN 66 2HD2 ASN 66 -6.903 7.286 -6.105 503 H ASN 67 H ASN 67 -12.959 8.398 -6.870 504 HA ASN 67 HA ASN 67 -13.594 9.804 -8.549 505 HB2 ASN 67 1HB ASN 67 -10.657 10.578 -8.526 506 HB3 ASN 67 2HB ASN 67 -11.986 11.564 -9.127 507 HD21 ASN 67 1HD2 ASN 67 -10.299 10.405 -6.245 508 HD22 ASN 67 2HD2 ASN 67 -11.196 11.356 -5.090 509 H GLY 68 H GLY 68 -13.107 7.184 -9.507 510 HA2 GLY 68 1HA GLY 68 -13.093 6.090 -11.512 511 HA3 GLY 68 2HA GLY 68 -12.934 7.655 -12.307 512 H GLY 69 H GLY 69 -10.290 6.835 -10.073 513 HA2 GLY 69 1HA GLY 69 -8.733 5.571 -12.256 514 HA3 GLY 69 2HA GLY 69 -8.086 7.024 -11.465 515 H MET 70 H MET 70 -6.912 4.358 -11.418 516 HA MET 70 HA MET 70 -7.302 3.520 -8.581 517 HB2 MET 70 1HB MET 70 -6.485 2.027 -11.077 518 HB3 MET 70 2HB MET 70 -6.257 1.372 -9.448 519 HG2 MET 70 1HG MET 70 -8.580 1.349 -8.990 520 HG3 MET 70 2HG MET 70 -8.954 2.395 -10.355 521 HE1 MET 70 3HE MET 70 -6.668 -0.844 -10.097 522 HE2 MET 70 1HE MET 70 -8.148 -1.274 -9.195 523 HE3 MET 70 2HE MET 70 -7.776 -2.068 -10.735 524 H THR 71 H THR 71 -5.986 4.777 -7.502 525 HA THR 71 HA THR 71 -3.162 5.084 -8.064 526 HB THR 71 HB THR 71 -4.458 5.078 -5.335 527 HG1 THR 71 1HG THR 71 -4.546 7.313 -7.052 528 HG21 THR 71 3HG2 THR 71 -2.212 6.762 -6.537 529 HG22 THR 71 1HG2 THR 71 -2.014 5.384 -5.431 530 HG23 THR 71 2HG2 THR 71 -2.799 6.864 -4.861 531 H THR 72 H THR 72 -1.970 3.198 -8.326 532 HA THR 72 HA THR 72 -2.698 0.818 -6.683 533 HB THR 72 HB THR 72 -1.172 1.038 -9.297 534 HG1 THR 72 1HG THR 72 -3.336 1.552 -9.514 535 HG21 THR 72 3HG2 THR 72 -1.627 -1.444 -9.432 536 HG22 THR 72 1HG2 THR 72 -2.164 -1.400 -7.754 537 HG23 THR 72 2HG2 THR 72 -0.472 -1.033 -8.156 538 H MET 73 H MET 73 -0.927 -0.434 -5.737 539 HA MET 73 HA MET 73 1.793 0.518 -5.885 540 HB2 MET 73 1HB MET 73 2.093 0.601 -3.401 541 HB3 MET 73 2HB MET 73 1.258 1.970 -4.124 542 HG2 MET 73 1HG MET 73 -0.916 0.866 -3.395 543 HG3 MET 73 2HG MET 73 0.073 -0.301 -2.536 544 HE1 MET 73 3HE MET 73 -0.250 4.202 -1.422 545 HE2 MET 73 1HE MET 73 0.797 3.687 -2.757 546 HE3 MET 73 2HE MET 73 -0.966 3.470 -2.874 547 H PHE 74 H PHE 74 3.104 -1.157 -4.432 548 HA PHE 74 HA PHE 74 1.771 -3.772 -4.237 549 HB2 PHE 74 1HB PHE 74 4.572 -3.396 -5.360 550 HB3 PHE 74 2HB PHE 74 3.682 -4.890 -5.189 551 HD1 PHE 74 2HD PHE 74 1.712 -5.384 -6.741 552 HD2 PHE 74 1HD PHE 74 4.205 -1.909 -7.266 553 HE1 PHE 74 2HE PHE 74 1.053 -5.264 -9.104 554 HE2 PHE 74 1HE PHE 74 3.520 -1.774 -9.617 555 HZ PHE 74 HZ PHE 74 1.966 -3.490 -10.578 556 H TYR 75 H TYR 75 3.691 -5.194 -2.946 557 HA TYR 75 HA TYR 75 5.113 -3.587 -0.986 558 HB2 TYR 75 1HB TYR 75 4.082 -4.684 0.931 559 HB3 TYR 75 2HB TYR 75 2.826 -3.853 0.038 560 HD1 TYR 75 1HD TYR 75 1.439 -5.294 -1.688 561 HD2 TYR 75 2HD TYR 75 3.895 -7.034 1.405 562 HE1 TYR 75 1HE TYR 75 0.208 -7.393 -1.880 563 HE2 TYR 75 2HE TYR 75 2.653 -9.179 1.179 564 HH TYR 75 HH TYR 75 0.360 -9.936 0.460 565 H TYR 76 H TYR 76 6.713 -5.057 0.124 566 HA TYR 76 HA TYR 76 6.410 -7.819 -0.200 567 HB2 TYR 76 1HB TYR 76 8.553 -8.403 -1.279 568 HB3 TYR 76 2HB TYR 76 7.383 -7.704 -2.353 569 HD1 TYR 76 2HD TYR 76 7.676 -5.364 -3.159 570 HD2 TYR 76 1HD TYR 76 10.727 -7.355 -0.868 571 HE1 TYR 76 2HE TYR 76 9.313 -3.571 -3.770 572 HE2 TYR 76 1HE TYR 76 12.387 -5.642 -1.610 573 HH TYR 76 HH TYR 76 11.987 -2.983 -2.079 574 H GLU 77 H GLU 77 8.421 -8.913 0.974 575 HA GLU 77 HA GLU 77 9.366 -7.223 3.216 576 HB2 GLU 77 1HB GLU 77 8.317 -9.477 3.690 577 HB3 GLU 77 2HB GLU 77 9.618 -10.231 2.762 578 HG2 GLU 77 1HG GLU 77 11.244 -9.015 4.380 579 HG3 GLU 77 2HG GLU 77 9.825 -8.679 5.371 580 H GLU 78 H GLU 78 11.385 -6.383 3.069 581 HA GLU 78 HA GLU 78 13.343 -7.697 1.275 582 HB2 GLU 78 1HB GLU 78 12.824 -5.464 0.395 583 HB3 GLU 78 2HB GLU 78 13.347 -4.737 1.901 584 HG2 GLU 78 1HG GLU 78 15.561 -5.032 1.459 585 HG3 GLU 78 2HG GLU 78 15.307 -6.665 0.868 586 H ASN 79 H ASN 79 14.688 -8.792 2.445 587 HA ASN 79 HA ASN 79 16.317 -9.318 3.871 588 HB2 ASN 79 1HB ASN 79 16.725 -6.707 3.129 589 HB3 ASN 79 2HB ASN 79 16.776 -6.563 4.878 590 HD21 ASN 79 1HD2 ASN 79 18.408 -7.715 1.999 591 HD22 ASN 79 2HD2 ASN 79 19.835 -8.305 2.801 592 H GLY 80 H GLY 80 13.454 -8.482 5.124 593 HA2 GLY 80 1HA GLY 80 13.014 -9.786 7.249 594 HA3 GLY 80 2HA GLY 80 14.259 -8.773 7.984 595 H LYS 81 H LYS 81 12.965 -6.432 6.046 596 HA LYS 81 HA LYS 81 10.781 -5.794 7.919 597 HB2 LYS 81 1HB LYS 81 13.235 -4.435 7.328 598 HB3 LYS 81 2HB LYS 81 11.998 -3.603 6.384 599 HG2 LYS 81 1HG LYS 81 12.089 -2.533 8.436 600 HG3 LYS 81 2HG LYS 81 10.589 -3.478 8.430 601 HD2 LYS 81 1HD LYS 81 12.261 -5.282 9.621 602 HD3 LYS 81 2HD LYS 81 13.063 -3.775 10.107 603 HE2 LYS 81 1HE LYS 81 10.986 -2.937 11.077 604 HE3 LYS 81 2HE LYS 81 10.111 -4.379 10.502 605 HZ1 LYS 81 3HZ LYS 81 12.223 -4.288 12.539 606 HZ2 LYS 81 1HZ LYS 81 11.615 -5.688 11.903 607 HZ3 LYS 81 2HZ LYS 81 10.627 -4.675 12.750 608 H TYR 82 H TYR 82 9.104 -4.297 6.879 609 HA TYR 82 HA TYR 82 8.507 -5.378 4.157 610 HB2 TYR 82 1HB TYR 82 6.676 -4.375 6.353 611 HB3 TYR 82 2HB TYR 82 6.156 -4.915 4.768 612 HD1 TYR 82 2HD TYR 82 6.325 -7.312 4.116 613 HD2 TYR 82 1HD TYR 82 7.286 -5.952 8.094 614 HE1 TYR 82 2HE TYR 82 5.993 -9.602 4.979 615 HE2 TYR 82 1HE TYR 82 6.916 -8.217 8.979 616 HH TYR 82 HH TYR 82 6.665 -10.512 8.280 617 H TYR 83 H TYR 83 7.912 -3.967 2.541 618 HA TYR 83 HA TYR 83 7.916 -1.093 3.158 619 HB2 TYR 83 1HB TYR 83 9.602 -2.320 0.938 620 HB3 TYR 83 2HB TYR 83 9.473 -0.617 1.321 621 HD1 TYR 83 2HD TYR 83 10.820 -3.887 2.484 622 HD2 TYR 83 1HD TYR 83 10.825 0.380 3.072 623 HE1 TYR 83 2HE TYR 83 12.745 -4.112 3.972 624 HE2 TYR 83 1HE TYR 83 12.774 0.180 4.592 625 HH TYR 83 HH TYR 83 14.141 -1.453 5.860 626 H ILE 84 H ILE 84 7.081 0.180 1.347 627 HA ILE 84 HA ILE 84 5.045 -1.367 -0.272 628 HB ILE 84 HB ILE 84 4.566 1.236 1.227 629 HG12 ILE 84 1HG1 ILE 84 2.726 -0.491 2.261 630 HG13 ILE 84 2HG1 ILE 84 4.005 -1.647 1.918 631 HG21 ILE 84 1HG2 ILE 84 2.197 0.947 0.602 632 HG22 ILE 84 2HG2 ILE 84 3.221 1.174 -0.819 633 HG23 ILE 84 3HG2 ILE 84 2.632 -0.454 -0.399 634 HD11 ILE 84 3HD1 ILE 84 4.101 -0.764 4.209 635 HD12 ILE 84 1HD1 ILE 84 5.554 -0.263 3.345 636 HD13 ILE 84 2HD1 ILE 84 4.232 0.894 3.608 637 H GLU 85 H GLU 85 4.791 -0.842 -2.411 638 HA GLU 85 HA GLU 85 6.730 0.884 -3.581 639 HB2 GLU 85 1HB GLU 85 5.259 -1.229 -4.544 640 HB3 GLU 85 2HB GLU 85 4.318 0.067 -5.212 641 HG2 GLU 85 1HG GLU 85 6.084 -0.825 -6.759 642 HG3 GLU 85 2HG GLU 85 6.187 0.910 -6.478 643 H CYS 86 H CYS 86 6.346 2.693 -5.111 644 HA CYS 86 HA CYS 86 3.913 4.072 -5.364 645 HB2 CYS 86 1HB CYS 86 5.585 4.706 -3.009 646 HB3 CYS 86 2HB CYS 86 5.362 6.119 -4.041 647 HG CYS 86 HG CYS 86 3.125 4.004 -2.894 648 HA PRO 87 HA PRO 87 6.899 6.183 -8.270 649 HB2 PRO 87 1HB PRO 87 6.071 8.741 -8.421 650 HB3 PRO 87 2HB PRO 87 5.070 7.415 -9.106 651 HG2 PRO 87 1HG PRO 87 4.789 8.724 -6.380 652 HG3 PRO 87 2HG PRO 87 3.532 8.462 -7.618 653 HD2 PRO 87 1HD PRO 87 3.960 6.749 -5.527 654 HD3 PRO 87 2HD PRO 87 3.358 6.195 -7.085 655 H TYR 88 H TYR 88 8.070 8.620 -7.869 656 HA TYR 88 HA TYR 88 10.212 8.315 -6.520 657 HB2 TYR 88 1HB TYR 88 8.591 10.899 -6.518 658 HB3 TYR 88 2HB TYR 88 10.302 10.803 -6.180 659 HD1 TYR 88 2HD TYR 88 11.977 10.413 -7.828 660 HD2 TYR 88 1HD TYR 88 7.797 10.631 -8.912 661 HE1 TYR 88 2HE TYR 88 12.611 10.801 -10.138 662 HE2 TYR 88 1HE TYR 88 8.440 10.935 -11.288 663 HH TYR 88 HH TYR 88 11.876 11.171 -12.304 664 H LYS 89 H LYS 89 7.341 8.533 -4.699 665 HA LYS 89 HA LYS 89 8.878 8.962 -2.211 666 HB2 LYS 89 1HB LYS 89 5.935 9.556 -2.591 667 HB3 LYS 89 2HB LYS 89 6.788 9.578 -1.053 668 HG2 LYS 89 1HG LYS 89 7.696 11.584 -1.376 669 HG3 LYS 89 2HG LYS 89 8.195 11.268 -3.009 670 HD2 LYS 89 1HD LYS 89 5.301 11.882 -2.288 671 HD3 LYS 89 2HD LYS 89 6.479 13.121 -2.797 672 HE2 LYS 89 1HE LYS 89 6.831 12.135 -4.919 673 HE3 LYS 89 2HE LYS 89 6.203 10.585 -4.391 674 HZ1 LYS 89 3HZ LYS 89 4.644 11.789 -5.852 675 HZ2 LYS 89 1HZ LYS 89 4.531 13.026 -4.776 676 HZ3 LYS 89 2HZ LYS 89 3.956 11.557 -4.371 677 H GLY 90 H GLY 90 8.891 6.436 -3.556 678 HA2 GLY 90 1HA GLY 90 7.331 4.796 -1.633 679 HA3 GLY 90 2HA GLY 90 7.753 4.344 -3.285 680 H ILE 91 H ILE 91 9.266 5.370 -0.199 681 HA ILE 91 HA ILE 91 10.766 2.859 -0.254 682 HB ILE 91 HB ILE 91 12.275 5.358 0.574 683 HG12 ILE 91 1HG1 ILE 91 12.262 3.909 -2.100 684 HG13 ILE 91 2HG1 ILE 91 11.957 5.626 -1.805 685 HG21 ILE 91 1HG2 ILE 91 13.276 2.606 -0.219 686 HG22 ILE 91 2HG2 ILE 91 14.125 3.825 0.746 687 HG23 ILE 91 3HG2 ILE 91 12.775 2.919 1.442 688 HD11 ILE 91 3HD1 ILE 91 14.249 6.064 -1.410 689 HD12 ILE 91 1HD1 ILE 91 14.688 4.342 -1.344 690 HD13 ILE 91 2HD1 ILE 91 14.171 5.055 -2.853 691 H TYR 92 H TYR 92 8.458 2.979 0.925 692 HA TYR 92 HA TYR 92 8.585 4.298 3.546 693 HB2 TYR 92 1HB TYR 92 6.407 2.361 2.652 694 HB3 TYR 92 2HB TYR 92 6.373 3.384 4.055 695 HD1 TYR 92 1HD TYR 92 6.110 3.239 0.422 696 HD2 TYR 92 2HD TYR 92 5.577 5.699 3.890 697 HE1 TYR 92 1HE TYR 92 5.005 4.892 -0.959 698 HE2 TYR 92 2HE TYR 92 4.622 7.488 2.493 699 HH TYR 92 HH TYR 92 4.811 7.253 -0.942 700 H GLU 93 H GLU 93 9.792 3.402 5.058 701 HA GLU 93 HA GLU 93 9.775 0.449 5.321 702 HB2 GLU 93 1HB GLU 93 11.800 1.931 5.951 703 HB3 GLU 93 2HB GLU 93 10.799 2.629 7.213 704 HG2 GLU 93 1HG GLU 93 10.606 0.317 8.244 705 HG3 GLU 93 2HG GLU 93 11.774 -0.244 7.039 706 H ILE 94 H ILE 94 8.137 -0.524 6.310 707 HA ILE 94 HA ILE 94 6.887 0.832 8.616 708 HB ILE 94 HB ILE 94 5.005 -0.677 8.568 709 HG12 ILE 94 1HG1 ILE 94 5.963 -1.693 5.873 710 HG13 ILE 94 2HG1 ILE 94 6.072 -2.562 7.398 711 HG21 ILE 94 1HG2 ILE 94 5.300 0.892 5.981 712 HG22 ILE 94 2HG2 ILE 94 3.772 0.366 6.714 713 HG23 ILE 94 3HG2 ILE 94 4.788 1.510 7.577 714 HD11 ILE 94 3HD1 ILE 94 3.621 -2.544 7.654 715 HD12 ILE 94 1HD1 ILE 94 3.449 -1.744 6.083 716 HD13 ILE 94 2HD1 ILE 94 4.146 -3.364 6.171 717 H GLU 95 H GLU 95 6.556 -0.704 10.432 718 HA GLU 95 HA GLU 95 8.574 -2.896 10.386 719 HB2 GLU 95 1HB GLU 95 7.986 -1.051 12.726 720 HB3 GLU 95 2HB GLU 95 9.077 -2.435 12.702 721 HG2 GLU 95 1HG GLU 95 10.312 -1.098 10.807 722 HG3 GLU 95 2HG GLU 95 9.421 0.282 11.424 723 H ASN 96 H ASN 96 6.109 -3.471 9.592 724 HA ASN 96 HA ASN 96 5.837 -5.736 11.158 725 HB2 ASN 96 1HB ASN 96 4.094 -3.753 12.181 726 HB3 ASN 96 2HB ASN 96 3.038 -4.678 11.138 727 HD21 ASN 96 1HD2 ASN 96 3.143 -4.458 14.092 728 HD22 ASN 96 2HD2 ASN 96 3.321 -6.078 14.733 729 H ASN 97 H ASN 97 3.817 -7.088 10.384 730 HA ASN 97 HA ASN 97 4.023 -7.332 7.455 731 HB2 ASN 97 1HB ASN 97 3.627 -9.337 9.056 732 HB3 ASN 97 2HB ASN 97 2.065 -8.702 9.373 733 HD21 ASN 97 1HD2 ASN 97 4.211 -10.022 6.785 734 HD22 ASN 97 2HD2 ASN 97 2.868 -10.554 5.796 735 H PHE 98 H PHE 98 2.708 -6.227 6.018 736 HA PHE 98 HA PHE 98 0.705 -4.394 6.988 737 HB2 PHE 98 1HB PHE 98 1.886 -3.889 4.959 738 HB3 PHE 98 2HB PHE 98 1.398 -5.400 4.214 739 HD1 PHE 98 2HD PHE 98 -0.910 -5.779 3.473 740 HD2 PHE 98 1HD PHE 98 0.298 -1.972 5.083 741 HE1 PHE 98 2HE PHE 98 -2.913 -4.784 2.518 742 HE2 PHE 98 1HE PHE 98 -1.740 -0.948 4.159 743 HZ PHE 98 HZ PHE 98 -3.379 -2.321 2.859 744 H GLU 99 H GLU 99 0.416 -7.617 5.299 745 HA GLU 99 HA GLU 99 -2.348 -7.625 5.137 746 HB2 GLU 99 1HB GLU 99 -0.148 -9.601 4.988 747 HB3 GLU 99 2HB GLU 99 -1.709 -10.285 5.447 748 HG2 GLU 99 1HG GLU 99 -2.783 -9.390 3.502 749 HG3 GLU 99 2HG GLU 99 -1.388 -8.467 3.042 750 H ASP 100 H ASP 100 -0.331 -8.513 8.003 751 HA ASP 100 HA ASP 100 -2.642 -9.717 9.347 752 HB2 ASP 100 1HB ASP 100 -0.496 -10.456 10.055 753 HB3 ASP 100 2HB ASP 100 0.110 -8.805 10.239 754 H MET 101 H MET 101 -1.563 -6.446 8.852 755 HA MET 101 HA MET 101 -2.815 -5.313 11.206 756 HB2 MET 101 1HB MET 101 -2.075 -4.031 8.565 757 HB3 MET 101 2HB MET 101 -2.443 -3.178 10.063 758 HG2 MET 101 1HG MET 101 -0.259 -5.089 10.423 759 HG3 MET 101 2HG MET 101 0.046 -4.009 9.067 760 HE1 MET 101 3HE MET 101 -0.061 -2.960 13.521 761 HE2 MET 101 1HE MET 101 -1.305 -3.957 12.728 762 HE3 MET 101 2HE MET 101 0.377 -4.534 12.813 763 H ILE 102 H ILE 102 -3.871 -6.109 7.880 764 HA ILE 102 HA ILE 102 -6.156 -4.307 8.064 765 HB ILE 102 HB ILE 102 -6.643 -5.044 5.726 766 HG12 ILE 102 1HG1 ILE 102 -3.915 -6.365 5.802 767 HG13 ILE 102 2HG1 ILE 102 -5.389 -7.305 6.032 768 HG21 ILE 102 1HG2 ILE 102 -5.310 -3.019 6.308 769 HG22 ILE 102 2HG2 ILE 102 -3.825 -3.986 6.257 770 HG23 ILE 102 3HG2 ILE 102 -4.774 -3.743 4.789 771 HD11 ILE 102 3HD1 ILE 102 -4.665 -7.430 3.710 772 HD12 ILE 102 1HD1 ILE 102 -6.215 -6.569 3.821 773 HD13 ILE 102 2HD1 ILE 102 -4.717 -5.665 3.557 Start of MODEL 8 1 H1 GLY 1 H GLY 1 5.617 13.809 5.963 2 HA2 GLY 1 1HA GLY 1 7.882 12.039 5.267 3 HA3 GLY 1 2HA GLY 1 7.221 12.299 6.887 4 H SER 2 H SER 2 4.579 11.827 6.847 5 HA SER 2 HA SER 2 4.025 9.160 6.282 6 HB2 SER 2 1HB SER 2 2.037 11.459 6.157 7 HB3 SER 2 2HB SER 2 1.765 9.831 6.787 8 HG SER 2 HG SER 2 2.815 10.342 8.622 9 HA PRO 3 HA PRO 3 2.972 9.323 1.862 10 HB2 PRO 3 1HB PRO 3 0.606 7.858 1.689 11 HB3 PRO 3 2HB PRO 3 2.227 7.135 1.770 12 HG2 PRO 3 1HG PRO 3 0.246 7.550 3.992 13 HG3 PRO 3 2HG PRO 3 1.318 6.145 3.652 14 HD2 PRO 3 1HD PRO 3 1.925 7.935 5.592 15 HD3 PRO 3 2HD PRO 3 3.155 7.158 4.575 16 H ILE 4 H ILE 4 1.375 10.233 0.400 17 HA ILE 4 HA ILE 4 -0.891 11.699 1.624 18 HB ILE 4 HB ILE 4 0.393 12.016 -1.135 19 HG12 ILE 4 1HG1 ILE 4 0.548 13.634 1.432 20 HG13 ILE 4 2HG1 ILE 4 1.878 12.856 0.608 21 HG21 ILE 4 1HG2 ILE 4 -1.886 13.539 0.234 22 HG22 ILE 4 2HG2 ILE 4 -1.182 13.911 -1.366 23 HG23 ILE 4 3HG2 ILE 4 -2.053 12.411 -1.125 24 HD11 ILE 4 3HD1 ILE 4 1.941 15.268 0.286 25 HD12 ILE 4 1HD1 ILE 4 1.788 14.377 -1.243 26 HD13 ILE 4 2HD1 ILE 4 0.386 15.235 -0.552 27 H LEU 5 H LEU 5 -2.617 10.424 1.636 28 HA LEU 5 HA LEU 5 -3.034 8.391 -0.468 29 HB2 LEU 5 1HB LEU 5 -4.335 7.142 1.234 30 HB3 LEU 5 2HB LEU 5 -2.612 7.170 1.536 31 HG LEU 5 HG LEU 5 -4.174 9.332 2.923 32 HD11 LEU 5 1HD1 LEU 5 -5.758 7.521 3.132 33 HD12 LEU 5 2HD1 LEU 5 -4.990 7.829 4.691 34 HD13 LEU 5 3HD1 LEU 5 -4.497 6.411 3.728 35 HD21 LEU 5 3HD2 LEU 5 -1.734 8.923 3.327 36 HD22 LEU 5 1HD2 LEU 5 -2.148 7.303 3.944 37 HD23 LEU 5 2HD2 LEU 5 -2.717 8.760 4.785 38 HA PRO 6 HA PRO 6 -6.692 10.730 -1.200 39 HB2 PRO 6 1HB PRO 6 -8.376 8.908 -2.385 40 HB3 PRO 6 2HB PRO 6 -6.864 9.465 -3.159 41 HG2 PRO 6 1HG PRO 6 -7.319 6.975 -1.491 42 HG3 PRO 6 2HG PRO 6 -6.571 7.089 -3.125 43 HD2 PRO 6 1HD PRO 6 -5.073 6.993 -0.883 44 HD3 PRO 6 2HD PRO 6 -4.600 8.036 -2.256 45 H LYS 7 H LYS 7 -8.999 11.035 -0.575 46 HA LYS 7 HA LYS 7 -9.278 10.507 2.205 47 HB2 LYS 7 1HB LYS 7 -11.473 11.470 0.321 48 HB3 LYS 7 2HB LYS 7 -11.310 11.736 2.064 49 HG2 LYS 7 1HG LYS 7 -10.517 13.775 1.457 50 HG3 LYS 7 2HG LYS 7 -8.999 12.906 1.244 51 HD2 LYS 7 1HD LYS 7 -9.319 14.149 -0.800 52 HD3 LYS 7 2HD LYS 7 -9.780 12.481 -1.160 53 HE2 LYS 7 1HE LYS 7 -11.568 13.556 -2.093 54 HE3 LYS 7 2HE LYS 7 -12.184 13.218 -0.461 55 HZ1 LYS 7 3HZ LYS 7 -12.663 15.427 -1.137 56 HZ2 LYS 7 1HZ LYS 7 -11.105 15.771 -1.479 57 HZ3 LYS 7 2HZ LYS 7 -11.618 15.551 0.096 58 H ALA 8 H ALA 8 -10.836 9.368 3.343 59 HA ALA 8 HA ALA 8 -11.844 6.909 2.241 60 HB1 ALA 8 1HB ALA 8 -11.364 7.507 4.709 61 HB2 ALA 8 2HB ALA 8 -12.921 8.338 4.701 62 HB3 ALA 8 3HB ALA 8 -12.846 6.590 4.388 63 H GLU 9 H GLU 9 -12.968 10.168 1.807 64 HA GLU 9 HA GLU 9 -15.798 9.295 1.558 65 HB2 GLU 9 1HB GLU 9 -16.357 11.589 1.488 66 HB3 GLU 9 2HB GLU 9 -15.233 11.332 2.841 67 HG2 GLU 9 1HG GLU 9 -13.399 12.273 1.523 68 HG3 GLU 9 2HG GLU 9 -14.442 12.468 0.121 69 H ASN 10 H ASN 10 -13.044 9.433 -0.442 70 HA ASN 10 HA ASN 10 -14.679 9.835 -2.856 71 HB2 ASN 10 1HB ASN 10 -13.236 11.318 -3.666 72 HB3 ASN 10 2HB ASN 10 -13.096 11.750 -1.975 73 HD21 ASN 10 1HD2 ASN 10 -11.259 9.308 -1.492 74 HD22 ASN 10 2HD2 ASN 10 -9.780 9.767 -2.323 75 H VAL 11 H VAL 11 -13.158 7.546 -1.149 76 HA VAL 11 HA VAL 11 -11.787 6.133 -3.346 77 HB VAL 11 HB VAL 11 -12.075 5.697 -0.353 78 HG11 VAL 11 1HG1 VAL 11 -10.967 3.698 -2.394 79 HG12 VAL 11 2HG1 VAL 11 -10.840 3.560 -0.622 80 HG13 VAL 11 3HG1 VAL 11 -12.418 3.468 -1.406 81 HG21 VAL 11 3HG2 VAL 11 -9.638 5.711 -0.396 82 HG22 VAL 11 1HG2 VAL 11 -9.638 5.770 -2.173 83 HG23 VAL 11 2HG2 VAL 11 -10.209 7.149 -1.252 84 H ASP 12 H ASP 12 -13.060 5.178 -4.653 85 HA ASP 12 HA ASP 12 -15.920 4.718 -4.163 86 HB2 ASP 12 1HB ASP 12 -14.057 4.392 -6.539 87 HB3 ASP 12 2HB ASP 12 -15.704 3.777 -6.550 88 H SER 13 H SER 13 -12.825 2.831 -4.670 89 HA SER 13 HA SER 13 -13.837 0.948 -2.799 90 HB2 SER 13 1HB SER 13 -13.680 -1.094 -4.302 91 HB3 SER 13 2HB SER 13 -15.074 -0.072 -4.569 92 HG SER 13 HG SER 13 -14.073 0.798 -6.390 93 H ILE 14 H ILE 14 -12.251 -0.895 -2.446 94 HA ILE 14 HA ILE 14 -9.478 -0.417 -3.388 95 HB ILE 14 HB ILE 14 -10.508 -1.221 -0.633 96 HG12 ILE 14 1HG1 ILE 14 -8.695 1.110 -1.372 97 HG13 ILE 14 2HG1 ILE 14 -10.448 1.209 -1.151 98 HG21 ILE 14 1HG2 ILE 14 -7.637 -1.275 -1.642 99 HG22 ILE 14 2HG2 ILE 14 -8.118 -1.462 0.068 100 HG23 ILE 14 3HG2 ILE 14 -8.604 -2.655 -1.106 101 HD11 ILE 14 3HD1 ILE 14 -9.393 1.971 0.865 102 HD12 ILE 14 1HD1 ILE 14 -10.248 0.448 1.185 103 HD13 ILE 14 2HD1 ILE 14 -8.477 0.472 1.035 104 H CYS 15 H CYS 15 -8.491 -2.282 -4.068 105 HA CYS 15 HA CYS 15 -9.709 -4.877 -3.358 106 HB2 CYS 15 1HB CYS 15 -9.917 -4.409 -5.882 107 HB3 CYS 15 2HB CYS 15 -8.157 -4.495 -5.930 108 HG CYS 15 HG CYS 15 -7.986 -6.871 -6.125 109 H ILE 16 H ILE 16 -8.133 -6.372 -2.767 110 HA ILE 16 HA ILE 16 -5.284 -5.638 -2.827 111 HB ILE 16 HB ILE 16 -6.686 -6.790 -0.374 112 HG12 ILE 16 1HG1 ILE 16 -5.426 -4.090 -1.008 113 HG13 ILE 16 2HG1 ILE 16 -7.087 -4.398 -0.510 114 HG21 ILE 16 1HG2 ILE 16 -4.413 -7.760 -0.834 115 HG22 ILE 16 2HG2 ILE 16 -3.754 -6.111 -0.723 116 HG23 ILE 16 3HG2 ILE 16 -4.522 -6.875 0.682 117 HD11 ILE 16 3HD1 ILE 16 -5.813 -3.364 1.267 118 HD12 ILE 16 1HD1 ILE 16 -6.307 -5.009 1.745 119 HD13 ILE 16 2HD1 ILE 16 -4.631 -4.656 1.230 120 H ASP 17 H ASP 17 -4.764 -6.996 -4.370 121 HA ASP 17 HA ASP 17 -5.891 -9.719 -4.621 122 HB2 ASP 17 1HB ASP 17 -4.310 -7.867 -6.365 123 HB3 ASP 17 2HB ASP 17 -3.937 -9.584 -6.489 124 H PHE 18 H PHE 18 -4.965 -11.252 -3.367 125 HA PHE 18 HA PHE 18 -2.597 -10.673 -1.782 126 HB2 PHE 18 1HB PHE 18 -4.660 -12.892 -1.967 127 HB3 PHE 18 2HB PHE 18 -3.198 -13.183 -1.083 128 HD1 PHE 18 1HD PHE 18 -6.028 -10.730 -1.356 129 HD2 PHE 18 2HD PHE 18 -2.927 -12.360 1.159 130 HE1 PHE 18 1HE PHE 18 -6.844 -9.378 0.515 131 HE2 PHE 18 2HE PHE 18 -3.805 -11.059 3.070 132 HZ PHE 18 HZ PHE 18 -5.796 -9.582 2.775 133 H THR 19 H THR 19 -1.052 -12.707 -1.562 134 HA THR 19 HA THR 19 0.612 -12.876 -3.825 135 HB THR 19 HB THR 19 1.576 -14.755 -2.257 136 HG1 THR 19 1HG THR 19 0.688 -14.587 -0.117 137 HG21 THR 19 3HG2 THR 19 2.459 -12.435 -2.340 138 HG22 THR 19 1HG2 THR 19 2.487 -13.103 -0.701 139 HG23 THR 19 2HG2 THR 19 1.232 -11.929 -1.159 140 H ASN 20 H ASN 20 -2.302 -14.557 -3.171 141 HA ASN 20 HA ASN 20 -1.515 -16.940 -4.742 142 HB2 ASN 20 1HB ASN 20 -2.945 -18.250 -3.360 143 HB3 ASN 20 2HB ASN 20 -1.815 -17.367 -2.354 144 HD21 ASN 20 1HD2 ASN 20 -3.639 -18.243 -0.870 145 HD22 ASN 20 2HD2 ASN 20 -4.840 -17.052 -0.402 146 H SER 21 H SER 21 -4.250 -17.950 -4.982 147 HA SER 21 HA SER 21 -4.908 -16.248 -7.288 148 HB2 SER 21 1HB SER 21 -6.368 -18.138 -7.913 149 HB3 SER 21 2HB SER 21 -4.655 -18.526 -7.777 150 HG SER 21 HG SER 21 -6.749 -19.651 -6.570 151 H ILE 22 H ILE 22 -5.493 -15.249 -4.514 152 HA ILE 22 HA ILE 22 -8.429 -14.965 -4.719 153 HB ILE 22 HB ILE 22 -6.875 -15.020 -2.106 154 HG12 ILE 22 1HG1 ILE 22 -8.317 -17.383 -3.447 155 HG13 ILE 22 2HG1 ILE 22 -6.599 -17.228 -3.124 156 HG21 ILE 22 1HG2 ILE 22 -9.834 -15.381 -2.752 157 HG22 ILE 22 2HG2 ILE 22 -9.120 -15.386 -1.127 158 HG23 ILE 22 3HG2 ILE 22 -9.081 -13.919 -2.070 159 HD11 ILE 22 3HD1 ILE 22 -7.396 -18.663 -1.440 160 HD12 ILE 22 1HD1 ILE 22 -7.192 -17.097 -0.639 161 HD13 ILE 22 2HD1 ILE 22 -8.814 -17.661 -1.114 162 H GLN 23 H GLN 23 -9.152 -12.876 -4.310 163 HA GLN 23 HA GLN 23 -7.309 -10.840 -3.445 164 HB2 GLN 23 1HB GLN 23 -8.031 -9.570 -5.137 165 HB3 GLN 23 2HB GLN 23 -7.858 -11.076 -5.990 166 HG2 GLN 23 1HG GLN 23 -10.446 -11.263 -5.586 167 HG3 GLN 23 2HG GLN 23 -10.324 -9.569 -5.105 168 HE21 GLN 23 1HE2 GLN 23 -8.090 -10.157 -7.684 169 HE22 GLN 23 2HE2 GLN 23 -9.033 -9.429 -8.896 170 H LYS 24 H LYS 24 -8.620 -9.020 -2.538 171 HA LYS 24 HA LYS 24 -11.339 -9.769 -1.652 172 HB2 LYS 24 1HB LYS 24 -9.024 -10.041 -0.009 173 HB3 LYS 24 2HB LYS 24 -9.746 -8.535 0.495 174 HG2 LYS 24 1HG LYS 24 -11.823 -10.564 0.217 175 HG3 LYS 24 2HG LYS 24 -10.476 -11.218 1.130 176 HD2 LYS 24 1HD LYS 24 -12.163 -10.272 2.601 177 HD3 LYS 24 2HD LYS 24 -10.638 -9.381 2.753 178 HE2 LYS 24 1HE LYS 24 -11.484 -7.590 1.323 179 HE3 LYS 24 2HE LYS 24 -12.930 -8.516 0.926 180 HZ1 LYS 24 3HZ LYS 24 -13.270 -6.790 2.617 181 HZ2 LYS 24 1HZ LYS 24 -12.284 -7.593 3.664 182 HZ3 LYS 24 2HZ LYS 24 -13.692 -8.257 3.145 183 H ILE 25 H ILE 25 -12.713 -8.066 -1.631 184 HA ILE 25 HA ILE 25 -11.601 -5.394 -2.274 185 HB ILE 25 HB ILE 25 -14.235 -6.728 -2.993 186 HG12 ILE 25 1HG1 ILE 25 -13.329 -5.730 -5.328 187 HG13 ILE 25 2HG1 ILE 25 -11.780 -5.828 -4.521 188 HG21 ILE 25 1HG2 ILE 25 -13.513 -3.801 -3.380 189 HG22 ILE 25 2HG2 ILE 25 -14.877 -4.619 -4.130 190 HG23 ILE 25 3HG2 ILE 25 -14.830 -4.474 -2.385 191 HD11 ILE 25 3HD1 ILE 25 -12.326 -7.812 -5.917 192 HD12 ILE 25 1HD1 ILE 25 -12.099 -8.279 -4.227 193 HD13 ILE 25 2HD1 ILE 25 -13.735 -8.147 -4.900 194 H TYR 26 H TYR 26 -12.478 -3.616 -1.149 195 HA TYR 26 HA TYR 26 -13.668 -4.292 1.514 196 HB2 TYR 26 1HB TYR 26 -11.288 -2.495 0.958 197 HB3 TYR 26 2HB TYR 26 -12.054 -2.699 2.513 198 HD1 TYR 26 1HD TYR 26 -10.072 -4.413 -0.114 199 HD2 TYR 26 2HD TYR 26 -11.455 -4.536 3.978 200 HE1 TYR 26 1HE TYR 26 -8.631 -6.395 0.343 201 HE2 TYR 26 2HE TYR 26 -10.028 -6.480 4.397 202 HH TYR 26 HH TYR 26 -8.546 -8.003 3.573 203 H ASP 27 H ASP 27 -15.084 -3.409 -0.724 204 HA ASP 27 HA ASP 27 -15.452 -0.637 -1.140 205 HB2 ASP 27 1HB ASP 27 -16.096 -2.523 -2.581 206 HB3 ASP 27 2HB ASP 27 -17.331 -3.001 -1.430 207 H ASP 28 H ASP 28 -16.406 -2.605 1.476 208 HA ASP 28 HA ASP 28 -18.672 -1.211 2.527 209 HB2 ASP 28 1HB ASP 28 -17.110 -2.680 4.520 210 HB3 ASP 28 2HB ASP 28 -18.763 -2.892 4.010 211 H SER 29 H SER 29 -18.581 0.708 3.601 212 HA SER 29 HA SER 29 -16.477 2.363 3.823 213 HB2 SER 29 1HB SER 29 -18.929 2.820 4.230 214 HB3 SER 29 2HB SER 29 -18.714 2.224 5.882 215 HG SER 29 HG SER 29 -17.398 4.396 4.625 216 H GLU 30 H GLU 30 -17.373 0.097 6.465 217 HA GLU 30 HA GLU 30 -15.439 1.175 8.324 218 HB2 GLU 30 1HB GLU 30 -17.552 0.044 8.918 219 HB3 GLU 30 2HB GLU 30 -16.919 -1.476 8.279 220 HG2 GLU 30 1HG GLU 30 -15.136 -1.463 9.993 221 HG3 GLU 30 2HG GLU 30 -15.715 0.099 10.588 222 H SER 31 H SER 31 -15.292 -1.205 5.774 223 HA SER 31 HA SER 31 -12.760 -2.515 6.489 224 HB2 SER 31 1HB SER 31 -14.375 -2.449 3.931 225 HB3 SER 31 2HB SER 31 -13.069 -3.519 4.360 226 HG SER 31 HG SER 31 -14.866 -3.606 6.344 227 H ILE 32 H ILE 32 -13.860 0.241 4.441 228 HA ILE 32 HA ILE 32 -11.214 0.862 3.457 229 HB ILE 32 HB ILE 32 -13.542 2.809 3.866 230 HG12 ILE 32 1HG1 ILE 32 -12.755 1.082 1.510 231 HG13 ILE 32 2HG1 ILE 32 -14.221 0.897 2.470 232 HG21 ILE 32 1HG2 ILE 32 -11.209 2.959 1.907 233 HG22 ILE 32 2HG2 ILE 32 -12.400 4.229 2.292 234 HG23 ILE 32 3HG2 ILE 32 -11.185 3.745 3.486 235 HD11 ILE 32 3HD1 ILE 32 -15.079 3.040 1.671 236 HD12 ILE 32 1HD1 ILE 32 -13.663 3.220 0.609 237 HD13 ILE 32 2HD1 ILE 32 -14.793 1.890 0.353 238 H GLN 33 H GLN 33 -13.169 2.130 6.202 239 HA GLN 33 HA GLN 33 -11.086 3.803 7.211 240 HB2 GLN 33 1HB GLN 33 -13.626 2.729 8.474 241 HB3 GLN 33 2HB GLN 33 -12.488 3.789 9.306 242 HG2 GLN 33 1HG GLN 33 -12.796 5.249 7.056 243 HG3 GLN 33 2HG GLN 33 -14.363 4.433 7.063 244 HE21 GLN 33 1HE2 GLN 33 -12.114 6.268 9.164 245 HE22 GLN 33 2HE2 GLN 33 -13.320 6.885 10.282 246 H LYS 34 H LYS 34 -11.385 0.413 7.452 247 HA LYS 34 HA LYS 34 -9.351 0.149 9.559 248 HB2 LYS 34 1HB LYS 34 -10.546 -1.821 9.340 249 HB3 LYS 34 2HB LYS 34 -10.694 -1.704 7.609 250 HG2 LYS 34 1HG LYS 34 -9.316 -3.589 8.313 251 HG3 LYS 34 2HG LYS 34 -8.486 -2.496 7.244 252 HD2 LYS 34 1HD LYS 34 -6.824 -2.922 8.667 253 HD3 LYS 34 2HD LYS 34 -7.454 -1.494 9.472 254 HE2 LYS 34 1HE LYS 34 -8.568 -2.830 11.134 255 HE3 LYS 34 2HE LYS 34 -8.305 -4.329 10.218 256 HZ1 LYS 34 3HZ LYS 34 -5.967 -2.772 10.946 257 HZ2 LYS 34 1HZ LYS 34 -6.143 -4.381 10.758 258 HZ3 LYS 34 2HZ LYS 34 -6.683 -3.678 12.142 259 H ILE 35 H ILE 35 -9.108 -0.599 6.079 260 HA ILE 35 HA ILE 35 -6.421 -0.850 6.097 261 HB ILE 35 HB ILE 35 -8.308 -0.030 3.848 262 HG12 ILE 35 1HG1 ILE 35 -6.921 -2.671 4.503 263 HG13 ILE 35 2HG1 ILE 35 -8.557 -2.254 5.012 264 HG21 ILE 35 1HG2 ILE 35 -5.375 -0.803 3.606 265 HG22 ILE 35 2HG2 ILE 35 -6.506 -0.784 2.240 266 HG23 ILE 35 3HG2 ILE 35 -6.148 0.706 3.065 267 HD11 ILE 35 3HD1 ILE 35 -8.575 -3.695 3.075 268 HD12 ILE 35 1HD1 ILE 35 -9.334 -2.120 2.724 269 HD13 ILE 35 2HD1 ILE 35 -7.718 -2.519 2.107 270 H LEU 36 H LEU 36 -8.041 2.276 5.495 271 HA LEU 36 HA LEU 36 -5.859 3.831 4.688 272 HB2 LEU 36 1HB LEU 36 -8.114 4.477 6.617 273 HB3 LEU 36 2HB LEU 36 -7.049 5.689 5.929 274 HG LEU 36 HG LEU 36 -8.693 3.840 4.143 275 HD11 LEU 36 1HD1 LEU 36 -10.258 4.931 5.649 276 HD12 LEU 36 2HD1 LEU 36 -10.337 5.693 4.060 277 HD13 LEU 36 3HD1 LEU 36 -9.473 6.507 5.392 278 HD21 LEU 36 3HD2 LEU 36 -7.764 6.685 3.641 279 HD22 LEU 36 1HD2 LEU 36 -8.536 5.591 2.502 280 HD23 LEU 36 2HD2 LEU 36 -6.888 5.235 3.051 281 H SER 37 H SER 37 -6.238 2.343 7.853 282 HA SER 37 HA SER 37 -4.541 4.105 9.376 283 HB2 SER 37 1HB SER 37 -6.355 2.340 10.127 284 HB3 SER 37 2HB SER 37 -5.007 1.199 10.033 285 HG SER 37 HG SER 37 -5.547 3.272 11.765 286 H GLU 38 H GLU 38 -4.108 0.767 8.055 287 HA GLU 38 HA GLU 38 -1.328 0.652 8.495 288 HB2 GLU 38 1HB GLU 38 -3.132 -0.917 6.572 289 HB3 GLU 38 2HB GLU 38 -1.491 -1.347 7.056 290 HG2 GLU 38 1HG GLU 38 -2.754 -2.664 8.461 291 HG3 GLU 38 2HG GLU 38 -2.311 -1.275 9.465 292 H ILE 39 H ILE 39 -3.225 1.855 5.776 293 HA ILE 39 HA ILE 39 -1.108 2.062 3.867 294 HB ILE 39 HB ILE 39 -3.610 3.728 4.291 295 HG12 ILE 39 1HG1 ILE 39 -3.911 1.290 3.711 296 HG13 ILE 39 2HG1 ILE 39 -4.600 2.405 2.550 297 HG21 ILE 39 1HG2 ILE 39 -2.183 5.136 2.999 298 HG22 ILE 39 2HG2 ILE 39 -1.721 3.797 1.930 299 HG23 ILE 39 3HG2 ILE 39 -3.397 4.428 1.921 300 HD11 ILE 39 3HD1 ILE 39 -2.717 1.924 1.015 301 HD12 ILE 39 1HD1 ILE 39 -1.992 0.881 2.270 302 HD13 ILE 39 2HD1 ILE 39 -3.534 0.439 1.529 303 H ALA 40 H ALA 40 -1.837 4.086 6.725 304 HA ALA 40 HA ALA 40 0.053 6.145 5.690 305 HB1 ALA 40 1HB ALA 40 -2.377 6.742 6.293 306 HB2 ALA 40 2HB ALA 40 -1.889 6.450 7.979 307 HB3 ALA 40 3HB ALA 40 -1.097 7.723 7.036 308 H THR 41 H THR 41 0.219 3.525 7.713 309 HA THR 41 HA THR 41 1.459 4.625 9.969 310 HB THR 41 HB THR 41 0.371 2.410 9.666 311 HG1 THR 41 1HG THR 41 1.345 2.798 11.486 312 HG21 THR 41 3HG2 THR 41 1.782 1.796 7.628 313 HG22 THR 41 1HG2 THR 41 1.473 0.542 8.825 314 HG23 THR 41 2HG2 THR 41 3.060 1.379 8.782 315 H GLY 42 H GLY 42 2.946 3.451 6.900 316 HA2 GLY 42 1HA GLY 42 5.612 3.771 7.824 317 HA3 GLY 42 2HA GLY 42 5.052 3.534 6.148 318 H LYS 43 H LYS 43 7.205 5.087 6.593 319 HA LYS 43 HA LYS 43 6.210 7.766 5.789 320 HB2 LYS 43 1HB LYS 43 8.509 7.144 7.696 321 HB3 LYS 43 2HB LYS 43 8.244 8.719 6.945 322 HG2 LYS 43 1HG LYS 43 6.099 8.990 8.041 323 HG3 LYS 43 2HG LYS 43 6.161 7.355 8.706 324 HD2 LYS 43 1HD LYS 43 8.245 9.444 9.376 325 HD3 LYS 43 2HD LYS 43 6.733 9.286 10.284 326 HE2 LYS 43 1HE LYS 43 7.231 7.009 10.916 327 HE3 LYS 43 2HE LYS 43 8.679 6.970 9.894 328 HZ1 LYS 43 3HZ LYS 43 9.755 8.490 11.328 329 HZ2 LYS 43 1HZ LYS 43 9.075 7.361 12.298 330 HZ3 LYS 43 2HZ LYS 43 8.376 8.820 12.180 331 H ARG 44 H ARG 44 7.182 8.314 3.870 332 HA ARG 44 HA ARG 44 8.798 6.313 2.540 333 HB2 ARG 44 1HB ARG 44 8.870 7.859 0.640 334 HB3 ARG 44 2HB ARG 44 7.276 7.481 1.229 335 HG2 ARG 44 1HG ARG 44 7.652 9.799 2.618 336 HG3 ARG 44 2HG ARG 44 8.774 10.089 1.266 337 HD2 ARG 44 1HD ARG 44 6.921 9.342 -0.270 338 HD3 ARG 44 2HD ARG 44 5.838 9.290 1.141 339 HE ARG 44 HE ARG 44 6.997 11.886 0.938 340 HH11 ARG 44 1HH1 ARG 44 4.581 9.794 -0.655 341 HH12 ARG 44 2HH1 ARG 44 3.812 11.116 -1.485 342 HH21 ARG 44 1HH2 ARG 44 5.738 13.626 0.041 343 HH22 ARG 44 2HH2 ARG 44 4.546 13.274 -1.182 344 H THR 45 H THR 45 9.683 8.285 4.851 345 HA THR 45 HA THR 45 11.514 9.252 5.668 346 HB THR 45 HB THR 45 13.594 8.160 5.356 347 HG1 THR 45 1HG THR 45 12.528 7.276 2.907 348 HG21 THR 45 3HG2 THR 45 13.061 5.883 5.780 349 HG22 THR 45 1HG2 THR 45 11.565 5.949 4.845 350 HG23 THR 45 2HG2 THR 45 11.696 6.813 6.390 351 H GLU 46 H GLU 46 13.858 10.354 4.622 352 HA GLU 46 HA GLU 46 12.698 12.318 2.723 353 HB2 GLU 46 1HB GLU 46 15.079 12.385 4.598 354 HB3 GLU 46 2HB GLU 46 14.875 13.539 3.281 355 HG2 GLU 46 1HG GLU 46 12.451 13.875 4.182 356 HG3 GLU 46 2HG GLU 46 13.038 13.057 5.630 357 H LYS 47 H LYS 47 14.074 9.399 2.268 358 HA LYS 47 HA LYS 47 16.113 10.057 0.312 359 HB2 LYS 47 1HB LYS 47 14.509 7.506 0.832 360 HB3 LYS 47 2HB LYS 47 15.916 7.603 -0.222 361 HG2 LYS 47 1HG LYS 47 15.983 8.249 2.737 362 HG3 LYS 47 2HG LYS 47 16.346 6.662 2.084 363 HD2 LYS 47 1HD LYS 47 17.910 9.028 1.020 364 HD3 LYS 47 2HD LYS 47 18.231 8.443 2.658 365 HE2 LYS 47 1HE LYS 47 18.711 6.232 1.898 366 HE3 LYS 47 2HE LYS 47 18.229 6.581 0.245 367 HZ1 LYS 47 3HZ LYS 47 20.442 8.029 1.612 368 HZ2 LYS 47 1HZ LYS 47 20.238 7.879 -0.022 369 HZ3 LYS 47 2HZ LYS 47 20.702 6.605 0.888 370 H GLN 48 H GLN 48 15.857 9.094 -1.905 371 HA GLN 48 HA GLN 48 13.367 10.075 -3.183 372 HB2 GLN 48 1HB GLN 48 14.706 10.603 -5.143 373 HB3 GLN 48 2HB GLN 48 14.969 11.576 -3.699 374 HG2 GLN 48 1HG GLN 48 17.033 11.342 -4.143 375 HG3 GLN 48 2HG GLN 48 16.975 9.807 -3.314 376 HE21 GLN 48 1HE2 GLN 48 16.601 7.772 -4.713 377 HE22 GLN 48 2HE2 GLN 48 17.389 7.836 -6.280 378 H SER 49 H SER 49 12.676 8.813 -5.123 379 HA SER 49 HA SER 49 13.455 5.966 -4.963 380 HB2 SER 49 1HB SER 49 10.598 6.775 -5.469 381 HB3 SER 49 2HB SER 49 11.253 5.359 -4.631 382 HG SER 49 HG SER 49 11.041 8.063 -3.779 383 H ILE 50 H ILE 50 13.243 4.916 -7.088 384 HA ILE 50 HA ILE 50 13.247 6.847 -9.360 385 HB ILE 50 HB ILE 50 15.379 5.921 -10.108 386 HG12 ILE 50 1HG1 ILE 50 15.593 4.473 -7.436 387 HG13 ILE 50 2HG1 ILE 50 15.067 3.661 -8.900 388 HG21 ILE 50 1HG2 ILE 50 15.224 7.946 -8.568 389 HG22 ILE 50 2HG2 ILE 50 15.684 6.872 -7.239 390 HG23 ILE 50 3HG2 ILE 50 16.782 7.134 -8.612 391 HD11 ILE 50 3HD1 ILE 50 17.171 4.073 -10.008 392 HD12 ILE 50 1HD1 ILE 50 17.756 5.051 -8.643 393 HD13 ILE 50 2HD1 ILE 50 17.465 3.325 -8.419 394 H GLN 51 H GLN 51 11.391 4.544 -8.474 395 HA GLN 51 HA GLN 51 11.435 3.029 -11.015 396 HB2 GLN 51 1HB GLN 51 11.032 0.963 -9.467 397 HB3 GLN 51 2HB GLN 51 12.663 1.560 -9.681 398 HG2 GLN 51 1HG GLN 51 12.568 2.755 -7.501 399 HG3 GLN 51 2HG GLN 51 10.880 2.250 -7.319 400 HE21 GLN 51 1HE2 GLN 51 10.479 0.155 -6.619 401 HE22 GLN 51 2HE2 GLN 51 11.662 -1.002 -6.152 402 H ASP 52 H ASP 52 9.389 1.421 -10.648 403 HA ASP 52 HA ASP 52 7.141 2.847 -9.357 404 HB2 ASP 52 1HB ASP 52 7.499 2.652 -12.243 405 HB3 ASP 52 2HB ASP 52 6.108 1.695 -11.788 406 H TYR 53 H TYR 53 8.944 -0.026 -9.602 407 HA TYR 53 HA TYR 53 6.641 -1.728 -8.960 408 HB2 TYR 53 1HB TYR 53 8.301 -1.906 -11.452 409 HB3 TYR 53 2HB TYR 53 8.024 -3.405 -10.612 410 HD1 TYR 53 2HD TYR 53 6.089 -0.479 -11.940 411 HD2 TYR 53 1HD TYR 53 6.104 -4.688 -11.014 412 HE1 TYR 53 2HE TYR 53 3.861 -0.672 -12.922 413 HE2 TYR 53 1HE TYR 53 3.900 -4.933 -12.035 414 HH TYR 53 HH TYR 53 1.909 -2.215 -13.030 415 HA PRO 54 HA PRO 54 9.175 -3.092 -5.903 416 HB2 PRO 54 1HB PRO 54 8.305 -5.624 -5.292 417 HB3 PRO 54 2HB PRO 54 7.320 -4.139 -5.093 418 HG2 PRO 54 1HG PRO 54 7.260 -6.076 -7.403 419 HG3 PRO 54 2HG PRO 54 5.907 -5.423 -6.402 420 HD2 PRO 54 1HD PRO 54 6.594 -4.293 -8.796 421 HD3 PRO 54 2HD PRO 54 6.101 -3.279 -7.411 422 H SER 55 H SER 55 10.636 -4.510 -4.941 423 HA SER 55 HA SER 55 12.558 -5.771 -6.789 424 HB2 SER 55 1HB SER 55 12.926 -3.828 -5.010 425 HB3 SER 55 2HB SER 55 13.001 -5.165 -3.855 426 HG SER 55 HG SER 55 14.710 -4.380 -5.915 427 H ALA 56 H ALA 56 9.991 -7.115 -5.896 428 HA ALA 56 HA ALA 56 11.069 -9.452 -4.391 429 HB1 ALA 56 1HB ALA 56 8.883 -9.609 -3.262 430 HB2 ALA 56 2HB ALA 56 9.766 -8.130 -2.861 431 HB3 ALA 56 3HB ALA 56 8.397 -8.072 -4.005 432 H GLU 57 H GLU 57 10.202 -11.443 -4.963 433 HA GLU 57 HA GLU 57 8.833 -11.635 -7.585 434 HB2 GLU 57 1HB GLU 57 10.647 -13.311 -5.950 435 HB3 GLU 57 2HB GLU 57 9.241 -14.222 -6.484 436 HG2 GLU 57 1HG GLU 57 11.047 -12.608 -8.329 437 HG3 GLU 57 2HG GLU 57 11.177 -14.344 -8.048 438 H GLU 58 H GLU 58 8.155 -11.827 -4.139 439 HA GLU 58 HA GLU 58 5.429 -12.854 -4.682 440 HB2 GLU 58 1HB GLU 58 7.433 -13.767 -2.608 441 HB3 GLU 58 2HB GLU 58 5.677 -13.815 -2.303 442 HG2 GLU 58 1HG GLU 58 5.249 -15.392 -3.942 443 HG3 GLU 58 2HG GLU 58 6.625 -14.924 -4.924 444 H TYR 59 H TYR 59 4.322 -11.149 -4.583 445 HA TYR 59 HA TYR 59 4.243 -9.366 -2.300 446 HB2 TYR 59 1HB TYR 59 4.297 -7.355 -3.674 447 HB3 TYR 59 2HB TYR 59 5.824 -8.206 -3.808 448 HD1 TYR 59 1HD TYR 59 2.661 -7.279 -5.533 449 HD2 TYR 59 2HD TYR 59 6.565 -9.057 -5.975 450 HE1 TYR 59 1HE TYR 59 2.412 -7.180 -7.975 451 HE2 TYR 59 2HE TYR 59 6.361 -8.911 -8.429 452 HH TYR 59 HH TYR 59 3.381 -7.545 -9.982 453 H GLY 60 H GLY 60 2.150 -8.053 -2.604 454 HA2 GLY 60 1HA GLY 60 0.209 -9.332 -4.481 455 HA3 GLY 60 2HA GLY 60 -0.224 -8.871 -2.834 456 H THR 61 H THR 61 -1.623 -7.757 -4.872 457 HA THR 61 HA THR 61 -0.401 -5.121 -5.534 458 HB THR 61 HB THR 61 -2.419 -6.824 -7.055 459 HG1 THR 61 1HG THR 61 -0.681 -7.051 -8.485 460 HG21 THR 61 3HG2 THR 61 -1.133 -4.130 -7.721 461 HG22 THR 61 1HG2 THR 61 -2.869 -4.476 -7.537 462 HG23 THR 61 2HG2 THR 61 -1.975 -5.155 -8.908 463 H ILE 62 H ILE 62 -1.558 -3.293 -5.136 464 HA ILE 62 HA ILE 62 -4.132 -3.578 -3.652 465 HB ILE 62 HB ILE 62 -1.889 -1.615 -3.151 466 HG12 ILE 62 1HG1 ILE 62 -1.941 -3.006 -0.849 467 HG13 ILE 62 2HG1 ILE 62 -2.392 -4.312 -1.931 468 HG21 ILE 62 1HG2 ILE 62 -3.146 -1.050 -1.112 469 HG22 ILE 62 2HG2 ILE 62 -4.075 -0.718 -2.577 470 HG23 ILE 62 3HG2 ILE 62 -4.440 -2.169 -1.608 471 HD11 ILE 62 3HD1 ILE 62 0.052 -2.500 -2.352 472 HD12 ILE 62 1HD1 ILE 62 0.095 -4.075 -1.511 473 HD13 ILE 62 2HD1 ILE 62 -0.313 -3.996 -3.217 474 H ASN 63 H ASN 63 -5.714 -2.454 -4.551 475 HA ASN 63 HA ASN 63 -5.148 -0.287 -6.520 476 HB2 ASN 63 1HB ASN 63 -7.717 -1.896 -6.206 477 HB3 ASN 63 2HB ASN 63 -7.259 -0.860 -7.540 478 HD21 ASN 63 1HD2 ASN 63 -6.025 -1.805 -9.270 479 HD22 ASN 63 2HD2 ASN 63 -5.560 -3.518 -9.183 480 H ILE 64 H ILE 64 -5.962 1.721 -5.945 481 HA ILE 64 HA ILE 64 -8.094 1.845 -3.861 482 HB ILE 64 HB ILE 64 -5.880 3.921 -4.166 483 HG12 ILE 64 1HG1 ILE 64 -6.186 1.849 -1.970 484 HG13 ILE 64 2HG1 ILE 64 -4.963 1.813 -3.246 485 HG21 ILE 64 1HG2 ILE 64 -8.132 3.512 -2.136 486 HG22 ILE 64 2HG2 ILE 64 -6.908 4.786 -2.053 487 HG23 ILE 64 3HG2 ILE 64 -8.056 4.766 -3.390 488 HD11 ILE 64 3HD1 ILE 64 -5.148 3.918 -1.061 489 HD12 ILE 64 1HD1 ILE 64 -3.930 2.656 -1.252 490 HD13 ILE 64 2HD1 ILE 64 -4.029 3.966 -2.447 491 H GLU 65 H GLU 65 -9.692 1.924 -5.386 492 HA GLU 65 HA GLU 65 -9.601 3.592 -7.784 493 HB2 GLU 65 1HB GLU 65 -10.669 1.339 -7.689 494 HB3 GLU 65 2HB GLU 65 -11.796 1.935 -6.471 495 HG2 GLU 65 1HG GLU 65 -12.763 3.517 -8.060 496 HG3 GLU 65 2HG GLU 65 -11.519 3.107 -9.249 497 H ASN 66 H ASN 66 -9.961 5.745 -7.578 498 HA ASN 66 HA ASN 66 -11.891 6.698 -5.610 499 HB2 ASN 66 1HB ASN 66 -10.438 8.471 -4.766 500 HB3 ASN 66 2HB ASN 66 -9.906 6.891 -4.273 501 HD21 ASN 66 1HD2 ASN 66 -7.884 5.951 -5.570 502 HD22 ASN 66 2HD2 ASN 66 -6.791 7.205 -6.117 503 H ASN 67 H ASN 67 -13.290 7.672 -6.777 504 HA ASN 67 HA ASN 67 -14.346 9.185 -7.849 505 HB2 ASN 67 1HB ASN 67 -11.761 10.610 -8.604 506 HB3 ASN 67 2HB ASN 67 -13.388 11.253 -8.701 507 HD21 ASN 67 1HD2 ASN 67 -10.815 10.319 -6.446 508 HD22 ASN 67 2HD2 ASN 67 -11.492 11.147 -5.060 509 H GLY 68 H GLY 68 -12.104 7.327 -9.534 510 HA2 GLY 68 1HA GLY 68 -12.907 6.699 -11.878 511 HA3 GLY 68 2HA GLY 68 -12.996 8.424 -12.185 512 H GLY 69 H GLY 69 -10.441 7.155 -10.114 513 HA2 GLY 69 1HA GLY 69 -8.616 6.545 -12.214 514 HA3 GLY 69 2HA GLY 69 -8.078 7.884 -11.168 515 H MET 70 H MET 70 -6.595 5.501 -10.972 516 HA MET 70 HA MET 70 -7.241 4.905 -8.197 517 HB2 MET 70 1HB MET 70 -6.980 2.528 -8.329 518 HB3 MET 70 2HB MET 70 -8.271 2.999 -9.425 519 HG2 MET 70 1HG MET 70 -5.431 2.314 -10.260 520 HG3 MET 70 2HG MET 70 -6.804 1.232 -10.263 521 HE1 MET 70 3HE MET 70 -5.171 1.295 -12.758 522 HE2 MET 70 1HE MET 70 -6.765 0.507 -12.805 523 HE3 MET 70 2HE MET 70 -6.298 1.641 -14.090 524 H THR 71 H THR 71 -5.612 4.499 -6.947 525 HA THR 71 HA THR 71 -2.839 4.923 -7.946 526 HB THR 71 HB THR 71 -3.888 4.502 -5.104 527 HG1 THR 71 1HG THR 71 -4.309 6.591 -6.288 528 HG21 THR 71 3HG2 THR 71 -1.620 5.246 -4.429 529 HG22 THR 71 1HG2 THR 71 -1.126 5.312 -6.131 530 HG23 THR 71 2HG2 THR 71 -1.534 3.757 -5.379 531 H THR 72 H THR 72 -1.691 3.108 -8.444 532 HA THR 72 HA THR 72 -2.602 0.461 -7.463 533 HB THR 72 HB THR 72 -0.746 1.178 -9.774 534 HG1 THR 72 1HG THR 72 -3.131 -0.112 -10.299 535 HG21 THR 72 3HG2 THR 72 -0.191 -0.994 -8.795 536 HG22 THR 72 1HG2 THR 72 -0.982 -1.245 -10.344 537 HG23 THR 72 2HG2 THR 72 -1.891 -1.494 -8.830 538 H MET 73 H MET 73 -0.960 -0.687 -6.254 539 HA MET 73 HA MET 73 1.741 0.308 -5.994 540 HB2 MET 73 1HB MET 73 1.563 0.652 -3.525 541 HB3 MET 73 2HB MET 73 0.797 1.861 -4.512 542 HG2 MET 73 1HG MET 73 -1.343 0.214 -4.082 543 HG3 MET 73 2HG MET 73 -0.431 -0.006 -2.608 544 HE1 MET 73 3HE MET 73 -0.396 3.851 -1.389 545 HE2 MET 73 1HE MET 73 0.279 2.232 -1.083 546 HE3 MET 73 2HE MET 73 0.806 3.168 -2.507 547 H PHE 74 H PHE 74 2.937 -1.205 -4.423 548 HA PHE 74 HA PHE 74 1.798 -3.924 -4.244 549 HB2 PHE 74 1HB PHE 74 4.512 -3.328 -5.492 550 HB3 PHE 74 2HB PHE 74 3.655 -4.855 -5.435 551 HD1 PHE 74 2HD PHE 74 1.649 -5.214 -6.934 552 HD2 PHE 74 1HD PHE 74 4.155 -1.721 -7.263 553 HE1 PHE 74 2HE PHE 74 0.794 -4.814 -9.221 554 HE2 PHE 74 1HE PHE 74 3.271 -1.300 -9.539 555 HZ PHE 74 HZ PHE 74 1.576 -2.839 -10.521 556 H TYR 75 H TYR 75 2.844 -5.036 -2.392 557 HA TYR 75 HA TYR 75 4.958 -3.456 -1.002 558 HB2 TYR 75 1HB TYR 75 2.851 -4.936 0.522 559 HB3 TYR 75 2HB TYR 75 3.943 -3.700 1.091 560 HD1 TYR 75 1HD TYR 75 3.188 -1.538 -1.046 561 HD2 TYR 75 2HD TYR 75 0.904 -4.145 1.502 562 HE1 TYR 75 1HE TYR 75 1.322 0.078 -1.094 563 HE2 TYR 75 2HE TYR 75 -0.936 -2.538 1.491 564 HH TYR 75 HH TYR 75 -1.683 -0.541 0.697 565 H TYR 76 H TYR 76 6.367 -4.774 0.325 566 HA TYR 76 HA TYR 76 6.158 -7.679 0.172 567 HB2 TYR 76 1HB TYR 76 8.295 -7.969 -1.005 568 HB3 TYR 76 2HB TYR 76 7.023 -7.321 -1.999 569 HD1 TYR 76 1HD TYR 76 10.212 -6.601 -0.326 570 HD2 TYR 76 2HD TYR 76 7.161 -5.042 -2.913 571 HE1 TYR 76 1HE TYR 76 11.761 -4.767 -1.008 572 HE2 TYR 76 2HE TYR 76 8.687 -3.133 -3.544 573 HH TYR 76 HH TYR 76 11.653 -2.485 -1.996 574 H GLU 77 H GLU 77 8.519 -8.532 0.996 575 HA GLU 77 HA GLU 77 9.383 -6.909 3.346 576 HB2 GLU 77 1HB GLU 77 8.148 -9.116 3.802 577 HB3 GLU 77 2HB GLU 77 9.494 -9.936 3.015 578 HG2 GLU 77 1HG GLU 77 11.043 -8.881 4.722 579 HG3 GLU 77 2HG GLU 77 9.630 -8.191 5.518 580 H GLU 78 H GLU 78 11.638 -6.639 3.587 581 HA GLU 78 HA GLU 78 13.460 -8.060 1.790 582 HB2 GLU 78 1HB GLU 78 12.763 -5.828 0.755 583 HB3 GLU 78 2HB GLU 78 13.624 -5.019 2.061 584 HG2 GLU 78 1HG GLU 78 14.832 -7.117 0.327 585 HG3 GLU 78 2HG GLU 78 14.910 -5.418 -0.146 586 H ASN 79 H ASN 79 15.128 -8.799 3.030 587 HA ASN 79 HA ASN 79 16.514 -9.176 4.790 588 HB2 ASN 79 1HB ASN 79 16.482 -6.222 4.652 589 HB3 ASN 79 2HB ASN 79 17.045 -6.852 6.170 590 HD21 ASN 79 1HD2 ASN 79 17.776 -6.434 2.828 591 HD22 ASN 79 2HD2 ASN 79 19.332 -7.143 2.797 592 H GLY 80 H GLY 80 13.438 -9.007 5.198 593 HA2 GLY 80 1HA GLY 80 12.147 -9.724 6.968 594 HA3 GLY 80 2HA GLY 80 13.477 -9.482 8.085 595 H LYS 81 H LYS 81 12.722 -6.702 5.985 596 HA LYS 81 HA LYS 81 11.126 -5.357 8.031 597 HB2 LYS 81 1HB LYS 81 13.793 -4.863 7.025 598 HB3 LYS 81 2HB LYS 81 12.744 -3.708 6.226 599 HG2 LYS 81 1HG LYS 81 13.667 -2.789 8.273 600 HG3 LYS 81 2HG LYS 81 11.896 -2.964 8.346 601 HD2 LYS 81 1HD LYS 81 11.915 -4.385 10.051 602 HD3 LYS 81 2HD LYS 81 13.303 -5.295 9.468 603 HE2 LYS 81 1HE LYS 81 13.648 -2.538 10.718 604 HE3 LYS 81 2HE LYS 81 13.431 -3.988 11.711 605 HZ1 LYS 81 3HZ LYS 81 15.711 -3.727 11.471 606 HZ2 LYS 81 1HZ LYS 81 15.669 -3.488 9.851 607 HZ3 LYS 81 2HZ LYS 81 15.327 -4.966 10.449 608 H TYR 82 H TYR 82 9.417 -3.884 7.013 609 HA TYR 82 HA TYR 82 8.635 -5.143 4.421 610 HB2 TYR 82 1HB TYR 82 7.016 -3.993 6.686 611 HB3 TYR 82 2HB TYR 82 6.344 -4.346 5.101 612 HD1 TYR 82 1HD TYR 82 6.159 -6.685 4.281 613 HD2 TYR 82 2HD TYR 82 7.771 -5.782 8.191 614 HE1 TYR 82 1HE TYR 82 5.903 -9.032 4.921 615 HE2 TYR 82 2HE TYR 82 7.512 -8.114 8.839 616 HH TYR 82 HH TYR 82 7.065 -10.353 7.922 617 H TYR 83 H TYR 83 7.902 -3.953 2.678 618 HA TYR 83 HA TYR 83 8.388 -1.034 2.806 619 HB2 TYR 83 1HB TYR 83 9.640 -2.978 0.833 620 HB3 TYR 83 2HB TYR 83 9.697 -1.222 0.708 621 HD1 TYR 83 1HD TYR 83 10.948 0.153 2.317 622 HD2 TYR 83 2HD TYR 83 11.077 -4.155 2.475 623 HE1 TYR 83 1HE TYR 83 12.933 0.263 3.792 624 HE2 TYR 83 2HE TYR 83 13.054 -4.097 3.874 625 HH TYR 83 HH TYR 83 14.731 -2.614 4.875 626 H ILE 84 H ILE 84 7.412 0.178 1.228 627 HA ILE 84 HA ILE 84 5.264 -1.141 -0.347 628 HB ILE 84 HB ILE 84 5.190 1.351 1.355 629 HG12 ILE 84 1HG1 ILE 84 2.889 -0.001 1.866 630 HG13 ILE 84 2HG1 ILE 84 3.938 -1.342 1.434 631 HG21 ILE 84 1HG2 ILE 84 2.842 1.676 0.388 632 HG22 ILE 84 2HG2 ILE 84 4.226 2.228 -0.558 633 HG23 ILE 84 3HG2 ILE 84 3.434 0.722 -0.984 634 HD11 ILE 84 3HD1 ILE 84 5.547 -0.626 3.204 635 HD12 ILE 84 1HD1 ILE 84 4.388 0.651 3.664 636 HD13 ILE 84 2HD1 ILE 84 3.935 -1.068 3.775 637 H GLU 85 H GLU 85 5.490 -0.929 -2.422 638 HA GLU 85 HA GLU 85 7.355 0.899 -3.595 639 HB2 GLU 85 1HB GLU 85 6.656 -1.494 -4.387 640 HB3 GLU 85 2HB GLU 85 5.149 -0.761 -4.946 641 HG2 GLU 85 1HG GLU 85 6.735 -1.013 -6.772 642 HG3 GLU 85 2HG GLU 85 6.397 0.688 -6.513 643 H CYS 86 H CYS 86 6.843 2.498 -5.176 644 HA CYS 86 HA CYS 86 4.332 3.556 -5.759 645 HB2 CYS 86 1HB CYS 86 5.593 4.431 -3.228 646 HB3 CYS 86 2HB CYS 86 5.309 5.795 -4.320 647 HG CYS 86 HG CYS 86 3.265 3.333 -3.526 648 HA PRO 87 HA PRO 87 7.249 5.617 -8.654 649 HB2 PRO 87 1HB PRO 87 6.287 8.140 -9.033 650 HB3 PRO 87 2HB PRO 87 5.434 6.682 -9.623 651 HG2 PRO 87 1HG PRO 87 4.945 8.188 -7.031 652 HG3 PRO 87 2HG PRO 87 3.758 7.702 -8.289 653 HD2 PRO 87 1HD PRO 87 4.153 6.201 -6.077 654 HD3 PRO 87 2HD PRO 87 3.842 5.468 -7.660 655 H TYR 88 H TYR 88 8.315 8.226 -8.516 656 HA TYR 88 HA TYR 88 10.450 8.213 -7.051 657 HB2 TYR 88 1HB TYR 88 8.724 10.683 -7.467 658 HB3 TYR 88 2HB TYR 88 10.356 10.757 -6.874 659 HD1 TYR 88 1HD TYR 88 8.352 10.005 -9.868 660 HD2 TYR 88 2HD TYR 88 12.301 10.457 -8.218 661 HE1 TYR 88 1HE TYR 88 9.281 10.234 -12.149 662 HE2 TYR 88 2HE TYR 88 13.230 10.784 -10.474 663 HH TYR 88 HH TYR 88 11.361 10.083 -13.315 664 H LYS 89 H LYS 89 7.564 8.232 -5.300 665 HA LYS 89 HA LYS 89 8.957 9.099 -2.843 666 HB2 LYS 89 1HB LYS 89 6.033 9.733 -3.388 667 HB3 LYS 89 2HB LYS 89 7.045 10.259 -2.038 668 HG2 LYS 89 1HG LYS 89 7.364 11.172 -4.905 669 HG3 LYS 89 2HG LYS 89 6.620 12.044 -3.583 670 HD2 LYS 89 1HD LYS 89 8.540 12.660 -2.605 671 HD3 LYS 89 2HD LYS 89 9.409 11.189 -3.008 672 HE2 LYS 89 1HE LYS 89 10.428 12.165 -4.691 673 HE3 LYS 89 2HE LYS 89 8.897 12.435 -5.506 674 HZ1 LYS 89 3HZ LYS 89 8.706 14.542 -4.318 675 HZ2 LYS 89 1HZ LYS 89 10.171 14.479 -5.113 676 HZ3 LYS 89 2HZ LYS 89 10.075 14.257 -3.490 677 H GLY 90 H GLY 90 8.975 6.525 -3.752 678 HA2 GLY 90 1HA GLY 90 7.202 5.108 -1.819 679 HA3 GLY 90 2HA GLY 90 7.687 4.502 -3.414 680 H ILE 91 H ILE 91 9.212 5.694 -0.364 681 HA ILE 91 HA ILE 91 10.614 3.105 -0.230 682 HB ILE 91 HB ILE 91 12.062 5.677 0.523 683 HG12 ILE 91 1HG1 ILE 91 12.110 4.053 -2.026 684 HG13 ILE 91 2HG1 ILE 91 11.932 5.790 -1.790 685 HG21 ILE 91 1HG2 ILE 91 12.653 3.516 1.746 686 HG22 ILE 91 2HG2 ILE 91 13.142 2.849 0.191 687 HG23 ILE 91 3HG2 ILE 91 13.999 4.262 0.866 688 HD11 ILE 91 3HD1 ILE 91 14.078 5.213 -2.789 689 HD12 ILE 91 1HD1 ILE 91 14.312 5.979 -1.196 690 HD13 ILE 91 2HD1 ILE 91 14.510 4.214 -1.412 691 H TYR 92 H TYR 92 8.313 3.239 0.842 692 HA TYR 92 HA TYR 92 8.374 4.460 3.537 693 HB2 TYR 92 1HB TYR 92 6.275 2.565 2.563 694 HB3 TYR 92 2HB TYR 92 6.210 3.597 3.942 695 HD1 TYR 92 1HD TYR 92 6.110 3.616 0.180 696 HD2 TYR 92 2HD TYR 92 5.494 5.852 3.830 697 HE1 TYR 92 1HE TYR 92 5.067 5.430 -1.100 698 HE2 TYR 92 2HE TYR 92 4.563 7.725 2.535 699 HH TYR 92 HH TYR 92 4.007 7.509 -1.002 700 H GLU 93 H GLU 93 9.185 3.498 5.210 701 HA GLU 93 HA GLU 93 10.024 0.649 5.018 702 HB2 GLU 93 1HB GLU 93 11.787 2.268 4.711 703 HB3 GLU 93 2HB GLU 93 11.257 3.234 6.061 704 HG2 GLU 93 1HG GLU 93 11.989 0.473 6.836 705 HG3 GLU 93 2HG GLU 93 13.292 1.320 6.016 706 H ILE 94 H ILE 94 8.492 -0.435 6.207 707 HA ILE 94 HA ILE 94 7.478 0.756 8.749 708 HB ILE 94 HB ILE 94 5.415 -0.110 8.471 709 HG12 ILE 94 1HG1 ILE 94 6.270 -1.741 6.062 710 HG13 ILE 94 2HG1 ILE 94 5.928 -2.361 7.679 711 HG21 ILE 94 1HG2 ILE 94 6.068 0.704 5.620 712 HG22 ILE 94 2HG2 ILE 94 4.614 1.073 6.582 713 HG23 ILE 94 3HG2 ILE 94 6.170 1.824 6.987 714 HD11 ILE 94 3HD1 ILE 94 4.003 -2.733 6.225 715 HD12 ILE 94 1HD1 ILE 94 3.610 -1.661 7.585 716 HD13 ILE 94 2HD1 ILE 94 3.835 -0.989 5.967 717 H GLU 95 H GLU 95 7.351 -0.725 10.575 718 HA GLU 95 HA GLU 95 9.348 -2.846 10.300 719 HB2 GLU 95 1HB GLU 95 8.152 -1.446 12.732 720 HB3 GLU 95 2HB GLU 95 9.156 -2.893 12.865 721 HG2 GLU 95 1HG GLU 95 10.815 -1.636 11.340 722 HG3 GLU 95 2HG GLU 95 9.957 -0.173 11.814 723 H ASN 96 H ASN 96 6.075 -2.912 10.056 724 HA ASN 96 HA ASN 96 5.981 -5.792 10.941 725 HB2 ASN 96 1HB ASN 96 3.792 -3.777 11.370 726 HB3 ASN 96 2HB ASN 96 3.603 -5.515 11.535 727 HD21 ASN 96 1HD2 ASN 96 3.294 -3.511 13.507 728 HD22 ASN 96 2HD2 ASN 96 4.299 -3.996 14.865 729 H ASN 97 H ASN 97 4.635 -7.152 9.872 730 HA ASN 97 HA ASN 97 4.264 -6.970 7.083 731 HB2 ASN 97 1HB ASN 97 4.434 -9.063 8.396 732 HB3 ASN 97 2HB ASN 97 2.957 -8.698 9.233 733 HD21 ASN 97 1HD2 ASN 97 4.328 -9.991 6.301 734 HD22 ASN 97 2HD2 ASN 97 2.799 -10.543 5.634 735 H PHE 98 H PHE 98 2.576 -6.292 5.806 736 HA PHE 98 HA PHE 98 0.446 -4.657 7.007 737 HB2 PHE 98 1HB PHE 98 1.765 -3.906 5.049 738 HB3 PHE 98 2HB PHE 98 1.168 -5.263 4.116 739 HD1 PHE 98 1HD PHE 98 -1.335 -5.418 3.604 740 HD2 PHE 98 2HD PHE 98 0.555 -1.817 5.055 741 HE1 PHE 98 1HE PHE 98 -3.251 -4.099 2.841 742 HE2 PHE 98 2HE PHE 98 -1.371 -0.482 4.232 743 HZ PHE 98 HZ PHE 98 -3.308 -1.620 3.181 744 H GLU 99 H GLU 99 0.681 -7.660 4.998 745 HA GLU 99 HA GLU 99 -2.114 -7.768 4.534 746 HB2 GLU 99 1HB GLU 99 0.237 -9.518 3.944 747 HB3 GLU 99 2HB GLU 99 -1.363 -10.276 3.853 748 HG2 GLU 99 1HG GLU 99 -2.180 -8.592 2.313 749 HG3 GLU 99 2HG GLU 99 -0.693 -7.659 2.452 750 H ASP 100 H ASP 100 -0.461 -8.898 7.336 751 HA ASP 100 HA ASP 100 -2.795 -10.563 8.147 752 HB2 ASP 100 1HB ASP 100 -0.370 -11.242 8.543 753 HB3 ASP 100 2HB ASP 100 -0.295 -9.967 9.756 754 H MET 101 H MET 101 -1.959 -7.265 8.325 755 HA MET 101 HA MET 101 -3.082 -6.718 10.989 756 HB2 MET 101 1HB MET 101 -2.364 -4.931 8.632 757 HB3 MET 101 2HB MET 101 -2.999 -4.338 10.151 758 HG2 MET 101 1HG MET 101 -0.550 -6.071 10.209 759 HG3 MET 101 2HG MET 101 -0.398 -4.414 9.644 760 HE1 MET 101 3HE MET 101 -0.554 -2.357 10.920 761 HE2 MET 101 1HE MET 101 -2.242 -2.600 11.411 762 HE3 MET 101 2HE MET 101 -1.022 -2.179 12.625 763 H ILE 102 H ILE 102 -4.132 -6.758 7.643 764 HA ILE 102 HA ILE 102 -6.094 -4.792 7.923 765 HB ILE 102 HB ILE 102 -6.557 -5.436 5.464 766 HG12 ILE 102 1HG1 ILE 102 -4.043 -7.118 5.813 767 HG13 ILE 102 2HG1 ILE 102 -5.656 -7.812 5.700 768 HG21 ILE 102 1HG2 ILE 102 -5.074 -3.584 6.326 769 HG22 ILE 102 2HG2 ILE 102 -3.696 -4.702 6.210 770 HG23 ILE 102 3HG2 ILE 102 -4.615 -4.242 4.762 771 HD11 ILE 102 3HD1 ILE 102 -4.499 -7.884 3.543 772 HD12 ILE 102 1HD1 ILE 102 -5.926 -6.835 3.437 773 HD13 ILE 102 2HD1 ILE 102 -4.293 -6.135 3.546 Start of MODEL 9 1 H1 GLY 1 H GLY 1 7.589 10.758 8.226 2 HA2 GLY 1 1HA GLY 1 5.901 12.494 8.318 3 HA3 GLY 1 2HA GLY 1 6.569 13.138 6.800 4 H SER 2 H SER 2 3.801 12.011 7.530 5 HA SER 2 HA SER 2 3.441 9.441 6.518 6 HB2 SER 2 1HB SER 2 1.968 11.390 7.810 7 HB3 SER 2 2HB SER 2 1.235 11.442 6.209 8 HG SER 2 HG SER 2 1.609 9.088 7.762 9 HA PRO 3 HA PRO 3 3.079 10.191 2.043 10 HB2 PRO 3 1HB PRO 3 1.037 8.508 1.284 11 HB3 PRO 3 2HB PRO 3 2.689 7.969 1.609 12 HG2 PRO 3 1HG PRO 3 0.307 7.858 3.445 13 HG3 PRO 3 2HG PRO 3 1.571 6.611 3.147 14 HD2 PRO 3 1HD PRO 3 1.594 8.253 5.323 15 HD3 PRO 3 2HD PRO 3 3.081 7.687 4.540 16 H ILE 4 H ILE 4 1.617 11.042 0.437 17 HA ILE 4 HA ILE 4 -0.906 12.270 1.396 18 HB ILE 4 HB ILE 4 0.579 12.722 -1.234 19 HG12 ILE 4 1HG1 ILE 4 0.656 14.454 1.270 20 HG13 ILE 4 2HG1 ILE 4 2.000 13.506 0.646 21 HG21 ILE 4 1HG2 ILE 4 -0.961 14.615 -1.482 22 HG22 ILE 4 2HG2 ILE 4 -1.890 13.152 -1.207 23 HG23 ILE 4 3HG2 ILE 4 -1.662 14.302 0.127 24 HD11 ILE 4 3HD1 ILE 4 0.761 15.889 -0.748 25 HD12 ILE 4 1HD1 ILE 4 2.376 15.749 -0.040 26 HD13 ILE 4 2HD1 ILE 4 1.963 14.783 -1.466 27 H LEU 5 H LEU 5 -2.390 10.575 1.272 28 HA LEU 5 HA LEU 5 -2.661 9.156 -1.313 29 HB2 LEU 5 1HB LEU 5 -2.778 8.192 1.565 30 HB3 LEU 5 2HB LEU 5 -3.614 7.295 0.319 31 HG LEU 5 HG LEU 5 -0.692 8.005 -0.037 32 HD11 LEU 5 1HD1 LEU 5 -1.391 6.603 2.171 33 HD12 LEU 5 2HD1 LEU 5 0.084 6.312 1.225 34 HD13 LEU 5 3HD1 LEU 5 -1.299 5.300 0.961 35 HD21 LEU 5 3HD2 LEU 5 -1.877 7.192 -2.045 36 HD22 LEU 5 1HD2 LEU 5 -2.384 5.733 -1.160 37 HD23 LEU 5 2HD2 LEU 5 -0.668 6.033 -1.496 38 HA PRO 6 HA PRO 6 -6.734 10.748 -1.334 39 HB2 PRO 6 1HB PRO 6 -8.420 8.566 -1.826 40 HB3 PRO 6 2HB PRO 6 -7.415 9.375 -3.050 41 HG2 PRO 6 1HG PRO 6 -6.827 6.884 -1.450 42 HG3 PRO 6 2HG PRO 6 -6.616 7.136 -3.204 43 HD2 PRO 6 1HD PRO 6 -4.528 7.333 -1.548 44 HD3 PRO 6 2HD PRO 6 -4.699 8.494 -2.886 45 H LYS 7 H LYS 7 -8.842 10.872 -0.143 46 HA LYS 7 HA LYS 7 -8.727 10.217 2.621 47 HB2 LYS 7 1HB LYS 7 -11.174 10.841 0.952 48 HB3 LYS 7 2HB LYS 7 -11.030 10.921 2.703 49 HG2 LYS 7 1HG LYS 7 -10.347 13.009 2.653 50 HG3 LYS 7 2HG LYS 7 -8.910 12.548 1.758 51 HD2 LYS 7 1HD LYS 7 -9.763 13.981 0.215 52 HD3 LYS 7 2HD LYS 7 -10.675 12.518 -0.204 53 HE2 LYS 7 1HE LYS 7 -12.603 13.298 1.092 54 HE3 LYS 7 2HE LYS 7 -11.676 14.677 1.683 55 HZ1 LYS 7 3HZ LYS 7 -11.580 15.455 -0.647 56 HZ2 LYS 7 1HZ LYS 7 -13.097 15.375 -0.019 57 HZ3 LYS 7 2HZ LYS 7 -12.605 14.250 -1.104 58 H ALA 8 H ALA 8 -10.858 8.958 3.575 59 HA ALA 8 HA ALA 8 -11.147 6.342 2.224 60 HB1 ALA 8 1HB ALA 8 -11.225 6.507 4.739 61 HB2 ALA 8 2HB ALA 8 -12.676 7.516 4.598 62 HB3 ALA 8 3HB ALA 8 -12.699 5.845 4.006 63 H GLU 9 H GLU 9 -12.850 9.397 2.933 64 HA GLU 9 HA GLU 9 -15.368 8.567 2.008 65 HB2 GLU 9 1HB GLU 9 -16.030 10.815 2.558 66 HB3 GLU 9 2HB GLU 9 -14.801 10.300 3.720 67 HG2 GLU 9 1HG GLU 9 -13.109 11.452 2.085 68 HG3 GLU 9 2HG GLU 9 -14.518 12.186 1.373 69 H ASN 10 H ASN 10 -12.872 9.007 -0.048 70 HA ASN 10 HA ASN 10 -14.527 9.974 -2.298 71 HB2 ASN 10 1HB ASN 10 -12.564 11.033 -3.172 72 HB3 ASN 10 2HB ASN 10 -12.787 11.613 -1.537 73 HD21 ASN 10 1HD2 ASN 10 -11.514 8.472 -1.191 74 HD22 ASN 10 2HD2 ASN 10 -9.886 8.924 -0.935 75 H VAL 11 H VAL 11 -13.416 7.170 -1.027 76 HA VAL 11 HA VAL 11 -12.039 6.099 -3.414 77 HB VAL 11 HB VAL 11 -12.604 5.103 -0.601 78 HG11 VAL 11 1HG1 VAL 11 -11.283 3.408 -2.749 79 HG12 VAL 11 2HG1 VAL 11 -11.468 3.040 -1.027 80 HG13 VAL 11 3HG1 VAL 11 -12.896 3.128 -2.062 81 HG21 VAL 11 3HG2 VAL 11 -10.005 5.486 -2.161 82 HG22 VAL 11 1HG2 VAL 11 -10.653 6.607 -0.971 83 HG23 VAL 11 2HG2 VAL 11 -10.144 5.002 -0.456 84 H ASP 12 H ASP 12 -13.031 4.647 -4.733 85 HA ASP 12 HA ASP 12 -15.987 4.355 -4.517 86 HB2 ASP 12 1HB ASP 12 -14.487 5.042 -6.649 87 HB3 ASP 12 2HB ASP 12 -14.464 3.291 -6.857 88 H SER 13 H SER 13 -13.014 2.339 -5.108 89 HA SER 13 HA SER 13 -13.974 0.417 -3.110 90 HB2 SER 13 1HB SER 13 -13.007 -1.112 -5.401 91 HB3 SER 13 2HB SER 13 -14.446 -1.336 -4.421 92 HG SER 13 HG SER 13 -14.104 -0.042 -6.870 93 H ILE 14 H ILE 14 -12.239 -1.157 -2.432 94 HA ILE 14 HA ILE 14 -9.550 -0.670 -3.580 95 HB ILE 14 HB ILE 14 -10.113 -1.340 -0.630 96 HG12 ILE 14 1HG1 ILE 14 -9.208 1.265 -1.933 97 HG13 ILE 14 2HG1 ILE 14 -10.696 0.988 -1.034 98 HG21 ILE 14 1HG2 ILE 14 -7.701 -1.090 -0.251 99 HG22 ILE 14 2HG2 ILE 14 -8.012 -2.328 -1.430 100 HG23 ILE 14 3HG2 ILE 14 -7.450 -0.738 -1.975 101 HD11 ILE 14 3HD1 ILE 14 -9.355 0.667 1.053 102 HD12 ILE 14 1HD1 ILE 14 -7.895 1.131 0.135 103 HD13 ILE 14 2HD1 ILE 14 -9.210 2.284 0.330 104 H CYS 15 H CYS 15 -8.441 -2.363 -4.091 105 HA CYS 15 HA CYS 15 -9.752 -4.987 -3.892 106 HB2 CYS 15 1HB CYS 15 -8.326 -3.542 -6.177 107 HB3 CYS 15 2HB CYS 15 -9.199 -5.029 -6.212 108 HG CYS 15 HG CYS 15 -11.590 -3.926 -5.517 109 H ILE 16 H ILE 16 -8.276 -6.312 -2.748 110 HA ILE 16 HA ILE 16 -5.375 -5.818 -3.166 111 HB ILE 16 HB ILE 16 -6.793 -6.861 -0.685 112 HG12 ILE 16 1HG1 ILE 16 -5.587 -4.156 -1.383 113 HG13 ILE 16 2HG1 ILE 16 -7.242 -4.507 -0.888 114 HG21 ILE 16 1HG2 ILE 16 -3.844 -6.218 -1.130 115 HG22 ILE 16 2HG2 ILE 16 -4.580 -6.844 0.368 116 HG23 ILE 16 3HG2 ILE 16 -4.527 -7.848 -1.069 117 HD11 ILE 16 3HD1 ILE 16 -4.791 -4.585 0.876 118 HD12 ILE 16 1HD1 ILE 16 -6.102 -3.410 0.912 119 HD13 ILE 16 2HD1 ILE 16 -6.410 -5.097 1.396 120 H ASP 17 H ASP 17 -4.411 -7.463 -4.200 121 HA ASP 17 HA ASP 17 -5.824 -10.080 -4.439 122 HB2 ASP 17 1HB ASP 17 -5.364 -8.389 -6.526 123 HB3 ASP 17 2HB ASP 17 -3.883 -9.321 -6.567 124 H PHE 18 H PHE 18 -4.777 -11.429 -3.108 125 HA PHE 18 HA PHE 18 -2.309 -10.606 -1.813 126 HB2 PHE 18 1HB PHE 18 -4.211 -12.977 -1.544 127 HB3 PHE 18 2HB PHE 18 -2.799 -12.776 -0.547 128 HD1 PHE 18 1HD PHE 18 -5.800 -10.576 -1.559 129 HD2 PHE 18 2HD PHE 18 -3.159 -11.931 1.588 130 HE1 PHE 18 1HE PHE 18 -6.992 -9.191 0.069 131 HE2 PHE 18 2HE PHE 18 -4.446 -10.634 3.217 132 HZ PHE 18 HZ PHE 18 -6.388 -9.261 2.475 133 H THR 19 H THR 19 -0.464 -12.365 -1.469 134 HA THR 19 HA THR 19 0.954 -12.809 -3.754 135 HB THR 19 HB THR 19 2.088 -14.681 -2.342 136 HG1 THR 19 1HG THR 19 1.189 -15.173 -0.488 137 HG21 THR 19 3HG2 THR 19 1.766 -11.907 -1.170 138 HG22 THR 19 1HG2 THR 19 2.969 -12.443 -2.374 139 HG23 THR 19 2HG2 THR 19 3.028 -13.089 -0.735 140 H ASN 20 H ASN 20 -1.242 -14.932 -2.283 141 HA ASN 20 HA ASN 20 -1.440 -17.263 -3.859 142 HB2 ASN 20 1HB ASN 20 -3.602 -15.657 -2.430 143 HB3 ASN 20 2HB ASN 20 -3.720 -17.361 -2.909 144 HD21 ASN 20 1HD2 ASN 20 -2.937 -15.312 -0.233 145 HD22 ASN 20 2HD2 ASN 20 -2.380 -16.636 0.711 146 H SER 21 H SER 21 -4.252 -17.159 -4.629 147 HA SER 21 HA SER 21 -4.463 -14.891 -6.512 148 HB2 SER 21 1HB SER 21 -5.623 -16.304 -8.083 149 HB3 SER 21 2HB SER 21 -3.982 -16.879 -7.820 150 HG SER 21 HG SER 21 -6.418 -18.018 -7.239 151 H ILE 22 H ILE 22 -5.221 -15.190 -3.682 152 HA ILE 22 HA ILE 22 -8.190 -15.220 -3.766 153 HB ILE 22 HB ILE 22 -6.603 -14.426 -1.320 154 HG12 ILE 22 1HG1 ILE 22 -7.141 -17.390 -1.765 155 HG13 ILE 22 2HG1 ILE 22 -5.617 -16.619 -2.085 156 HG21 ILE 22 1HG2 ILE 22 -8.543 -15.255 -0.121 157 HG22 ILE 22 2HG2 ILE 22 -9.140 -14.302 -1.473 158 HG23 ILE 22 3HG2 ILE 22 -9.158 -16.074 -1.571 159 HD11 ILE 22 3HD1 ILE 22 -5.458 -17.538 0.099 160 HD12 ILE 22 1HD1 ILE 22 -5.561 -15.783 0.291 161 HD13 ILE 22 2HD1 ILE 22 -6.988 -16.801 0.602 162 H GLN 23 H GLN 23 -9.252 -13.348 -3.788 163 HA GLN 23 HA GLN 23 -7.699 -10.827 -3.526 164 HB2 GLN 23 1HB GLN 23 -8.224 -11.396 -5.934 165 HB3 GLN 23 2HB GLN 23 -9.929 -11.284 -5.515 166 HG2 GLN 23 1HG GLN 23 -9.390 -8.896 -4.628 167 HG3 GLN 23 2HG GLN 23 -7.804 -9.091 -5.376 168 HE21 GLN 23 1HE2 GLN 23 -8.073 -9.927 -7.840 169 HE22 GLN 23 2HE2 GLN 23 -9.136 -8.859 -8.738 170 H LYS 24 H LYS 24 -8.556 -9.445 -2.140 171 HA LYS 24 HA LYS 24 -11.351 -9.878 -1.179 172 HB2 LYS 24 1HB LYS 24 -9.083 -10.074 0.386 173 HB3 LYS 24 2HB LYS 24 -9.532 -8.411 0.645 174 HG2 LYS 24 1HG LYS 24 -11.187 -10.921 1.077 175 HG3 LYS 24 2HG LYS 24 -10.488 -9.906 2.322 176 HD2 LYS 24 1HD LYS 24 -12.772 -9.038 0.504 177 HD3 LYS 24 2HD LYS 24 -12.925 -9.724 2.119 178 HE2 LYS 24 1HE LYS 24 -11.493 -7.787 2.991 179 HE3 LYS 24 2HE LYS 24 -11.645 -7.053 1.401 180 HZ1 LYS 24 3HZ LYS 24 -13.272 -6.470 3.243 181 HZ2 LYS 24 1HZ LYS 24 -13.987 -7.896 2.978 182 HZ3 LYS 24 2HZ LYS 24 -13.910 -6.797 1.728 183 H ILE 25 H ILE 25 -12.681 -8.220 -1.555 184 HA ILE 25 HA ILE 25 -11.533 -5.630 -2.434 185 HB ILE 25 HB ILE 25 -14.329 -6.724 -2.901 186 HG12 ILE 25 1HG1 ILE 25 -13.388 -6.361 -5.395 187 HG13 ILE 25 2HG1 ILE 25 -11.839 -6.658 -4.636 188 HG21 ILE 25 1HG2 ILE 25 -13.002 -4.185 -3.952 189 HG22 ILE 25 2HG2 ILE 25 -14.655 -4.718 -4.247 190 HG23 ILE 25 3HG2 ILE 25 -14.201 -4.237 -2.634 191 HD11 ILE 25 3HD1 ILE 25 -12.871 -8.684 -5.638 192 HD12 ILE 25 1HD1 ILE 25 -12.652 -8.902 -3.897 193 HD13 ILE 25 2HD1 ILE 25 -14.263 -8.524 -4.551 194 H TYR 26 H TYR 26 -12.030 -3.886 -1.208 195 HA TYR 26 HA TYR 26 -13.562 -4.249 1.328 196 HB2 TYR 26 1HB TYR 26 -11.072 -2.576 0.881 197 HB3 TYR 26 2HB TYR 26 -12.029 -2.622 2.341 198 HD1 TYR 26 1HD TYR 26 -9.830 -4.555 0.091 199 HD2 TYR 26 2HD TYR 26 -11.600 -4.339 4.021 200 HE1 TYR 26 1HE TYR 26 -8.382 -6.434 0.860 201 HE2 TYR 26 2HE TYR 26 -10.079 -6.043 4.826 202 HH TYR 26 HH TYR 26 -8.258 -7.356 4.368 203 H ASP 27 H ASP 27 -15.411 -3.519 0.102 204 HA ASP 27 HA ASP 27 -15.363 -0.710 -0.828 205 HB2 ASP 27 1HB ASP 27 -17.056 -1.325 -2.427 206 HB3 ASP 27 2HB ASP 27 -15.600 -2.270 -2.673 207 H ASP 28 H ASP 28 -15.470 -0.946 1.755 208 HA ASP 28 HA ASP 28 -18.171 -0.030 2.335 209 HB2 ASP 28 1HB ASP 28 -16.884 -1.349 4.665 210 HB3 ASP 28 2HB ASP 28 -18.554 -1.164 4.224 211 H SER 29 H SER 29 -18.030 1.778 3.610 212 HA SER 29 HA SER 29 -15.908 3.397 3.855 213 HB2 SER 29 1HB SER 29 -18.185 4.061 4.351 214 HB3 SER 29 2HB SER 29 -18.233 3.027 5.780 215 HG SER 29 HG SER 29 -16.592 5.334 5.421 216 H GLU 30 H GLU 30 -16.804 1.116 6.497 217 HA GLU 30 HA GLU 30 -14.580 2.063 8.089 218 HB2 GLU 30 1HB GLU 30 -16.731 1.183 8.992 219 HB3 GLU 30 2HB GLU 30 -16.217 -0.459 8.512 220 HG2 GLU 30 1HG GLU 30 -14.397 -0.433 10.076 221 HG3 GLU 30 2HG GLU 30 -14.474 1.325 10.247 222 H SER 31 H SER 31 -14.975 -0.527 5.797 223 HA SER 31 HA SER 31 -12.673 -2.150 6.451 224 HB2 SER 31 1HB SER 31 -14.297 -1.752 3.907 225 HB3 SER 31 2HB SER 31 -13.142 -3.054 4.189 226 HG SER 31 HG SER 31 -15.488 -3.364 4.569 227 H ILE 32 H ILE 32 -13.367 0.453 4.089 228 HA ILE 32 HA ILE 32 -10.683 0.913 3.137 229 HB ILE 32 HB ILE 32 -13.211 2.608 3.293 230 HG12 ILE 32 1HG1 ILE 32 -11.922 1.313 0.858 231 HG13 ILE 32 2HG1 ILE 32 -13.121 0.466 1.814 232 HG21 ILE 32 1HG2 ILE 32 -10.509 3.131 1.999 233 HG22 ILE 32 2HG2 ILE 32 -11.988 4.053 1.600 234 HG23 ILE 32 3HG2 ILE 32 -11.337 4.087 3.234 235 HD11 ILE 32 3HD1 ILE 32 -14.804 2.191 1.369 236 HD12 ILE 32 1HD1 ILE 32 -13.636 3.106 0.398 237 HD13 ILE 32 2HD1 ILE 32 -14.155 1.500 -0.132 238 H GLN 33 H GLN 33 -12.525 2.563 5.840 239 HA GLN 33 HA GLN 33 -10.306 4.157 6.524 240 HB2 GLN 33 1HB GLN 33 -12.763 3.264 8.010 241 HB3 GLN 33 2HB GLN 33 -11.532 4.173 8.861 242 HG2 GLN 33 1HG GLN 33 -12.705 5.192 6.268 243 HG3 GLN 33 2HG GLN 33 -13.443 5.483 7.831 244 HE21 GLN 33 1HE2 GLN 33 -13.020 7.587 8.452 245 HE22 GLN 33 2HE2 GLN 33 -11.421 8.317 8.386 246 H LYS 34 H LYS 34 -10.888 0.764 7.424 247 HA LYS 34 HA LYS 34 -8.912 0.650 9.515 248 HB2 LYS 34 1HB LYS 34 -10.717 -0.994 9.281 249 HB3 LYS 34 2HB LYS 34 -10.144 -1.485 7.693 250 HG2 LYS 34 1HG LYS 34 -8.054 -1.667 9.751 251 HG3 LYS 34 2HG LYS 34 -9.479 -2.603 10.177 252 HD2 LYS 34 1HD LYS 34 -8.140 -2.875 7.469 253 HD3 LYS 34 2HD LYS 34 -7.629 -3.800 8.879 254 HE2 LYS 34 1HE LYS 34 -10.531 -3.891 8.081 255 HE3 LYS 34 2HE LYS 34 -9.349 -4.822 7.148 256 HZ1 LYS 34 3HZ LYS 34 -10.414 -5.985 9.105 257 HZ2 LYS 34 1HZ LYS 34 -9.438 -5.087 10.077 258 HZ3 LYS 34 2HZ LYS 34 -8.796 -6.103 8.961 259 H ILE 35 H ILE 35 -8.879 -0.455 6.124 260 HA ILE 35 HA ILE 35 -6.190 -0.899 5.756 261 HB ILE 35 HB ILE 35 -8.489 0.002 3.990 262 HG12 ILE 35 1HG1 ILE 35 -6.849 -2.550 4.342 263 HG13 ILE 35 2HG1 ILE 35 -8.454 -2.279 5.009 264 HG21 ILE 35 1HG2 ILE 35 -7.201 -0.425 1.968 265 HG22 ILE 35 2HG2 ILE 35 -6.590 0.925 2.868 266 HG23 ILE 35 3HG2 ILE 35 -5.734 -0.658 2.944 267 HD11 ILE 35 3HD1 ILE 35 -8.513 -3.685 3.073 268 HD12 ILE 35 1HD1 ILE 35 -9.411 -2.167 2.767 269 HD13 ILE 35 2HD1 ILE 35 -7.812 -2.468 2.039 270 H LEU 36 H LEU 36 -7.865 2.308 5.230 271 HA LEU 36 HA LEU 36 -5.731 3.671 4.360 272 HB2 LEU 36 1HB LEU 36 -8.172 4.435 5.852 273 HB3 LEU 36 2HB LEU 36 -6.856 5.578 6.016 274 HG LEU 36 HG LEU 36 -6.810 4.939 3.263 275 HD11 LEU 36 1HD1 LEU 36 -9.049 5.409 2.494 276 HD12 LEU 36 2HD1 LEU 36 -9.619 5.115 4.169 277 HD13 LEU 36 3HD1 LEU 36 -8.753 3.834 3.266 278 HD21 LEU 36 3HD2 LEU 36 -8.180 7.274 4.708 279 HD22 LEU 36 1HD2 LEU 36 -7.680 7.268 3.007 280 HD23 LEU 36 2HD2 LEU 36 -6.451 7.205 4.276 281 H SER 37 H SER 37 -5.992 2.610 7.714 282 HA SER 37 HA SER 37 -3.966 4.404 8.755 283 HB2 SER 37 1HB SER 37 -5.673 3.086 10.106 284 HB3 SER 37 2HB SER 37 -4.728 1.627 9.767 285 HG SER 37 HG SER 37 -2.968 2.543 10.790 286 H GLU 38 H GLU 38 -3.872 0.914 7.741 287 HA GLU 38 HA GLU 38 -1.033 0.749 8.003 288 HB2 GLU 38 1HB GLU 38 -3.143 -0.963 6.611 289 HB3 GLU 38 2HB GLU 38 -1.436 -1.394 6.632 290 HG2 GLU 38 1HG GLU 38 -3.162 -0.999 9.098 291 HG3 GLU 38 2HG GLU 38 -2.676 -2.544 8.414 292 H ILE 39 H ILE 39 -3.114 1.593 5.292 293 HA ILE 39 HA ILE 39 -1.158 1.578 3.211 294 HB ILE 39 HB ILE 39 -3.678 3.188 3.683 295 HG12 ILE 39 1HG1 ILE 39 -3.982 0.697 3.404 296 HG13 ILE 39 2HG1 ILE 39 -4.783 1.688 2.177 297 HG21 ILE 39 1HG2 ILE 39 -3.827 3.503 1.203 298 HG22 ILE 39 2HG2 ILE 39 -2.762 4.511 2.161 299 HG23 ILE 39 3HG2 ILE 39 -2.079 3.151 1.185 300 HD11 ILE 39 3HD1 ILE 39 -2.213 0.139 1.808 301 HD12 ILE 39 1HD1 ILE 39 -3.820 -0.344 1.239 302 HD13 ILE 39 2HD1 ILE 39 -3.048 1.089 0.552 303 H ALA 40 H ALA 40 -1.660 3.855 5.887 304 HA ALA 40 HA ALA 40 0.253 5.744 4.626 305 HB1 ALA 40 1HB ALA 40 -2.037 6.622 4.942 306 HB2 ALA 40 2HB ALA 40 -1.918 6.266 6.685 307 HB3 ALA 40 3HB ALA 40 -0.854 7.482 5.953 308 H THR 41 H THR 41 0.161 3.439 7.106 309 HA THR 41 HA THR 41 1.180 4.818 9.261 310 HB THR 41 HB THR 41 0.138 2.533 9.097 311 HG1 THR 41 1HG THR 41 1.004 3.355 11.003 312 HG21 THR 41 3HG2 THR 41 1.510 0.609 8.897 313 HG22 THR 41 1HG2 THR 41 2.994 1.588 8.789 314 HG23 THR 41 2HG2 THR 41 1.811 1.604 7.467 315 H GLY 42 H GLY 42 2.946 3.799 6.401 316 HA2 GLY 42 1HA GLY 42 5.489 3.608 7.764 317 HA3 GLY 42 2HA GLY 42 5.152 3.421 6.037 318 H LYS 43 H LYS 43 7.435 4.555 6.843 319 HA LYS 43 HA LYS 43 7.174 7.436 6.157 320 HB2 LYS 43 1HB LYS 43 9.610 7.445 6.971 321 HB3 LYS 43 2HB LYS 43 8.237 7.531 8.053 322 HG2 LYS 43 1HG LYS 43 8.566 5.056 8.570 323 HG3 LYS 43 2HG LYS 43 10.054 5.135 7.602 324 HD2 LYS 43 1HD LYS 43 10.962 6.845 9.136 325 HD3 LYS 43 2HD LYS 43 9.414 6.880 10.014 326 HE2 LYS 43 1HE LYS 43 9.742 4.411 10.498 327 HE3 LYS 43 2HE LYS 43 11.390 4.566 9.871 328 HZ1 LYS 43 3HZ LYS 43 11.793 6.228 11.633 329 HZ2 LYS 43 1HZ LYS 43 11.252 4.814 12.276 330 HZ3 LYS 43 2HZ LYS 43 10.234 6.084 12.129 331 H ARG 44 H ARG 44 7.289 7.514 3.945 332 HA ARG 44 HA ARG 44 9.062 5.907 2.329 333 HB2 ARG 44 1HB ARG 44 8.720 7.711 0.610 334 HB3 ARG 44 2HB ARG 44 7.325 6.862 1.154 335 HG2 ARG 44 1HG ARG 44 6.442 8.913 1.410 336 HG3 ARG 44 2HG ARG 44 7.222 8.974 2.929 337 HD2 ARG 44 1HD ARG 44 8.705 10.447 2.346 338 HD3 ARG 44 2HD ARG 44 8.859 9.889 0.670 339 HE ARG 44 HE ARG 44 7.521 11.615 0.086 340 HH11 ARG 44 1HH1 ARG 44 6.605 10.877 3.474 341 HH12 ARG 44 2HH1 ARG 44 5.214 11.898 3.416 342 HH21 ARG 44 1HH2 ARG 44 5.857 13.121 0.152 343 HH22 ARG 44 2HH2 ARG 44 4.928 13.345 1.620 344 H THR 45 H THR 45 9.590 8.199 4.504 345 HA THR 45 HA THR 45 11.620 8.990 5.439 346 HB THR 45 HB THR 45 13.733 7.974 4.811 347 HG1 THR 45 1HG THR 45 12.489 7.272 2.440 348 HG21 THR 45 3HG2 THR 45 13.257 5.664 5.171 349 HG22 THR 45 1HG2 THR 45 11.715 5.747 4.330 350 HG23 THR 45 2HG2 THR 45 11.911 6.502 5.930 351 H GLU 46 H GLU 46 13.883 10.186 4.141 352 HA GLU 46 HA GLU 46 12.564 11.967 2.131 353 HB2 GLU 46 1HB GLU 46 14.680 12.495 4.220 354 HB3 GLU 46 2HB GLU 46 14.640 13.427 2.722 355 HG2 GLU 46 1HG GLU 46 12.155 13.847 3.128 356 HG3 GLU 46 2HG GLU 46 12.390 13.173 4.745 357 H LYS 47 H LYS 47 14.028 9.172 1.950 358 HA LYS 47 HA LYS 47 15.980 9.712 -0.104 359 HB2 LYS 47 1HB LYS 47 14.282 7.253 0.539 360 HB3 LYS 47 2HB LYS 47 15.473 7.336 -0.762 361 HG2 LYS 47 1HG LYS 47 17.176 7.996 1.046 362 HG3 LYS 47 2HG LYS 47 15.976 7.515 2.198 363 HD2 LYS 47 1HD LYS 47 16.728 5.578 -0.030 364 HD3 LYS 47 2HD LYS 47 17.844 5.799 1.319 365 HE2 LYS 47 1HE LYS 47 16.284 5.056 2.926 366 HE3 LYS 47 2HE LYS 47 14.924 5.153 1.810 367 HZ1 LYS 47 3HZ LYS 47 17.143 3.168 1.579 368 HZ2 LYS 47 1HZ LYS 47 15.806 3.184 0.659 369 HZ3 LYS 47 2HZ LYS 47 15.668 2.897 2.241 370 H GLN 48 H GLN 48 15.533 8.918 -2.303 371 HA GLN 48 HA GLN 48 12.843 9.711 -3.366 372 HB2 GLN 48 1HB GLN 48 13.994 10.550 -5.372 373 HB3 GLN 48 2HB GLN 48 14.340 11.441 -3.877 374 HG2 GLN 48 1HG GLN 48 16.546 10.450 -3.722 375 HG3 GLN 48 2HG GLN 48 16.200 9.376 -5.087 376 HE21 GLN 48 1HE2 GLN 48 15.604 12.927 -4.626 377 HE22 GLN 48 2HE2 GLN 48 16.419 13.369 -6.123 378 H SER 49 H SER 49 12.001 8.546 -5.049 379 HA SER 49 HA SER 49 13.245 5.914 -5.638 380 HB2 SER 49 1HB SER 49 11.255 5.137 -5.023 381 HB3 SER 49 2HB SER 49 10.463 6.720 -5.008 382 HG SER 49 HG SER 49 10.046 4.804 -6.699 383 H ILE 50 H ILE 50 13.133 5.213 -7.820 384 HA ILE 50 HA ILE 50 12.723 7.253 -9.909 385 HB ILE 50 HB ILE 50 14.808 6.718 -10.995 386 HG12 ILE 50 1HG1 ILE 50 15.459 4.934 -8.600 387 HG13 ILE 50 2HG1 ILE 50 15.159 4.406 -10.256 388 HG21 ILE 50 1HG2 ILE 50 16.316 7.983 -9.587 389 HG22 ILE 50 2HG2 ILE 50 14.673 8.589 -9.277 390 HG23 ILE 50 3HG2 ILE 50 15.453 7.503 -8.123 391 HD11 ILE 50 3HD1 ILE 50 17.158 5.936 -10.911 392 HD12 ILE 50 1HD1 ILE 50 17.530 5.908 -9.171 393 HD13 ILE 50 2HD1 ILE 50 17.497 4.399 -10.094 394 H GLN 51 H GLN 51 11.420 4.546 -8.826 395 HA GLN 51 HA GLN 51 10.977 3.434 -11.494 396 HB2 GLN 51 1HB GLN 51 10.942 1.166 -10.151 397 HB3 GLN 51 2HB GLN 51 12.429 1.839 -10.756 398 HG2 GLN 51 1HG GLN 51 12.847 1.066 -8.575 399 HG3 GLN 51 2HG GLN 51 12.930 2.784 -8.448 400 HE21 GLN 51 1HE2 GLN 51 10.927 -0.103 -7.814 401 HE22 GLN 51 2HE2 GLN 51 9.917 0.556 -6.625 402 H ASP 52 H ASP 52 9.134 1.828 -11.279 403 HA ASP 52 HA ASP 52 6.844 3.001 -9.775 404 HB2 ASP 52 1HB ASP 52 7.315 2.220 -12.649 405 HB3 ASP 52 2HB ASP 52 5.734 1.892 -11.981 406 H TYR 53 H TYR 53 8.816 0.243 -9.893 407 HA TYR 53 HA TYR 53 6.600 -1.531 -9.064 408 HB2 TYR 53 1HB TYR 53 8.318 -1.900 -11.513 409 HB3 TYR 53 2HB TYR 53 7.979 -3.305 -10.526 410 HD1 TYR 53 2HD TYR 53 6.195 -0.528 -12.324 411 HD2 TYR 53 1HD TYR 53 5.971 -4.509 -10.675 412 HE1 TYR 53 2HE TYR 53 3.977 -0.793 -13.304 413 HE2 TYR 53 1HE TYR 53 3.741 -4.799 -11.676 414 HH TYR 53 HH TYR 53 2.114 -2.205 -13.534 415 HA PRO 54 HA PRO 54 9.645 -2.561 -6.097 416 HB2 PRO 54 1HB PRO 54 8.885 -5.021 -5.188 417 HB3 PRO 54 2HB PRO 54 7.841 -3.588 -4.970 418 HG2 PRO 54 1HG PRO 54 7.672 -5.655 -7.169 419 HG3 PRO 54 2HG PRO 54 6.359 -5.079 -6.087 420 HD2 PRO 54 1HD PRO 54 6.758 -4.041 -8.583 421 HD3 PRO 54 2HD PRO 54 6.229 -3.021 -7.225 422 H SER 55 H SER 55 11.408 -4.122 -5.598 423 HA SER 55 HA SER 55 12.160 -5.848 -7.881 424 HB2 SER 55 1HB SER 55 13.513 -3.687 -7.073 425 HB3 SER 55 2HB SER 55 14.253 -4.888 -5.983 426 HG SER 55 HG SER 55 14.708 -6.165 -7.846 427 H ALA 56 H ALA 56 10.390 -6.353 -5.490 428 HA ALA 56 HA ALA 56 11.640 -8.776 -4.357 429 HB1 ALA 56 1HB ALA 56 9.393 -9.080 -3.352 430 HB2 ALA 56 2HB ALA 56 10.077 -7.513 -2.922 431 HB3 ALA 56 3HB ALA 56 8.814 -7.620 -4.177 432 H GLU 57 H GLU 57 10.231 -10.732 -4.748 433 HA GLU 57 HA GLU 57 9.348 -10.977 -7.566 434 HB2 GLU 57 1HB GLU 57 10.331 -13.101 -7.665 435 HB3 GLU 57 2HB GLU 57 11.561 -12.029 -7.005 436 HG2 GLU 57 1HG GLU 57 9.891 -14.024 -5.401 437 HG3 GLU 57 2HG GLU 57 11.531 -14.279 -5.968 438 H GLU 58 H GLU 58 8.704 -11.493 -4.161 439 HA GLU 58 HA GLU 58 6.011 -12.620 -4.775 440 HB2 GLU 58 1HB GLU 58 7.885 -13.067 -2.443 441 HB3 GLU 58 2HB GLU 58 6.127 -13.362 -2.336 442 HG2 GLU 58 1HG GLU 58 6.167 -15.112 -3.853 443 HG3 GLU 58 2HG GLU 58 7.754 -14.683 -4.512 444 H TYR 59 H TYR 59 4.626 -10.973 -4.673 445 HA TYR 59 HA TYR 59 4.382 -9.375 -2.299 446 HB2 TYR 59 1HB TYR 59 4.077 -7.270 -3.654 447 HB3 TYR 59 2HB TYR 59 5.726 -7.825 -3.503 448 HD1 TYR 59 2HD TYR 59 2.844 -7.566 -5.844 449 HD2 TYR 59 1HD TYR 59 7.056 -8.361 -5.414 450 HE1 TYR 59 2HE TYR 59 3.145 -7.309 -8.278 451 HE2 TYR 59 1HE TYR 59 7.346 -8.208 -7.859 452 HH TYR 59 HH TYR 59 6.308 -7.756 -9.866 453 H GLY 60 H GLY 60 2.203 -8.149 -2.650 454 HA2 GLY 60 1HA GLY 60 0.300 -9.644 -4.413 455 HA3 GLY 60 2HA GLY 60 -0.144 -8.985 -2.822 456 H THR 61 H THR 61 -1.575 -8.161 -5.090 457 HA THR 61 HA THR 61 -0.491 -5.511 -5.821 458 HB THR 61 HB THR 61 -3.189 -6.430 -6.713 459 HG1 THR 61 1HG THR 61 -0.865 -7.734 -7.693 460 HG21 THR 61 3HG2 THR 61 -2.450 -4.351 -7.590 461 HG22 THR 61 1HG2 THR 61 -2.257 -5.506 -8.927 462 HG23 THR 61 2HG2 THR 61 -0.857 -4.989 -7.989 463 H ILE 62 H ILE 62 -1.558 -3.602 -5.292 464 HA ILE 62 HA ILE 62 -4.057 -3.765 -3.719 465 HB ILE 62 HB ILE 62 -1.672 -1.978 -3.120 466 HG12 ILE 62 1HG1 ILE 62 -1.992 -3.295 -0.787 467 HG13 ILE 62 2HG1 ILE 62 -2.525 -4.569 -1.876 468 HG21 ILE 62 1HG2 ILE 62 -2.957 -1.238 -1.153 469 HG22 ILE 62 2HG2 ILE 62 -3.800 -0.856 -2.654 470 HG23 ILE 62 3HG2 ILE 62 -4.332 -2.237 -1.669 471 HD11 ILE 62 3HD1 ILE 62 -0.091 -4.662 -1.299 472 HD12 ILE 62 1HD1 ILE 62 -0.348 -4.523 -3.037 473 HD13 ILE 62 2HD1 ILE 62 0.133 -3.098 -2.119 474 H ASN 63 H ASN 63 -5.576 -2.485 -4.704 475 HA ASN 63 HA ASN 63 -4.651 -0.163 -6.307 476 HB2 ASN 63 1HB ASN 63 -6.919 -2.048 -7.059 477 HB3 ASN 63 2HB ASN 63 -6.430 -0.567 -7.870 478 HD21 ASN 63 1HD2 ASN 63 -5.894 -3.989 -7.693 479 HD22 ASN 63 2HD2 ASN 63 -4.618 -4.051 -8.861 480 H ILE 64 H ILE 64 -5.911 1.647 -5.970 481 HA ILE 64 HA ILE 64 -8.294 1.471 -4.165 482 HB ILE 64 HB ILE 64 -6.072 3.590 -4.129 483 HG12 ILE 64 1HG1 ILE 64 -6.559 1.373 -2.115 484 HG13 ILE 64 2HG1 ILE 64 -5.200 1.550 -3.235 485 HG21 ILE 64 1HG2 ILE 64 -7.197 4.558 -2.205 486 HG22 ILE 64 2HG2 ILE 64 -8.344 4.445 -3.530 487 HG23 ILE 64 3HG2 ILE 64 -8.413 3.275 -2.199 488 HD11 ILE 64 3HD1 ILE 64 -5.791 3.337 -0.860 489 HD12 ILE 64 1HD1 ILE 64 -4.437 2.217 -1.079 490 HD13 ILE 64 2HD1 ILE 64 -4.546 3.670 -2.092 491 H GLU 65 H GLU 65 -9.908 1.825 -5.636 492 HA GLU 65 HA GLU 65 -9.503 3.827 -7.750 493 HB2 GLU 65 1HB GLU 65 -10.930 1.979 -8.310 494 HB3 GLU 65 2HB GLU 65 -12.022 2.320 -6.948 495 HG2 GLU 65 1HG GLU 65 -12.616 4.478 -7.823 496 HG3 GLU 65 2HG GLU 65 -11.322 4.467 -9.011 497 H ASN 66 H ASN 66 -10.024 5.866 -7.538 498 HA ASN 66 HA ASN 66 -11.884 6.917 -5.640 499 HB2 ASN 66 1HB ASN 66 -10.288 8.257 -4.361 500 HB3 ASN 66 2HB ASN 66 -9.799 6.578 -4.208 501 HD21 ASN 66 1HD2 ASN 66 -7.849 5.817 -5.662 502 HD22 ASN 66 2HD2 ASN 66 -6.784 7.110 -6.167 503 H ASN 67 H ASN 67 -11.225 9.486 -5.885 504 HA ASN 67 HA ASN 67 -11.885 10.487 -8.296 505 HB2 ASN 67 1HB ASN 67 -9.758 12.241 -7.397 506 HB3 ASN 67 2HB ASN 67 -11.479 12.445 -7.492 507 HD21 ASN 67 1HD2 ASN 67 -9.295 10.438 -5.300 508 HD22 ASN 67 2HD2 ASN 67 -10.024 11.064 -3.833 509 H GLY 68 H GLY 68 -8.675 9.214 -7.590 510 HA2 GLY 68 1HA GLY 68 -7.434 10.682 -9.794 511 HA3 GLY 68 2HA GLY 68 -6.631 9.551 -8.697 512 H GLY 69 H GLY 69 -9.489 8.132 -9.764 513 HA2 GLY 69 1HA GLY 69 -9.748 6.204 -11.115 514 HA3 GLY 69 2HA GLY 69 -8.143 6.483 -11.845 515 H MET 70 H MET 70 -6.913 4.692 -11.220 516 HA MET 70 HA MET 70 -7.066 3.851 -8.375 517 HB2 MET 70 1HB MET 70 -6.609 2.234 -10.872 518 HB3 MET 70 2HB MET 70 -5.950 1.718 -9.313 519 HG2 MET 70 1HG MET 70 -8.144 1.890 -8.274 520 HG3 MET 70 2HG MET 70 -8.879 2.352 -9.809 521 HE1 MET 70 3HE MET 70 -10.253 -0.061 -8.224 522 HE2 MET 70 1HE MET 70 -9.367 -1.595 -8.236 523 HE3 MET 70 2HE MET 70 -8.736 -0.205 -7.326 524 H THR 71 H THR 71 -5.543 4.654 -7.258 525 HA THR 71 HA THR 71 -2.726 4.802 -8.122 526 HB THR 71 HB THR 71 -4.039 4.683 -5.361 527 HG1 THR 71 1HG THR 71 -4.188 6.703 -6.486 528 HG21 THR 71 3HG2 THR 71 -1.805 5.204 -4.439 529 HG22 THR 71 1HG2 THR 71 -1.090 5.026 -6.077 530 HG23 THR 71 2HG2 THR 71 -1.794 3.638 -5.261 531 H THR 72 H THR 72 -1.586 2.968 -8.537 532 HA THR 72 HA THR 72 -2.493 0.342 -7.483 533 HB THR 72 HB THR 72 -1.030 1.118 -10.041 534 HG1 THR 72 1HG THR 72 -3.506 -0.210 -9.660 535 HG21 THR 72 3HG2 THR 72 -1.691 -1.662 -8.978 536 HG22 THR 72 1HG2 THR 72 -0.086 -0.987 -9.288 537 HG23 THR 72 2HG2 THR 72 -1.172 -1.291 -10.644 538 H MET 73 H MET 73 -0.856 -0.898 -6.461 539 HA MET 73 HA MET 73 1.890 0.036 -6.177 540 HB2 MET 73 1HB MET 73 1.639 0.455 -3.758 541 HB3 MET 73 2HB MET 73 0.879 1.628 -4.784 542 HG2 MET 73 1HG MET 73 -1.266 -0.020 -4.338 543 HG3 MET 73 2HG MET 73 -0.337 -0.341 -2.905 544 HE1 MET 73 3HE MET 73 -0.276 3.691 -1.780 545 HE2 MET 73 1HE MET 73 0.824 2.291 -1.879 546 HE3 MET 73 2HE MET 73 0.524 3.307 -3.310 547 H PHE 74 H PHE 74 2.923 -1.450 -4.453 548 HA PHE 74 HA PHE 74 1.740 -4.180 -4.323 549 HB2 PHE 74 1HB PHE 74 4.431 -3.566 -5.608 550 HB3 PHE 74 2HB PHE 74 3.657 -5.127 -5.467 551 HD1 PHE 74 2HD PHE 74 1.767 -5.740 -7.008 552 HD2 PHE 74 1HD PHE 74 3.825 -1.967 -7.361 553 HE1 PHE 74 2HE PHE 74 0.921 -5.478 -9.320 554 HE2 PHE 74 1HE PHE 74 2.915 -1.677 -9.636 555 HZ PHE 74 HZ PHE 74 1.437 -3.429 -10.618 556 H TYR 75 H TYR 75 2.495 -5.221 -2.325 557 HA TYR 75 HA TYR 75 4.669 -3.723 -0.908 558 HB2 TYR 75 1HB TYR 75 2.334 -5.008 0.481 559 HB3 TYR 75 2HB TYR 75 3.536 -3.921 1.133 560 HD1 TYR 75 1HD TYR 75 3.149 -1.840 -1.350 561 HD2 TYR 75 2HD TYR 75 0.586 -3.721 1.548 562 HE1 TYR 75 1HE TYR 75 1.539 -0.040 -1.643 563 HE2 TYR 75 2HE TYR 75 -0.963 -1.799 1.369 564 HH TYR 75 HH TYR 75 -0.639 0.693 -1.107 565 H TYR 76 H TYR 76 6.089 -4.917 0.383 566 HA TYR 76 HA TYR 76 6.163 -7.848 0.133 567 HB2 TYR 76 1HB TYR 76 8.359 -7.750 -0.986 568 HB3 TYR 76 2HB TYR 76 7.049 -7.178 -1.971 569 HD1 TYR 76 2HD TYR 76 6.787 -4.709 -2.418 570 HD2 TYR 76 1HD TYR 76 10.189 -6.305 -0.337 571 HE1 TYR 76 2HE TYR 76 8.006 -2.558 -2.783 572 HE2 TYR 76 1HE TYR 76 11.436 -4.195 -0.719 573 HH TYR 76 HH TYR 76 10.012 -1.349 -2.362 574 H GLU 77 H GLU 77 8.515 -8.541 1.073 575 HA GLU 77 HA GLU 77 9.265 -6.798 3.357 576 HB2 GLU 77 1HB GLU 77 8.233 -9.118 3.896 577 HB3 GLU 77 2HB GLU 77 9.736 -9.789 3.262 578 HG2 GLU 77 1HG GLU 77 11.028 -8.483 4.946 579 HG3 GLU 77 2HG GLU 77 9.535 -7.725 5.504 580 H GLU 78 H GLU 78 11.525 -6.495 3.680 581 HA GLU 78 HA GLU 78 13.389 -7.768 1.822 582 HB2 GLU 78 1HB GLU 78 12.555 -5.571 0.807 583 HB3 GLU 78 2HB GLU 78 13.403 -4.750 2.095 584 HG2 GLU 78 1HG GLU 78 15.002 -6.779 0.643 585 HG3 GLU 78 2HG GLU 78 14.496 -5.427 -0.345 586 H ASN 79 H ASN 79 14.856 -8.611 3.145 587 HA ASN 79 HA ASN 79 16.304 -8.995 4.794 588 HB2 ASN 79 1HB ASN 79 16.601 -6.039 4.468 589 HB3 ASN 79 2HB ASN 79 17.255 -6.710 5.945 590 HD21 ASN 79 1HD2 ASN 79 17.347 -6.979 2.476 591 HD22 ASN 79 2HD2 ASN 79 18.950 -7.504 2.289 592 H GLY 80 H GLY 80 13.289 -8.080 5.563 593 HA2 GLY 80 1HA GLY 80 12.396 -9.096 7.604 594 HA3 GLY 80 2HA GLY 80 13.781 -8.494 8.495 595 H LYS 81 H LYS 81 12.846 -6.022 6.317 596 HA LYS 81 HA LYS 81 10.813 -4.889 8.150 597 HB2 LYS 81 1HB LYS 81 13.134 -3.654 6.719 598 HB3 LYS 81 2HB LYS 81 11.589 -2.861 6.436 599 HG2 LYS 81 1HG LYS 81 12.666 -1.836 8.312 600 HG3 LYS 81 2HG LYS 81 11.180 -2.675 8.797 601 HD2 LYS 81 1HD LYS 81 12.663 -4.613 9.585 602 HD3 LYS 81 2HD LYS 81 14.051 -3.603 9.214 603 HE2 LYS 81 1HE LYS 81 13.477 -3.552 11.599 604 HE3 LYS 81 2HE LYS 81 13.281 -1.947 10.897 605 HZ1 LYS 81 3HZ LYS 81 11.403 -2.697 12.352 606 HZ2 LYS 81 1HZ LYS 81 11.030 -3.844 11.248 607 HZ3 LYS 81 2HZ LYS 81 10.946 -2.255 10.843 608 H TYR 82 H TYR 82 8.981 -4.019 7.100 609 HA TYR 82 HA TYR 82 8.492 -5.281 4.443 610 HB2 TYR 82 1HB TYR 82 6.644 -4.198 6.551 611 HB3 TYR 82 2HB TYR 82 6.118 -4.672 4.939 612 HD1 TYR 82 2HD TYR 82 6.284 -7.103 4.238 613 HD2 TYR 82 1HD TYR 82 7.149 -5.787 8.264 614 HE1 TYR 82 2HE TYR 82 6.098 -9.420 5.025 615 HE2 TYR 82 1HE TYR 82 6.931 -8.094 9.066 616 HH TYR 82 HH TYR 82 6.691 -10.332 8.412 617 H TYR 83 H TYR 83 7.679 -3.989 2.733 618 HA TYR 83 HA TYR 83 7.936 -1.087 3.091 619 HB2 TYR 83 1HB TYR 83 9.412 -2.661 0.974 620 HB3 TYR 83 2HB TYR 83 9.302 -0.913 1.013 621 HD1 TYR 83 2HD TYR 83 10.528 0.409 2.758 622 HD2 TYR 83 1HD TYR 83 10.842 -3.889 2.536 623 HE1 TYR 83 2HE TYR 83 12.522 0.484 4.219 624 HE2 TYR 83 1HE TYR 83 12.796 -3.843 3.969 625 HH TYR 83 HH TYR 83 14.418 -2.453 5.022 626 H ILE 84 H ILE 84 7.099 0.124 1.400 627 HA ILE 84 HA ILE 84 4.921 -1.201 -0.174 628 HB ILE 84 HB ILE 84 4.972 1.410 1.338 629 HG12 ILE 84 1HG1 ILE 84 2.648 0.621 2.057 630 HG13 ILE 84 2HG1 ILE 84 3.090 -0.956 1.424 631 HG21 ILE 84 1HG2 ILE 84 4.143 2.275 -0.622 632 HG22 ILE 84 2HG2 ILE 84 3.320 0.808 -1.050 633 HG23 ILE 84 3HG2 ILE 84 2.671 1.846 0.240 634 HD11 ILE 84 3HD1 ILE 84 4.709 0.480 3.549 635 HD12 ILE 84 1HD1 ILE 84 3.342 -0.602 3.883 636 HD13 ILE 84 2HD1 ILE 84 4.772 -1.249 3.084 637 H GLU 85 H GLU 85 5.232 -1.090 -2.355 638 HA GLU 85 HA GLU 85 7.021 0.760 -3.604 639 HB2 GLU 85 1HB GLU 85 6.611 -1.361 -4.612 640 HB3 GLU 85 2HB GLU 85 4.851 -1.126 -4.597 641 HG2 GLU 85 1HG GLU 85 5.714 -1.056 -6.838 642 HG3 GLU 85 2HG GLU 85 4.947 0.453 -6.364 643 H CYS 86 H CYS 86 6.607 2.421 -4.939 644 HA CYS 86 HA CYS 86 4.163 3.498 -5.681 645 HB2 CYS 86 1HB CYS 86 5.191 4.378 -3.048 646 HB3 CYS 86 2HB CYS 86 4.986 5.767 -4.107 647 HG CYS 86 HG CYS 86 2.915 3.300 -3.479 648 HA PRO 87 HA PRO 87 7.107 5.839 -8.372 649 HB2 PRO 87 1HB PRO 87 6.095 8.362 -8.514 650 HB3 PRO 87 2HB PRO 87 5.199 6.978 -9.202 651 HG2 PRO 87 1HG PRO 87 4.925 8.089 -6.359 652 HG3 PRO 87 2HG PRO 87 3.643 7.992 -7.605 653 HD2 PRO 87 1HD PRO 87 3.829 5.997 -5.911 654 HD3 PRO 87 2HD PRO 87 3.758 5.604 -7.640 655 H TYR 88 H TYR 88 8.087 8.399 -8.032 656 HA TYR 88 HA TYR 88 10.241 8.387 -6.647 657 HB2 TYR 88 1HB TYR 88 8.430 10.808 -6.477 658 HB3 TYR 88 2HB TYR 88 10.167 10.785 -6.454 659 HD1 TYR 88 2HD TYR 88 11.486 10.464 -8.523 660 HD2 TYR 88 1HD TYR 88 7.163 10.711 -8.584 661 HE1 TYR 88 2HE TYR 88 11.558 11.064 -10.880 662 HE2 TYR 88 1HE TYR 88 7.243 11.297 -10.982 663 HH TYR 88 HH TYR 88 10.264 11.956 -12.732 664 H LYS 89 H LYS 89 7.251 8.290 -4.866 665 HA LYS 89 HA LYS 89 8.518 8.700 -2.315 666 HB2 LYS 89 1HB LYS 89 6.233 8.935 -1.627 667 HB3 LYS 89 2HB LYS 89 7.254 10.309 -2.104 668 HG2 LYS 89 1HG LYS 89 5.087 8.896 -3.707 669 HG3 LYS 89 2HG LYS 89 5.014 10.278 -2.610 670 HD2 LYS 89 1HD LYS 89 6.342 10.292 -5.344 671 HD3 LYS 89 2HD LYS 89 4.803 11.007 -4.984 672 HE2 LYS 89 1HE LYS 89 7.277 11.908 -3.473 673 HE3 LYS 89 2HE LYS 89 6.945 12.498 -5.104 674 HZ1 LYS 89 3HZ LYS 89 6.062 13.977 -3.461 675 HZ2 LYS 89 1HZ LYS 89 5.055 12.807 -2.834 676 HZ3 LYS 89 2HZ LYS 89 4.885 13.376 -4.376 677 H GLY 90 H GLY 90 8.971 6.310 -3.447 678 HA2 GLY 90 1HA GLY 90 6.969 4.483 -2.292 679 HA3 GLY 90 2HA GLY 90 7.953 4.188 -3.729 680 H ILE 91 H ILE 91 8.969 5.287 -0.487 681 HA ILE 91 HA ILE 91 10.514 2.738 -0.214 682 HB ILE 91 HB ILE 91 11.642 5.444 0.557 683 HG12 ILE 91 1HG1 ILE 91 11.957 4.042 -2.130 684 HG13 ILE 91 2HG1 ILE 91 11.090 5.558 -1.903 685 HG21 ILE 91 1HG2 ILE 91 12.894 2.810 -0.311 686 HG22 ILE 91 2HG2 ILE 91 13.712 4.161 0.494 687 HG23 ILE 91 3HG2 ILE 91 12.526 3.148 1.364 688 HD11 ILE 91 3HD1 ILE 91 13.235 5.910 -2.840 689 HD12 ILE 91 1HD1 ILE 91 13.061 6.736 -1.288 690 HD13 ILE 91 2HD1 ILE 91 14.058 5.249 -1.428 691 H TYR 92 H TYR 92 8.111 2.928 0.921 692 HA TYR 92 HA TYR 92 8.273 4.268 3.522 693 HB2 TYR 92 1HB TYR 92 6.039 2.417 2.732 694 HB3 TYR 92 2HB TYR 92 6.065 3.537 4.043 695 HD1 TYR 92 2HD TYR 92 5.892 3.318 0.311 696 HD2 TYR 92 1HD TYR 92 5.503 5.820 3.808 697 HE1 TYR 92 2HE TYR 92 4.904 5.091 -1.065 698 HE2 TYR 92 1HE TYR 92 4.788 7.711 2.361 699 HH TYR 92 HH TYR 92 4.388 7.333 -1.154 700 H GLU 93 H GLU 93 9.650 3.439 4.884 701 HA GLU 93 HA GLU 93 9.772 0.548 5.366 702 HB2 GLU 93 1HB GLU 93 11.683 2.242 5.644 703 HB3 GLU 93 2HB GLU 93 10.764 2.979 6.948 704 HG2 GLU 93 1HG GLU 93 10.933 0.555 8.047 705 HG3 GLU 93 2HG GLU 93 12.230 0.347 6.876 706 H ILE 94 H ILE 94 8.270 -0.419 6.548 707 HA ILE 94 HA ILE 94 6.815 1.024 8.716 708 HB ILE 94 HB ILE 94 4.955 -0.489 8.523 709 HG12 ILE 94 1HG1 ILE 94 6.408 -1.744 6.176 710 HG13 ILE 94 2HG1 ILE 94 6.078 -2.483 7.744 711 HG21 ILE 94 1HG2 ILE 94 4.896 1.561 7.289 712 HG22 ILE 94 2HG2 ILE 94 5.568 0.780 5.828 713 HG23 ILE 94 3HG2 ILE 94 3.960 0.339 6.462 714 HD11 ILE 94 3HD1 ILE 94 4.495 -3.344 6.114 715 HD12 ILE 94 1HD1 ILE 94 3.645 -2.347 7.300 716 HD13 ILE 94 2HD1 ILE 94 3.989 -1.723 5.674 717 H GLU 95 H GLU 95 6.060 -0.824 10.373 718 HA GLU 95 HA GLU 95 8.555 -2.287 11.046 719 HB2 GLU 95 1HB GLU 95 7.791 -2.152 13.370 720 HB3 GLU 95 2HB GLU 95 7.949 -0.575 12.597 721 HG2 GLU 95 1HG GLU 95 5.485 -0.445 12.321 722 HG3 GLU 95 2HG GLU 95 5.319 -2.020 13.100 723 H ASN 96 H ASN 96 5.341 -2.960 10.018 724 HA ASN 96 HA ASN 96 5.490 -5.717 11.113 725 HB2 ASN 96 1HB ASN 96 3.503 -3.509 11.608 726 HB3 ASN 96 2HB ASN 96 2.783 -5.031 11.258 727 HD21 ASN 96 1HD2 ASN 96 2.257 -6.168 13.048 728 HD22 ASN 96 2HD2 ASN 96 2.811 -5.629 14.644 729 H ASN 97 H ASN 97 3.569 -7.048 10.228 730 HA ASN 97 HA ASN 97 3.886 -7.050 7.315 731 HB2 ASN 97 1HB ASN 97 3.986 -9.185 8.630 732 HB3 ASN 97 2HB ASN 97 2.316 -8.930 9.154 733 HD21 ASN 97 1HD2 ASN 97 4.402 -9.608 6.402 734 HD22 ASN 97 2HD2 ASN 97 3.153 -9.869 5.203 735 H PHE 98 H PHE 98 2.479 -6.000 6.019 736 HA PHE 98 HA PHE 98 0.180 -4.611 6.917 737 HB2 PHE 98 1HB PHE 98 1.491 -3.925 4.987 738 HB3 PHE 98 2HB PHE 98 1.138 -5.426 4.150 739 HD1 PHE 98 1HD PHE 98 -1.049 -5.845 3.113 740 HD2 PHE 98 2HD PHE 98 -0.112 -2.087 4.974 741 HE1 PHE 98 1HE PHE 98 -2.956 -4.807 1.974 742 HE2 PHE 98 2HE PHE 98 -2.100 -1.037 3.888 743 HZ PHE 98 HZ PHE 98 -3.568 -2.428 2.424 744 H GLU 99 H GLU 99 0.440 -7.806 5.208 745 HA GLU 99 HA GLU 99 -2.340 -7.991 4.639 746 HB2 GLU 99 1HB GLU 99 -0.056 -9.965 4.614 747 HB3 GLU 99 2HB GLU 99 -1.725 -10.512 4.398 748 HG2 GLU 99 1HG GLU 99 -2.043 -9.001 2.504 749 HG3 GLU 99 2HG GLU 99 -0.427 -8.320 2.724 750 H ASP 100 H ASP 100 -0.480 -8.959 7.478 751 HA ASP 100 HA ASP 100 -2.583 -10.512 8.695 752 HB2 ASP 100 1HB ASP 100 -0.100 -10.591 9.253 753 HB3 ASP 100 2HB ASP 100 -0.325 -9.077 10.136 754 H MET 101 H MET 101 -2.119 -7.118 8.357 755 HA MET 101 HA MET 101 -3.671 -6.410 10.768 756 HB2 MET 101 1HB MET 101 -2.131 -4.736 8.767 757 HB3 MET 101 2HB MET 101 -2.863 -4.116 10.241 758 HG2 MET 101 1HG MET 101 -0.876 -6.348 10.537 759 HG3 MET 101 2HG MET 101 -0.278 -4.797 9.985 760 HE1 MET 101 3HE MET 101 -2.062 -6.741 12.834 761 HE2 MET 101 1HE MET 101 -2.153 -5.551 14.150 762 HE3 MET 101 2HE MET 101 -3.207 -5.380 12.730 763 H ILE 102 H ILE 102 -4.454 -7.081 7.541 764 HA ILE 102 HA ILE 102 -6.508 -4.953 7.381 765 HB ILE 102 HB ILE 102 -6.667 -5.608 4.967 766 HG12 ILE 102 1HG1 ILE 102 -4.019 -6.987 5.469 767 HG13 ILE 102 2HG1 ILE 102 -5.509 -7.901 5.330 768 HG21 ILE 102 1HG2 ILE 102 -5.425 -3.634 5.883 769 HG22 ILE 102 2HG2 ILE 102 -3.948 -4.608 5.930 770 HG23 ILE 102 3HG2 ILE 102 -4.736 -4.252 4.382 771 HD11 ILE 102 3HD1 ILE 102 -5.811 -6.998 3.004 772 HD12 ILE 102 1HD1 ILE 102 -4.271 -6.144 3.172 773 HD13 ILE 102 2HD1 ILE 102 -4.304 -7.907 3.208 Start of MODEL 10 1 H1 GLY 1 H GLY 1 6.452 11.157 10.013 2 HA2 GLY 1 1HA GLY 1 6.471 9.589 7.495 3 HA3 GLY 1 2HA GLY 1 5.828 8.977 9.029 4 H SER 2 H SER 2 4.976 10.385 6.154 5 HA SER 2 HA SER 2 2.253 10.349 6.717 6 HB2 SER 2 1HB SER 2 3.388 13.140 6.761 7 HB3 SER 2 2HB SER 2 1.776 12.821 6.087 8 HG SER 2 HG SER 2 2.638 11.892 8.613 9 HA PRO 3 HA PRO 3 3.239 10.009 2.191 10 HB2 PRO 3 1HB PRO 3 1.090 8.322 1.725 11 HB3 PRO 3 2HB PRO 3 2.747 7.771 2.021 12 HG2 PRO 3 1HG PRO 3 0.450 7.955 3.933 13 HG3 PRO 3 2HG PRO 3 1.710 6.673 3.811 14 HD2 PRO 3 1HD PRO 3 1.760 8.580 5.723 15 HD3 PRO 3 2HD PRO 3 3.236 7.893 4.994 16 H ILE 4 H ILE 4 1.854 10.966 0.499 17 HA ILE 4 HA ILE 4 -0.618 12.298 1.316 18 HB ILE 4 HB ILE 4 0.851 11.901 -1.336 19 HG12 ILE 4 1HG1 ILE 4 1.167 14.355 -1.183 20 HG13 ILE 4 2HG1 ILE 4 0.567 14.355 0.467 21 HG21 ILE 4 1HG2 ILE 4 -1.632 13.568 -0.706 22 HG22 ILE 4 2HG2 ILE 4 -0.723 13.615 -2.231 23 HG23 ILE 4 3HG2 ILE 4 -1.558 12.140 -1.764 24 HD11 ILE 4 3HD1 ILE 4 3.083 12.934 -0.512 25 HD12 ILE 4 1HD1 ILE 4 3.043 14.560 0.194 26 HD13 ILE 4 2HD1 ILE 4 2.595 13.190 1.190 27 H LEU 5 H LEU 5 -2.685 11.222 1.017 28 HA LEU 5 HA LEU 5 -2.897 8.949 -0.753 29 HB2 LEU 5 1HB LEU 5 -4.139 7.743 1.046 30 HB3 LEU 5 2HB LEU 5 -2.414 7.853 1.295 31 HG LEU 5 HG LEU 5 -3.853 10.043 2.653 32 HD11 LEU 5 1HD1 LEU 5 -5.662 8.396 2.839 33 HD12 LEU 5 2HD1 LEU 5 -4.903 8.683 4.407 34 HD13 LEU 5 3HD1 LEU 5 -4.528 7.195 3.505 35 HD21 LEU 5 3HD2 LEU 5 -1.500 9.303 3.102 36 HD22 LEU 5 1HD2 LEU 5 -2.130 7.761 3.733 37 HD23 LEU 5 2HD2 LEU 5 -2.511 9.298 4.553 38 HA PRO 6 HA PRO 6 -6.814 10.987 -1.511 39 HB2 PRO 6 1HB PRO 6 -8.637 8.889 -1.696 40 HB3 PRO 6 2HB PRO 6 -7.470 9.298 -2.966 41 HG2 PRO 6 1HG PRO 6 -7.224 7.263 -0.743 42 HG3 PRO 6 2HG PRO 6 -6.902 7.018 -2.490 43 HD2 PRO 6 1HD PRO 6 -4.871 7.444 -0.896 44 HD3 PRO 6 2HD PRO 6 -4.947 8.301 -2.441 45 H LYS 7 H LYS 7 -9.283 11.144 -0.591 46 HA LYS 7 HA LYS 7 -9.284 11.234 2.236 47 HB2 LYS 7 1HB LYS 7 -11.605 11.395 0.358 48 HB3 LYS 7 2HB LYS 7 -11.570 11.825 2.052 49 HG2 LYS 7 1HG LYS 7 -11.109 13.864 1.419 50 HG3 LYS 7 2HG LYS 7 -9.442 13.368 1.261 51 HD2 LYS 7 1HD LYS 7 -11.280 12.896 -0.989 52 HD3 LYS 7 2HD LYS 7 -10.988 14.597 -0.671 53 HE2 LYS 7 1HE LYS 7 -8.811 12.538 -1.165 54 HE3 LYS 7 2HE LYS 7 -9.586 13.460 -2.469 55 HZ1 LYS 7 3HZ LYS 7 -7.638 14.578 -1.953 56 HZ2 LYS 7 1HZ LYS 7 -7.824 14.471 -0.352 57 HZ3 LYS 7 2HZ LYS 7 -8.824 15.484 -1.262 58 H ALA 8 H ALA 8 -11.514 10.102 3.073 59 HA ALA 8 HA ALA 8 -11.542 7.189 2.301 60 HB1 ALA 8 1HB ALA 8 -13.101 8.551 4.540 61 HB2 ALA 8 2HB ALA 8 -12.915 6.811 4.247 62 HB3 ALA 8 3HB ALA 8 -11.513 7.772 4.737 63 H GLU 9 H GLU 9 -13.612 10.139 2.349 64 HA GLU 9 HA GLU 9 -15.944 8.766 1.456 65 HB2 GLU 9 1HB GLU 9 -16.944 10.918 1.326 66 HB3 GLU 9 2HB GLU 9 -15.927 10.839 2.754 67 HG2 GLU 9 1HG GLU 9 -14.080 11.907 1.134 68 HG3 GLU 9 2HG GLU 9 -15.478 12.286 0.137 69 H ASN 10 H ASN 10 -13.249 9.892 -0.361 70 HA ASN 10 HA ASN 10 -14.678 10.006 -2.928 71 HB2 ASN 10 1HB ASN 10 -12.509 10.608 -3.822 72 HB3 ASN 10 2HB ASN 10 -12.842 11.602 -2.428 73 HD21 ASN 10 1HD2 ASN 10 -11.881 8.465 -1.327 74 HD22 ASN 10 2HD2 ASN 10 -10.268 8.893 -0.911 75 H VAL 11 H VAL 11 -13.805 7.389 -1.021 76 HA VAL 11 HA VAL 11 -12.238 5.946 -3.080 77 HB VAL 11 HB VAL 11 -12.880 5.119 -0.231 78 HG11 VAL 11 1HG1 VAL 11 -11.048 3.446 -0.664 79 HG12 VAL 11 2HG1 VAL 11 -12.387 3.229 -1.796 80 HG13 VAL 11 3HG1 VAL 11 -10.920 4.049 -2.332 81 HG21 VAL 11 3HG2 VAL 11 -10.450 5.561 0.215 82 HG22 VAL 11 1HG2 VAL 11 -10.422 6.523 -1.276 83 HG23 VAL 11 2HG2 VAL 11 -11.510 6.952 0.050 84 H ASP 12 H ASP 12 -13.285 4.750 -4.426 85 HA ASP 12 HA ASP 12 -16.166 4.302 -4.130 86 HB2 ASP 12 1HB ASP 12 -14.173 3.896 -6.385 87 HB3 ASP 12 2HB ASP 12 -15.887 3.515 -6.488 88 H SER 13 H SER 13 -13.100 2.348 -4.622 89 HA SER 13 HA SER 13 -13.968 0.596 -2.516 90 HB2 SER 13 1HB SER 13 -13.482 -0.769 -5.188 91 HB3 SER 13 2HB SER 13 -13.961 -1.531 -3.676 92 HG SER 13 HG SER 13 -15.742 0.348 -4.262 93 H ILE 14 H ILE 14 -12.197 -1.274 -2.237 94 HA ILE 14 HA ILE 14 -9.583 -0.546 -3.425 95 HB ILE 14 HB ILE 14 -10.101 -1.537 -0.586 96 HG12 ILE 14 1HG1 ILE 14 -9.124 1.140 -1.650 97 HG13 ILE 14 2HG1 ILE 14 -10.661 0.855 -0.829 98 HG21 ILE 14 1HG2 ILE 14 -8.044 -2.507 -1.460 99 HG22 ILE 14 2HG2 ILE 14 -7.457 -0.911 -1.945 100 HG23 ILE 14 3HG2 ILE 14 -7.672 -1.325 -0.233 101 HD11 ILE 14 3HD1 ILE 14 -7.913 0.827 0.434 102 HD12 ILE 14 1HD1 ILE 14 -9.242 1.948 0.715 103 HD13 ILE 14 2HD1 ILE 14 -9.398 0.265 1.257 104 H CYS 15 H CYS 15 -8.403 -2.403 -4.077 105 HA CYS 15 HA CYS 15 -9.639 -5.065 -3.580 106 HB2 CYS 15 1HB CYS 15 -9.973 -4.217 -5.993 107 HB3 CYS 15 2HB CYS 15 -8.218 -4.349 -6.160 108 HG CYS 15 HG CYS 15 -9.545 -6.507 -7.116 109 H ILE 16 H ILE 16 -8.097 -6.554 -2.842 110 HA ILE 16 HA ILE 16 -5.216 -5.966 -3.202 111 HB ILE 16 HB ILE 16 -6.621 -6.894 -0.661 112 HG12 ILE 16 1HG1 ILE 16 -5.456 -4.230 -1.533 113 HG13 ILE 16 2HG1 ILE 16 -7.084 -4.569 -0.929 114 HG21 ILE 16 1HG2 ILE 16 -4.374 -7.895 -0.932 115 HG22 ILE 16 2HG2 ILE 16 -3.672 -6.269 -1.084 116 HG23 ILE 16 3HG2 ILE 16 -4.450 -6.780 0.434 117 HD11 ILE 16 3HD1 ILE 16 -4.526 -4.451 0.645 118 HD12 ILE 16 1HD1 ILE 16 -5.883 -3.325 0.703 119 HD13 ILE 16 2HD1 ILE 16 -6.099 -4.978 1.327 120 H ASP 17 H ASP 17 -4.593 -7.540 -4.584 121 HA ASP 17 HA ASP 17 -5.750 -10.278 -4.418 122 HB2 ASP 17 1HB ASP 17 -5.428 -8.887 -6.717 123 HB3 ASP 17 2HB ASP 17 -3.838 -9.557 -6.615 124 H PHE 18 H PHE 18 -4.582 -11.538 -3.128 125 HA PHE 18 HA PHE 18 -2.096 -10.595 -1.942 126 HB2 PHE 18 1HB PHE 18 -3.848 -13.072 -1.632 127 HB3 PHE 18 2HB PHE 18 -2.339 -12.875 -0.764 128 HD1 PHE 18 1HD PHE 18 -5.560 -10.897 -1.356 129 HD2 PHE 18 2HD PHE 18 -2.404 -11.988 1.387 130 HE1 PHE 18 1HE PHE 18 -6.593 -9.513 0.394 131 HE2 PHE 18 2HE PHE 18 -3.499 -10.668 3.153 132 HZ PHE 18 HZ PHE 18 -5.599 -9.401 2.663 133 H THR 19 H THR 19 -0.168 -12.289 -1.772 134 HA THR 19 HA THR 19 1.029 -12.691 -4.258 135 HB THR 19 HB THR 19 2.376 -14.424 -2.837 136 HG1 THR 19 1HG THR 19 1.536 -14.908 -1.029 137 HG21 THR 19 3HG2 THR 19 2.096 -11.557 -1.864 138 HG22 THR 19 1HG2 THR 19 3.183 -12.174 -3.130 139 HG23 THR 19 2HG2 THR 19 3.422 -12.662 -1.442 140 H ASN 20 H ASN 20 -0.965 -14.743 -2.373 141 HA ASN 20 HA ASN 20 -1.132 -17.170 -3.726 142 HB2 ASN 20 1HB ASN 20 -3.265 -15.673 -2.128 143 HB3 ASN 20 2HB ASN 20 -3.294 -17.403 -2.504 144 HD21 ASN 20 1HD2 ASN 20 -3.594 -17.738 -0.178 145 HD22 ASN 20 2HD2 ASN 20 -2.165 -17.605 0.836 146 H SER 21 H SER 21 -4.054 -17.386 -4.191 147 HA SER 21 HA SER 21 -4.495 -15.518 -6.474 148 HB2 SER 21 1HB SER 21 -6.106 -17.180 -7.310 149 HB3 SER 21 2HB SER 21 -4.428 -17.715 -7.367 150 HG SER 21 HG SER 21 -6.337 -19.085 -6.401 151 H ILE 22 H ILE 22 -5.102 -15.628 -3.284 152 HA ILE 22 HA ILE 22 -8.016 -15.341 -3.330 153 HB ILE 22 HB ILE 22 -6.250 -14.388 -1.083 154 HG12 ILE 22 1HG1 ILE 22 -7.068 -17.316 -1.437 155 HG13 ILE 22 2HG1 ILE 22 -5.447 -16.679 -1.654 156 HG21 ILE 22 1HG2 ILE 22 -8.183 -14.930 0.308 157 HG22 ILE 22 2HG2 ILE 22 -8.713 -13.947 -1.040 158 HG23 ILE 22 3HG2 ILE 22 -9.002 -15.703 -1.062 159 HD11 ILE 22 3HD1 ILE 22 -6.972 -16.707 0.955 160 HD12 ILE 22 1HD1 ILE 22 -5.576 -17.693 0.505 161 HD13 ILE 22 2HD1 ILE 22 -5.386 -15.936 0.695 162 H GLN 23 H GLN 23 -9.045 -13.482 -3.550 163 HA GLN 23 HA GLN 23 -7.572 -10.902 -3.693 164 HB2 GLN 23 1HB GLN 23 -7.833 -11.767 -5.909 165 HB3 GLN 23 2HB GLN 23 -9.583 -11.922 -5.733 166 HG2 GLN 23 1HG GLN 23 -9.744 -9.457 -5.497 167 HG3 GLN 23 2HG GLN 23 -7.987 -9.320 -5.592 168 HE21 GLN 23 1HE2 GLN 23 -8.433 -11.629 -7.853 169 HE22 GLN 23 2HE2 GLN 23 -8.536 -10.555 -9.208 170 H LYS 24 H LYS 24 -8.351 -9.696 -2.187 171 HA LYS 24 HA LYS 24 -11.170 -10.082 -1.281 172 HB2 LYS 24 1HB LYS 24 -8.811 -10.257 0.212 173 HB3 LYS 24 2HB LYS 24 -9.365 -8.631 0.542 174 HG2 LYS 24 1HG LYS 24 -10.857 -11.235 0.953 175 HG3 LYS 24 2HG LYS 24 -10.191 -10.178 2.195 176 HD2 LYS 24 1HD LYS 24 -12.545 -9.501 0.425 177 HD3 LYS 24 2HD LYS 24 -12.614 -10.098 2.078 178 HE2 LYS 24 1HE LYS 24 -11.379 -8.042 2.846 179 HE3 LYS 24 2HE LYS 24 -11.434 -7.432 1.187 180 HZ1 LYS 24 3HZ LYS 24 -13.261 -6.655 2.665 181 HZ2 LYS 24 1HZ LYS 24 -13.837 -8.180 2.731 182 HZ3 LYS 24 2HZ LYS 24 -13.766 -7.347 1.293 183 H ILE 25 H ILE 25 -12.513 -8.391 -1.569 184 HA ILE 25 HA ILE 25 -11.363 -5.825 -2.554 185 HB ILE 25 HB ILE 25 -14.175 -6.889 -2.963 186 HG12 ILE 25 1HG1 ILE 25 -13.096 -6.545 -5.490 187 HG13 ILE 25 2HG1 ILE 25 -11.691 -7.119 -4.623 188 HG21 ILE 25 1HG2 ILE 25 -12.813 -4.436 -4.171 189 HG22 ILE 25 2HG2 ILE 25 -14.494 -4.927 -4.365 190 HG23 ILE 25 3HG2 ILE 25 -13.942 -4.376 -2.800 191 HD11 ILE 25 3HD1 ILE 25 -12.966 -8.945 -5.697 192 HD12 ILE 25 1HD1 ILE 25 -12.923 -9.150 -3.930 193 HD13 ILE 25 2HD1 ILE 25 -14.390 -8.531 -4.726 194 H TYR 26 H TYR 26 -11.716 -4.141 -1.255 195 HA TYR 26 HA TYR 26 -13.367 -4.453 1.217 196 HB2 TYR 26 1HB TYR 26 -10.870 -2.767 0.898 197 HB3 TYR 26 2HB TYR 26 -11.854 -2.923 2.331 198 HD1 TYR 26 1HD TYR 26 -9.620 -4.741 0.070 199 HD2 TYR 26 2HD TYR 26 -11.339 -4.498 4.043 200 HE1 TYR 26 1HE TYR 26 -8.252 -6.686 0.769 201 HE2 TYR 26 2HE TYR 26 -10.023 -6.433 4.733 202 HH TYR 26 HH TYR 26 -8.556 -8.138 4.101 203 H ASP 27 H ASP 27 -15.099 -3.926 -0.221 204 HA ASP 27 HA ASP 27 -15.092 -1.257 -1.518 205 HB2 ASP 27 1HB ASP 27 -17.297 -1.928 -2.366 206 HB3 ASP 27 2HB ASP 27 -16.026 -3.054 -2.823 207 H ASP 28 H ASP 28 -15.844 -2.675 1.485 208 HA ASP 28 HA ASP 28 -18.221 -1.184 2.055 209 HB2 ASP 28 1HB ASP 28 -16.677 -2.690 4.162 210 HB3 ASP 28 2HB ASP 28 -18.415 -2.579 3.910 211 H SER 29 H SER 29 -18.439 0.613 3.395 212 HA SER 29 HA SER 29 -16.462 2.486 3.500 213 HB2 SER 29 1HB SER 29 -18.956 2.708 3.875 214 HB3 SER 29 2HB SER 29 -18.691 2.243 5.561 215 HG SER 29 HG SER 29 -17.711 4.502 4.144 216 H GLU 30 H GLU 30 -17.154 0.253 6.223 217 HA GLU 30 HA GLU 30 -15.316 1.590 8.033 218 HB2 GLU 30 1HB GLU 30 -17.366 0.368 8.727 219 HB3 GLU 30 2HB GLU 30 -16.641 -1.142 8.177 220 HG2 GLU 30 1HG GLU 30 -14.767 -0.753 9.851 221 HG3 GLU 30 2HG GLU 30 -15.666 0.654 10.439 222 H SER 31 H SER 31 -15.078 -1.079 5.790 223 HA SER 31 HA SER 31 -12.430 -2.188 6.417 224 HB2 SER 31 1HB SER 31 -14.325 -2.373 4.093 225 HB3 SER 31 2HB SER 31 -12.759 -3.137 4.227 226 HG SER 31 HG SER 31 -14.569 -3.359 6.382 227 H ILE 32 H ILE 32 -13.647 0.537 4.386 228 HA ILE 32 HA ILE 32 -11.033 1.116 3.311 229 HB ILE 32 HB ILE 32 -13.363 3.075 3.631 230 HG12 ILE 32 1HG1 ILE 32 -12.655 1.191 1.342 231 HG13 ILE 32 2HG1 ILE 32 -14.093 1.172 2.381 232 HG21 ILE 32 1HG2 ILE 32 -10.942 3.125 1.781 233 HG22 ILE 32 2HG2 ILE 32 -12.234 4.352 1.874 234 HG23 ILE 32 3HG2 ILE 32 -11.131 4.116 3.230 235 HD11 ILE 32 3HD1 ILE 32 -14.776 1.904 0.288 236 HD12 ILE 32 1HD1 ILE 32 -14.855 3.293 1.412 237 HD13 ILE 32 2HD1 ILE 32 -13.534 3.136 0.223 238 H GLN 33 H GLN 33 -12.928 2.405 6.068 239 HA GLN 33 HA GLN 33 -10.920 4.219 6.973 240 HB2 GLN 33 1HB GLN 33 -13.341 2.940 8.199 241 HB3 GLN 33 2HB GLN 33 -12.222 3.817 9.236 242 HG2 GLN 33 1HG GLN 33 -12.977 5.298 6.748 243 HG3 GLN 33 2HG GLN 33 -14.312 4.940 7.829 244 HE21 GLN 33 1HE2 GLN 33 -11.229 6.786 7.585 245 HE22 GLN 33 2HE2 GLN 33 -11.399 7.569 9.132 246 H LYS 34 H LYS 34 -11.257 0.666 7.623 247 HA LYS 34 HA LYS 34 -9.157 0.598 9.540 248 HB2 LYS 34 1HB LYS 34 -10.990 -1.134 8.893 249 HB3 LYS 34 2HB LYS 34 -9.912 -1.666 7.627 250 HG2 LYS 34 1HG LYS 34 -8.828 -1.469 10.454 251 HG3 LYS 34 2HG LYS 34 -10.033 -2.693 10.077 252 HD2 LYS 34 1HD LYS 34 -8.079 -2.986 8.104 253 HD3 LYS 34 2HD LYS 34 -7.200 -2.628 9.596 254 HE2 LYS 34 1HE LYS 34 -9.461 -4.615 9.646 255 HE3 LYS 34 2HE LYS 34 -7.869 -5.105 9.070 256 HZ1 LYS 34 3HZ LYS 34 -6.908 -4.474 11.177 257 HZ2 LYS 34 1HZ LYS 34 -8.072 -5.611 11.351 258 HZ3 LYS 34 2HZ LYS 34 -8.403 -4.071 11.773 259 H ILE 35 H ILE 35 -9.094 -0.284 6.026 260 HA ILE 35 HA ILE 35 -6.409 -0.762 5.854 261 HB ILE 35 HB ILE 35 -8.422 0.274 3.812 262 HG12 ILE 35 1HG1 ILE 35 -7.013 -2.374 4.306 263 HG13 ILE 35 2HG1 ILE 35 -8.658 -1.994 4.785 264 HG21 ILE 35 1HG2 ILE 35 -6.745 -0.334 2.022 265 HG22 ILE 35 2HG2 ILE 35 -6.292 1.073 2.939 266 HG23 ILE 35 3HG2 ILE 35 -5.512 -0.490 3.281 267 HD11 ILE 35 3HD1 ILE 35 -7.665 -2.248 1.923 268 HD12 ILE 35 1HD1 ILE 35 -8.565 -3.418 2.851 269 HD13 ILE 35 2HD1 ILE 35 -9.330 -1.856 2.440 270 H LEU 36 H LEU 36 -7.986 2.409 5.237 271 HA LEU 36 HA LEU 36 -5.748 3.819 4.389 272 HB2 LEU 36 1HB LEU 36 -8.268 4.556 5.841 273 HB3 LEU 36 2HB LEU 36 -7.102 5.793 5.445 274 HG LEU 36 HG LEU 36 -9.243 5.053 3.932 275 HD11 LEU 36 1HD1 LEU 36 -6.718 6.319 2.883 276 HD12 LEU 36 2HD1 LEU 36 -8.042 7.149 3.755 277 HD13 LEU 36 3HD1 LEU 36 -8.346 6.460 2.170 278 HD21 LEU 36 3HD2 LEU 36 -6.897 3.762 2.476 279 HD22 LEU 36 1HD2 LEU 36 -8.506 4.073 1.809 280 HD23 LEU 36 2HD2 LEU 36 -8.322 2.916 3.117 281 H SER 37 H SER 37 -6.242 2.689 7.664 282 HA SER 37 HA SER 37 -4.537 4.591 8.997 283 HB2 SER 37 1HB SER 37 -6.135 2.752 9.999 284 HB3 SER 37 2HB SER 37 -4.691 1.721 9.853 285 HG SER 37 HG SER 37 -5.205 3.953 11.433 286 H GLU 38 H GLU 38 -3.902 1.296 7.665 287 HA GLU 38 HA GLU 38 -1.095 1.383 8.101 288 HB2 GLU 38 1HB GLU 38 -2.726 -0.328 6.181 289 HB3 GLU 38 2HB GLU 38 -1.067 -0.640 6.707 290 HG2 GLU 38 1HG GLU 38 -3.527 -0.562 8.492 291 HG3 GLU 38 2HG GLU 38 -2.705 -2.023 7.961 292 H ILE 39 H ILE 39 -3.142 2.338 5.383 293 HA ILE 39 HA ILE 39 -1.070 2.839 3.479 294 HB ILE 39 HB ILE 39 -3.736 4.246 3.851 295 HG12 ILE 39 1HG1 ILE 39 -3.979 1.755 3.558 296 HG13 ILE 39 2HG1 ILE 39 -4.675 2.673 2.239 297 HG21 ILE 39 1HG2 ILE 39 -1.883 4.121 1.484 298 HG22 ILE 39 2HG2 ILE 39 -3.601 4.593 1.364 299 HG23 ILE 39 3HG2 ILE 39 -2.501 5.560 2.356 300 HD11 ILE 39 3HD1 ILE 39 -1.924 1.355 2.131 301 HD12 ILE 39 1HD1 ILE 39 -3.426 0.628 1.558 302 HD13 ILE 39 2HD1 ILE 39 -2.806 2.096 0.785 303 H ALA 40 H ALA 40 -1.750 4.489 6.436 304 HA ALA 40 HA ALA 40 0.081 6.707 5.665 305 HB1 ALA 40 1HB ALA 40 -2.302 7.359 6.241 306 HB2 ALA 40 2HB ALA 40 -1.960 6.746 7.885 307 HB3 ALA 40 3HB ALA 40 -1.032 8.107 7.235 308 H THR 41 H THR 41 0.314 3.766 7.171 309 HA THR 41 HA THR 41 1.516 4.708 9.626 310 HB THR 41 HB THR 41 0.309 2.481 9.139 311 HG1 THR 41 1HG THR 41 1.019 2.788 11.055 312 HG21 THR 41 3HG2 THR 41 1.920 1.749 7.302 313 HG22 THR 41 1HG2 THR 41 1.689 0.581 8.610 314 HG23 THR 41 2HG2 THR 41 3.155 1.582 8.563 315 H GLY 42 H GLY 42 2.744 3.964 6.377 316 HA2 GLY 42 1HA GLY 42 5.353 3.425 7.301 317 HA3 GLY 42 2HA GLY 42 4.784 3.502 5.621 318 H LYS 43 H LYS 43 7.326 4.280 6.453 319 HA LYS 43 HA LYS 43 7.313 7.266 6.421 320 HB2 LYS 43 1HB LYS 43 9.438 5.320 7.447 321 HB3 LYS 43 2HB LYS 43 9.422 7.069 7.592 322 HG2 LYS 43 1HG LYS 43 8.744 6.411 9.689 323 HG3 LYS 43 2HG LYS 43 7.212 6.759 8.928 324 HD2 LYS 43 1HD LYS 43 6.760 4.355 8.682 325 HD3 LYS 43 2HD LYS 43 8.404 3.937 9.161 326 HE2 LYS 43 1HE LYS 43 6.577 5.535 10.973 327 HE3 LYS 43 2HE LYS 43 6.397 3.782 10.846 328 HZ1 LYS 43 3HZ LYS 43 8.359 3.409 11.850 329 HZ2 LYS 43 1HZ LYS 43 8.000 4.838 12.581 330 HZ3 LYS 43 2HZ LYS 43 9.096 4.751 11.329 331 H ARG 44 H ARG 44 7.505 7.756 4.102 332 HA ARG 44 HA ARG 44 8.866 6.072 2.306 333 HB2 ARG 44 1HB ARG 44 8.752 7.808 0.687 334 HB3 ARG 44 2HB ARG 44 7.283 7.728 1.590 335 HG2 ARG 44 1HG ARG 44 8.262 9.599 3.091 336 HG3 ARG 44 2HG ARG 44 9.458 9.797 1.750 337 HD2 ARG 44 1HD ARG 44 7.804 10.289 0.211 338 HD3 ARG 44 2HD ARG 44 6.495 9.740 1.323 339 HE ARG 44 HE ARG 44 8.242 12.087 1.921 340 HH11 ARG 44 1HH1 ARG 44 4.862 11.238 1.027 341 HH12 ARG 44 2HH1 ARG 44 4.227 12.209 2.337 342 HH21 ARG 44 1HH2 ARG 44 7.182 13.441 3.586 343 HH22 ARG 44 2HH2 ARG 44 5.476 13.711 3.414 344 H THR 45 H THR 45 10.284 7.814 4.689 345 HA THR 45 HA THR 45 12.333 8.499 5.296 346 HB THR 45 HB THR 45 14.236 7.313 4.550 347 HG1 THR 45 1HG THR 45 12.722 6.721 2.266 348 HG21 THR 45 3HG2 THR 45 12.465 5.950 5.749 349 HG22 THR 45 1HG2 THR 45 13.617 5.031 4.773 350 HG23 THR 45 2HG2 THR 45 11.965 5.309 4.173 351 H GLU 46 H GLU 46 14.403 9.732 4.418 352 HA GLU 46 HA GLU 46 13.488 11.950 2.787 353 HB2 GLU 46 1HB GLU 46 15.855 12.703 2.990 354 HB3 GLU 46 2HB GLU 46 15.053 12.385 4.531 355 HG2 GLU 46 1HG GLU 46 16.211 10.381 4.884 356 HG3 GLU 46 2HG GLU 46 16.742 10.229 3.221 357 H LYS 47 H LYS 47 14.564 8.813 1.942 358 HA LYS 47 HA LYS 47 16.311 9.324 -0.221 359 HB2 LYS 47 1HB LYS 47 14.267 7.078 0.227 360 HB3 LYS 47 2HB LYS 47 15.454 7.069 -1.053 361 HG2 LYS 47 1HG LYS 47 16.224 7.139 1.886 362 HG3 LYS 47 2HG LYS 47 15.992 5.664 0.940 363 HD2 LYS 47 1HD LYS 47 17.729 6.663 -0.720 364 HD3 LYS 47 2HD LYS 47 18.113 7.799 0.595 365 HE2 LYS 47 1HE LYS 47 18.457 5.778 2.096 366 HE3 LYS 47 2HE LYS 47 18.189 4.745 0.689 367 HZ1 LYS 47 3HZ LYS 47 20.377 6.732 0.906 368 HZ2 LYS 47 1HZ LYS 47 20.074 5.730 -0.385 369 HZ3 LYS 47 2HZ LYS 47 20.544 5.096 1.026 370 H GLN 48 H GLN 48 15.905 8.979 -2.434 371 HA GLN 48 HA GLN 48 13.266 9.836 -3.468 372 HB2 GLN 48 1HB GLN 48 14.509 10.566 -5.486 373 HB3 GLN 48 2HB GLN 48 14.805 11.519 -4.022 374 HG2 GLN 48 1HG GLN 48 16.977 10.294 -3.703 375 HG3 GLN 48 2HG GLN 48 16.620 9.382 -5.180 376 HE21 GLN 48 1HE2 GLN 48 16.141 12.923 -4.472 377 HE22 GLN 48 2HE2 GLN 48 17.207 13.449 -5.752 378 H SER 49 H SER 49 12.527 8.674 -5.261 379 HA SER 49 HA SER 49 13.432 5.861 -5.172 380 HB2 SER 49 1HB SER 49 10.499 6.669 -5.381 381 HB3 SER 49 2HB SER 49 11.295 5.157 -4.826 382 HG SER 49 HG SER 49 11.084 7.749 -3.667 383 H ILE 50 H ILE 50 14.006 5.165 -7.188 384 HA ILE 50 HA ILE 50 13.459 7.113 -9.354 385 HB ILE 50 HB ILE 50 15.530 6.484 -10.282 386 HG12 ILE 50 1HG1 ILE 50 15.700 4.264 -8.221 387 HG13 ILE 50 2HG1 ILE 50 15.487 4.057 -9.952 388 HG21 ILE 50 1HG2 ILE 50 16.001 6.667 -7.281 389 HG22 ILE 50 2HG2 ILE 50 16.995 7.329 -8.599 390 HG23 ILE 50 3HG2 ILE 50 15.414 8.025 -8.259 391 HD11 ILE 50 3HD1 ILE 50 17.695 5.159 -10.345 392 HD12 ILE 50 1HD1 ILE 50 17.938 5.226 -8.587 393 HD13 ILE 50 2HD1 ILE 50 17.814 3.669 -9.384 394 H GLN 51 H GLN 51 11.720 4.516 -8.548 395 HA GLN 51 HA GLN 51 11.254 3.663 -11.296 396 HB2 GLN 51 1HB GLN 51 11.085 1.308 -10.145 397 HB3 GLN 51 2HB GLN 51 12.634 1.932 -10.615 398 HG2 GLN 51 1HG GLN 51 12.919 0.972 -8.492 399 HG3 GLN 51 2HG GLN 51 13.016 2.694 -8.166 400 HE21 GLN 51 1HE2 GLN 51 10.977 -0.229 -7.853 401 HE22 GLN 51 2HE2 GLN 51 9.994 0.405 -6.615 402 H ASP 52 H ASP 52 9.217 2.130 -11.045 403 HA ASP 52 HA ASP 52 7.168 3.389 -9.298 404 HB2 ASP 52 1HB ASP 52 6.955 2.460 -12.204 405 HB3 ASP 52 2HB ASP 52 5.602 2.985 -11.231 406 H TYR 53 H TYR 53 8.893 0.528 -9.985 407 HA TYR 53 HA TYR 53 6.630 -1.209 -9.161 408 HB2 TYR 53 1HB TYR 53 8.256 -1.310 -11.696 409 HB3 TYR 53 2HB TYR 53 7.845 -2.823 -10.914 410 HD1 TYR 53 2HD TYR 53 6.262 0.266 -12.322 411 HD2 TYR 53 1HD TYR 53 5.766 -3.854 -11.146 412 HE1 TYR 53 2HE TYR 53 4.062 0.246 -13.375 413 HE2 TYR 53 1HE TYR 53 3.576 -3.910 -12.188 414 HH TYR 53 HH TYR 53 2.238 -1.109 -14.025 415 HA PRO 54 HA PRO 54 9.516 -2.829 -6.452 416 HB2 PRO 54 1HB PRO 54 8.692 -5.469 -6.106 417 HB3 PRO 54 2HB PRO 54 7.870 -4.029 -5.459 418 HG2 PRO 54 1HG PRO 54 7.176 -5.560 -7.934 419 HG3 PRO 54 2HG PRO 54 6.110 -4.951 -6.620 420 HD2 PRO 54 1HD PRO 54 6.468 -3.610 -8.985 421 HD3 PRO 54 2HD PRO 54 6.270 -2.730 -7.447 422 H SER 55 H SER 55 11.370 -3.920 -6.131 423 HA SER 55 HA SER 55 12.445 -5.740 -8.164 424 HB2 SER 55 1HB SER 55 13.524 -3.901 -6.399 425 HB3 SER 55 2HB SER 55 14.486 -5.396 -6.535 426 HG SER 55 HG SER 55 15.143 -3.912 -8.133 427 H ALA 56 H ALA 56 10.378 -6.155 -5.844 428 HA ALA 56 HA ALA 56 11.418 -8.573 -4.531 429 HB1 ALA 56 1HB ALA 56 9.838 -7.209 -3.288 430 HB2 ALA 56 2HB ALA 56 8.642 -7.322 -4.603 431 HB3 ALA 56 3HB ALA 56 9.092 -8.764 -3.676 432 H GLU 57 H GLU 57 10.238 -10.554 -4.895 433 HA GLU 57 HA GLU 57 9.157 -11.050 -7.634 434 HB2 GLU 57 1HB GLU 57 10.894 -12.539 -5.730 435 HB3 GLU 57 2HB GLU 57 9.496 -13.473 -6.219 436 HG2 GLU 57 1HG GLU 57 10.060 -13.092 -8.604 437 HG3 GLU 57 2HG GLU 57 11.472 -12.152 -8.096 438 H GLU 58 H GLU 58 8.635 -11.160 -4.119 439 HA GLU 58 HA GLU 58 5.998 -12.501 -4.484 440 HB2 GLU 58 1HB GLU 58 8.026 -12.644 -2.247 441 HB3 GLU 58 2HB GLU 58 6.349 -13.240 -2.163 442 HG2 GLU 58 1HG GLU 58 6.728 -14.944 -3.756 443 HG3 GLU 58 2HG GLU 58 8.181 -14.185 -4.387 444 H TYR 59 H TYR 59 4.606 -10.920 -4.574 445 HA TYR 59 HA TYR 59 4.146 -9.137 -2.339 446 HB2 TYR 59 1HB TYR 59 4.166 -7.080 -3.725 447 HB3 TYR 59 2HB TYR 59 5.762 -7.783 -3.550 448 HD1 TYR 59 2HD TYR 59 3.006 -7.030 -5.841 449 HD2 TYR 59 1HD TYR 59 6.935 -8.766 -5.485 450 HE1 TYR 59 2HE TYR 59 3.299 -6.860 -8.289 451 HE2 TYR 59 1HE TYR 59 7.236 -8.614 -7.931 452 HH TYR 59 HH TYR 59 6.274 -7.939 -9.928 453 H GLY 60 H GLY 60 2.080 -7.978 -2.676 454 HA2 GLY 60 1HA GLY 60 0.185 -9.473 -4.456 455 HA3 GLY 60 2HA GLY 60 -0.246 -8.635 -2.966 456 H THR 61 H THR 61 -1.720 -8.068 -5.239 457 HA THR 61 HA THR 61 -0.598 -5.537 -6.343 458 HB THR 61 HB THR 61 -2.726 -7.441 -7.434 459 HG1 THR 61 1HG THR 61 -0.318 -8.028 -7.649 460 HG21 THR 61 3HG2 THR 61 -1.327 -5.082 -8.716 461 HG22 THR 61 1HG2 THR 61 -2.958 -4.956 -8.033 462 HG23 THR 61 2HG2 THR 61 -2.653 -6.033 -9.408 463 H ILE 62 H ILE 62 -1.581 -3.678 -5.633 464 HA ILE 62 HA ILE 62 -4.220 -3.892 -4.275 465 HB ILE 62 HB ILE 62 -1.991 -1.911 -3.842 466 HG12 ILE 62 1HG1 ILE 62 -2.251 -3.110 -1.428 467 HG13 ILE 62 2HG1 ILE 62 -2.604 -4.490 -2.430 468 HG21 ILE 62 1HG2 ILE 62 -4.622 -2.252 -2.373 469 HG22 ILE 62 2HG2 ILE 62 -3.289 -1.138 -1.929 470 HG23 ILE 62 3HG2 ILE 62 -4.160 -0.892 -3.426 471 HD11 ILE 62 3HD1 ILE 62 -0.445 -4.132 -3.652 472 HD12 ILE 62 1HD1 ILE 62 -0.145 -2.662 -2.703 473 HD13 ILE 62 2HD1 ILE 62 -0.165 -4.272 -1.920 474 H ASN 63 H ASN 63 -5.806 -2.630 -5.069 475 HA ASN 63 HA ASN 63 -5.146 -0.254 -6.756 476 HB2 ASN 63 1HB ASN 63 -7.585 -2.095 -6.987 477 HB3 ASN 63 2HB ASN 63 -7.432 -0.518 -7.749 478 HD21 ASN 63 1HD2 ASN 63 -6.185 -3.895 -7.805 479 HD22 ASN 63 2HD2 ASN 63 -5.653 -3.776 -9.440 480 H ILE 64 H ILE 64 -5.979 1.632 -5.744 481 HA ILE 64 HA ILE 64 -8.246 1.255 -3.859 482 HB ILE 64 HB ILE 64 -6.163 3.451 -3.755 483 HG12 ILE 64 1HG1 ILE 64 -6.395 1.048 -1.894 484 HG13 ILE 64 2HG1 ILE 64 -5.128 1.288 -3.088 485 HG21 ILE 64 1HG2 ILE 64 -7.367 4.418 -2.104 486 HG22 ILE 64 2HG2 ILE 64 -8.721 3.514 -2.795 487 HG23 ILE 64 3HG2 ILE 64 -7.870 2.887 -1.381 488 HD11 ILE 64 3HD1 ILE 64 -4.496 3.433 -1.888 489 HD12 ILE 64 1HD1 ILE 64 -5.597 2.910 -0.583 490 HD13 ILE 64 2HD1 ILE 64 -4.204 1.916 -1.013 491 H GLU 65 H GLU 65 -9.935 1.699 -5.143 492 HA GLU 65 HA GLU 65 -9.670 3.283 -7.596 493 HB2 GLU 65 1HB GLU 65 -10.744 1.055 -7.609 494 HB3 GLU 65 2HB GLU 65 -11.958 1.600 -6.452 495 HG2 GLU 65 1HG GLU 65 -12.899 3.155 -7.988 496 HG3 GLU 65 2HG GLU 65 -11.518 3.056 -9.064 497 H ASN 66 H ASN 66 -9.814 5.481 -7.229 498 HA ASN 66 HA ASN 66 -12.031 6.496 -5.626 499 HB2 ASN 66 1HB ASN 66 -9.839 8.207 -4.932 500 HB3 ASN 66 2HB ASN 66 -10.814 7.251 -3.868 501 HD21 ASN 66 1HD2 ASN 66 -7.687 6.939 -5.680 502 HD22 ASN 66 2HD2 ASN 66 -7.155 5.819 -4.470 503 H ASN 67 H ASN 67 -12.497 8.676 -6.174 504 HA ASN 67 HA ASN 67 -12.679 10.512 -7.525 505 HB2 ASN 67 1HB ASN 67 -9.644 10.398 -7.593 506 HB3 ASN 67 2HB ASN 67 -10.636 11.790 -7.938 507 HD21 ASN 67 1HD2 ASN 67 -9.038 10.055 -5.447 508 HD22 ASN 67 2HD2 ASN 67 -9.796 10.868 -4.061 509 H GLY 68 H GLY 68 -12.791 7.990 -9.079 510 HA2 GLY 68 1HA GLY 68 -12.811 7.328 -11.273 511 HA3 GLY 68 2HA GLY 68 -12.603 9.020 -11.736 512 H GLY 69 H GLY 69 -10.422 6.892 -9.821 513 HA2 GLY 69 1HA GLY 69 -8.722 6.281 -12.094 514 HA3 GLY 69 2HA GLY 69 -7.964 7.280 -10.827 515 H MET 70 H MET 70 -6.651 5.094 -10.889 516 HA MET 70 HA MET 70 -7.494 3.959 -8.320 517 HB2 MET 70 1HB MET 70 -6.490 1.811 -8.721 518 HB3 MET 70 2HB MET 70 -7.873 2.066 -9.775 519 HG2 MET 70 1HG MET 70 -5.150 2.738 -10.878 520 HG3 MET 70 2HG MET 70 -5.509 1.053 -10.583 521 HE1 MET 70 3HE MET 70 -7.959 0.123 -11.243 522 HE2 MET 70 1HE MET 70 -8.277 0.096 -12.992 523 HE3 MET 70 2HE MET 70 -6.726 -0.493 -12.359 524 H THR 71 H THR 71 -5.998 3.988 -6.821 525 HA THR 71 HA THR 71 -3.318 5.103 -7.426 526 HB THR 71 HB THR 71 -4.608 4.343 -4.773 527 HG1 THR 71 1HG THR 71 -4.731 6.754 -6.186 528 HG21 THR 71 3HG2 THR 71 -2.251 6.178 -5.365 529 HG22 THR 71 1HG2 THR 71 -2.122 4.526 -4.722 530 HG23 THR 71 2HG2 THR 71 -2.916 5.789 -3.762 531 H THR 72 H THR 72 -2.357 3.387 -8.544 532 HA THR 72 HA THR 72 -2.652 0.619 -7.632 533 HB THR 72 HB THR 72 -0.875 1.880 -9.759 534 HG1 THR 72 1HG THR 72 -3.333 0.542 -10.157 535 HG21 THR 72 3HG2 THR 72 -0.181 -0.429 -9.098 536 HG22 THR 72 1HG2 THR 72 -0.834 -0.390 -10.748 537 HG23 THR 72 2HG2 THR 72 -1.834 -0.990 -9.400 538 H MET 73 H MET 73 -1.083 -0.525 -6.519 539 HA MET 73 HA MET 73 1.596 0.484 -6.022 540 HB2 MET 73 1HB MET 73 1.249 0.656 -3.554 541 HB3 MET 73 2HB MET 73 0.461 1.880 -4.491 542 HG2 MET 73 1HG MET 73 -1.609 0.128 -4.367 543 HG3 MET 73 2HG MET 73 -0.806 -0.233 -2.872 544 HE1 MET 73 3HE MET 73 -0.983 3.575 -1.363 545 HE2 MET 73 1HE MET 73 -0.431 1.932 -0.965 546 HE3 MET 73 2HE MET 73 0.335 2.838 -2.294 547 H PHE 74 H PHE 74 2.752 -1.152 -4.550 548 HA PHE 74 HA PHE 74 1.579 -3.860 -4.528 549 HB2 PHE 74 1HB PHE 74 4.355 -3.196 -5.624 550 HB3 PHE 74 2HB PHE 74 3.600 -4.762 -5.493 551 HD1 PHE 74 1HD PHE 74 1.729 -5.421 -7.044 552 HD2 PHE 74 2HD PHE 74 3.816 -1.662 -7.501 553 HE1 PHE 74 1HE PHE 74 0.925 -5.241 -9.373 554 HE2 PHE 74 2HE PHE 74 2.953 -1.452 -9.773 555 HZ PHE 74 HZ PHE 74 1.484 -3.233 -10.741 556 H TYR 75 H TYR 75 2.718 -5.034 -2.560 557 HA TYR 75 HA TYR 75 4.726 -3.390 -1.126 558 HB2 TYR 75 1HB TYR 75 2.756 -4.804 0.583 559 HB3 TYR 75 2HB TYR 75 3.639 -3.384 0.907 560 HD1 TYR 75 2HD TYR 75 2.785 -1.372 -0.979 561 HD2 TYR 75 1HD TYR 75 0.543 -4.485 0.944 562 HE1 TYR 75 2HE TYR 75 0.772 0.073 -1.045 563 HE2 TYR 75 1HE TYR 75 -1.469 -3.101 0.833 564 HH TYR 75 HH TYR 75 -2.205 -0.969 0.618 565 H TYR 76 H TYR 76 6.125 -4.697 0.233 566 HA TYR 76 HA TYR 76 5.812 -7.610 0.140 567 HB2 TYR 76 1HB TYR 76 8.151 -7.914 -0.709 568 HB3 TYR 76 2HB TYR 76 6.972 -7.361 -1.870 569 HD1 TYR 76 1HD TYR 76 9.728 -6.142 0.344 570 HD2 TYR 76 2HD TYR 76 7.299 -5.395 -3.125 571 HE1 TYR 76 1HE TYR 76 11.154 -4.184 -0.192 572 HE2 TYR 76 2HE TYR 76 8.748 -3.489 -3.697 573 HH TYR 76 HH TYR 76 10.231 -1.978 -2.857 574 H GLU 77 H GLU 77 7.761 -8.639 1.376 575 HA GLU 77 HA GLU 77 8.727 -6.937 3.611 576 HB2 GLU 77 1HB GLU 77 7.700 -9.284 4.090 577 HB3 GLU 77 2HB GLU 77 9.155 -9.920 3.332 578 HG2 GLU 77 1HG GLU 77 10.537 -8.590 4.987 579 HG3 GLU 77 2HG GLU 77 9.047 -8.037 5.747 580 H GLU 78 H GLU 78 11.014 -6.659 3.755 581 HA GLU 78 HA GLU 78 12.651 -8.291 2.011 582 HB2 GLU 78 1HB GLU 78 12.329 -6.118 0.756 583 HB3 GLU 78 2HB GLU 78 13.164 -5.301 2.072 584 HG2 GLU 78 1HG GLU 78 15.183 -6.459 1.728 585 HG3 GLU 78 2HG GLU 78 14.382 -7.722 0.820 586 H ASN 79 H ASN 79 14.095 -9.221 3.331 587 HA ASN 79 HA ASN 79 15.615 -9.586 4.917 588 HB2 ASN 79 1HB ASN 79 16.012 -6.708 4.248 589 HB3 ASN 79 2HB ASN 79 16.702 -7.193 5.782 590 HD21 ASN 79 1HD2 ASN 79 17.200 -7.281 2.334 591 HD22 ASN 79 2HD2 ASN 79 18.406 -8.536 2.337 592 H GLY 80 H GLY 80 12.711 -8.468 5.805 593 HA2 GLY 80 1HA GLY 80 11.852 -9.268 7.926 594 HA3 GLY 80 2HA GLY 80 13.325 -8.730 8.717 595 H LYS 81 H LYS 81 12.437 -6.237 6.449 596 HA LYS 81 HA LYS 81 10.481 -5.014 8.254 597 HB2 LYS 81 1HB LYS 81 12.894 -3.927 6.949 598 HB3 LYS 81 2HB LYS 81 11.405 -3.102 6.481 599 HG2 LYS 81 1HG LYS 81 12.196 -1.955 8.277 600 HG3 LYS 81 2HG LYS 81 10.802 -2.855 8.876 601 HD2 LYS 81 1HD LYS 81 12.266 -3.153 10.612 602 HD3 LYS 81 2HD LYS 81 12.682 -4.594 9.670 603 HE2 LYS 81 1HE LYS 81 14.635 -3.457 8.707 604 HE3 LYS 81 2HE LYS 81 14.065 -1.904 9.326 605 HZ1 LYS 81 3HZ LYS 81 14.294 -2.989 11.605 606 HZ2 LYS 81 1HZ LYS 81 15.619 -2.463 10.838 607 HZ3 LYS 81 2HZ LYS 81 15.296 -4.086 10.828 608 H TYR 82 H TYR 82 8.749 -3.925 7.130 609 HA TYR 82 HA TYR 82 8.191 -5.245 4.517 610 HB2 TYR 82 1HB TYR 82 6.394 -4.097 6.639 611 HB3 TYR 82 2HB TYR 82 5.829 -4.573 5.045 612 HD1 TYR 82 2HD TYR 82 5.922 -7.058 4.397 613 HD2 TYR 82 1HD TYR 82 6.830 -5.623 8.369 614 HE1 TYR 82 2HE TYR 82 5.762 -9.373 5.281 615 HE2 TYR 82 1HE TYR 82 6.609 -7.896 9.257 616 HH TYR 82 HH TYR 82 6.787 -10.234 8.479 617 H TYR 83 H TYR 83 7.348 -3.900 2.831 618 HA TYR 83 HA TYR 83 7.831 -1.044 3.184 619 HB2 TYR 83 1HB TYR 83 9.101 -2.750 1.023 620 HB3 TYR 83 2HB TYR 83 9.194 -0.994 1.106 621 HD1 TYR 83 2HD TYR 83 10.449 0.121 2.940 622 HD2 TYR 83 1HD TYR 83 10.506 -4.150 2.445 623 HE1 TYR 83 2HE TYR 83 12.398 -0.035 4.519 624 HE2 TYR 83 1HE TYR 83 12.444 -4.343 3.906 625 HH TYR 83 HH TYR 83 14.122 -3.106 5.117 626 H ILE 84 H ILE 84 6.959 0.299 1.449 627 HA ILE 84 HA ILE 84 4.911 -1.007 -0.283 628 HB ILE 84 HB ILE 84 4.687 1.587 1.281 629 HG12 ILE 84 1HG1 ILE 84 2.380 0.389 1.768 630 HG13 ILE 84 2HG1 ILE 84 3.301 -1.070 1.428 631 HG21 ILE 84 1HG2 ILE 84 3.853 2.283 -0.780 632 HG22 ILE 84 2HG2 ILE 84 2.985 0.783 -1.059 633 HG23 ILE 84 3HG2 ILE 84 2.446 1.918 0.200 634 HD11 ILE 84 3HD1 ILE 84 4.745 -0.666 3.269 635 HD12 ILE 84 1HD1 ILE 84 4.175 1.020 3.441 636 HD13 ILE 84 2HD1 ILE 84 3.093 -0.340 3.813 637 H GLU 85 H GLU 85 5.065 -0.654 -2.390 638 HA GLU 85 HA GLU 85 6.977 1.207 -3.559 639 HB2 GLU 85 1HB GLU 85 4.883 -0.659 -4.755 640 HB3 GLU 85 2HB GLU 85 6.058 0.223 -5.698 641 HG2 GLU 85 1HG GLU 85 6.779 -1.843 -3.587 642 HG3 GLU 85 2HG GLU 85 6.633 -2.142 -5.309 643 H CYS 86 H CYS 86 6.266 2.581 -5.397 644 HA CYS 86 HA CYS 86 3.785 3.981 -5.485 645 HB2 CYS 86 1HB CYS 86 5.381 4.428 -3.105 646 HB3 CYS 86 2HB CYS 86 5.409 5.908 -4.074 647 HG CYS 86 HG CYS 86 2.931 4.010 -3.040 648 HA PRO 87 HA PRO 87 6.683 6.168 -8.445 649 HB2 PRO 87 1HB PRO 87 5.825 8.742 -8.551 650 HB3 PRO 87 2HB PRO 87 4.711 7.482 -9.151 651 HG2 PRO 87 1HG PRO 87 4.775 8.727 -6.371 652 HG3 PRO 87 2HG PRO 87 3.364 8.545 -7.442 653 HD2 PRO 87 1HD PRO 87 3.943 6.781 -5.478 654 HD3 PRO 87 2HD PRO 87 3.167 6.281 -6.987 655 H TYR 88 H TYR 88 7.911 8.511 -8.111 656 HA TYR 88 HA TYR 88 10.005 8.120 -6.852 657 HB2 TYR 88 1HB TYR 88 8.703 10.855 -6.832 658 HB3 TYR 88 2HB TYR 88 10.392 10.591 -6.526 659 HD1 TYR 88 2HD TYR 88 7.815 10.578 -9.184 660 HD2 TYR 88 1HD TYR 88 12.017 10.137 -8.229 661 HE1 TYR 88 2HE TYR 88 8.401 10.969 -11.542 662 HE2 TYR 88 1HE TYR 88 12.599 10.557 -10.567 663 HH TYR 88 HH TYR 88 10.137 10.884 -13.118 664 H LYS 89 H LYS 89 7.456 8.266 -4.799 665 HA LYS 89 HA LYS 89 9.096 8.682 -2.381 666 HB2 LYS 89 1HB LYS 89 6.142 9.363 -2.902 667 HB3 LYS 89 2HB LYS 89 6.897 9.405 -1.342 668 HG2 LYS 89 1HG LYS 89 7.578 11.531 -1.705 669 HG3 LYS 89 2HG LYS 89 8.562 11.018 -3.050 670 HD2 LYS 89 1HD LYS 89 5.648 11.914 -3.159 671 HD3 LYS 89 2HD LYS 89 7.079 12.801 -3.708 672 HE2 LYS 89 1HE LYS 89 7.522 10.758 -5.227 673 HE3 LYS 89 2HE LYS 89 5.848 10.296 -4.892 674 HZ1 LYS 89 3HZ LYS 89 5.290 12.631 -5.741 675 HZ2 LYS 89 1HZ LYS 89 5.807 11.571 -6.877 676 HZ3 LYS 89 2HZ LYS 89 6.826 12.700 -6.303 677 H GLY 90 H GLY 90 8.966 6.186 -3.797 678 HA2 GLY 90 1HA GLY 90 7.147 4.635 -2.092 679 HA3 GLY 90 2HA GLY 90 7.705 4.156 -3.701 680 H ILE 91 H ILE 91 9.245 5.255 -0.664 681 HA ILE 91 HA ILE 91 10.423 2.546 -0.322 682 HB ILE 91 HB ILE 91 12.019 5.070 0.245 683 HG12 ILE 91 1HG1 ILE 91 11.982 3.241 -2.183 684 HG13 ILE 91 2HG1 ILE 91 11.759 4.982 -2.105 685 HG21 ILE 91 1HG2 ILE 91 12.945 2.183 -0.007 686 HG22 ILE 91 2HG2 ILE 91 13.854 3.579 0.659 687 HG23 ILE 91 3HG2 ILE 91 12.474 2.879 1.538 688 HD11 ILE 91 3HD1 ILE 91 14.160 5.216 -1.395 689 HD12 ILE 91 1HD1 ILE 91 14.367 3.484 -1.742 690 HD13 ILE 91 2HD1 ILE 91 13.916 4.598 -3.041 691 H TYR 92 H TYR 92 8.119 2.945 0.779 692 HA TYR 92 HA TYR 92 8.374 4.251 3.426 693 HB2 TYR 92 1HB TYR 92 6.128 2.438 2.508 694 HB3 TYR 92 2HB TYR 92 6.156 3.409 3.955 695 HD1 TYR 92 1HD TYR 92 5.733 3.413 0.318 696 HD2 TYR 92 2HD TYR 92 5.768 5.877 3.858 697 HE1 TYR 92 1HE TYR 92 4.853 5.263 -0.976 698 HE2 TYR 92 2HE TYR 92 5.029 7.796 2.539 699 HH TYR 92 HH TYR 92 4.830 7.510 -0.976 700 H GLU 93 H GLU 93 9.851 3.368 4.566 701 HA GLU 93 HA GLU 93 9.956 0.521 5.192 702 HB2 GLU 93 1HB GLU 93 11.848 2.164 5.560 703 HB3 GLU 93 2HB GLU 93 10.788 3.116 6.577 704 HG2 GLU 93 1HG GLU 93 10.730 0.667 7.899 705 HG3 GLU 93 2HG GLU 93 12.310 0.618 7.136 706 H ILE 94 H ILE 94 8.416 -0.502 6.357 707 HA ILE 94 HA ILE 94 6.969 0.988 8.461 708 HB ILE 94 HB ILE 94 4.939 0.008 8.072 709 HG12 ILE 94 1HG1 ILE 94 6.210 -1.936 6.142 710 HG13 ILE 94 2HG1 ILE 94 5.600 -2.297 7.755 711 HG21 ILE 94 1HG2 ILE 94 4.262 0.750 5.961 712 HG22 ILE 94 2HG2 ILE 94 5.742 1.667 6.312 713 HG23 ILE 94 3HG2 ILE 94 5.829 0.314 5.203 714 HD11 ILE 94 3HD1 ILE 94 3.279 -1.625 6.911 715 HD12 ILE 94 1HD1 ILE 94 4.001 -1.621 5.289 716 HD13 ILE 94 2HD1 ILE 94 3.969 -3.105 6.209 717 H GLU 95 H GLU 95 6.644 -0.286 10.401 718 HA GLU 95 HA GLU 95 8.703 -2.233 10.853 719 HB2 GLU 95 1HB GLU 95 6.422 -1.044 12.509 720 HB3 GLU 95 2HB GLU 95 7.572 -2.223 13.127 721 HG2 GLU 95 1HG GLU 95 8.534 -0.340 13.794 722 HG3 GLU 95 2HG GLU 95 9.451 -0.629 12.335 723 H ASN 96 H ASN 96 5.179 -2.481 10.433 724 HA ASN 96 HA ASN 96 5.259 -5.384 11.214 725 HB2 ASN 96 1HB ASN 96 3.132 -3.212 11.545 726 HB3 ASN 96 2HB ASN 96 2.683 -4.902 11.521 727 HD21 ASN 96 1HD2 ASN 96 3.772 -6.387 13.094 728 HD22 ASN 96 2HD2 ASN 96 3.913 -5.691 14.710 729 H ASN 97 H ASN 97 3.508 -6.725 10.206 730 HA ASN 97 HA ASN 97 3.784 -6.497 7.331 731 HB2 ASN 97 1HB ASN 97 3.715 -8.707 8.478 732 HB3 ASN 97 2HB ASN 97 2.086 -8.358 9.057 733 HD21 ASN 97 1HD2 ASN 97 3.914 -8.404 5.892 734 HD22 ASN 97 2HD2 ASN 97 2.567 -9.047 4.999 735 H PHE 98 H PHE 98 2.373 -5.582 5.864 736 HA PHE 98 HA PHE 98 0.184 -3.981 6.774 737 HB2 PHE 98 1HB PHE 98 1.504 -3.473 4.776 738 HB3 PHE 98 2HB PHE 98 0.954 -4.944 3.990 739 HD1 PHE 98 2HD PHE 98 -1.448 -5.195 3.316 740 HD2 PHE 98 1HD PHE 98 0.172 -1.448 4.692 741 HE1 PHE 98 2HE PHE 98 -3.380 -4.034 2.393 742 HE2 PHE 98 1HE PHE 98 -1.776 -0.238 3.699 743 HZ PHE 98 HZ PHE 98 -3.603 -1.552 2.604 744 H GLU 99 H GLU 99 0.347 -7.253 5.265 745 HA GLU 99 HA GLU 99 -2.415 -7.390 4.691 746 HB2 GLU 99 1HB GLU 99 -0.085 -9.263 4.620 747 HB3 GLU 99 2HB GLU 99 -1.724 -9.933 4.477 748 HG2 GLU 99 1HG GLU 99 -2.221 -8.537 2.575 749 HG3 GLU 99 2HG GLU 99 -0.757 -7.586 2.799 750 H ASP 100 H ASP 100 -0.608 -8.532 7.544 751 HA ASP 100 HA ASP 100 -2.894 -9.946 8.609 752 HB2 ASP 100 1HB ASP 100 -0.433 -10.330 9.228 753 HB3 ASP 100 2HB ASP 100 -0.582 -8.907 10.275 754 H MET 101 H MET 101 -1.873 -6.604 8.640 755 HA MET 101 HA MET 101 -3.602 -5.834 10.893 756 HB2 MET 101 1HB MET 101 -1.907 -4.238 8.934 757 HB3 MET 101 2HB MET 101 -2.872 -3.514 10.220 758 HG2 MET 101 1HG MET 101 -0.623 -5.507 10.666 759 HG3 MET 101 2HG MET 101 -0.495 -3.756 10.818 760 HE1 MET 101 3HE MET 101 0.592 -5.469 13.049 761 HE2 MET 101 1HE MET 101 0.452 -3.706 13.246 762 HE3 MET 101 2HE MET 101 -0.132 -4.800 14.525 763 H ILE 102 H ILE 102 -4.198 -6.430 7.525 764 HA ILE 102 HA ILE 102 -6.550 -4.593 7.558 765 HB ILE 102 HB ILE 102 -6.888 -5.404 5.193 766 HG12 ILE 102 1HG1 ILE 102 -4.122 -6.552 5.472 767 HG13 ILE 102 2HG1 ILE 102 -5.598 -7.526 5.380 768 HG21 ILE 102 1HG2 ILE 102 -4.202 -4.082 5.742 769 HG22 ILE 102 2HG2 ILE 102 -5.202 -3.915 4.279 770 HG23 ILE 102 3HG2 ILE 102 -5.800 -3.288 5.834 771 HD11 ILE 102 3HD1 ILE 102 -4.489 -5.744 3.186 772 HD12 ILE 102 1HD1 ILE 102 -4.478 -7.497 3.228 773 HD13 ILE 102 2HD1 ILE 102 -6.026 -6.631 3.105 Start of MODEL 11 1 H1 GLY 1 H GLY 1 7.135 12.220 7.239 2 HA2 GLY 1 1HA GLY 1 5.124 12.172 8.718 3 HA3 GLY 1 2HA GLY 1 4.419 13.365 7.609 4 H SER 2 H SER 2 2.692 11.677 7.374 5 HA SER 2 HA SER 2 3.238 9.149 6.228 6 HB2 SER 2 1HB SER 2 0.784 9.032 5.987 7 HB3 SER 2 2HB SER 2 1.228 9.703 7.553 8 HG SER 2 HG SER 2 0.454 11.173 5.229 9 HA PRO 3 HA PRO 3 2.882 9.891 1.684 10 HB2 PRO 3 1HB PRO 3 0.626 8.306 1.187 11 HB3 PRO 3 2HB PRO 3 2.300 7.717 1.178 12 HG2 PRO 3 1HG PRO 3 0.288 7.622 3.424 13 HG3 PRO 3 2HG PRO 3 1.378 6.314 2.863 14 HD2 PRO 3 1HD PRO 3 1.992 7.721 5.031 15 HD3 PRO 3 2HD PRO 3 3.251 7.324 3.868 16 H ILE 4 H ILE 4 1.444 11.090 0.407 17 HA ILE 4 HA ILE 4 -0.956 12.319 1.630 18 HB ILE 4 HB ILE 4 0.321 12.611 -1.139 19 HG12 ILE 4 1HG1 ILE 4 0.241 14.636 1.147 20 HG13 ILE 4 2HG1 ILE 4 1.637 13.614 0.805 21 HG21 ILE 4 1HG2 ILE 4 -2.135 12.988 -1.193 22 HG22 ILE 4 2HG2 ILE 4 -1.985 14.173 0.131 23 HG23 ILE 4 3HG2 ILE 4 -1.260 14.483 -1.462 24 HD11 ILE 4 3HD1 ILE 4 0.531 15.766 -1.018 25 HD12 ILE 4 1HD1 ILE 4 2.087 15.721 -0.175 26 HD13 ILE 4 2HD1 ILE 4 1.773 14.576 -1.490 27 H LEU 5 H LEU 5 -2.954 11.379 1.143 28 HA LEU 5 HA LEU 5 -3.111 9.223 -0.896 29 HB2 LEU 5 1HB LEU 5 -3.961 9.239 2.029 30 HB3 LEU 5 2HB LEU 5 -4.853 8.272 0.882 31 HG LEU 5 HG LEU 5 -1.915 7.879 0.679 32 HD11 LEU 5 1HD1 LEU 5 -1.708 6.530 2.695 33 HD12 LEU 5 2HD1 LEU 5 -3.361 6.953 3.186 34 HD13 LEU 5 3HD1 LEU 5 -2.095 8.207 3.111 35 HD21 LEU 5 3HD2 LEU 5 -2.524 5.579 0.446 36 HD22 LEU 5 1HD2 LEU 5 -3.716 6.494 -0.473 37 HD23 LEU 5 2HD2 LEU 5 -4.146 5.848 1.116 38 HA PRO 6 HA PRO 6 -7.047 11.414 -1.749 39 HB2 PRO 6 1HB PRO 6 -8.769 9.284 -2.124 40 HB3 PRO 6 2HB PRO 6 -7.617 9.810 -3.359 41 HG2 PRO 6 1HG PRO 6 -7.296 7.596 -1.320 42 HG3 PRO 6 2HG PRO 6 -7.015 7.520 -3.094 43 HD2 PRO 6 1HD PRO 6 -4.976 7.903 -1.398 44 HD3 PRO 6 2HD PRO 6 -5.046 8.789 -2.935 45 H LYS 7 H LYS 7 -9.291 11.642 -0.481 46 HA LYS 7 HA LYS 7 -9.256 11.059 2.205 47 HB2 LYS 7 1HB LYS 7 -11.637 11.117 0.268 48 HB3 LYS 7 2HB LYS 7 -11.711 11.437 1.961 49 HG2 LYS 7 1HG LYS 7 -9.841 13.237 0.379 50 HG3 LYS 7 2HG LYS 7 -11.551 13.325 -0.004 51 HD2 LYS 7 1HD LYS 7 -10.936 14.933 1.793 52 HD3 LYS 7 2HD LYS 7 -12.109 13.678 2.200 53 HE2 LYS 7 1HE LYS 7 -10.740 13.741 4.121 54 HE3 LYS 7 2HE LYS 7 -10.238 12.320 3.175 55 HZ1 LYS 7 3HZ LYS 7 -8.857 14.905 3.505 56 HZ2 LYS 7 1HZ LYS 7 -8.473 13.935 2.234 57 HZ3 LYS 7 2HZ LYS 7 -8.243 13.412 3.761 58 H ALA 8 H ALA 8 -11.011 9.546 3.235 59 HA ALA 8 HA ALA 8 -11.002 6.838 2.058 60 HB1 ALA 8 1HB ALA 8 -12.336 6.285 4.016 61 HB2 ALA 8 2HB ALA 8 -10.955 7.267 4.535 62 HB3 ALA 8 3HB ALA 8 -12.570 8.001 4.418 63 H GLU 9 H GLU 9 -13.410 9.452 2.748 64 HA GLU 9 HA GLU 9 -15.521 8.121 1.756 65 HB2 GLU 9 1HB GLU 9 -16.726 10.168 2.040 66 HB3 GLU 9 2HB GLU 9 -15.455 10.105 3.260 67 HG2 GLU 9 1HG GLU 9 -14.017 11.506 1.643 68 HG3 GLU 9 2HG GLU 9 -15.482 11.738 0.688 69 H ASN 10 H ASN 10 -13.175 9.664 -0.335 70 HA ASN 10 HA ASN 10 -14.978 9.736 -2.602 71 HB2 ASN 10 1HB ASN 10 -13.176 10.879 -3.695 72 HB3 ASN 10 2HB ASN 10 -13.335 11.578 -2.087 73 HD21 ASN 10 1HD2 ASN 10 -11.828 8.927 -0.976 74 HD22 ASN 10 2HD2 ASN 10 -10.215 9.301 -1.338 75 H VAL 11 H VAL 11 -13.425 7.183 -1.184 76 HA VAL 11 HA VAL 11 -12.175 6.019 -3.574 77 HB VAL 11 HB VAL 11 -12.474 5.133 -0.665 78 HG11 VAL 11 1HG1 VAL 11 -12.441 3.115 -2.078 79 HG12 VAL 11 2HG1 VAL 11 -10.948 3.668 -2.855 80 HG13 VAL 11 3HG1 VAL 11 -10.969 3.282 -1.125 81 HG21 VAL 11 3HG2 VAL 11 -10.010 6.000 -2.241 82 HG22 VAL 11 1HG2 VAL 11 -10.842 6.929 -1.005 83 HG23 VAL 11 2HG2 VAL 11 -10.035 5.434 -0.553 84 H ASP 12 H ASP 12 -13.316 4.555 -4.849 85 HA ASP 12 HA ASP 12 -16.172 3.983 -4.183 86 HB2 ASP 12 1HB ASP 12 -14.467 3.456 -6.572 87 HB3 ASP 12 2HB ASP 12 -15.774 2.343 -6.242 88 H SER 13 H SER 13 -13.148 2.088 -4.873 89 HA SER 13 HA SER 13 -13.623 0.698 -2.330 90 HB2 SER 13 1HB SER 13 -13.634 -1.567 -3.351 91 HB3 SER 13 2HB SER 13 -15.070 -0.618 -3.746 92 HG SER 13 HG SER 13 -14.379 -1.526 -5.635 93 H ILE 14 H ILE 14 -11.885 -0.789 -1.764 94 HA ILE 14 HA ILE 14 -9.377 -0.289 -3.266 95 HB ILE 14 HB ILE 14 -9.544 -1.285 -0.404 96 HG12 ILE 14 1HG1 ILE 14 -8.694 1.474 -1.463 97 HG13 ILE 14 2HG1 ILE 14 -10.233 1.158 -0.685 98 HG21 ILE 14 1HG2 ILE 14 -7.182 -0.386 -2.136 99 HG22 ILE 14 2HG2 ILE 14 -7.078 -0.926 -0.457 100 HG23 ILE 14 3HG2 ILE 14 -7.563 -2.057 -1.695 101 HD11 ILE 14 3HD1 ILE 14 -7.539 0.910 0.679 102 HD12 ILE 14 1HD1 ILE 14 -8.720 2.197 0.881 103 HD13 ILE 14 2HD1 ILE 14 -9.116 0.544 1.407 104 H CYS 15 H CYS 15 -8.686 -2.031 -4.374 105 HA CYS 15 HA CYS 15 -9.802 -4.730 -3.750 106 HB2 CYS 15 1HB CYS 15 -9.749 -3.863 -6.190 107 HB3 CYS 15 2HB CYS 15 -7.981 -3.985 -6.067 108 HG CYS 15 HG CYS 15 -10.132 -6.091 -6.765 109 H ILE 16 H ILE 16 -8.402 -6.197 -2.737 110 HA ILE 16 HA ILE 16 -5.509 -5.643 -2.861 111 HB ILE 16 HB ILE 16 -6.974 -6.755 -0.436 112 HG12 ILE 16 1HG1 ILE 16 -5.539 -4.134 -0.993 113 HG13 ILE 16 2HG1 ILE 16 -7.250 -4.307 -0.630 114 HG21 ILE 16 1HG2 ILE 16 -4.729 -7.784 -0.908 115 HG22 ILE 16 2HG2 ILE 16 -4.005 -6.169 -0.898 116 HG23 ILE 16 3HG2 ILE 16 -4.730 -6.847 0.575 117 HD11 ILE 16 3HD1 ILE 16 -6.071 -3.411 1.283 118 HD12 ILE 16 1HD1 ILE 16 -6.657 -5.042 1.686 119 HD13 ILE 16 2HD1 ILE 16 -4.937 -4.750 1.312 120 H ASP 17 H ASP 17 -4.800 -7.066 -4.269 121 HA ASP 17 HA ASP 17 -6.008 -9.774 -4.525 122 HB2 ASP 17 1HB ASP 17 -5.151 -8.120 -6.508 123 HB3 ASP 17 2HB ASP 17 -3.675 -9.032 -6.209 124 H PHE 18 H PHE 18 -5.023 -11.391 -3.329 125 HA PHE 18 HA PHE 18 -2.937 -10.721 -1.471 126 HB2 PHE 18 1HB PHE 18 -4.333 -13.327 -2.203 127 HB3 PHE 18 2HB PHE 18 -3.026 -13.263 -1.060 128 HD1 PHE 18 1HD PHE 18 -5.979 -10.873 -1.337 129 HD2 PHE 18 2HD PHE 18 -3.866 -13.843 0.987 130 HE1 PHE 18 1HE PHE 18 -7.263 -10.253 0.642 131 HE2 PHE 18 2HE PHE 18 -5.252 -13.288 2.947 132 HZ PHE 18 HZ PHE 18 -6.918 -11.441 2.818 133 H THR 19 H THR 19 -0.860 -12.019 -1.237 134 HA THR 19 HA THR 19 0.684 -12.240 -3.593 135 HB THR 19 HB THR 19 1.983 -13.903 -1.923 136 HG1 THR 19 1HG THR 19 0.628 -14.119 -0.301 137 HG21 THR 19 3HG2 THR 19 1.760 -10.896 -1.561 138 HG22 THR 19 1HG2 THR 19 2.895 -11.798 -2.611 139 HG23 THR 19 2HG2 THR 19 3.033 -11.925 -0.856 140 H ASN 20 H ASN 20 -1.636 -14.557 -2.200 141 HA ASN 20 HA ASN 20 -0.505 -16.713 -3.840 142 HB2 ASN 20 1HB ASN 20 -1.819 -18.241 -2.747 143 HB3 ASN 20 2HB ASN 20 -1.251 -17.143 -1.505 144 HD21 ASN 20 1HD2 ASN 20 -3.777 -18.994 -1.946 145 HD22 ASN 20 2HD2 ASN 20 -5.022 -17.938 -1.334 146 H SER 21 H SER 21 -3.936 -15.755 -3.540 147 HA SER 21 HA SER 21 -4.412 -15.145 -6.247 148 HB2 SER 21 1HB SER 21 -3.830 -17.522 -6.599 149 HB3 SER 21 2HB SER 21 -5.166 -18.000 -5.535 150 HG SER 21 HG SER 21 -6.305 -16.443 -7.149 151 H ILE 22 H ILE 22 -5.470 -15.341 -2.966 152 HA ILE 22 HA ILE 22 -8.334 -15.191 -3.621 153 HB ILE 22 HB ILE 22 -6.831 -14.491 -1.073 154 HG12 ILE 22 1HG1 ILE 22 -6.653 -16.889 -1.580 155 HG13 ILE 22 2HG1 ILE 22 -7.591 -16.579 -0.138 156 HG21 ILE 22 1HG2 ILE 22 -9.159 -14.771 -0.030 157 HG22 ILE 22 2HG2 ILE 22 -8.880 -13.300 -0.968 158 HG23 ILE 22 3HG2 ILE 22 -9.806 -14.650 -1.670 159 HD11 ILE 22 3HD1 ILE 22 -8.723 -17.344 -2.867 160 HD12 ILE 22 1HD1 ILE 22 -8.599 -18.383 -1.433 161 HD13 ILE 22 2HD1 ILE 22 -9.695 -17.004 -1.417 162 H GLN 23 H GLN 23 -9.420 -13.184 -3.565 163 HA GLN 23 HA GLN 23 -7.776 -10.717 -3.527 164 HB2 GLN 23 1HB GLN 23 -7.867 -11.370 -5.890 165 HB3 GLN 23 2HB GLN 23 -9.630 -11.487 -5.807 166 HG2 GLN 23 1HG GLN 23 -9.452 -8.939 -5.022 167 HG3 GLN 23 2HG GLN 23 -7.855 -9.022 -5.758 168 HE21 GLN 23 1HE2 GLN 23 -7.762 -9.323 -8.051 169 HE22 GLN 23 2HE2 GLN 23 -9.216 -9.300 -9.056 170 H LYS 24 H LYS 24 -8.732 -9.300 -2.256 171 HA LYS 24 HA LYS 24 -11.584 -9.741 -1.497 172 HB2 LYS 24 1HB LYS 24 -9.426 -10.370 0.057 173 HB3 LYS 24 2HB LYS 24 -9.641 -8.698 0.548 174 HG2 LYS 24 1HG LYS 24 -12.152 -10.301 0.514 175 HG3 LYS 24 2HG LYS 24 -10.900 -10.978 1.536 176 HD2 LYS 24 1HD LYS 24 -12.389 -9.579 2.828 177 HD3 LYS 24 2HD LYS 24 -10.748 -8.889 2.832 178 HE2 LYS 24 1HE LYS 24 -11.346 -7.213 1.226 179 HE3 LYS 24 2HE LYS 24 -12.807 -8.068 0.767 180 HZ1 LYS 24 3HZ LYS 24 -13.757 -7.549 2.877 181 HZ2 LYS 24 1HZ LYS 24 -13.325 -6.209 2.037 182 HZ3 LYS 24 2HZ LYS 24 -12.422 -6.700 3.356 183 H ILE 25 H ILE 25 -12.846 -7.925 -1.546 184 HA ILE 25 HA ILE 25 -11.492 -5.361 -2.194 185 HB ILE 25 HB ILE 25 -14.240 -6.331 -3.053 186 HG12 ILE 25 1HG1 ILE 25 -13.041 -5.924 -5.396 187 HG13 ILE 25 2HG1 ILE 25 -11.568 -6.231 -4.489 188 HG21 ILE 25 1HG2 ILE 25 -12.711 -3.768 -3.680 189 HG22 ILE 25 2HG2 ILE 25 -14.213 -4.265 -4.460 190 HG23 ILE 25 3HG2 ILE 25 -14.236 -3.907 -2.750 191 HD11 ILE 25 3HD1 ILE 25 -12.353 -8.508 -3.974 192 HD12 ILE 25 1HD1 ILE 25 -13.962 -8.126 -4.638 193 HD13 ILE 25 2HD1 ILE 25 -12.555 -8.199 -5.702 194 H TYR 26 H TYR 26 -12.246 -3.528 -1.219 195 HA TYR 26 HA TYR 26 -13.755 -3.817 1.358 196 HB2 TYR 26 1HB TYR 26 -11.242 -2.253 0.648 197 HB3 TYR 26 2HB TYR 26 -12.100 -2.143 2.164 198 HD1 TYR 26 2HD TYR 26 -10.202 -4.516 -0.042 199 HD2 TYR 26 1HD TYR 26 -11.347 -3.548 3.989 200 HE1 TYR 26 2HE TYR 26 -8.882 -6.447 0.819 201 HE2 TYR 26 1HE TYR 26 -10.054 -5.411 4.842 202 HH TYR 26 HH TYR 26 -8.409 -6.895 4.342 203 H ASP 27 H ASP 27 -15.689 -3.116 0.501 204 HA ASP 27 HA ASP 27 -15.824 -0.459 -0.769 205 HB2 ASP 27 1HB ASP 27 -17.665 -1.219 -2.110 206 HB3 ASP 27 2HB ASP 27 -16.236 -2.164 -2.437 207 H ASP 28 H ASP 28 -15.714 -0.476 1.896 208 HA ASP 28 HA ASP 28 -18.348 0.566 2.595 209 HB2 ASP 28 1HB ASP 28 -16.859 -0.763 4.823 210 HB3 ASP 28 2HB ASP 28 -18.559 -0.423 4.627 211 H SER 29 H SER 29 -18.045 2.150 4.342 212 HA SER 29 HA SER 29 -15.698 3.668 4.502 213 HB2 SER 29 1HB SER 29 -17.780 3.097 6.671 214 HB3 SER 29 2HB SER 29 -16.583 4.393 6.743 215 HG SER 29 HG SER 29 -18.490 4.163 4.605 216 H GLU 30 H GLU 30 -16.651 1.037 6.778 217 HA GLU 30 HA GLU 30 -14.302 1.476 8.351 218 HB2 GLU 30 1HB GLU 30 -16.628 -0.386 8.355 219 HB3 GLU 30 2HB GLU 30 -15.165 -1.062 8.979 220 HG2 GLU 30 1HG GLU 30 -16.182 -0.141 10.870 221 HG3 GLU 30 2HG GLU 30 -14.944 1.031 10.445 222 H SER 31 H SER 31 -14.997 -0.694 5.621 223 HA SER 31 HA SER 31 -12.698 -2.383 6.069 224 HB2 SER 31 1HB SER 31 -13.297 -3.289 3.823 225 HB3 SER 31 2HB SER 31 -14.661 -3.243 4.878 226 HG SER 31 HG SER 31 -15.561 -2.304 3.305 227 H ILE 32 H ILE 32 -13.415 0.515 4.053 228 HA ILE 32 HA ILE 32 -10.808 0.634 2.868 229 HB ILE 32 HB ILE 32 -13.115 2.581 3.199 230 HG12 ILE 32 1HG1 ILE 32 -11.920 1.298 0.707 231 HG13 ILE 32 2HG1 ILE 32 -13.204 0.544 1.638 232 HG21 ILE 32 1HG2 ILE 32 -11.374 4.089 3.166 233 HG22 ILE 32 2HG2 ILE 32 -10.367 3.134 2.063 234 HG23 ILE 32 3HG2 ILE 32 -11.807 4.012 1.472 235 HD11 ILE 32 3HD1 ILE 32 -14.149 1.680 -0.263 236 HD12 ILE 32 1HD1 ILE 32 -14.681 2.481 1.229 237 HD13 ILE 32 2HD1 ILE 32 -13.434 3.221 0.216 238 H GLN 33 H GLN 33 -12.250 2.302 5.687 239 HA GLN 33 HA GLN 33 -10.191 3.950 6.534 240 HB2 GLN 33 1HB GLN 33 -12.408 2.458 7.886 241 HB3 GLN 33 2HB GLN 33 -11.189 3.164 8.915 242 HG2 GLN 33 1HG GLN 33 -12.567 4.759 6.716 243 HG3 GLN 33 2HG GLN 33 -13.234 4.637 8.337 244 HE21 GLN 33 1HE2 GLN 33 -12.402 7.092 7.089 245 HE22 GLN 33 2HE2 GLN 33 -11.073 7.734 8.091 246 H LYS 34 H LYS 34 -10.550 0.434 7.435 247 HA LYS 34 HA LYS 34 -8.382 0.419 9.171 248 HB2 LYS 34 1HB LYS 34 -10.327 -1.122 8.911 249 HB3 LYS 34 2HB LYS 34 -9.647 -1.772 7.437 250 HG2 LYS 34 1HG LYS 34 -7.949 -1.739 9.956 251 HG3 LYS 34 2HG LYS 34 -9.325 -2.823 9.881 252 HD2 LYS 34 1HD LYS 34 -7.902 -3.142 7.351 253 HD3 LYS 34 2HD LYS 34 -6.720 -3.095 8.664 254 HE2 LYS 34 1HE LYS 34 -7.289 -5.319 8.839 255 HE3 LYS 34 2HE LYS 34 -8.474 -4.602 9.925 256 HZ1 LYS 34 3HZ LYS 34 -9.464 -6.195 8.601 257 HZ2 LYS 34 1HZ LYS 34 -8.921 -5.587 7.192 258 HZ3 LYS 34 2HZ LYS 34 -10.080 -4.751 8.090 259 H ILE 35 H ILE 35 -8.532 -0.417 5.656 260 HA ILE 35 HA ILE 35 -5.803 -1.010 5.384 261 HB ILE 35 HB ILE 35 -7.766 0.111 3.342 262 HG12 ILE 35 1HG1 ILE 35 -6.836 -2.747 3.802 263 HG13 ILE 35 2HG1 ILE 35 -8.325 -2.128 4.484 264 HG21 ILE 35 1HG2 ILE 35 -6.104 -0.919 1.671 265 HG22 ILE 35 2HG2 ILE 35 -5.532 0.486 2.525 266 HG23 ILE 35 3HG2 ILE 35 -4.992 -1.138 3.028 267 HD11 ILE 35 3HD1 ILE 35 -9.369 -1.809 2.424 268 HD12 ILE 35 1HD1 ILE 35 -7.886 -1.975 1.484 269 HD13 ILE 35 2HD1 ILE 35 -8.512 -3.375 2.314 270 H LEU 36 H LEU 36 -7.499 2.184 4.814 271 HA LEU 36 HA LEU 36 -5.311 3.673 3.916 272 HB2 LEU 36 1HB LEU 36 -7.555 4.427 5.827 273 HB3 LEU 36 2HB LEU 36 -6.407 5.608 5.253 274 HG LEU 36 HG LEU 36 -7.812 4.011 3.122 275 HD11 LEU 36 1HD1 LEU 36 -9.640 4.464 4.602 276 HD12 LEU 36 2HD1 LEU 36 -9.723 5.618 3.285 277 HD13 LEU 36 3HD1 LEU 36 -9.105 6.130 4.884 278 HD21 LEU 36 3HD2 LEU 36 -7.850 6.177 1.984 279 HD22 LEU 36 1HD2 LEU 36 -6.199 5.895 2.587 280 HD23 LEU 36 2HD2 LEU 36 -7.317 7.006 3.446 281 H SER 37 H SER 37 -6.100 2.808 7.302 282 HA SER 37 HA SER 37 -4.172 4.381 8.568 283 HB2 SER 37 1HB SER 37 -6.114 3.035 9.546 284 HB3 SER 37 2HB SER 37 -5.047 1.619 9.501 285 HG SER 37 HG SER 37 -5.133 2.882 11.477 286 H GLU 38 H GLU 38 -3.913 0.933 7.535 287 HA GLU 38 HA GLU 38 -1.153 0.679 8.304 288 HB2 GLU 38 1HB GLU 38 -2.918 -1.036 6.511 289 HB3 GLU 38 2HB GLU 38 -1.360 -1.531 7.168 290 HG2 GLU 38 1HG GLU 38 -3.873 -0.888 8.774 291 HG3 GLU 38 2HG GLU 38 -3.236 -2.476 8.432 292 H ILE 39 H ILE 39 -2.721 1.787 5.409 293 HA ILE 39 HA ILE 39 -0.364 1.578 3.694 294 HB ILE 39 HB ILE 39 -3.107 2.861 3.485 295 HG12 ILE 39 1HG1 ILE 39 -2.957 0.379 3.280 296 HG13 ILE 39 2HG1 ILE 39 -3.593 1.201 1.881 297 HG21 ILE 39 1HG2 ILE 39 -1.766 4.303 2.161 298 HG22 ILE 39 2HG2 ILE 39 -0.945 2.929 1.374 299 HG23 ILE 39 3HG2 ILE 39 -2.683 3.233 1.087 300 HD11 ILE 39 3HD1 ILE 39 -0.748 0.145 2.055 301 HD12 ILE 39 1HD1 ILE 39 -2.110 -0.659 1.253 302 HD13 ILE 39 2HD1 ILE 39 -1.526 0.869 0.628 303 H ALA 40 H ALA 40 -1.501 3.859 6.106 304 HA ALA 40 HA ALA 40 0.339 5.954 5.071 305 HB1 ALA 40 1HB ALA 40 -1.036 7.525 6.332 306 HB2 ALA 40 2HB ALA 40 -2.067 6.537 5.271 307 HB3 ALA 40 3HB ALA 40 -1.988 6.189 7.011 308 H THR 41 H THR 41 0.131 3.693 7.697 309 HA THR 41 HA THR 41 1.461 5.133 9.702 310 HB THR 41 HB THR 41 0.433 3.042 10.179 311 HG1 THR 41 1HG THR 41 1.774 2.849 11.682 312 HG21 THR 41 3HG2 THR 41 2.584 1.692 8.554 313 HG22 THR 41 1HG2 THR 41 0.876 1.856 8.106 314 HG23 THR 41 2HG2 THR 41 1.323 0.923 9.541 315 H GLY 42 H GLY 42 2.790 3.708 6.722 316 HA2 GLY 42 1HA GLY 42 5.453 3.686 7.691 317 HA3 GLY 42 2HA GLY 42 4.925 3.487 6.014 318 H LYS 43 H LYS 43 7.210 4.820 7.003 319 HA LYS 43 HA LYS 43 6.775 7.625 6.138 320 HB2 LYS 43 1HB LYS 43 9.164 7.808 7.016 321 HB3 LYS 43 2HB LYS 43 7.769 7.918 8.040 322 HG2 LYS 43 1HG LYS 43 9.302 5.307 7.719 323 HG3 LYS 43 2HG LYS 43 9.866 6.584 8.774 324 HD2 LYS 43 1HD LYS 43 7.068 5.471 9.180 325 HD3 LYS 43 2HD LYS 43 8.478 4.589 9.750 326 HE2 LYS 43 1HE LYS 43 9.197 6.491 11.099 327 HE3 LYS 43 2HE LYS 43 7.839 7.472 10.504 328 HZ1 LYS 43 3HZ LYS 43 7.597 4.976 12.073 329 HZ2 LYS 43 1HZ LYS 43 6.332 5.922 11.559 330 HZ3 LYS 43 2HZ LYS 43 7.391 6.500 12.662 331 H ARG 44 H ARG 44 7.124 7.725 4.003 332 HA ARG 44 HA ARG 44 8.939 5.942 2.548 333 HB2 ARG 44 1HB ARG 44 8.689 7.566 0.693 334 HB3 ARG 44 2HB ARG 44 7.270 6.703 1.192 335 HG2 ARG 44 1HG ARG 44 6.483 8.848 0.902 336 HG3 ARG 44 2HG ARG 44 6.671 8.837 2.620 337 HD2 ARG 44 1HD ARG 44 8.629 10.125 2.470 338 HD3 ARG 44 2HD ARG 44 8.818 9.823 0.707 339 HE ARG 44 HE ARG 44 6.425 11.153 0.909 340 HH11 ARG 44 1HH1 ARG 44 9.754 11.839 1.946 341 HH12 ARG 44 2HH1 ARG 44 9.632 13.558 1.738 342 HH21 ARG 44 1HH2 ARG 44 6.236 13.378 0.606 343 HH22 ARG 44 2HH2 ARG 44 7.533 14.477 0.923 344 H THR 45 H THR 45 9.143 8.530 4.480 345 HA THR 45 HA THR 45 11.038 9.699 5.381 346 HB THR 45 HB THR 45 13.077 8.579 5.442 347 HG1 THR 45 1HG THR 45 12.371 7.550 2.936 348 HG21 THR 45 3HG2 THR 45 11.366 6.166 4.679 349 HG22 THR 45 1HG2 THR 45 11.205 7.013 6.232 350 HG23 THR 45 2HG2 THR 45 12.733 6.244 5.804 351 H GLU 46 H GLU 46 13.278 10.695 4.521 352 HA GLU 46 HA GLU 46 12.601 12.553 2.471 353 HB2 GLU 46 1HB GLU 46 15.144 11.772 3.923 354 HB3 GLU 46 2HB GLU 46 15.104 13.082 2.761 355 HG2 GLU 46 1HG GLU 46 12.981 13.049 4.920 356 HG3 GLU 46 2HG GLU 46 14.591 13.471 5.383 357 H LYS 47 H LYS 47 13.779 9.273 2.199 358 HA LYS 47 HA LYS 47 15.588 9.588 0.056 359 HB2 LYS 47 1HB LYS 47 13.845 7.158 0.769 360 HB3 LYS 47 2HB LYS 47 15.266 7.144 -0.262 361 HG2 LYS 47 1HG LYS 47 15.721 8.265 2.480 362 HG3 LYS 47 2HG LYS 47 15.233 6.579 2.396 363 HD2 LYS 47 1HD LYS 47 17.601 7.665 0.834 364 HD3 LYS 47 2HD LYS 47 17.693 7.008 2.470 365 HE2 LYS 47 1HE LYS 47 16.255 5.016 1.246 366 HE3 LYS 47 2HE LYS 47 17.225 5.582 -0.125 367 HZ1 LYS 47 3HZ LYS 47 18.362 3.837 1.083 368 HZ2 LYS 47 1HZ LYS 47 18.246 4.675 2.498 369 HZ3 LYS 47 2HZ LYS 47 19.193 5.230 1.274 370 H GLN 48 H GLN 48 15.433 8.913 -2.118 371 HA GLN 48 HA GLN 48 12.789 9.418 -3.367 372 HB2 GLN 48 1HB GLN 48 13.881 10.000 -5.404 373 HB3 GLN 48 2HB GLN 48 14.446 11.025 -4.092 374 HG2 GLN 48 1HG GLN 48 16.583 9.768 -4.008 375 HG3 GLN 48 2HG GLN 48 15.982 8.672 -5.258 376 HE21 GLN 48 1HE2 GLN 48 16.139 12.241 -4.803 377 HE22 GLN 48 2HE2 GLN 48 16.541 12.594 -6.474 378 H SER 49 H SER 49 11.871 7.822 -4.478 379 HA SER 49 HA SER 49 13.234 5.255 -4.992 380 HB2 SER 49 1HB SER 49 11.177 4.478 -4.894 381 HB3 SER 49 2HB SER 49 10.469 6.119 -4.797 382 HG SER 49 HG SER 49 10.385 4.364 -6.771 383 H ILE 50 H ILE 50 13.538 4.672 -7.276 384 HA ILE 50 HA ILE 50 13.349 6.841 -9.247 385 HB ILE 50 HB ILE 50 15.511 6.208 -10.246 386 HG12 ILE 50 1HG1 ILE 50 16.560 5.000 -7.703 387 HG13 ILE 50 2HG1 ILE 50 15.517 3.953 -8.663 388 HG21 ILE 50 1HG2 ILE 50 16.925 7.513 -8.808 389 HG22 ILE 50 2HG2 ILE 50 15.298 8.208 -8.814 390 HG23 ILE 50 3HG2 ILE 50 15.844 7.262 -7.417 391 HD11 ILE 50 3HD1 ILE 50 17.920 3.733 -9.266 392 HD12 ILE 50 1HD1 ILE 50 16.880 4.196 -10.617 393 HD13 ILE 50 2HD1 ILE 50 17.911 5.416 -9.825 394 H GLN 51 H GLN 51 12.041 4.031 -8.406 395 HA GLN 51 HA GLN 51 11.920 3.017 -11.172 396 HB2 GLN 51 1HB GLN 51 11.235 0.832 -9.782 397 HB3 GLN 51 2HB GLN 51 12.862 1.204 -10.279 398 HG2 GLN 51 1HG GLN 51 12.961 0.393 -8.113 399 HG3 GLN 51 2HG GLN 51 13.391 2.089 -7.987 400 HE21 GLN 51 1HE2 GLN 51 10.707 -0.253 -7.437 401 HE22 GLN 51 2HE2 GLN 51 9.987 0.666 -6.176 402 H ASP 52 H ASP 52 9.783 1.653 -11.239 403 HA ASP 52 HA ASP 52 7.576 3.376 -10.165 404 HB2 ASP 52 1HB ASP 52 8.219 3.505 -12.664 405 HB3 ASP 52 2HB ASP 52 7.536 1.893 -12.817 406 H TYR 53 H TYR 53 8.965 0.366 -9.764 407 HA TYR 53 HA TYR 53 6.484 -1.022 -9.117 408 HB2 TYR 53 1HB TYR 53 8.341 -1.765 -11.416 409 HB3 TYR 53 2HB TYR 53 7.639 -3.059 -10.496 410 HD1 TYR 53 1HD TYR 53 6.771 -0.081 -12.511 411 HD2 TYR 53 2HD TYR 53 5.379 -3.806 -10.868 412 HE1 TYR 53 1HE TYR 53 4.698 0.179 -13.772 413 HE2 TYR 53 2HE TYR 53 3.292 -3.602 -12.154 414 HH TYR 53 HH TYR 53 1.922 -1.879 -13.228 415 HA PRO 54 HA PRO 54 9.188 -2.686 -6.087 416 HB2 PRO 54 1HB PRO 54 8.241 -5.214 -5.573 417 HB3 PRO 54 2HB PRO 54 7.330 -3.729 -5.143 418 HG2 PRO 54 1HG PRO 54 6.886 -5.534 -7.488 419 HG3 PRO 54 2HG PRO 54 5.710 -4.774 -6.365 420 HD2 PRO 54 1HD PRO 54 6.431 -3.770 -8.870 421 HD3 PRO 54 2HD PRO 54 5.808 -2.745 -7.573 422 H SER 55 H SER 55 10.940 -4.234 -5.750 423 HA SER 55 HA SER 55 11.783 -5.656 -8.215 424 HB2 SER 55 1HB SER 55 13.187 -3.749 -7.325 425 HB3 SER 55 2HB SER 55 13.555 -4.780 -5.938 426 HG SER 55 HG SER 55 14.337 -6.375 -7.513 427 H ALA 56 H ALA 56 9.941 -6.431 -5.816 428 HA ALA 56 HA ALA 56 11.244 -8.865 -4.850 429 HB1 ALA 56 1HB ALA 56 8.985 -9.268 -3.835 430 HB2 ALA 56 2HB ALA 56 9.705 -7.736 -3.367 431 HB3 ALA 56 3HB ALA 56 8.404 -7.767 -4.586 432 H GLU 57 H GLU 57 10.035 -10.853 -5.102 433 HA GLU 57 HA GLU 57 8.998 -11.297 -7.862 434 HB2 GLU 57 1HB GLU 57 9.904 -13.490 -7.749 435 HB3 GLU 57 2HB GLU 57 11.149 -12.369 -7.178 436 HG2 GLU 57 1HG GLU 57 10.194 -12.996 -4.772 437 HG3 GLU 57 2HG GLU 57 9.510 -14.379 -5.603 438 H GLU 58 H GLU 58 8.386 -11.563 -4.391 439 HA GLU 58 HA GLU 58 5.620 -12.533 -4.841 440 HB2 GLU 58 1HB GLU 58 7.527 -12.927 -2.506 441 HB3 GLU 58 2HB GLU 58 5.761 -12.996 -2.342 442 HG2 GLU 58 1HG GLU 58 5.665 -14.807 -4.033 443 HG3 GLU 58 2HG GLU 58 7.432 -14.799 -4.137 444 H TYR 59 H TYR 59 4.297 -10.795 -4.763 445 HA TYR 59 HA TYR 59 4.470 -8.929 -2.584 446 HB2 TYR 59 1HB TYR 59 4.235 -6.951 -4.082 447 HB3 TYR 59 2HB TYR 59 5.828 -7.684 -4.169 448 HD1 TYR 59 1HD TYR 59 2.524 -7.373 -5.883 449 HD2 TYR 59 2HD TYR 59 6.683 -8.446 -6.305 450 HE1 TYR 59 1HE TYR 59 2.220 -7.505 -8.293 451 HE2 TYR 59 2HE TYR 59 6.403 -8.563 -8.756 452 HH TYR 59 HH TYR 59 4.758 -8.715 -10.501 453 H GLY 60 H GLY 60 2.336 -7.649 -2.652 454 HA2 GLY 60 1HA GLY 60 0.216 -9.001 -4.277 455 HA3 GLY 60 2HA GLY 60 -0.039 -8.550 -2.597 456 H THR 61 H THR 61 -1.757 -7.482 -4.389 457 HA THR 61 HA THR 61 -0.634 -4.946 -5.457 458 HB THR 61 HB THR 61 -2.683 -6.912 -6.551 459 HG1 THR 61 1HG THR 61 -0.937 -7.291 -8.068 460 HG21 THR 61 3HG2 THR 61 -2.637 -5.714 -8.621 461 HG22 THR 61 1HG2 THR 61 -1.350 -4.643 -8.083 462 HG23 THR 61 2HG2 THR 61 -2.968 -4.503 -7.379 463 H ILE 62 H ILE 62 -1.593 -3.109 -4.752 464 HA ILE 62 HA ILE 62 -4.281 -3.319 -3.500 465 HB ILE 62 HB ILE 62 -2.078 -1.435 -2.631 466 HG12 ILE 62 1HG1 ILE 62 -2.427 -3.082 -0.494 467 HG13 ILE 62 2HG1 ILE 62 -2.638 -4.266 -1.766 468 HG21 ILE 62 1HG2 ILE 62 -4.435 -0.739 -2.200 469 HG22 ILE 62 2HG2 ILE 62 -4.694 -2.237 -1.305 470 HG23 ILE 62 3HG2 ILE 62 -3.506 -1.060 -0.715 471 HD11 ILE 62 3HD1 ILE 62 -0.273 -4.036 -0.957 472 HD12 ILE 62 1HD1 ILE 62 -0.423 -3.692 -2.692 473 HD13 ILE 62 2HD1 ILE 62 -0.247 -2.354 -1.533 474 H ASN 63 H ASN 63 -5.656 -2.412 -4.766 475 HA ASN 63 HA ASN 63 -4.952 -0.102 -6.518 476 HB2 ASN 63 1HB ASN 63 -7.460 -1.828 -6.702 477 HB3 ASN 63 2HB ASN 63 -6.757 -0.801 -7.910 478 HD21 ASN 63 1HD2 ASN 63 -6.189 -2.101 -9.509 479 HD22 ASN 63 2HD2 ASN 63 -5.462 -3.715 -9.373 480 H ILE 64 H ILE 64 -5.656 1.880 -5.560 481 HA ILE 64 HA ILE 64 -8.213 1.811 -3.992 482 HB ILE 64 HB ILE 64 -6.185 4.070 -4.274 483 HG12 ILE 64 1HG1 ILE 64 -6.578 2.456 -1.749 484 HG13 ILE 64 2HG1 ILE 64 -5.301 2.111 -2.918 485 HG21 ILE 64 1HG2 ILE 64 -8.523 3.741 -2.327 486 HG22 ILE 64 2HG2 ILE 64 -7.508 5.183 -2.514 487 HG23 ILE 64 3HG2 ILE 64 -8.600 4.702 -3.807 488 HD11 ILE 64 3HD1 ILE 64 -4.396 3.546 -1.147 489 HD12 ILE 64 1HD1 ILE 64 -4.434 4.449 -2.666 490 HD13 ILE 64 2HD1 ILE 64 -5.656 4.745 -1.403 491 H GLU 65 H GLU 65 -9.804 1.851 -5.572 492 HA GLU 65 HA GLU 65 -9.570 3.685 -7.848 493 HB2 GLU 65 1HB GLU 65 -10.860 1.675 -8.148 494 HB3 GLU 65 2HB GLU 65 -11.898 2.053 -6.764 495 HG2 GLU 65 1HG GLU 65 -12.791 3.972 -7.781 496 HG3 GLU 65 2HG GLU 65 -11.570 4.022 -9.068 497 H ASN 66 H ASN 66 -9.942 5.838 -7.595 498 HA ASN 66 HA ASN 66 -11.826 6.784 -5.601 499 HB2 ASN 66 1HB ASN 66 -10.321 8.268 -4.443 500 HB3 ASN 66 2HB ASN 66 -9.696 6.632 -4.297 501 HD21 ASN 66 1HD2 ASN 66 -7.836 6.002 -5.766 502 HD22 ASN 66 2HD2 ASN 66 -6.775 7.286 -6.320 503 H ASN 67 H ASN 67 -12.798 8.540 -6.253 504 HA ASN 67 HA ASN 67 -13.625 10.081 -7.664 505 HB2 ASN 67 1HB ASN 67 -10.777 10.929 -8.257 506 HB3 ASN 67 2HB ASN 67 -12.246 11.886 -8.377 507 HD21 ASN 67 1HD2 ASN 67 -9.899 10.423 -6.021 508 HD22 ASN 67 2HD2 ASN 67 -10.694 11.132 -4.627 509 H GLY 68 H GLY 68 -12.967 7.380 -8.662 510 HA2 GLY 68 1HA GLY 68 -13.291 6.161 -10.525 511 HA3 GLY 68 2HA GLY 68 -13.480 7.632 -11.472 512 H GLY 69 H GLY 69 -10.537 8.031 -9.988 513 HA2 GLY 69 1HA GLY 69 -8.948 6.761 -12.172 514 HA3 GLY 69 2HA GLY 69 -8.375 8.023 -11.064 515 H MET 70 H MET 70 -6.671 5.984 -10.952 516 HA MET 70 HA MET 70 -7.378 4.907 -8.344 517 HB2 MET 70 1HB MET 70 -6.888 2.566 -8.847 518 HB3 MET 70 2HB MET 70 -8.201 3.166 -9.853 519 HG2 MET 70 1HG MET 70 -6.143 3.686 -11.520 520 HG3 MET 70 2HG MET 70 -5.426 2.354 -10.622 521 HE1 MET 70 3HE MET 70 -5.204 0.811 -12.819 522 HE2 MET 70 1HE MET 70 -6.535 0.594 -13.978 523 HE3 MET 70 2HE MET 70 -5.807 2.195 -13.758 524 H THR 71 H THR 71 -5.781 4.411 -7.028 525 HA THR 71 HA THR 71 -2.979 5.058 -7.838 526 HB THR 71 HB THR 71 -4.233 4.780 -5.058 527 HG1 THR 71 1HG THR 71 -4.417 6.770 -6.478 528 HG21 THR 71 3HG2 THR 71 -1.981 5.447 -4.249 529 HG22 THR 71 1HG2 THR 71 -1.340 5.360 -5.901 530 HG23 THR 71 2HG2 THR 71 -1.905 3.896 -5.071 531 H THR 72 H THR 72 -2.081 3.318 -8.691 532 HA THR 72 HA THR 72 -2.507 0.555 -7.767 533 HB THR 72 HB THR 72 -0.799 1.984 -9.858 534 HG1 THR 72 1HG THR 72 -2.925 0.236 -10.434 535 HG21 THR 72 3HG2 THR 72 -1.233 -1.010 -9.671 536 HG22 THR 72 1HG2 THR 72 0.276 -0.166 -9.258 537 HG23 THR 72 2HG2 THR 72 -0.333 -0.115 -10.920 538 H MET 73 H MET 73 -1.118 -0.273 -6.120 539 HA MET 73 HA MET 73 1.666 0.455 -6.145 540 HB2 MET 73 1HB MET 73 1.864 0.934 -3.777 541 HB3 MET 73 2HB MET 73 0.903 2.171 -4.584 542 HG2 MET 73 1HG MET 73 -1.152 1.191 -3.707 543 HG3 MET 73 2HG MET 73 -0.255 -0.161 -3.012 544 HE1 MET 73 3HE MET 73 -0.032 4.151 -1.347 545 HE2 MET 73 1HE MET 73 0.779 3.718 -2.862 546 HE3 MET 73 2HE MET 73 -1.001 3.683 -2.757 547 H PHE 74 H PHE 74 2.716 -1.012 -4.308 548 HA PHE 74 HA PHE 74 1.337 -3.594 -3.980 549 HB2 PHE 74 1HB PHE 74 4.153 -3.311 -5.074 550 HB3 PHE 74 2HB PHE 74 3.266 -4.801 -4.854 551 HD1 PHE 74 1HD PHE 74 1.465 -5.483 -6.410 552 HD2 PHE 74 2HD PHE 74 3.693 -1.847 -7.054 553 HE1 PHE 74 1HE PHE 74 0.845 -5.519 -8.795 554 HE2 PHE 74 2HE PHE 74 3.075 -1.878 -9.428 555 HZ PHE 74 HZ PHE 74 1.673 -3.764 -10.328 556 H TYR 75 H TYR 75 3.088 -5.012 -2.508 557 HA TYR 75 HA TYR 75 4.659 -3.267 -0.730 558 HB2 TYR 75 1HB TYR 75 3.760 -4.072 1.241 559 HB3 TYR 75 2HB TYR 75 2.334 -3.749 0.299 560 HD1 TYR 75 2HD TYR 75 1.139 -5.797 -0.849 561 HD2 TYR 75 1HD TYR 75 4.250 -6.247 2.128 562 HE1 TYR 75 2HE TYR 75 0.524 -8.182 -0.524 563 HE2 TYR 75 1HE TYR 75 3.618 -8.611 2.412 564 HH TYR 75 HH TYR 75 2.497 -10.419 1.396 565 H TYR 76 H TYR 76 6.380 -4.599 0.407 566 HA TYR 76 HA TYR 76 6.386 -7.378 0.129 567 HB2 TYR 76 1HB TYR 76 8.416 -7.816 -1.109 568 HB3 TYR 76 2HB TYR 76 7.176 -7.165 -2.114 569 HD1 TYR 76 1HD TYR 76 7.330 -4.860 -3.005 570 HD2 TYR 76 2HD TYR 76 10.528 -6.642 -0.729 571 HE1 TYR 76 1HE TYR 76 8.936 -3.043 -3.776 572 HE2 TYR 76 2HE TYR 76 12.083 -4.914 -1.524 573 HH TYR 76 HH TYR 76 11.742 -2.428 -2.351 574 H GLU 77 H GLU 77 8.577 -8.293 1.090 575 HA GLU 77 HA GLU 77 9.387 -6.595 3.382 576 HB2 GLU 77 1HB GLU 77 8.373 -8.891 3.748 577 HB3 GLU 77 2HB GLU 77 9.769 -9.586 2.929 578 HG2 GLU 77 1HG GLU 77 11.257 -8.597 4.672 579 HG3 GLU 77 2HG GLU 77 9.839 -7.918 5.476 580 H GLU 78 H GLU 78 11.558 -6.076 3.672 581 HA GLU 78 HA GLU 78 13.500 -7.246 1.820 582 HB2 GLU 78 1HB GLU 78 12.639 -4.984 0.920 583 HB3 GLU 78 2HB GLU 78 13.513 -4.251 2.246 584 HG2 GLU 78 1HG GLU 78 15.546 -4.580 1.305 585 HG3 GLU 78 2HG GLU 78 15.182 -6.258 0.937 586 H ASN 79 H ASN 79 14.755 -8.301 3.157 587 HA ASN 79 HA ASN 79 16.397 -8.722 4.602 588 HB2 ASN 79 1HB ASN 79 16.785 -5.953 3.993 589 HB3 ASN 79 2HB ASN 79 17.057 -6.134 5.715 590 HD21 ASN 79 1HD2 ASN 79 18.197 -6.988 2.494 591 HD22 ASN 79 2HD2 ASN 79 19.725 -7.637 3.025 592 H GLY 80 H GLY 80 13.455 -8.058 5.573 593 HA2 GLY 80 1HA GLY 80 12.701 -9.091 7.624 594 HA3 GLY 80 2HA GLY 80 14.083 -8.415 8.477 595 H LYS 81 H LYS 81 13.216 -5.821 6.570 596 HA LYS 81 HA LYS 81 11.094 -4.907 8.408 597 HB2 LYS 81 1HB LYS 81 13.437 -3.562 7.214 598 HB3 LYS 81 2HB LYS 81 11.920 -2.838 6.661 599 HG2 LYS 81 1HG LYS 81 12.587 -1.703 8.625 600 HG3 LYS 81 2HG LYS 81 11.119 -2.636 8.937 601 HD2 LYS 81 1HD LYS 81 12.366 -2.991 10.862 602 HD3 LYS 81 2HD LYS 81 12.722 -4.450 9.922 603 HE2 LYS 81 1HE LYS 81 14.843 -3.455 9.153 604 HE3 LYS 81 2HE LYS 81 14.474 -1.956 10.018 605 HZ1 LYS 81 3HZ LYS 81 14.569 -3.134 12.065 606 HZ2 LYS 81 1HZ LYS 81 15.962 -3.460 11.191 607 HZ3 LYS 81 2HZ LYS 81 14.773 -4.588 11.304 608 H TYR 82 H TYR 82 9.296 -3.818 7.317 609 HA TYR 82 HA TYR 82 8.736 -5.036 4.660 610 HB2 TYR 82 1HB TYR 82 6.912 -4.196 6.924 611 HB3 TYR 82 2HB TYR 82 6.382 -4.780 5.368 612 HD1 TYR 82 1HD TYR 82 6.661 -7.147 4.737 613 HD2 TYR 82 2HD TYR 82 7.765 -5.709 8.649 614 HE1 TYR 82 1HE TYR 82 6.670 -9.455 5.580 615 HE2 TYR 82 2HE TYR 82 7.755 -8.023 9.519 616 HH TYR 82 HH TYR 82 7.016 -10.855 7.415 617 H TYR 83 H TYR 83 7.751 -3.646 3.115 618 HA TYR 83 HA TYR 83 7.579 -0.843 3.868 619 HB2 TYR 83 1HB TYR 83 9.162 -1.690 1.439 620 HB3 TYR 83 2HB TYR 83 8.939 -0.071 1.993 621 HD1 TYR 83 2HD TYR 83 10.680 -3.332 2.863 622 HD2 TYR 83 1HD TYR 83 10.448 0.931 3.511 623 HE1 TYR 83 2HE TYR 83 12.706 -3.459 4.169 624 HE2 TYR 83 1HE TYR 83 12.545 0.835 4.822 625 HH TYR 83 HH TYR 83 14.352 -2.219 5.381 626 H ILE 84 H ILE 84 6.702 0.418 1.915 627 HA ILE 84 HA ILE 84 4.836 -1.236 0.275 628 HB ILE 84 HB ILE 84 4.206 1.446 1.564 629 HG12 ILE 84 1HG1 ILE 84 2.175 -0.056 2.381 630 HG13 ILE 84 2HG1 ILE 84 3.312 -1.381 2.180 631 HG21 ILE 84 1HG2 ILE 84 3.172 1.385 -0.652 632 HG22 ILE 84 2HG2 ILE 84 2.463 -0.206 -0.288 633 HG23 ILE 84 3HG2 ILE 84 1.951 1.233 0.600 634 HD11 ILE 84 3HD1 ILE 84 3.902 1.134 3.814 635 HD12 ILE 84 1HD1 ILE 84 3.058 -0.274 4.465 636 HD13 ILE 84 2HD1 ILE 84 4.736 -0.441 3.899 637 H GLU 85 H GLU 85 4.454 -0.472 -1.776 638 HA GLU 85 HA GLU 85 6.761 0.717 -3.075 639 HB2 GLU 85 1HB GLU 85 5.502 -1.526 -3.460 640 HB3 GLU 85 2HB GLU 85 4.231 -0.545 -4.170 641 HG2 GLU 85 1HG GLU 85 7.048 -0.879 -5.226 642 HG3 GLU 85 2HG GLU 85 5.617 -1.726 -5.767 643 H CYS 86 H CYS 86 6.386 2.275 -4.947 644 HA CYS 86 HA CYS 86 4.220 3.707 -5.603 645 HB2 CYS 86 1HB CYS 86 5.244 4.591 -2.985 646 HB3 CYS 86 2HB CYS 86 5.354 5.906 -4.148 647 HG CYS 86 HG CYS 86 2.866 3.922 -3.351 648 HA PRO 87 HA PRO 87 7.532 5.568 -8.206 649 HB2 PRO 87 1HB PRO 87 6.685 8.059 -8.833 650 HB3 PRO 87 2HB PRO 87 5.731 6.641 -9.372 651 HG2 PRO 87 1HG PRO 87 5.327 8.283 -6.831 652 HG3 PRO 87 2HG PRO 87 4.129 7.938 -8.116 653 HD2 PRO 87 1HD PRO 87 4.273 6.415 -5.909 654 HD3 PRO 87 2HD PRO 87 3.974 5.675 -7.479 655 H TYR 88 H TYR 88 8.664 8.002 -8.099 656 HA TYR 88 HA TYR 88 10.623 8.020 -6.558 657 HB2 TYR 88 1HB TYR 88 9.010 10.549 -7.075 658 HB3 TYR 88 2HB TYR 88 10.642 10.579 -6.471 659 HD1 TYR 88 2HD TYR 88 8.593 9.805 -9.474 660 HD2 TYR 88 1HD TYR 88 12.571 10.154 -7.817 661 HE1 TYR 88 2HE TYR 88 9.551 9.724 -11.747 662 HE2 TYR 88 1HE TYR 88 13.527 10.124 -10.083 663 HH TYR 88 HH TYR 88 11.564 9.337 -12.925 664 H LYS 89 H LYS 89 7.661 8.262 -4.856 665 HA LYS 89 HA LYS 89 9.179 8.849 -2.395 666 HB2 LYS 89 1HB LYS 89 6.282 9.611 -2.617 667 HB3 LYS 89 2HB LYS 89 7.376 9.881 -1.293 668 HG2 LYS 89 1HG LYS 89 7.885 11.850 -2.094 669 HG3 LYS 89 2HG LYS 89 8.647 11.167 -3.490 670 HD2 LYS 89 1HD LYS 89 5.703 11.935 -3.222 671 HD3 LYS 89 2HD LYS 89 6.944 12.821 -4.136 672 HE2 LYS 89 1HE LYS 89 7.313 10.835 -5.564 673 HE3 LYS 89 2HE LYS 89 6.070 9.954 -4.674 674 HZ1 LYS 89 3HZ LYS 89 5.173 10.936 -6.730 675 HZ2 LYS 89 1HZ LYS 89 5.657 12.404 -6.294 676 HZ3 LYS 89 2HZ LYS 89 4.461 11.656 -5.414 677 H GLY 90 H GLY 90 8.654 6.285 -3.744 678 HA2 GLY 90 1HA GLY 90 6.959 4.991 -1.722 679 HA3 GLY 90 2HA GLY 90 7.397 4.378 -3.337 680 H ILE 91 H ILE 91 8.694 5.110 -0.126 681 HA ILE 91 HA ILE 91 10.118 2.555 -0.112 682 HB ILE 91 HB ILE 91 11.688 5.064 0.602 683 HG12 ILE 91 1HG1 ILE 91 11.767 3.539 -2.023 684 HG13 ILE 91 2HG1 ILE 91 11.345 5.239 -1.798 685 HG21 ILE 91 1HG2 ILE 91 12.221 2.685 1.550 686 HG22 ILE 91 2HG2 ILE 91 12.726 2.291 -0.081 687 HG23 ILE 91 3HG2 ILE 91 13.547 3.607 0.806 688 HD11 ILE 91 3HD1 ILE 91 14.110 4.052 -1.373 689 HD12 ILE 91 1HD1 ILE 91 13.542 5.034 -2.708 690 HD13 ILE 91 2HD1 ILE 91 13.633 5.751 -1.090 691 H TYR 92 H TYR 92 7.872 2.996 1.127 692 HA TYR 92 HA TYR 92 8.060 4.490 3.620 693 HB2 TYR 92 1HB TYR 92 5.795 2.583 2.951 694 HB3 TYR 92 2HB TYR 92 5.804 3.870 4.119 695 HD1 TYR 92 2HD TYR 92 5.358 6.195 3.472 696 HD2 TYR 92 1HD TYR 92 5.442 3.013 0.583 697 HE1 TYR 92 2HE TYR 92 4.572 7.759 1.717 698 HE2 TYR 92 1HE TYR 92 4.424 4.469 -1.089 699 HH TYR 92 HH TYR 92 4.080 7.993 -0.593 700 H GLU 93 H GLU 93 9.408 3.731 5.116 701 HA GLU 93 HA GLU 93 9.588 0.878 5.716 702 HB2 GLU 93 1HB GLU 93 11.424 2.641 6.035 703 HB3 GLU 93 2HB GLU 93 10.467 3.313 7.341 704 HG2 GLU 93 1HG GLU 93 10.617 0.934 8.411 705 HG3 GLU 93 2HG GLU 93 11.856 0.618 7.203 706 H ILE 94 H ILE 94 8.115 -0.135 6.751 707 HA ILE 94 HA ILE 94 6.596 1.080 8.994 708 HB ILE 94 HB ILE 94 4.807 -0.521 8.681 709 HG12 ILE 94 1HG1 ILE 94 6.252 -1.497 6.206 710 HG13 ILE 94 2HG1 ILE 94 6.106 -2.363 7.730 711 HG21 ILE 94 1HG2 ILE 94 3.746 0.416 6.711 712 HG22 ILE 94 2HG2 ILE 94 4.653 1.632 7.589 713 HG23 ILE 94 3HG2 ILE 94 5.320 0.961 6.077 714 HD11 ILE 94 3HD1 ILE 94 4.511 -3.263 6.182 715 HD12 ILE 94 1HD1 ILE 94 3.660 -2.443 7.511 716 HD13 ILE 94 2HD1 ILE 94 3.784 -1.684 5.914 717 H GLU 95 H GLU 95 6.022 -0.846 10.579 718 HA GLU 95 HA GLU 95 8.602 -2.275 10.958 719 HB2 GLU 95 1HB GLU 95 6.443 -1.648 13.011 720 HB3 GLU 95 2HB GLU 95 8.046 -2.330 13.315 721 HG2 GLU 95 1HG GLU 95 9.059 -0.241 12.362 722 HG3 GLU 95 2HG GLU 95 7.450 0.477 12.332 723 H ASN 96 H ASN 96 5.401 -3.087 9.995 724 HA ASN 96 HA ASN 96 5.698 -5.858 11.048 725 HB2 ASN 96 1HB ASN 96 3.007 -4.476 10.878 726 HB3 ASN 96 2HB ASN 96 3.432 -5.942 11.747 727 HD21 ASN 96 1HD2 ASN 96 3.058 -2.551 11.929 728 HD22 ASN 96 2HD2 ASN 96 3.485 -2.328 13.611 729 H ASN 97 H ASN 97 4.082 -7.378 9.871 730 HA ASN 97 HA ASN 97 4.380 -6.987 7.019 731 HB2 ASN 97 1HB ASN 97 4.379 -9.263 8.022 732 HB3 ASN 97 2HB ASN 97 2.727 -9.009 8.599 733 HD21 ASN 97 1HD2 ASN 97 4.698 -9.062 5.566 734 HD22 ASN 97 2HD2 ASN 97 3.369 -9.655 4.586 735 H PHE 98 H PHE 98 2.863 -6.288 5.547 736 HA PHE 98 HA PHE 98 0.707 -4.648 6.424 737 HB2 PHE 98 1HB PHE 98 1.946 -4.203 4.386 738 HB3 PHE 98 2HB PHE 98 1.496 -5.764 3.706 739 HD1 PHE 98 2HD PHE 98 0.069 -2.482 4.858 740 HD2 PHE 98 1HD PHE 98 -0.465 -5.988 2.391 741 HE1 PHE 98 2HE PHE 98 -1.874 -1.417 3.761 742 HE2 PHE 98 1HE PHE 98 -2.451 -4.968 1.355 743 HZ PHE 98 HZ PHE 98 -3.184 -2.679 2.036 744 H GLU 99 H GLU 99 0.662 -7.962 4.879 745 HA GLU 99 HA GLU 99 -2.175 -7.871 4.555 746 HB2 GLU 99 1HB GLU 99 -0.135 -10.082 4.281 747 HB3 GLU 99 2HB GLU 99 -1.881 -10.388 4.237 748 HG2 GLU 99 1HG GLU 99 -2.007 -8.499 2.480 749 HG3 GLU 99 2HG GLU 99 -0.267 -8.676 2.326 750 H ASP 100 H ASP 100 -0.108 -8.950 7.133 751 HA ASP 100 HA ASP 100 -2.086 -10.473 8.542 752 HB2 ASP 100 1HB ASP 100 0.550 -10.262 8.859 753 HB3 ASP 100 2HB ASP 100 0.122 -9.007 10.023 754 H MET 101 H MET 101 -1.864 -7.115 8.042 755 HA MET 101 HA MET 101 -3.372 -6.439 10.514 756 HB2 MET 101 1HB MET 101 -1.945 -4.710 8.442 757 HB3 MET 101 2HB MET 101 -2.790 -4.122 9.872 758 HG2 MET 101 1HG MET 101 -0.450 -6.033 10.007 759 HG3 MET 101 2HG MET 101 -0.321 -4.255 10.141 760 HE1 MET 101 3HE MET 101 0.774 -6.374 12.152 761 HE2 MET 101 1HE MET 101 0.972 -4.623 12.421 762 HE3 MET 101 2HE MET 101 0.347 -5.671 13.718 763 H ILE 102 H ILE 102 -4.170 -7.196 7.254 764 HA ILE 102 HA ILE 102 -6.204 -5.022 7.135 765 HB ILE 102 HB ILE 102 -6.130 -5.235 4.684 766 HG12 ILE 102 1HG1 ILE 102 -3.774 -6.251 3.919 767 HG13 ILE 102 2HG1 ILE 102 -3.994 -7.243 5.333 768 HG21 ILE 102 1HG2 ILE 102 -4.103 -3.946 4.456 769 HG22 ILE 102 2HG2 ILE 102 -4.906 -3.495 5.970 770 HG23 ILE 102 3HG2 ILE 102 -3.476 -4.549 5.997 771 HD11 ILE 102 3HD1 ILE 102 -6.176 -8.064 4.428 772 HD12 ILE 102 1HD1 ILE 102 -5.887 -7.090 2.961 773 HD13 ILE 102 2HD1 ILE 102 -4.800 -8.421 3.395 Start of MODEL 12 1 H1 GLY 1 H GLY 1 2.786 16.820 6.986 2 HA2 GLY 1 1HA GLY 1 4.258 14.845 6.839 3 HA3 GLY 1 2HA GLY 1 3.238 14.809 8.293 4 H SER 2 H SER 2 4.284 12.369 7.158 5 HA SER 2 HA SER 2 3.710 10.356 6.501 6 HB2 SER 2 1HB SER 2 1.679 9.443 7.179 7 HB3 SER 2 2HB SER 2 1.967 10.787 8.255 8 HG SER 2 HG SER 2 0.579 12.015 6.802 9 HA PRO 3 HA PRO 3 2.981 10.423 2.136 10 HB2 PRO 3 1HB PRO 3 1.193 8.443 1.434 11 HB3 PRO 3 2HB PRO 3 2.913 8.178 1.796 12 HG2 PRO 3 1HG PRO 3 0.554 7.805 3.581 13 HG3 PRO 3 2HG PRO 3 1.997 6.743 3.399 14 HD2 PRO 3 1HD PRO 3 1.657 8.495 5.446 15 HD3 PRO 3 2HD PRO 3 3.266 8.090 4.813 16 H ILE 4 H ILE 4 1.295 11.059 0.460 17 HA ILE 4 HA ILE 4 -1.176 12.212 1.624 18 HB ILE 4 HB ILE 4 -0.047 12.512 -1.185 19 HG12 ILE 4 1HG1 ILE 4 1.795 13.184 0.220 20 HG13 ILE 4 2HG1 ILE 4 1.081 14.548 -0.577 21 HG21 ILE 4 1HG2 ILE 4 -1.769 14.418 0.443 22 HG22 ILE 4 2HG2 ILE 4 -1.319 14.572 -1.261 23 HG23 ILE 4 3HG2 ILE 4 -2.397 13.263 -0.726 24 HD11 ILE 4 3HD1 ILE 4 0.031 15.279 1.530 25 HD12 ILE 4 1HD1 ILE 4 0.660 13.819 2.337 26 HD13 ILE 4 2HD1 ILE 4 1.775 15.040 1.727 27 H LEU 5 H LEU 5 -3.086 11.034 1.205 28 HA LEU 5 HA LEU 5 -3.182 9.080 -0.968 29 HB2 LEU 5 1HB LEU 5 -4.394 7.586 0.573 30 HB3 LEU 5 2HB LEU 5 -2.662 7.700 0.652 31 HG LEU 5 HG LEU 5 -3.999 7.332 2.705 32 HD11 LEU 5 1HD1 LEU 5 -1.569 7.746 2.700 33 HD12 LEU 5 2HD1 LEU 5 -2.356 8.319 4.160 34 HD13 LEU 5 3HD1 LEU 5 -1.889 9.485 2.912 35 HD21 LEU 5 3HD2 LEU 5 -4.376 10.346 2.694 36 HD22 LEU 5 1HD2 LEU 5 -4.605 9.286 4.098 37 HD23 LEU 5 2HD2 LEU 5 -5.634 9.093 2.686 38 HA PRO 6 HA PRO 6 -7.240 10.893 -1.589 39 HB2 PRO 6 1HB PRO 6 -8.842 8.622 -2.046 40 HB3 PRO 6 2HB PRO 6 -7.918 9.511 -3.265 41 HG2 PRO 6 1HG PRO 6 -7.271 6.944 -1.889 42 HG3 PRO 6 2HG PRO 6 -6.873 7.448 -3.533 43 HD2 PRO 6 1HD PRO 6 -5.086 7.440 -1.465 44 HD3 PRO 6 2HD PRO 6 -4.943 8.538 -2.845 45 H LYS 7 H LYS 7 -9.591 10.803 -0.530 46 HA LYS 7 HA LYS 7 -9.428 10.427 2.275 47 HB2 LYS 7 1HB LYS 7 -11.979 10.383 0.612 48 HB3 LYS 7 2HB LYS 7 -11.782 10.757 2.316 49 HG2 LYS 7 1HG LYS 7 -11.748 12.834 1.756 50 HG3 LYS 7 2HG LYS 7 -10.062 12.604 1.316 51 HD2 LYS 7 1HD LYS 7 -10.583 13.170 -0.840 52 HD3 LYS 7 2HD LYS 7 -11.656 11.775 -0.896 53 HE2 LYS 7 1HE LYS 7 -13.021 13.607 -1.433 54 HE3 LYS 7 2HE LYS 7 -13.450 13.085 0.202 55 HZ1 LYS 7 3HZ LYS 7 -13.217 15.528 -0.092 56 HZ2 LYS 7 1HZ LYS 7 -11.651 15.334 -0.492 57 HZ3 LYS 7 2HZ LYS 7 -12.116 14.965 1.039 58 H ALA 8 H ALA 8 -11.339 9.006 3.344 59 HA ALA 8 HA ALA 8 -11.124 6.234 2.367 60 HB1 ALA 8 1HB ALA 8 -12.764 7.384 4.673 61 HB2 ALA 8 2HB ALA 8 -12.619 5.686 4.223 62 HB3 ALA 8 3HB ALA 8 -11.193 6.560 4.826 63 H GLU 9 H GLU 9 -13.430 8.979 2.763 64 HA GLU 9 HA GLU 9 -15.659 7.510 2.052 65 HB2 GLU 9 1HB GLU 9 -16.841 9.639 1.875 66 HB3 GLU 9 2HB GLU 9 -15.787 9.577 3.292 67 HG2 GLU 9 1HG GLU 9 -14.117 10.983 2.105 68 HG3 GLU 9 2HG GLU 9 -15.143 10.993 0.678 69 H ASN 10 H ASN 10 -13.440 9.031 -0.105 70 HA ASN 10 HA ASN 10 -15.138 8.907 -2.469 71 HB2 ASN 10 1HB ASN 10 -13.407 10.097 -3.500 72 HB3 ASN 10 2HB ASN 10 -13.528 10.777 -1.904 73 HD21 ASN 10 1HD2 ASN 10 -12.005 8.070 -0.984 74 HD22 ASN 10 2HD2 ASN 10 -10.382 8.635 -1.156 75 H VAL 11 H VAL 11 -13.423 6.444 -0.947 76 HA VAL 11 HA VAL 11 -12.052 5.430 -3.344 77 HB VAL 11 HB VAL 11 -12.262 4.531 -0.463 78 HG11 VAL 11 1HG1 VAL 11 -10.749 2.721 -0.996 79 HG12 VAL 11 2HG1 VAL 11 -12.318 2.481 -1.772 80 HG13 VAL 11 3HG1 VAL 11 -10.927 3.025 -2.743 81 HG21 VAL 11 3HG2 VAL 11 -10.621 6.332 -1.043 82 HG22 VAL 11 1HG2 VAL 11 -9.834 4.870 -0.471 83 HG23 VAL 11 2HG2 VAL 11 -9.849 5.269 -2.200 84 H ASP 12 H ASP 12 -13.262 4.547 -4.806 85 HA ASP 12 HA ASP 12 -16.088 4.021 -4.420 86 HB2 ASP 12 1HB ASP 12 -14.155 4.084 -6.700 87 HB3 ASP 12 2HB ASP 12 -15.478 2.919 -6.862 88 H SER 13 H SER 13 -13.112 2.068 -4.869 89 HA SER 13 HA SER 13 -13.862 0.440 -2.687 90 HB2 SER 13 1HB SER 13 -13.909 -1.782 -3.991 91 HB3 SER 13 2HB SER 13 -15.404 -0.834 -3.988 92 HG SER 13 HG SER 13 -13.496 -0.498 -6.028 93 H ILE 14 H ILE 14 -11.937 -0.492 -1.880 94 HA ILE 14 HA ILE 14 -9.514 -0.359 -3.580 95 HB ILE 14 HB ILE 14 -9.789 -1.712 -0.895 96 HG12 ILE 14 1HG1 ILE 14 -9.047 1.192 -1.362 97 HG13 ILE 14 2HG1 ILE 14 -10.549 0.596 -0.611 98 HG21 ILE 14 1HG2 ILE 14 -7.349 -0.535 -2.282 99 HG22 ILE 14 2HG2 ILE 14 -7.344 -1.340 -0.697 100 HG23 ILE 14 3HG2 ILE 14 -7.713 -2.251 -2.128 101 HD11 ILE 14 3HD1 ILE 14 -9.294 -0.347 1.255 102 HD12 ILE 14 1HD1 ILE 14 -7.796 0.367 0.596 103 HD13 ILE 14 2HD1 ILE 14 -9.125 1.408 1.111 104 H CYS 15 H CYS 15 -8.410 -2.316 -4.144 105 HA CYS 15 HA CYS 15 -9.839 -4.881 -3.859 106 HB2 CYS 15 1HB CYS 15 -10.061 -3.844 -6.278 107 HB3 CYS 15 2HB CYS 15 -8.335 -4.195 -6.384 108 HG CYS 15 HG CYS 15 -10.981 -6.091 -6.165 109 H ILE 16 H ILE 16 -8.295 -6.372 -3.090 110 HA ILE 16 HA ILE 16 -5.430 -5.717 -3.449 111 HB ILE 16 HB ILE 16 -6.568 -6.711 -0.819 112 HG12 ILE 16 1HG1 ILE 16 -5.460 -3.983 -1.609 113 HG13 ILE 16 2HG1 ILE 16 -7.136 -4.337 -1.182 114 HG21 ILE 16 1HG2 ILE 16 -4.193 -6.360 -0.058 115 HG22 ILE 16 2HG2 ILE 16 -4.362 -7.625 -1.278 116 HG23 ILE 16 3HG2 ILE 16 -3.745 -6.040 -1.747 117 HD11 ILE 16 3HD1 ILE 16 -6.395 -4.986 1.105 118 HD12 ILE 16 1HD1 ILE 16 -4.764 -4.375 0.683 119 HD13 ILE 16 2HD1 ILE 16 -6.138 -3.273 0.676 120 H ASP 17 H ASP 17 -4.656 -7.243 -4.641 121 HA ASP 17 HA ASP 17 -5.761 -9.986 -4.755 122 HB2 ASP 17 1HB ASP 17 -3.909 -8.350 -6.438 123 HB3 ASP 17 2HB ASP 17 -3.507 -10.058 -6.240 124 H PHE 18 H PHE 18 -4.983 -11.307 -3.233 125 HA PHE 18 HA PHE 18 -2.817 -10.738 -1.423 126 HB2 PHE 18 1HB PHE 18 -4.642 -13.052 -2.074 127 HB3 PHE 18 2HB PHE 18 -3.350 -13.346 -1.021 128 HD1 PHE 18 1HD PHE 18 -5.811 -10.371 -1.270 129 HD2 PHE 18 2HD PHE 18 -4.097 -13.519 1.171 130 HE1 PHE 18 1HE PHE 18 -7.073 -9.591 0.617 131 HE2 PHE 18 2HE PHE 18 -5.457 -12.729 3.075 132 HZ PHE 18 HZ PHE 18 -6.958 -10.770 2.824 133 H THR 19 H THR 19 -1.072 -12.695 -1.213 134 HA THR 19 HA THR 19 0.508 -12.688 -3.669 135 HB THR 19 HB THR 19 1.992 -14.284 -2.257 136 HG1 THR 19 1HG THR 19 0.266 -13.255 -0.215 137 HG21 THR 19 3HG2 THR 19 1.577 -11.392 -1.436 138 HG22 THR 19 1HG2 THR 19 2.608 -12.020 -2.754 139 HG23 THR 19 2HG2 THR 19 3.007 -12.398 -1.077 140 H ASN 20 H ASN 20 -2.163 -14.299 -3.035 141 HA ASN 20 HA ASN 20 -1.604 -16.584 -4.760 142 HB2 ASN 20 1HB ASN 20 -3.454 -17.820 -3.465 143 HB3 ASN 20 2HB ASN 20 -1.876 -17.750 -2.709 144 HD21 ASN 20 1HD2 ASN 20 -4.582 -15.258 -2.665 145 HD22 ASN 20 2HD2 ASN 20 -4.831 -15.480 -0.931 146 H SER 21 H SER 21 -3.988 -17.059 -5.888 147 HA SER 21 HA SER 21 -4.144 -14.410 -7.105 148 HB2 SER 21 1HB SER 21 -5.293 -15.645 -8.913 149 HB3 SER 21 2HB SER 21 -3.642 -16.136 -8.564 150 HG SER 21 HG SER 21 -6.006 -17.560 -8.306 151 H ILE 22 H ILE 22 -5.762 -15.731 -4.733 152 HA ILE 22 HA ILE 22 -8.486 -14.860 -5.124 153 HB ILE 22 HB ILE 22 -7.021 -14.908 -2.486 154 HG12 ILE 22 1HG1 ILE 22 -8.107 -17.413 -3.928 155 HG13 ILE 22 2HG1 ILE 22 -6.416 -17.050 -3.594 156 HG21 ILE 22 1HG2 ILE 22 -9.397 -14.161 -2.683 157 HG22 ILE 22 2HG2 ILE 22 -9.810 -15.763 -3.332 158 HG23 ILE 22 3HG2 ILE 22 -9.240 -15.580 -1.648 159 HD11 ILE 22 3HD1 ILE 22 -7.179 -18.710 -2.021 160 HD12 ILE 22 1HD1 ILE 22 -6.859 -17.210 -1.148 161 HD13 ILE 22 2HD1 ILE 22 -8.530 -17.705 -1.509 162 H GLN 23 H GLN 23 -9.090 -12.815 -4.969 163 HA GLN 23 HA GLN 23 -7.376 -10.790 -3.736 164 HB2 GLN 23 1HB GLN 23 -7.817 -9.499 -5.468 165 HB3 GLN 23 2HB GLN 23 -7.936 -10.972 -6.351 166 HG2 GLN 23 1HG GLN 23 -10.507 -10.740 -5.850 167 HG3 GLN 23 2HG GLN 23 -10.080 -9.073 -5.458 168 HE21 GLN 23 1HE2 GLN 23 -7.906 -9.006 -7.758 169 HE22 GLN 23 2HE2 GLN 23 -8.935 -8.823 -9.145 170 H LYS 24 H LYS 24 -8.713 -9.018 -2.752 171 HA LYS 24 HA LYS 24 -11.510 -9.805 -2.125 172 HB2 LYS 24 1HB LYS 24 -9.547 -10.187 -0.188 173 HB3 LYS 24 2HB LYS 24 -10.051 -8.548 0.150 174 HG2 LYS 24 1HG LYS 24 -12.503 -9.811 -0.066 175 HG3 LYS 24 2HG LYS 24 -11.452 -11.101 0.518 176 HD2 LYS 24 1HD LYS 24 -12.323 -10.104 2.492 177 HD3 LYS 24 2HD LYS 24 -10.679 -9.521 2.338 178 HE2 LYS 24 1HE LYS 24 -11.730 -7.547 2.792 179 HE3 LYS 24 2HE LYS 24 -11.788 -7.502 1.040 180 HZ1 LYS 24 3HZ LYS 24 -13.918 -7.238 1.255 181 HZ2 LYS 24 1HZ LYS 24 -13.932 -7.512 2.868 182 HZ3 LYS 24 2HZ LYS 24 -14.112 -8.775 1.785 183 H ILE 25 H ILE 25 -12.886 -7.957 -1.690 184 HA ILE 25 HA ILE 25 -11.748 -5.386 -2.622 185 HB ILE 25 HB ILE 25 -14.446 -6.731 -3.050 186 HG12 ILE 25 1HG1 ILE 25 -13.689 -5.609 -5.424 187 HG13 ILE 25 2HG1 ILE 25 -12.108 -5.798 -4.716 188 HG21 ILE 25 1HG2 ILE 25 -15.003 -4.464 -2.325 189 HG22 ILE 25 2HG2 ILE 25 -13.809 -3.802 -3.470 190 HG23 ILE 25 3HG2 ILE 25 -15.266 -4.635 -4.055 191 HD11 ILE 25 3HD1 ILE 25 -12.510 -8.241 -4.481 192 HD12 ILE 25 1HD1 ILE 25 -14.147 -8.020 -5.156 193 HD13 ILE 25 2HD1 ILE 25 -12.715 -7.698 -6.153 194 H TYR 26 H TYR 26 -12.164 -3.592 -1.440 195 HA TYR 26 HA TYR 26 -13.337 -3.975 1.293 196 HB2 TYR 26 1HB TYR 26 -10.709 -2.626 0.642 197 HB3 TYR 26 2HB TYR 26 -11.455 -2.686 2.188 198 HD1 TYR 26 1HD TYR 26 -9.810 -4.736 -0.460 199 HD2 TYR 26 2HD TYR 26 -11.091 -4.638 3.684 200 HE1 TYR 26 1HE TYR 26 -8.562 -6.825 0.014 201 HE2 TYR 26 2HE TYR 26 -9.819 -6.679 4.117 202 HH TYR 26 HH TYR 26 -8.395 -8.274 3.269 203 H ASP 27 H ASP 27 -15.204 -3.041 0.557 204 HA ASP 27 HA ASP 27 -15.181 -0.182 -0.217 205 HB2 ASP 27 1HB ASP 27 -17.182 -0.600 -1.411 206 HB3 ASP 27 2HB ASP 27 -16.091 -1.905 -1.875 207 H ASP 28 H ASP 28 -15.755 -2.345 2.325 208 HA ASP 28 HA ASP 28 -18.055 -1.123 3.601 209 HB2 ASP 28 1HB ASP 28 -15.725 -2.442 5.024 210 HB3 ASP 28 2HB ASP 28 -17.343 -2.204 5.613 211 H SER 29 H SER 29 -17.993 0.775 4.913 212 HA SER 29 HA SER 29 -15.944 2.658 4.481 213 HB2 SER 29 1HB SER 29 -18.280 3.115 5.271 214 HB3 SER 29 2HB SER 29 -17.820 2.496 6.862 215 HG SER 29 HG SER 29 -17.543 4.594 7.035 216 H GLU 30 H GLU 30 -16.399 0.377 7.220 217 HA GLU 30 HA GLU 30 -14.107 1.285 8.649 218 HB2 GLU 30 1HB GLU 30 -16.070 -0.173 9.506 219 HB3 GLU 30 2HB GLU 30 -15.172 -1.547 8.811 220 HG2 GLU 30 1HG GLU 30 -13.161 -0.788 10.170 221 HG3 GLU 30 2HG GLU 30 -14.216 0.425 10.918 222 H SER 31 H SER 31 -14.490 -1.153 6.056 223 HA SER 31 HA SER 31 -11.905 -2.401 6.219 224 HB2 SER 31 1HB SER 31 -12.218 -3.167 4.127 225 HB3 SER 31 2HB SER 31 -13.784 -3.281 4.867 226 HG SER 31 HG SER 31 -14.161 -1.181 3.651 227 H ILE 32 H ILE 32 -13.083 0.518 4.491 228 HA ILE 32 HA ILE 32 -10.505 1.100 3.379 229 HB ILE 32 HB ILE 32 -12.968 2.868 3.653 230 HG12 ILE 32 1HG1 ILE 32 -12.012 1.394 1.154 231 HG13 ILE 32 2HG1 ILE 32 -13.164 0.657 2.250 232 HG21 ILE 32 1HG2 ILE 32 -10.480 3.114 1.884 233 HG22 ILE 32 2HG2 ILE 32 -11.884 4.199 1.858 234 HG23 ILE 32 3HG2 ILE 32 -10.839 4.128 3.283 235 HD11 ILE 32 3HD1 ILE 32 -13.673 3.317 0.874 236 HD12 ILE 32 1HD1 ILE 32 -14.258 1.747 0.327 237 HD13 ILE 32 2HD1 ILE 32 -14.797 2.398 1.890 238 H GLN 33 H GLN 33 -12.370 2.606 6.133 239 HA GLN 33 HA GLN 33 -10.340 4.503 6.767 240 HB2 GLN 33 1HB GLN 33 -12.652 3.303 8.347 241 HB3 GLN 33 2HB GLN 33 -11.508 4.430 9.074 242 HG2 GLN 33 1HG GLN 33 -12.042 5.957 7.042 243 HG3 GLN 33 2HG GLN 33 -13.445 4.920 6.796 244 HE21 GLN 33 1HE2 GLN 33 -11.791 6.518 9.621 245 HE22 GLN 33 2HE2 GLN 33 -13.296 7.129 10.315 246 H LYS 34 H LYS 34 -10.670 1.123 7.711 247 HA LYS 34 HA LYS 34 -8.507 1.114 9.622 248 HB2 LYS 34 1HB LYS 34 -10.227 -0.651 9.560 249 HB3 LYS 34 2HB LYS 34 -9.753 -1.049 7.908 250 HG2 LYS 34 1HG LYS 34 -7.340 -1.353 9.200 251 HG3 LYS 34 2HG LYS 34 -8.441 -1.773 10.491 252 HD2 LYS 34 1HD LYS 34 -8.226 -2.939 7.720 253 HD3 LYS 34 2HD LYS 34 -7.837 -3.739 9.254 254 HE2 LYS 34 1HE LYS 34 -10.687 -2.808 8.790 255 HE3 LYS 34 2HE LYS 34 -10.129 -4.263 7.986 256 HZ1 LYS 34 3HZ LYS 34 -11.244 -4.575 10.155 257 HZ2 LYS 34 1HZ LYS 34 -9.870 -4.029 10.893 258 HZ3 LYS 34 2HZ LYS 34 -9.834 -5.368 9.935 259 H ILE 35 H ILE 35 -8.645 -0.225 6.182 260 HA ILE 35 HA ILE 35 -6.043 -0.717 5.925 261 HB ILE 35 HB ILE 35 -8.092 0.208 3.873 262 HG12 ILE 35 1HG1 ILE 35 -6.712 -2.437 4.400 263 HG13 ILE 35 2HG1 ILE 35 -8.257 -2.051 5.052 264 HG21 ILE 35 1HG2 ILE 35 -5.189 -0.570 3.398 265 HG22 ILE 35 2HG2 ILE 35 -6.399 -0.644 2.113 266 HG23 ILE 35 3HG2 ILE 35 -6.026 0.900 2.850 267 HD11 ILE 35 3HD1 ILE 35 -9.288 -1.977 2.850 268 HD12 ILE 35 1HD1 ILE 35 -7.747 -2.265 2.028 269 HD13 ILE 35 2HD1 ILE 35 -8.418 -3.507 3.069 270 H LEU 36 H LEU 36 -7.606 2.468 5.285 271 HA LEU 36 HA LEU 36 -5.549 4.026 4.320 272 HB2 LEU 36 1HB LEU 36 -7.805 4.604 6.253 273 HB3 LEU 36 2HB LEU 36 -6.665 5.841 5.814 274 HG LEU 36 HG LEU 36 -9.039 5.237 4.514 275 HD11 LEU 36 1HD1 LEU 36 -6.671 6.870 3.534 276 HD12 LEU 36 2HD1 LEU 36 -7.918 7.412 4.686 277 HD13 LEU 36 3HD1 LEU 36 -8.363 7.050 3.017 278 HD21 LEU 36 3HD2 LEU 36 -8.525 4.726 2.212 279 HD22 LEU 36 1HD2 LEU 36 -7.979 3.378 3.209 280 HD23 LEU 36 2HD2 LEU 36 -6.797 4.551 2.567 281 H SER 37 H SER 37 -5.792 2.844 7.693 282 HA SER 37 HA SER 37 -3.877 4.658 8.791 283 HB2 SER 37 1HB SER 37 -5.508 3.124 10.028 284 HB3 SER 37 2HB SER 37 -4.407 1.796 9.686 285 HG SER 37 HG SER 37 -3.103 2.469 11.107 286 H GLU 38 H GLU 38 -3.536 1.275 7.460 287 HA GLU 38 HA GLU 38 -0.637 1.443 7.654 288 HB2 GLU 38 1HB GLU 38 -2.471 -0.652 6.444 289 HB3 GLU 38 2HB GLU 38 -0.715 -0.803 6.593 290 HG2 GLU 38 1HG GLU 38 -2.583 -0.458 8.959 291 HG3 GLU 38 2HG GLU 38 -1.992 -1.997 8.372 292 H ILE 39 H ILE 39 -2.896 2.505 5.351 293 HA ILE 39 HA ILE 39 -0.971 2.733 3.167 294 HB ILE 39 HB ILE 39 -3.501 4.276 3.712 295 HG12 ILE 39 1HG1 ILE 39 -3.817 1.793 3.297 296 HG13 ILE 39 2HG1 ILE 39 -4.644 2.868 2.187 297 HG21 ILE 39 1HG2 ILE 39 -2.137 5.582 2.241 298 HG22 ILE 39 2HG2 ILE 39 -1.795 4.159 1.225 299 HG23 ILE 39 3HG2 ILE 39 -3.445 4.840 1.323 300 HD11 ILE 39 3HD1 ILE 39 -2.016 1.460 1.559 301 HD12 ILE 39 1HD1 ILE 39 -3.625 0.846 1.135 302 HD13 ILE 39 2HD1 ILE 39 -3.054 2.355 0.422 303 H ALA 40 H ALA 40 -1.486 4.421 6.226 304 HA ALA 40 HA ALA 40 0.143 6.731 5.318 305 HB1 ALA 40 1HB ALA 40 -1.089 7.996 6.987 306 HB2 ALA 40 2HB ALA 40 -2.270 7.093 6.012 307 HB3 ALA 40 3HB ALA 40 -1.834 6.520 7.625 308 H THR 41 H THR 41 0.281 4.101 7.599 309 HA THR 41 HA THR 41 1.621 5.515 9.652 310 HB THR 41 HB THR 41 2.401 3.137 10.288 311 HG1 THR 41 1HG THR 41 0.747 1.631 9.221 312 HG21 THR 41 3HG2 THR 41 0.252 2.580 11.242 313 HG22 THR 41 1HG2 THR 41 -0.576 3.698 10.149 314 HG23 THR 41 2HG2 THR 41 0.539 4.318 11.377 315 H GLY 42 H GLY 42 3.004 4.091 6.714 316 HA2 GLY 42 1HA GLY 42 5.595 3.713 7.857 317 HA3 GLY 42 2HA GLY 42 5.152 3.580 6.153 318 H LYS 43 H LYS 43 7.591 4.478 6.973 319 HA LYS 43 HA LYS 43 7.592 7.388 6.375 320 HB2 LYS 43 1HB LYS 43 10.078 7.110 7.150 321 HB3 LYS 43 2HB LYS 43 8.785 7.271 8.291 322 HG2 LYS 43 1HG LYS 43 8.876 5.010 8.959 323 HG3 LYS 43 2HG LYS 43 9.672 4.499 7.469 324 HD2 LYS 43 1HD LYS 43 11.761 5.375 8.079 325 HD3 LYS 43 2HD LYS 43 11.111 6.266 9.458 326 HE2 LYS 43 1HE LYS 43 10.971 3.222 9.196 327 HE3 LYS 43 2HE LYS 43 12.315 4.040 9.977 328 HZ1 LYS 43 3HZ LYS 43 10.746 4.970 11.573 329 HZ2 LYS 43 1HZ LYS 43 10.639 3.306 11.537 330 HZ3 LYS 43 2HZ LYS 43 9.492 4.235 10.848 331 H ARG 44 H ARG 44 7.664 7.560 4.191 332 HA ARG 44 HA ARG 44 9.228 5.949 2.449 333 HB2 ARG 44 1HB ARG 44 9.144 7.759 0.849 334 HB3 ARG 44 2HB ARG 44 7.593 7.333 1.518 335 HG2 ARG 44 1HG ARG 44 8.162 9.401 3.176 336 HG3 ARG 44 2HG ARG 44 9.203 9.844 1.782 337 HD2 ARG 44 1HD ARG 44 7.286 9.487 0.290 338 HD3 ARG 44 2HD ARG 44 6.245 9.237 1.701 339 HE ARG 44 HE ARG 44 7.468 11.786 1.937 340 HH11 ARG 44 1HH1 ARG 44 4.973 9.986 0.173 341 HH12 ARG 44 2HH1 ARG 44 4.158 11.395 -0.428 342 HH21 ARG 44 1HH2 ARG 44 6.412 13.686 1.111 343 HH22 ARG 44 2HH2 ARG 44 4.944 13.567 0.224 344 H THR 45 H THR 45 10.315 8.022 4.825 345 HA THR 45 HA THR 45 12.261 9.104 5.272 346 HB THR 45 HB THR 45 14.243 7.953 4.884 347 HG1 THR 45 1HG THR 45 13.042 7.004 2.516 348 HG21 THR 45 3HG2 THR 45 12.230 5.675 4.373 349 HG22 THR 45 1HG2 THR 45 12.517 6.413 5.958 350 HG23 THR 45 2HG2 THR 45 13.836 5.582 5.117 351 H GLU 46 H GLU 46 14.267 10.426 4.045 352 HA GLU 46 HA GLU 46 12.907 11.937 1.905 353 HB2 GLU 46 1HB GLU 46 15.447 12.481 3.470 354 HB3 GLU 46 2HB GLU 46 14.771 13.493 2.178 355 HG2 GLU 46 1HG GLU 46 12.538 13.365 3.563 356 HG3 GLU 46 2HG GLU 46 13.574 12.839 4.882 357 H LYS 47 H LYS 47 14.460 9.118 1.833 358 HA LYS 47 HA LYS 47 16.474 9.430 -0.187 359 HB2 LYS 47 1HB LYS 47 14.667 7.103 0.582 360 HB3 LYS 47 2HB LYS 47 15.912 6.990 -0.635 361 HG2 LYS 47 1HG LYS 47 17.047 8.079 1.826 362 HG3 LYS 47 2HG LYS 47 16.226 6.555 2.148 363 HD2 LYS 47 1HD LYS 47 18.192 6.905 -0.144 364 HD3 LYS 47 2HD LYS 47 18.690 6.375 1.474 365 HE2 LYS 47 1HE LYS 47 17.531 4.351 1.343 366 HE3 LYS 47 2HE LYS 47 16.353 4.997 0.198 367 HZ1 LYS 47 3HZ LYS 47 17.854 3.412 -0.795 368 HZ2 LYS 47 1HZ LYS 47 19.145 4.333 -0.450 369 HZ3 LYS 47 2HZ LYS 47 17.996 4.885 -1.535 370 H GLN 48 H GLN 48 16.385 8.735 -2.379 371 HA GLN 48 HA GLN 48 14.037 9.776 -3.858 372 HB2 GLN 48 1HB GLN 48 16.894 9.002 -4.627 373 HB3 GLN 48 2HB GLN 48 15.700 9.534 -5.802 374 HG2 GLN 48 1HG GLN 48 16.033 11.283 -3.431 375 HG3 GLN 48 2HG GLN 48 17.456 11.183 -4.458 376 HE21 GLN 48 1HE2 GLN 48 14.426 12.698 -3.946 377 HE22 GLN 48 2HE2 GLN 48 14.369 13.583 -5.467 378 H SER 49 H SER 49 12.506 8.237 -4.495 379 HA SER 49 HA SER 49 13.383 5.466 -4.904 380 HB2 SER 49 1HB SER 49 11.271 5.759 -3.692 381 HB3 SER 49 2HB SER 49 10.528 6.615 -5.026 382 HG SER 49 HG SER 49 10.364 4.701 -6.037 383 H ILE 50 H ILE 50 13.664 4.786 -6.965 384 HA ILE 50 HA ILE 50 12.842 6.438 -9.269 385 HB ILE 50 HB ILE 50 15.122 6.121 -10.250 386 HG12 ILE 50 1HG1 ILE 50 16.101 5.744 -7.384 387 HG13 ILE 50 2HG1 ILE 50 15.876 4.392 -8.489 388 HG21 ILE 50 1HG2 ILE 50 15.959 8.143 -9.411 389 HG22 ILE 50 2HG2 ILE 50 14.222 8.281 -9.217 390 HG23 ILE 50 3HG2 ILE 50 15.247 7.930 -7.799 391 HD11 ILE 50 3HD1 ILE 50 17.738 6.751 -8.951 392 HD12 ILE 50 1HD1 ILE 50 18.207 5.115 -8.460 393 HD13 ILE 50 2HD1 ILE 50 17.497 5.390 -10.068 394 H GLN 51 H GLN 51 11.689 4.033 -8.090 395 HA GLN 51 HA GLN 51 12.192 2.126 -10.334 396 HB2 GLN 51 1HB GLN 51 11.043 0.512 -8.645 397 HB3 GLN 51 2HB GLN 51 12.742 0.851 -8.547 398 HG2 GLN 51 1HG GLN 51 12.240 2.549 -6.671 399 HG3 GLN 51 2HG GLN 51 10.567 2.002 -6.754 400 HE21 GLN 51 1HE2 GLN 51 10.577 -0.554 -6.917 401 HE22 GLN 51 2HE2 GLN 51 11.432 -1.384 -5.616 402 H ASP 52 H ASP 52 10.052 0.736 -10.639 403 HA ASP 52 HA ASP 52 7.608 2.473 -10.547 404 HB2 ASP 52 1HB ASP 52 9.059 1.465 -12.933 405 HB3 ASP 52 2HB ASP 52 7.354 1.056 -12.948 406 H TYR 53 H TYR 53 9.031 -0.381 -9.599 407 HA TYR 53 HA TYR 53 6.543 -1.792 -9.140 408 HB2 TYR 53 1HB TYR 53 8.730 -2.798 -11.029 409 HB3 TYR 53 2HB TYR 53 7.694 -3.898 -10.170 410 HD1 TYR 53 2HD TYR 53 5.131 -3.691 -10.427 411 HD2 TYR 53 1HD TYR 53 7.987 -1.863 -13.104 412 HE1 TYR 53 2HE TYR 53 3.397 -3.557 -12.199 413 HE2 TYR 53 1HE TYR 53 6.279 -1.690 -14.824 414 HH TYR 53 HH TYR 53 4.175 -2.925 -15.466 415 HA PRO 54 HA PRO 54 9.199 -3.018 -5.781 416 HB2 PRO 54 1HB PRO 54 8.355 -5.518 -5.032 417 HB3 PRO 54 2HB PRO 54 7.349 -4.045 -4.829 418 HG2 PRO 54 1HG PRO 54 7.190 -6.072 -7.038 419 HG3 PRO 54 2HG PRO 54 5.884 -5.378 -6.009 420 HD2 PRO 54 1HD PRO 54 6.483 -4.404 -8.511 421 HD3 PRO 54 2HD PRO 54 5.944 -3.334 -7.192 422 H SER 55 H SER 55 10.749 -4.758 -5.048 423 HA SER 55 HA SER 55 12.255 -5.919 -7.327 424 HB2 SER 55 1HB SER 55 13.150 -4.228 -5.546 425 HB3 SER 55 2HB SER 55 13.141 -5.622 -4.456 426 HG SER 55 HG SER 55 15.097 -5.540 -5.249 427 H ALA 56 H ALA 56 9.939 -6.886 -5.020 428 HA ALA 56 HA ALA 56 11.103 -9.462 -4.281 429 HB1 ALA 56 1HB ALA 56 8.353 -8.180 -3.917 430 HB2 ALA 56 2HB ALA 56 8.791 -9.771 -3.280 431 HB3 ALA 56 3HB ALA 56 9.659 -8.339 -2.707 432 H GLU 57 H GLU 57 10.313 -11.498 -4.982 433 HA GLU 57 HA GLU 57 9.108 -11.595 -7.665 434 HB2 GLU 57 1HB GLU 57 10.827 -13.259 -5.997 435 HB3 GLU 57 2HB GLU 57 9.430 -14.195 -6.499 436 HG2 GLU 57 1HG GLU 57 10.950 -12.582 -8.547 437 HG3 GLU 57 2HG GLU 57 11.594 -14.087 -7.946 438 H GLU 58 H GLU 58 8.094 -11.849 -4.316 439 HA GLU 58 HA GLU 58 5.365 -12.549 -5.237 440 HB2 GLU 58 1HB GLU 58 6.852 -13.737 -2.868 441 HB3 GLU 58 2HB GLU 58 5.093 -13.715 -3.005 442 HG2 GLU 58 1HG GLU 58 5.134 -15.569 -4.206 443 HG3 GLU 58 2HG GLU 58 5.982 -14.741 -5.498 444 H TYR 59 H TYR 59 4.367 -10.725 -5.046 445 HA TYR 59 HA TYR 59 4.469 -9.181 -2.519 446 HB2 TYR 59 1HB TYR 59 4.234 -7.106 -3.851 447 HB3 TYR 59 2HB TYR 59 5.784 -7.891 -4.054 448 HD1 TYR 59 1HD TYR 59 2.558 -7.068 -5.713 449 HD2 TYR 59 2HD TYR 59 6.487 -8.771 -6.231 450 HE1 TYR 59 1HE TYR 59 2.313 -6.863 -8.154 451 HE2 TYR 59 2HE TYR 59 6.264 -8.556 -8.679 452 HH TYR 59 HH TYR 59 3.458 -6.907 -10.186 453 H GLY 60 H GLY 60 2.462 -8.111 -2.069 454 HA2 GLY 60 1HA GLY 60 0.059 -9.296 -3.386 455 HA3 GLY 60 2HA GLY 60 0.048 -8.396 -1.892 456 H THR 61 H THR 61 -1.562 -7.781 -4.206 457 HA THR 61 HA THR 61 -0.275 -5.375 -5.419 458 HB THR 61 HB THR 61 -1.971 -7.583 -6.649 459 HG1 THR 61 1HG THR 61 -0.030 -8.353 -6.536 460 HG21 THR 61 3HG2 THR 61 -1.357 -6.424 -8.818 461 HG22 THR 61 1HG2 THR 61 -0.892 -5.009 -7.835 462 HG23 THR 61 2HG2 THR 61 -2.565 -5.588 -7.816 463 H ILE 62 H ILE 62 -1.463 -3.521 -5.388 464 HA ILE 62 HA ILE 62 -4.208 -3.676 -4.227 465 HB ILE 62 HB ILE 62 -1.976 -1.687 -3.710 466 HG12 ILE 62 1HG1 ILE 62 -2.379 -2.861 -1.287 467 HG13 ILE 62 2HG1 ILE 62 -2.729 -4.230 -2.312 468 HG21 ILE 62 1HG2 ILE 62 -4.152 -0.677 -3.462 469 HG22 ILE 62 2HG2 ILE 62 -4.712 -2.005 -2.426 470 HG23 ILE 62 3HG2 ILE 62 -3.432 -0.900 -1.868 471 HD11 ILE 62 3HD1 ILE 62 -0.470 -3.984 -3.383 472 HD12 ILE 62 1HD1 ILE 62 -0.155 -2.583 -2.352 473 HD13 ILE 62 2HD1 ILE 62 -0.363 -4.213 -1.654 474 H ASN 63 H ASN 63 -5.728 -2.637 -5.445 475 HA ASN 63 HA ASN 63 -4.899 -0.288 -7.057 476 HB2 ASN 63 1HB ASN 63 -7.215 -2.167 -7.702 477 HB3 ASN 63 2HB ASN 63 -6.924 -0.624 -8.432 478 HD21 ASN 63 1HD2 ASN 63 -5.589 -3.905 -8.118 479 HD22 ASN 63 2HD2 ASN 63 -4.606 -3.864 -9.574 480 H ILE 64 H ILE 64 -6.187 1.518 -6.518 481 HA ILE 64 HA ILE 64 -8.260 1.172 -4.380 482 HB ILE 64 HB ILE 64 -6.151 3.347 -4.666 483 HG12 ILE 64 1HG1 ILE 64 -6.363 1.545 -2.250 484 HG13 ILE 64 2HG1 ILE 64 -5.521 1.016 -3.697 485 HG21 ILE 64 1HG2 ILE 64 -8.250 4.275 -3.758 486 HG22 ILE 64 2HG2 ILE 64 -8.307 3.003 -2.535 487 HG23 ILE 64 3HG2 ILE 64 -7.018 4.222 -2.499 488 HD11 ILE 64 3HD1 ILE 64 -3.994 1.992 -2.024 489 HD12 ILE 64 1HD1 ILE 64 -3.929 2.792 -3.604 490 HD13 ILE 64 2HD1 ILE 64 -4.790 3.561 -2.257 491 H GLU 65 H GLU 65 -9.841 1.094 -6.176 492 HA GLU 65 HA GLU 65 -10.048 3.198 -8.104 493 HB2 GLU 65 1HB GLU 65 -11.354 0.982 -8.096 494 HB3 GLU 65 2HB GLU 65 -12.322 1.650 -6.789 495 HG2 GLU 65 1HG GLU 65 -13.631 2.165 -8.566 496 HG3 GLU 65 2HG GLU 65 -12.727 3.661 -8.419 497 H ASN 66 H ASN 66 -10.443 5.335 -7.662 498 HA ASN 66 HA ASN 66 -12.178 6.066 -5.443 499 HB2 ASN 66 1HB ASN 66 -10.666 7.568 -4.358 500 HB3 ASN 66 2HB ASN 66 -9.956 5.961 -4.348 501 HD21 ASN 66 1HD2 ASN 66 -8.026 5.542 -5.802 502 HD22 ASN 66 2HD2 ASN 66 -7.236 6.990 -6.471 503 H ASN 67 H ASN 67 -13.613 7.341 -6.388 504 HA ASN 67 HA ASN 67 -14.615 8.722 -7.826 505 HB2 ASN 67 1HB ASN 67 -11.951 10.157 -8.202 506 HB3 ASN 67 2HB ASN 67 -13.552 10.800 -8.489 507 HD21 ASN 67 1HD2 ASN 67 -11.153 10.102 -6.038 508 HD22 ASN 67 2HD2 ASN 67 -12.000 10.874 -4.701 509 H GLY 68 H GLY 68 -13.228 6.285 -8.826 510 HA2 GLY 68 1HA GLY 68 -12.779 5.197 -10.741 511 HA3 GLY 68 2HA GLY 68 -13.588 6.475 -11.638 512 H GLY 69 H GLY 69 -11.089 7.823 -9.809 513 HA2 GLY 69 1HA GLY 69 -8.857 7.490 -11.694 514 HA3 GLY 69 2HA GLY 69 -8.875 8.318 -10.124 515 H MET 70 H MET 70 -6.923 6.383 -10.459 516 HA MET 70 HA MET 70 -7.726 4.676 -8.275 517 HB2 MET 70 1HB MET 70 -6.915 2.553 -9.163 518 HB3 MET 70 2HB MET 70 -8.209 3.167 -10.193 519 HG2 MET 70 1HG MET 70 -6.536 4.064 -11.776 520 HG3 MET 70 2HG MET 70 -5.229 3.483 -10.743 521 HE1 MET 70 3HE MET 70 -4.877 1.346 -13.890 522 HE2 MET 70 1HE MET 70 -5.605 2.969 -13.877 523 HE3 MET 70 2HE MET 70 -4.206 2.608 -12.839 524 H THR 71 H THR 71 -5.802 3.576 -7.318 525 HA THR 71 HA THR 71 -3.252 4.967 -7.861 526 HB THR 71 HB THR 71 -4.445 4.538 -5.079 527 HG1 THR 71 1HG THR 71 -5.547 6.077 -6.152 528 HG21 THR 71 3HG2 THR 71 -2.021 6.187 -5.879 529 HG22 THR 71 1HG2 THR 71 -1.935 4.547 -5.196 530 HG23 THR 71 2HG2 THR 71 -2.639 5.858 -4.244 531 H THR 72 H THR 72 -1.588 3.427 -7.936 532 HA THR 72 HA THR 72 -2.357 0.631 -7.289 533 HB THR 72 HB THR 72 -0.604 1.589 -9.570 534 HG1 THR 72 1HG THR 72 -2.403 0.995 -10.840 535 HG21 THR 72 3HG2 THR 72 -0.856 -0.750 -10.371 536 HG22 THR 72 1HG2 THR 72 -1.795 -1.156 -8.919 537 HG23 THR 72 2HG2 THR 72 -0.082 -0.723 -8.785 538 H MET 73 H MET 73 -0.985 -0.448 -5.955 539 HA MET 73 HA MET 73 1.798 0.361 -5.675 540 HB2 MET 73 1HB MET 73 1.660 0.656 -3.214 541 HB3 MET 73 2HB MET 73 0.836 1.893 -4.141 542 HG2 MET 73 1HG MET 73 -1.354 0.798 -3.714 543 HG3 MET 73 2HG MET 73 -0.519 -0.413 -2.750 544 HE1 MET 73 3HE MET 73 -0.428 3.511 -2.909 545 HE2 MET 73 1HE MET 73 -0.205 3.870 -1.172 546 HE3 MET 73 2HE MET 73 1.060 2.993 -2.066 547 H PHE 74 H PHE 74 2.842 -1.179 -3.976 548 HA PHE 74 HA PHE 74 1.693 -3.873 -3.961 549 HB2 PHE 74 1HB PHE 74 4.475 -3.350 -5.055 550 HB3 PHE 74 2HB PHE 74 3.536 -4.825 -5.127 551 HD1 PHE 74 2HD PHE 74 1.533 -4.932 -6.758 552 HD2 PHE 74 1HD PHE 74 4.299 -1.621 -6.750 553 HE1 PHE 74 2HE PHE 74 0.772 -4.261 -9.011 554 HE2 PHE 74 1HE PHE 74 3.534 -0.960 -8.974 555 HZ PHE 74 HZ PHE 74 1.748 -2.257 -10.108 556 H TYR 75 H TYR 75 2.791 -5.118 -2.212 557 HA TYR 75 HA TYR 75 4.893 -3.636 -0.753 558 HB2 TYR 75 1HB TYR 75 3.019 -5.091 1.022 559 HB3 TYR 75 2HB TYR 75 3.946 -3.659 1.301 560 HD1 TYR 75 2HD TYR 75 3.070 -1.567 -0.261 561 HD2 TYR 75 1HD TYR 75 0.701 -4.859 1.135 562 HE1 TYR 75 2HE TYR 75 1.071 -0.123 -0.349 563 HE2 TYR 75 1HE TYR 75 -1.329 -3.479 0.910 564 HH TYR 75 HH TYR 75 -1.174 -0.025 -0.064 565 H TYR 76 H TYR 76 6.258 -4.997 0.541 566 HA TYR 76 HA TYR 76 6.095 -7.877 0.340 567 HB2 TYR 76 1HB TYR 76 8.259 -8.116 -0.817 568 HB3 TYR 76 2HB TYR 76 6.985 -7.516 -1.843 569 HD1 TYR 76 2HD TYR 76 6.904 -5.051 -2.436 570 HD2 TYR 76 1HD TYR 76 10.318 -6.872 -0.532 571 HE1 TYR 76 2HE TYR 76 8.315 -3.082 -3.061 572 HE2 TYR 76 1HE TYR 76 11.753 -5.029 -1.312 573 HH TYR 76 HH TYR 76 11.869 -3.148 -2.714 574 H GLU 77 H GLU 77 8.228 -8.780 1.374 575 HA GLU 77 HA GLU 77 9.187 -7.040 3.589 576 HB2 GLU 77 1HB GLU 77 8.046 -9.155 4.240 577 HB3 GLU 77 2HB GLU 77 9.202 -10.078 3.274 578 HG2 GLU 77 1HG GLU 77 11.061 -9.275 4.722 579 HG3 GLU 77 2HG GLU 77 9.911 -8.305 5.647 580 H GLU 78 H GLU 78 11.347 -6.613 3.743 581 HA GLU 78 HA GLU 78 13.225 -8.073 2.023 582 HB2 GLU 78 1HB GLU 78 12.584 -6.085 0.753 583 HB3 GLU 78 2HB GLU 78 13.101 -5.039 2.069 584 HG2 GLU 78 1HG GLU 78 15.373 -5.511 1.738 585 HG3 GLU 78 2HG GLU 78 15.042 -7.031 0.908 586 H ASN 79 H ASN 79 14.708 -8.846 3.287 587 HA ASN 79 HA ASN 79 15.817 -9.484 5.052 588 HB2 ASN 79 1HB ASN 79 16.482 -6.611 4.785 589 HB3 ASN 79 2HB ASN 79 16.761 -7.216 6.408 590 HD21 ASN 79 1HD2 ASN 79 18.124 -7.027 3.307 591 HD22 ASN 79 2HD2 ASN 79 19.358 -8.235 3.533 592 H GLY 80 H GLY 80 12.981 -8.024 5.746 593 HA2 GLY 80 1HA GLY 80 11.959 -9.423 7.725 594 HA3 GLY 80 2HA GLY 80 13.135 -8.543 8.685 595 H LYS 81 H LYS 81 12.839 -6.106 6.966 596 HA LYS 81 HA LYS 81 10.547 -4.809 8.285 597 HB2 LYS 81 1HB LYS 81 12.766 -3.994 6.406 598 HB3 LYS 81 2HB LYS 81 11.343 -2.967 6.635 599 HG2 LYS 81 1HG LYS 81 13.076 -2.137 7.982 600 HG3 LYS 81 2HG LYS 81 11.844 -2.823 9.052 601 HD2 LYS 81 1HD LYS 81 13.273 -4.710 9.562 602 HD3 LYS 81 2HD LYS 81 14.354 -4.346 8.219 603 HE2 LYS 81 1HE LYS 81 15.295 -3.690 10.436 604 HE3 LYS 81 2HE LYS 81 15.179 -2.362 9.274 605 HZ1 LYS 81 3HZ LYS 81 13.188 -1.601 10.391 606 HZ2 LYS 81 1HZ LYS 81 14.416 -1.711 11.462 607 HZ3 LYS 81 2HZ LYS 81 13.283 -2.873 11.477 608 H TYR 82 H TYR 82 8.721 -3.997 7.027 609 HA TYR 82 HA TYR 82 8.438 -5.266 4.352 610 HB2 TYR 82 1HB TYR 82 6.382 -4.099 6.224 611 HB3 TYR 82 2HB TYR 82 6.065 -4.635 4.591 612 HD1 TYR 82 2HD TYR 82 6.886 -5.679 8.022 613 HD2 TYR 82 1HD TYR 82 5.998 -7.044 4.035 614 HE1 TYR 82 2HE TYR 82 6.405 -7.930 8.910 615 HE2 TYR 82 1HE TYR 82 5.419 -9.246 4.926 616 HH TYR 82 HH TYR 82 6.321 -10.666 7.369 617 H TYR 83 H TYR 83 7.822 -3.977 2.611 618 HA TYR 83 HA TYR 83 8.168 -1.077 2.967 619 HB2 TYR 83 1HB TYR 83 9.656 -2.765 0.930 620 HB3 TYR 83 2HB TYR 83 9.628 -0.999 0.993 621 HD1 TYR 83 1HD TYR 83 10.707 0.236 2.903 622 HD2 TYR 83 2HD TYR 83 10.951 -4.053 2.535 623 HE1 TYR 83 1HE TYR 83 12.553 0.199 4.548 624 HE2 TYR 83 2HE TYR 83 12.771 -4.108 4.157 625 HH TYR 83 HH TYR 83 14.156 -1.009 5.512 626 H ILE 84 H ILE 84 7.391 0.191 1.295 627 HA ILE 84 HA ILE 84 5.131 -1.040 -0.188 628 HB ILE 84 HB ILE 84 5.253 1.555 1.373 629 HG12 ILE 84 1HG1 ILE 84 3.205 0.593 2.516 630 HG13 ILE 84 2HG1 ILE 84 3.619 -0.976 1.836 631 HG21 ILE 84 1HG2 ILE 84 3.165 0.634 -0.592 632 HG22 ILE 84 2HG2 ILE 84 2.835 1.836 0.683 633 HG23 ILE 84 3HG2 ILE 84 4.057 2.151 -0.539 634 HD11 ILE 84 3HD1 ILE 84 4.259 -0.418 4.242 635 HD12 ILE 84 1HD1 ILE 84 5.481 -1.194 3.251 636 HD13 ILE 84 2HD1 ILE 84 5.566 0.566 3.571 637 H GLU 85 H GLU 85 5.327 -0.850 -2.252 638 HA GLU 85 HA GLU 85 7.225 0.922 -3.496 639 HB2 GLU 85 1HB GLU 85 6.118 -1.543 -4.115 640 HB3 GLU 85 2HB GLU 85 5.041 -0.502 -5.033 641 HG2 GLU 85 1HG GLU 85 8.008 -1.004 -5.366 642 HG3 GLU 85 2HG GLU 85 6.685 -1.269 -6.512 643 H CYS 86 H CYS 86 6.617 2.478 -5.216 644 HA CYS 86 HA CYS 86 4.172 3.764 -5.490 645 HB2 CYS 86 1HB CYS 86 5.629 4.306 -2.971 646 HB3 CYS 86 2HB CYS 86 5.405 5.795 -3.906 647 HG CYS 86 HG CYS 86 3.264 3.425 -3.102 648 HA PRO 87 HA PRO 87 6.998 6.003 -8.370 649 HB2 PRO 87 1HB PRO 87 6.186 8.626 -8.294 650 HB3 PRO 87 2HB PRO 87 5.167 7.364 -9.013 651 HG2 PRO 87 1HG PRO 87 5.064 8.392 -6.163 652 HG3 PRO 87 2HG PRO 87 3.717 8.306 -7.345 653 HD2 PRO 87 1HD PRO 87 4.049 6.362 -5.542 654 HD3 PRO 87 2HD PRO 87 3.680 5.929 -7.223 655 H TYR 88 H TYR 88 8.272 8.484 -8.052 656 HA TYR 88 HA TYR 88 10.440 8.002 -6.704 657 HB2 TYR 88 1HB TYR 88 9.288 10.784 -6.584 658 HB3 TYR 88 2HB TYR 88 10.970 10.334 -6.713 659 HD1 TYR 88 1HD TYR 88 7.785 10.616 -8.599 660 HD2 TYR 88 2HD TYR 88 11.984 9.686 -8.861 661 HE1 TYR 88 1HE TYR 88 7.693 10.965 -11.021 662 HE2 TYR 88 2HE TYR 88 11.939 10.125 -11.267 663 HH TYR 88 HH TYR 88 8.883 11.061 -12.980 664 H LYS 89 H LYS 89 7.636 8.407 -4.918 665 HA LYS 89 HA LYS 89 9.070 9.080 -2.418 666 HB2 LYS 89 1HB LYS 89 6.116 9.282 -3.229 667 HB3 LYS 89 2HB LYS 89 6.639 9.541 -1.599 668 HG2 LYS 89 1HG LYS 89 7.216 11.290 -4.009 669 HG3 LYS 89 2HG LYS 89 6.271 11.655 -2.573 670 HD2 LYS 89 1HD LYS 89 8.117 12.741 -1.871 671 HD3 LYS 89 2HD LYS 89 8.666 11.142 -1.380 672 HE2 LYS 89 1HE LYS 89 9.542 11.119 -3.961 673 HE3 LYS 89 2HE LYS 89 9.472 12.856 -3.747 674 HZ1 LYS 89 3HZ LYS 89 11.656 11.869 -3.128 675 HZ2 LYS 89 1HZ LYS 89 10.928 11.035 -1.915 676 HZ3 LYS 89 2HZ LYS 89 10.979 12.674 -1.880 677 H GLY 90 H GLY 90 8.625 6.350 -3.956 678 HA2 GLY 90 1HA GLY 90 7.321 4.981 -1.769 679 HA3 GLY 90 2HA GLY 90 7.737 4.330 -3.368 680 H ILE 91 H ILE 91 9.162 5.284 -0.225 681 HA ILE 91 HA ILE 91 10.690 2.785 -0.344 682 HB ILE 91 HB ILE 91 12.237 5.187 0.665 683 HG12 ILE 91 1HG1 ILE 91 12.197 4.173 -2.175 684 HG13 ILE 91 2HG1 ILE 91 11.745 5.795 -1.636 685 HG21 ILE 91 1HG2 ILE 91 13.230 2.609 -0.608 686 HG22 ILE 91 2HG2 ILE 91 14.051 3.646 0.595 687 HG23 ILE 91 3HG2 ILE 91 12.685 2.632 1.058 688 HD11 ILE 91 3HD1 ILE 91 13.860 6.516 -1.538 689 HD12 ILE 91 1HD1 ILE 91 14.570 4.947 -1.091 690 HD13 ILE 91 2HD1 ILE 91 14.087 5.250 -2.745 691 H TYR 92 H TYR 92 8.361 3.068 0.930 692 HA TYR 92 HA TYR 92 8.754 4.268 3.573 693 HB2 TYR 92 1HB TYR 92 6.365 2.629 2.693 694 HB3 TYR 92 2HB TYR 92 6.466 3.641 4.095 695 HD1 TYR 92 2HD TYR 92 6.273 3.698 0.325 696 HD2 TYR 92 1HD TYR 92 5.787 5.944 4.010 697 HE1 TYR 92 2HE TYR 92 5.332 5.598 -0.912 698 HE2 TYR 92 1HE TYR 92 4.983 7.835 2.784 699 HH TYR 92 HH TYR 92 4.500 7.774 -0.810 700 H GLU 93 H GLU 93 10.012 3.269 4.960 701 HA GLU 93 HA GLU 93 9.823 0.363 5.389 702 HB2 GLU 93 1HB GLU 93 11.870 1.772 5.969 703 HB3 GLU 93 2HB GLU 93 10.915 2.540 7.241 704 HG2 GLU 93 1HG GLU 93 10.515 0.231 8.210 705 HG3 GLU 93 2HG GLU 93 11.616 -0.418 6.991 706 H ILE 94 H ILE 94 8.172 -0.510 6.394 707 HA ILE 94 HA ILE 94 7.069 0.879 8.755 708 HB ILE 94 HB ILE 94 5.119 -0.578 8.759 709 HG12 ILE 94 1HG1 ILE 94 5.956 -1.431 5.966 710 HG13 ILE 94 2HG1 ILE 94 5.958 -2.402 7.427 711 HG21 ILE 94 1HG2 ILE 94 4.965 1.688 7.948 712 HG22 ILE 94 2HG2 ILE 94 5.311 1.159 6.270 713 HG23 ILE 94 3HG2 ILE 94 3.812 0.676 7.105 714 HD11 ILE 94 3HD1 ILE 94 3.456 -1.277 6.090 715 HD12 ILE 94 1HD1 ILE 94 3.984 -2.962 6.131 716 HD13 ILE 94 2HD1 ILE 94 3.483 -2.147 7.628 717 H GLU 95 H GLU 95 6.749 -0.849 10.531 718 HA GLU 95 HA GLU 95 8.780 -3.005 10.232 719 HB2 GLU 95 1HB GLU 95 9.599 -2.639 12.366 720 HB3 GLU 95 2HB GLU 95 9.569 -1.109 11.484 721 HG2 GLU 95 1HG GLU 95 7.500 -0.472 12.811 722 HG3 GLU 95 2HG GLU 95 7.719 -1.944 13.760 723 H ASN 96 H ASN 96 5.942 -3.014 9.892 724 HA ASN 96 HA ASN 96 5.409 -5.556 11.236 725 HB2 ASN 96 1HB ASN 96 3.331 -3.342 11.125 726 HB3 ASN 96 2HB ASN 96 3.071 -4.963 11.702 727 HD21 ASN 96 1HD2 ASN 96 3.667 -1.874 12.683 728 HD22 ASN 96 2HD2 ASN 96 4.326 -2.176 14.293 729 H ASN 97 H ASN 97 3.535 -6.682 10.169 730 HA ASN 97 HA ASN 97 3.739 -6.413 7.268 731 HB2 ASN 97 1HB ASN 97 3.768 -8.590 8.537 732 HB3 ASN 97 2HB ASN 97 2.134 -8.257 9.065 733 HD21 ASN 97 1HD2 ASN 97 2.950 -7.474 5.618 734 HD22 ASN 97 2HD2 ASN 97 2.135 -8.887 5.017 735 H PHE 98 H PHE 98 2.416 -5.036 6.204 736 HA PHE 98 HA PHE 98 0.122 -3.681 7.110 737 HB2 PHE 98 1HB PHE 98 1.398 -3.049 5.128 738 HB3 PHE 98 2HB PHE 98 1.062 -4.589 4.351 739 HD1 PHE 98 2HD PHE 98 -1.378 -5.168 3.730 740 HD2 PHE 98 1HD PHE 98 0.045 -1.181 4.528 741 HE1 PHE 98 2HE PHE 98 -3.284 -4.290 2.562 742 HE2 PHE 98 1HE PHE 98 -1.907 -0.239 3.306 743 HZ PHE 98 HZ PHE 98 -3.598 -1.792 2.324 744 H GLU 99 H GLU 99 0.443 -6.834 5.415 745 HA GLU 99 HA GLU 99 -2.340 -7.233 4.981 746 HB2 GLU 99 1HB GLU 99 0.008 -9.159 5.075 747 HB3 GLU 99 2HB GLU 99 -1.604 -9.592 4.511 748 HG2 GLU 99 1HG GLU 99 -1.489 -8.096 2.641 749 HG3 GLU 99 2HG GLU 99 -0.061 -7.270 3.244 750 H ASP 100 H ASP 100 -0.504 -7.615 7.887 751 HA ASP 100 HA ASP 100 -2.338 -9.641 9.033 752 HB2 ASP 100 1HB ASP 100 0.216 -9.628 9.238 753 HB3 ASP 100 2HB ASP 100 0.029 -8.275 10.352 754 H MET 101 H MET 101 -1.958 -6.264 8.682 755 HA MET 101 HA MET 101 -3.481 -5.602 11.130 756 HB2 MET 101 1HB MET 101 -1.655 -4.035 9.281 757 HB3 MET 101 2HB MET 101 -2.593 -3.270 10.567 758 HG2 MET 101 1HG MET 101 -0.640 -5.534 11.137 759 HG3 MET 101 2HG MET 101 -0.137 -3.866 10.982 760 HE1 MET 101 3HE MET 101 -1.852 -6.549 13.019 761 HE2 MET 101 1HE MET 101 -2.250 -5.777 14.569 762 HE3 MET 101 2HE MET 101 -3.330 -5.569 13.189 763 H ILE 102 H ILE 102 -4.063 -6.135 7.833 764 HA ILE 102 HA ILE 102 -6.086 -4.054 7.593 765 HB ILE 102 HB ILE 102 -6.761 -5.260 5.488 766 HG12 ILE 102 1HG1 ILE 102 -4.239 -6.891 5.870 767 HG13 ILE 102 2HG1 ILE 102 -5.832 -7.528 6.266 768 HG21 ILE 102 1HG2 ILE 102 -4.961 -4.352 4.229 769 HG22 ILE 102 2HG2 ILE 102 -5.128 -3.340 5.687 770 HG23 ILE 102 3HG2 ILE 102 -3.820 -4.517 5.583 771 HD11 ILE 102 3HD1 ILE 102 -4.899 -6.643 3.505 772 HD12 ILE 102 1HD1 ILE 102 -5.223 -8.297 4.043 773 HD13 ILE 102 2HD1 ILE 102 -6.553 -7.147 3.895 Start of MODEL 13 1 H1 GLY 1 H GLY 1 6.435 13.568 8.973 2 HA2 GLY 1 1HA GLY 1 4.085 13.203 9.561 3 HA3 GLY 1 2HA GLY 1 4.276 14.490 8.362 4 H SER 2 H SER 2 4.295 10.876 8.090 5 HA SER 2 HA SER 2 3.059 9.420 7.038 6 HB2 SER 2 1HB SER 2 0.887 11.448 6.504 7 HB3 SER 2 2HB SER 2 0.732 9.713 6.765 8 HG SER 2 HG SER 2 1.765 10.415 8.978 9 HA PRO 3 HA PRO 3 3.053 10.146 2.454 10 HB2 PRO 3 1HB PRO 3 1.114 8.288 1.731 11 HB3 PRO 3 2HB PRO 3 2.808 7.892 2.058 12 HG2 PRO 3 1HG PRO 3 0.471 7.618 3.895 13 HG3 PRO 3 2HG PRO 3 1.847 6.492 3.613 14 HD2 PRO 3 1HD PRO 3 1.758 8.124 5.766 15 HD3 PRO 3 2HD PRO 3 3.280 7.701 4.944 16 H ILE 4 H ILE 4 1.232 10.470 0.768 17 HA ILE 4 HA ILE 4 -1.174 11.812 1.887 18 HB ILE 4 HB ILE 4 0.116 12.170 -0.864 19 HG12 ILE 4 1HG1 ILE 4 0.072 14.035 1.547 20 HG13 ILE 4 2HG1 ILE 4 1.488 13.211 0.902 21 HG21 ILE 4 1HG2 ILE 4 -2.220 13.668 0.425 22 HG22 ILE 4 2HG2 ILE 4 -1.559 13.931 -1.201 23 HG23 ILE 4 3HG2 ILE 4 -2.379 12.432 -0.842 24 HD11 ILE 4 3HD1 ILE 4 1.219 14.473 -1.245 25 HD12 ILE 4 1HD1 ILE 4 -0.045 15.450 -0.453 26 HD13 ILE 4 2HD1 ILE 4 1.605 15.471 0.171 27 H LEU 5 H LEU 5 -3.049 10.742 1.462 28 HA LEU 5 HA LEU 5 -3.303 8.764 -0.667 29 HB2 LEU 5 1HB LEU 5 -4.630 7.406 0.924 30 HB3 LEU 5 2HB LEU 5 -2.886 7.377 1.002 31 HG LEU 5 HG LEU 5 -4.160 7.190 3.074 32 HD11 LEU 5 1HD1 LEU 5 -2.161 9.425 3.410 33 HD12 LEU 5 2HD1 LEU 5 -1.671 7.800 2.903 34 HD13 LEU 5 3HD1 LEU 5 -2.484 8.018 4.448 35 HD21 LEU 5 3HD2 LEU 5 -5.805 8.936 2.904 36 HD22 LEU 5 1HD2 LEU 5 -4.540 10.188 2.987 37 HD23 LEU 5 2HD2 LEU 5 -4.848 9.123 4.372 38 HA PRO 6 HA PRO 6 -7.131 10.971 -1.365 39 HB2 PRO 6 1HB PRO 6 -8.958 8.826 -1.765 40 HB3 PRO 6 2HB PRO 6 -7.977 9.640 -2.998 41 HG2 PRO 6 1HG PRO 6 -7.518 7.053 -1.568 42 HG3 PRO 6 2HG PRO 6 -7.082 7.497 -3.231 43 HD2 PRO 6 1HD PRO 6 -5.267 7.373 -1.235 44 HD3 PRO 6 2HD PRO 6 -5.123 8.576 -2.537 45 H LYS 7 H LYS 7 -9.670 11.084 -0.534 46 HA LYS 7 HA LYS 7 -9.720 10.922 2.303 47 HB2 LYS 7 1HB LYS 7 -12.073 11.232 0.444 48 HB3 LYS 7 2HB LYS 7 -11.979 11.541 2.169 49 HG2 LYS 7 1HG LYS 7 -11.648 13.621 1.569 50 HG3 LYS 7 2HG LYS 7 -9.961 13.187 1.527 51 HD2 LYS 7 1HD LYS 7 -11.567 12.730 -0.916 52 HD3 LYS 7 2HD LYS 7 -11.399 14.441 -0.487 53 HE2 LYS 7 1HE LYS 7 -8.982 14.349 -0.582 54 HE3 LYS 7 2HE LYS 7 -9.013 12.590 -0.701 55 HZ1 LYS 7 3HZ LYS 7 -8.649 13.275 -2.863 56 HZ2 LYS 7 1HZ LYS 7 -9.733 14.522 -2.783 57 HZ3 LYS 7 2HZ LYS 7 -10.279 13.012 -2.851 58 H ALA 8 H ALA 8 -11.951 9.753 3.091 59 HA ALA 8 HA ALA 8 -11.734 6.879 2.339 60 HB1 ALA 8 1HB ALA 8 -11.998 7.350 4.766 61 HB2 ALA 8 2HB ALA 8 -13.385 8.416 4.437 62 HB3 ALA 8 3HB ALA 8 -13.535 6.699 4.149 63 H GLU 9 H GLU 9 -14.034 9.608 2.006 64 HA GLU 9 HA GLU 9 -15.991 7.596 1.130 65 HB2 GLU 9 1HB GLU 9 -17.561 9.428 1.023 66 HB3 GLU 9 2HB GLU 9 -16.663 9.403 2.550 67 HG2 GLU 9 1HG GLU 9 -15.065 11.135 1.487 68 HG3 GLU 9 2HG GLU 9 -16.230 11.243 0.172 69 H ASN 10 H ASN 10 -13.748 9.671 -0.442 70 HA ASN 10 HA ASN 10 -14.963 9.642 -3.090 71 HB2 ASN 10 1HB ASN 10 -12.900 10.660 -3.791 72 HB3 ASN 10 2HB ASN 10 -13.357 11.395 -2.278 73 HD21 ASN 10 1HD2 ASN 10 -12.198 8.452 -1.293 74 HD22 ASN 10 2HD2 ASN 10 -10.573 8.904 -0.937 75 H VAL 11 H VAL 11 -13.679 7.085 -1.259 76 HA VAL 11 HA VAL 11 -12.321 5.721 -3.477 77 HB VAL 11 HB VAL 11 -12.845 5.165 -0.529 78 HG11 VAL 11 1HG1 VAL 11 -11.694 3.040 -0.766 79 HG12 VAL 11 2HG1 VAL 11 -13.243 3.041 -1.604 80 HG13 VAL 11 3HG1 VAL 11 -11.761 3.229 -2.542 81 HG21 VAL 11 3HG2 VAL 11 -10.294 5.346 -2.204 82 HG22 VAL 11 1HG2 VAL 11 -10.887 6.604 -1.123 83 HG23 VAL 11 2HG2 VAL 11 -10.373 5.057 -0.453 84 H ASP 12 H ASP 12 -13.372 4.350 -4.761 85 HA ASP 12 HA ASP 12 -16.274 3.922 -4.388 86 HB2 ASP 12 1HB ASP 12 -14.314 3.454 -6.629 87 HB3 ASP 12 2HB ASP 12 -15.813 2.537 -6.574 88 H SER 13 H SER 13 -13.327 1.776 -4.865 89 HA SER 13 HA SER 13 -14.033 0.342 -2.485 90 HB2 SER 13 1HB SER 13 -13.909 -1.795 -4.423 91 HB3 SER 13 2HB SER 13 -15.057 -1.477 -3.183 92 HG SER 13 HG SER 13 -16.433 -0.988 -4.548 93 H ILE 14 H ILE 14 -12.120 -0.564 -1.647 94 HA ILE 14 HA ILE 14 -9.672 -0.257 -3.317 95 HB ILE 14 HB ILE 14 -10.162 -0.785 -0.363 96 HG12 ILE 14 1HG1 ILE 14 -8.671 1.332 -1.932 97 HG13 ILE 14 2HG1 ILE 14 -10.278 1.512 -1.251 98 HG21 ILE 14 1HG2 ILE 14 -7.723 -0.939 -0.025 99 HG22 ILE 14 2HG2 ILE 14 -8.275 -2.263 -1.020 100 HG23 ILE 14 3HG2 ILE 14 -7.460 -0.885 -1.782 101 HD11 ILE 14 3HD1 ILE 14 -7.671 1.309 0.294 102 HD12 ILE 14 1HD1 ILE 14 -8.760 2.697 0.163 103 HD13 ILE 14 2HD1 ILE 14 -9.285 1.248 1.045 104 H CYS 15 H CYS 15 -8.488 -1.976 -4.061 105 HA CYS 15 HA CYS 15 -9.548 -4.697 -3.474 106 HB2 CYS 15 1HB CYS 15 -9.666 -3.597 -5.960 107 HB3 CYS 15 2HB CYS 15 -7.992 -4.124 -5.971 108 HG CYS 15 HG CYS 15 -8.999 -6.081 -6.994 109 H ILE 16 H ILE 16 -7.994 -6.184 -2.839 110 HA ILE 16 HA ILE 16 -5.140 -5.510 -3.033 111 HB ILE 16 HB ILE 16 -6.472 -6.420 -0.460 112 HG12 ILE 16 1HG1 ILE 16 -5.111 -3.810 -1.283 113 HG13 ILE 16 2HG1 ILE 16 -6.805 -4.026 -0.834 114 HG21 ILE 16 1HG2 ILE 16 -4.310 -7.532 -0.719 115 HG22 ILE 16 2HG2 ILE 16 -3.532 -5.975 -1.056 116 HG23 ILE 16 3HG2 ILE 16 -4.220 -6.312 0.553 117 HD11 ILE 16 3HD1 ILE 16 -5.697 -2.915 0.951 118 HD12 ILE 16 1HD1 ILE 16 -6.096 -4.555 1.494 119 HD13 ILE 16 2HD1 ILE 16 -4.428 -4.146 1.014 120 H ASP 17 H ASP 17 -4.526 -7.014 -4.357 121 HA ASP 17 HA ASP 17 -5.698 -9.723 -4.581 122 HB2 ASP 17 1HB ASP 17 -4.778 -7.940 -6.481 123 HB3 ASP 17 2HB ASP 17 -3.327 -8.865 -6.205 124 H PHE 18 H PHE 18 -4.844 -11.122 -3.036 125 HA PHE 18 HA PHE 18 -2.427 -10.388 -1.568 126 HB2 PHE 18 1HB PHE 18 -4.417 -12.689 -1.433 127 HB3 PHE 18 2HB PHE 18 -2.970 -12.692 -0.487 128 HD1 PHE 18 1HD PHE 18 -5.988 -10.449 -1.149 129 HD2 PHE 18 2HD PHE 18 -2.963 -11.737 1.660 130 HE1 PHE 18 1HE PHE 18 -6.992 -9.055 0.596 131 HE2 PHE 18 2HE PHE 18 -4.069 -10.410 3.434 132 HZ PHE 18 HZ PHE 18 -6.103 -9.086 2.910 133 H THR 19 H THR 19 -0.881 -12.569 -1.225 134 HA THR 19 HA THR 19 0.480 -12.796 -3.677 135 HB THR 19 HB THR 19 1.667 -14.742 -2.522 136 HG1 THR 19 1HG THR 19 0.696 -15.581 -0.949 137 HG21 THR 19 3HG2 THR 19 1.481 -12.113 -0.998 138 HG22 THR 19 1HG2 THR 19 2.511 -12.456 -2.407 139 HG23 THR 19 2HG2 THR 19 2.784 -13.329 -0.888 140 H ASN 20 H ASN 20 -1.812 -15.124 -2.118 141 HA ASN 20 HA ASN 20 -1.676 -17.142 -4.150 142 HB2 ASN 20 1HB ASN 20 -2.089 -17.349 -1.676 143 HB3 ASN 20 2HB ASN 20 -3.626 -16.521 -1.890 144 HD21 ASN 20 1HD2 ASN 20 -3.956 -18.645 -0.665 145 HD22 ASN 20 2HD2 ASN 20 -4.405 -20.047 -1.599 146 H SER 21 H SER 21 -4.233 -17.778 -4.902 147 HA SER 21 HA SER 21 -4.882 -15.767 -6.880 148 HB2 SER 21 1HB SER 21 -6.566 -17.429 -7.552 149 HB3 SER 21 2HB SER 21 -4.951 -18.137 -7.400 150 HG SER 21 HG SER 21 -6.894 -19.268 -6.462 151 H ILE 22 H ILE 22 -5.382 -15.231 -3.870 152 HA ILE 22 HA ILE 22 -8.339 -15.085 -3.760 153 HB ILE 22 HB ILE 22 -6.428 -14.942 -1.408 154 HG12 ILE 22 1HG1 ILE 22 -7.852 -17.408 -2.563 155 HG13 ILE 22 2HG1 ILE 22 -6.109 -17.166 -2.445 156 HG21 ILE 22 1HG2 ILE 22 -9.393 -15.619 -1.604 157 HG22 ILE 22 2HG2 ILE 22 -8.448 -15.407 -0.104 158 HG23 ILE 22 3HG2 ILE 22 -8.735 -14.026 -1.141 159 HD11 ILE 22 3HD1 ILE 22 -6.299 -17.177 0.047 160 HD12 ILE 22 1HD1 ILE 22 -8.016 -17.628 -0.136 161 HD13 ILE 22 2HD1 ILE 22 -6.757 -18.704 -0.734 162 H GLN 23 H GLN 23 -9.173 -13.120 -3.377 163 HA GLN 23 HA GLN 23 -7.482 -10.742 -3.062 164 HB2 GLN 23 1HB GLN 23 -7.418 -11.160 -5.453 165 HB3 GLN 23 2HB GLN 23 -9.178 -11.305 -5.541 166 HG2 GLN 23 1HG GLN 23 -9.484 -8.976 -5.128 167 HG3 GLN 23 2HG GLN 23 -7.844 -8.772 -4.547 168 HE21 GLN 23 1HE2 GLN 23 -8.519 -10.632 -7.599 169 HE22 GLN 23 2HE2 GLN 23 -8.045 -9.272 -8.600 170 H LYS 24 H LYS 24 -8.637 -9.144 -2.064 171 HA LYS 24 HA LYS 24 -11.468 -9.774 -1.330 172 HB2 LYS 24 1HB LYS 24 -9.150 -9.859 0.326 173 HB3 LYS 24 2HB LYS 24 -9.931 -8.386 0.767 174 HG2 LYS 24 1HG LYS 24 -11.080 -11.174 0.802 175 HG3 LYS 24 2HG LYS 24 -10.546 -10.235 2.173 176 HD2 LYS 24 1HD LYS 24 -12.976 -9.515 0.550 177 HD3 LYS 24 2HD LYS 24 -13.001 -10.511 2.004 178 HE2 LYS 24 1HE LYS 24 -11.540 -8.031 2.530 179 HE3 LYS 24 2HE LYS 24 -13.013 -7.676 1.710 180 HZ1 LYS 24 3HZ LYS 24 -12.653 -8.968 4.336 181 HZ2 LYS 24 1HZ LYS 24 -14.132 -9.036 3.537 182 HZ3 LYS 24 2HZ LYS 24 -13.472 -7.634 4.008 183 H ILE 25 H ILE 25 -12.791 -8.002 -1.405 184 HA ILE 25 HA ILE 25 -11.588 -5.451 -2.376 185 HB ILE 25 HB ILE 25 -14.390 -6.386 -3.063 186 HG12 ILE 25 1HG1 ILE 25 -13.010 -6.016 -5.453 187 HG13 ILE 25 2HG1 ILE 25 -11.774 -6.760 -4.458 188 HG21 ILE 25 1HG2 ILE 25 -14.073 -3.915 -2.821 189 HG22 ILE 25 2HG2 ILE 25 -12.731 -3.989 -3.983 190 HG23 ILE 25 3HG2 ILE 25 -14.377 -4.375 -4.493 191 HD11 ILE 25 3HD1 ILE 25 -13.121 -8.360 -5.816 192 HD12 ILE 25 1HD1 ILE 25 -13.151 -8.716 -4.079 193 HD13 ILE 25 2HD1 ILE 25 -14.555 -7.936 -4.867 194 H TYR 26 H TYR 26 -11.790 -3.905 -1.011 195 HA TYR 26 HA TYR 26 -13.437 -4.177 1.478 196 HB2 TYR 26 1HB TYR 26 -11.146 -2.273 0.807 197 HB3 TYR 26 2HB TYR 26 -11.987 -2.398 2.338 198 HD1 TYR 26 1HD TYR 26 -9.447 -3.938 0.117 199 HD2 TYR 26 2HD TYR 26 -11.505 -4.267 3.892 200 HE1 TYR 26 1HE TYR 26 -8.071 -5.925 0.744 201 HE2 TYR 26 2HE TYR 26 -10.048 -6.148 4.541 202 HH TYR 26 HH TYR 26 -8.416 -7.662 3.860 203 H ASP 27 H ASP 27 -15.370 -3.741 0.133 204 HA ASP 27 HA ASP 27 -15.553 -1.057 -1.168 205 HB2 ASP 27 1HB ASP 27 -16.260 -3.097 -2.444 206 HB3 ASP 27 2HB ASP 27 -17.443 -3.448 -1.223 207 H ASP 28 H ASP 28 -16.598 -2.902 1.615 208 HA ASP 28 HA ASP 28 -18.844 -1.185 2.318 209 HB2 ASP 28 1HB ASP 28 -17.325 -2.664 4.461 210 HB3 ASP 28 2HB ASP 28 -19.053 -2.352 4.288 211 H SER 29 H SER 29 -18.788 0.714 3.628 212 HA SER 29 HA SER 29 -16.557 2.268 3.598 213 HB2 SER 29 1HB SER 29 -18.937 2.955 4.005 214 HB3 SER 29 2HB SER 29 -18.762 2.439 5.693 215 HG SER 29 HG SER 29 -17.495 4.493 4.246 216 H GLU 30 H GLU 30 -17.539 0.253 6.400 217 HA GLU 30 HA GLU 30 -15.388 1.085 8.119 218 HB2 GLU 30 1HB GLU 30 -17.593 0.145 8.847 219 HB3 GLU 30 2HB GLU 30 -17.107 -1.426 8.201 220 HG2 GLU 30 1HG GLU 30 -15.260 -1.550 9.807 221 HG3 GLU 30 2HG GLU 30 -15.682 0.050 10.433 222 H SER 31 H SER 31 -15.569 -1.211 5.456 223 HA SER 31 HA SER 31 -13.285 -2.812 6.304 224 HB2 SER 31 1HB SER 31 -13.460 -3.967 4.283 225 HB3 SER 31 2HB SER 31 -15.105 -3.694 4.732 226 HG SER 31 HG SER 31 -15.035 -1.821 3.270 227 H ILE 32 H ILE 32 -13.863 0.012 4.204 228 HA ILE 32 HA ILE 32 -11.147 0.324 3.312 229 HB ILE 32 HB ILE 32 -13.394 2.350 3.562 230 HG12 ILE 32 1HG1 ILE 32 -12.577 0.882 1.024 231 HG13 ILE 32 2HG1 ILE 32 -13.849 0.269 2.068 232 HG21 ILE 32 1HG2 ILE 32 -10.970 3.242 3.229 233 HG22 ILE 32 2HG2 ILE 32 -11.033 2.483 1.645 234 HG23 ILE 32 3HG2 ILE 32 -12.189 3.762 2.043 235 HD11 ILE 32 3HD1 ILE 32 -14.796 1.542 0.225 236 HD12 ILE 32 1HD1 ILE 32 -15.173 2.299 1.781 237 HD13 ILE 32 2HD1 ILE 32 -13.924 3.000 0.737 238 H GLN 33 H GLN 33 -13.050 1.775 6.038 239 HA GLN 33 HA GLN 33 -11.171 3.640 6.705 240 HB2 GLN 33 1HB GLN 33 -13.688 2.926 7.536 241 HB3 GLN 33 2HB GLN 33 -12.789 2.533 8.975 242 HG2 GLN 33 1HG GLN 33 -12.158 5.199 7.712 243 HG3 GLN 33 2HG GLN 33 -13.825 4.980 8.196 244 HE21 GLN 33 1HE2 GLN 33 -12.243 6.967 9.318 245 HE22 GLN 33 2HE2 GLN 33 -12.097 6.643 11.039 246 H LYS 34 H LYS 34 -11.000 0.299 7.584 247 HA LYS 34 HA LYS 34 -9.035 0.561 9.686 248 HB2 LYS 34 1HB LYS 34 -10.522 -1.486 8.828 249 HB3 LYS 34 2HB LYS 34 -9.148 -1.827 7.811 250 HG2 LYS 34 1HG LYS 34 -8.982 -1.522 10.845 251 HG3 LYS 34 2HG LYS 34 -9.325 -3.012 10.014 252 HD2 LYS 34 1HD LYS 34 -7.148 -3.274 10.404 253 HD3 LYS 34 2HD LYS 34 -7.065 -2.607 8.768 254 HE2 LYS 34 1HE LYS 34 -6.021 -0.716 9.447 255 HE3 LYS 34 2HE LYS 34 -6.911 -0.601 10.970 256 HZ1 LYS 34 3HZ LYS 34 -4.460 -1.108 11.087 257 HZ2 LYS 34 1HZ LYS 34 -4.823 -2.624 10.509 258 HZ3 LYS 34 2HZ LYS 34 -5.430 -2.102 11.944 259 H ILE 35 H ILE 35 -8.823 -0.066 6.170 260 HA ILE 35 HA ILE 35 -6.071 -0.548 6.032 261 HB ILE 35 HB ILE 35 -7.752 0.726 3.840 262 HG12 ILE 35 1HG1 ILE 35 -7.629 -2.274 4.410 263 HG13 ILE 35 2HG1 ILE 35 -8.969 -1.227 4.879 264 HG21 ILE 35 1HG2 ILE 35 -5.448 -1.274 3.743 265 HG22 ILE 35 2HG2 ILE 35 -6.332 -0.668 2.324 266 HG23 ILE 35 3HG2 ILE 35 -5.384 0.449 3.284 267 HD11 ILE 35 3HD1 ILE 35 -8.937 -0.490 2.343 268 HD12 ILE 35 1HD1 ILE 35 -8.235 -2.116 2.150 269 HD13 ILE 35 2HD1 ILE 35 -9.807 -1.865 2.965 270 H LEU 36 H LEU 36 -7.924 2.463 5.641 271 HA LEU 36 HA LEU 36 -5.944 4.323 5.006 272 HB2 LEU 36 1HB LEU 36 -8.524 4.334 6.566 273 HB3 LEU 36 2HB LEU 36 -7.563 5.782 6.566 274 HG LEU 36 HG LEU 36 -9.526 5.420 4.864 275 HD11 LEU 36 1HD1 LEU 36 -6.901 6.630 3.919 276 HD12 LEU 36 2HD1 LEU 36 -8.060 7.415 5.020 277 HD13 LEU 36 3HD1 LEU 36 -8.554 7.043 3.385 278 HD21 LEU 36 3HD2 LEU 36 -8.704 3.351 3.792 279 HD22 LEU 36 1HD2 LEU 36 -7.275 4.226 3.201 280 HD23 LEU 36 2HD2 LEU 36 -8.894 4.682 2.645 281 H SER 37 H SER 37 -6.201 2.626 8.121 282 HA SER 37 HA SER 37 -4.421 4.392 9.598 283 HB2 SER 37 1HB SER 37 -5.836 2.779 10.789 284 HB3 SER 37 2HB SER 37 -5.124 1.439 9.878 285 HG SER 37 HG SER 37 -3.537 1.351 11.131 286 H GLU 38 H GLU 38 -3.920 1.151 8.089 287 HA GLU 38 HA GLU 38 -1.134 1.301 8.470 288 HB2 GLU 38 1HB GLU 38 -2.589 -0.544 6.553 289 HB3 GLU 38 2HB GLU 38 -0.999 -0.789 7.294 290 HG2 GLU 38 1HG GLU 38 -3.736 -0.872 8.584 291 HG3 GLU 38 2HG GLU 38 -2.538 -2.150 8.518 292 H ILE 39 H ILE 39 -3.115 2.330 5.769 293 HA ILE 39 HA ILE 39 -1.079 2.659 3.815 294 HB ILE 39 HB ILE 39 -3.667 4.114 4.386 295 HG12 ILE 39 1HG1 ILE 39 -3.657 1.686 3.628 296 HG13 ILE 39 2HG1 ILE 39 -4.619 2.791 2.649 297 HG21 ILE 39 1HG2 ILE 39 -2.364 5.713 3.192 298 HG22 ILE 39 2HG2 ILE 39 -1.942 4.541 1.934 299 HG23 ILE 39 3HG2 ILE 39 -3.630 5.059 2.147 300 HD11 ILE 39 3HD1 ILE 39 -2.932 2.743 0.880 301 HD12 ILE 39 1HD1 ILE 39 -1.816 1.827 1.927 302 HD13 ILE 39 2HD1 ILE 39 -3.311 1.086 1.359 303 H ALA 40 H ALA 40 -1.674 4.548 6.790 304 HA ALA 40 HA ALA 40 0.167 6.666 5.862 305 HB1 ALA 40 1HB ALA 40 -1.945 7.329 6.950 306 HB2 ALA 40 2HB ALA 40 -1.482 6.414 8.403 307 HB3 ALA 40 3HB ALA 40 -0.535 7.828 7.907 308 H THR 41 H THR 41 0.417 3.701 7.424 309 HA THR 41 HA THR 41 1.879 4.360 9.733 310 HB THR 41 HB THR 41 0.494 2.311 9.118 311 HG1 THR 41 1HG THR 41 1.339 2.403 11.062 312 HG21 THR 41 3HG2 THR 41 1.504 0.416 8.195 313 HG22 THR 41 1HG2 THR 41 3.146 1.020 8.519 314 HG23 THR 41 2HG2 THR 41 2.193 1.709 7.191 315 H GLY 42 H GLY 42 3.118 4.202 6.477 316 HA2 GLY 42 1HA GLY 42 5.829 3.502 7.388 317 HA3 GLY 42 2HA GLY 42 5.209 3.526 5.742 318 H LYS 43 H LYS 43 7.636 4.602 6.686 319 HA LYS 43 HA LYS 43 7.285 7.523 6.143 320 HB2 LYS 43 1HB LYS 43 9.681 7.612 7.062 321 HB3 LYS 43 2HB LYS 43 8.326 7.479 8.158 322 HG2 LYS 43 1HG LYS 43 8.856 4.971 8.322 323 HG3 LYS 43 2HG LYS 43 10.345 5.328 7.449 324 HD2 LYS 43 1HD LYS 43 10.986 6.916 9.238 325 HD3 LYS 43 2HD LYS 43 9.505 6.536 10.135 326 HE2 LYS 43 1HE LYS 43 11.646 4.530 9.334 327 HE3 LYS 43 2HE LYS 43 11.604 5.319 10.907 328 HZ1 LYS 43 3HZ LYS 43 10.594 3.039 10.707 329 HZ2 LYS 43 1HZ LYS 43 9.307 3.730 9.957 330 HZ3 LYS 43 2HZ LYS 43 9.651 4.177 11.474 331 H ARG 44 H ARG 44 7.607 7.790 3.929 332 HA ARG 44 HA ARG 44 9.204 6.071 2.313 333 HB2 ARG 44 1HB ARG 44 9.131 7.792 0.631 334 HB3 ARG 44 2HB ARG 44 7.553 7.490 1.341 335 HG2 ARG 44 1HG ARG 44 8.109 9.498 2.927 336 HG3 ARG 44 2HG ARG 44 9.405 9.867 1.757 337 HD2 ARG 44 1HD ARG 44 7.884 10.190 0.023 338 HD3 ARG 44 2HD ARG 44 6.572 9.358 0.897 339 HE ARG 44 HE ARG 44 7.370 12.174 1.123 340 HH11 ARG 44 1HH1 ARG 44 5.675 9.506 2.703 341 HH12 ARG 44 2HH1 ARG 44 4.840 10.589 3.827 342 HH21 ARG 44 1HH2 ARG 44 6.178 13.498 2.564 343 HH22 ARG 44 2HH2 ARG 44 5.153 12.843 3.780 344 H THR 45 H THR 45 10.182 8.007 4.823 345 HA THR 45 HA THR 45 12.105 8.811 5.578 346 HB THR 45 HB THR 45 14.123 7.702 5.062 347 HG1 THR 45 1HG THR 45 12.930 7.044 2.616 348 HG21 THR 45 3HG2 THR 45 12.215 6.338 6.078 349 HG22 THR 45 1HG2 THR 45 13.534 5.434 5.361 350 HG23 THR 45 2HG2 THR 45 12.022 5.584 4.478 351 H GLU 46 H GLU 46 14.441 9.958 4.216 352 HA GLU 46 HA GLU 46 13.059 11.909 2.451 353 HB2 GLU 46 1HB GLU 46 15.597 12.103 4.083 354 HB3 GLU 46 2HB GLU 46 15.099 13.266 2.860 355 HG2 GLU 46 1HG GLU 46 12.767 13.009 4.341 356 HG3 GLU 46 2HG GLU 46 13.984 12.745 5.572 357 H LYS 47 H LYS 47 14.445 9.038 1.982 358 HA LYS 47 HA LYS 47 16.439 9.639 -0.081 359 HB2 LYS 47 1HB LYS 47 14.728 7.189 0.570 360 HB3 LYS 47 2HB LYS 47 15.961 7.190 -0.674 361 HG2 LYS 47 1HG LYS 47 16.744 7.916 2.145 362 HG3 LYS 47 2HG LYS 47 16.466 6.230 1.729 363 HD2 LYS 47 1HD LYS 47 18.290 7.942 0.011 364 HD3 LYS 47 2HD LYS 47 18.865 7.221 1.529 365 HE2 LYS 47 1HE LYS 47 18.544 5.021 0.823 366 HE3 LYS 47 2HE LYS 47 17.345 5.490 -0.391 367 HZ1 LYS 47 3HZ LYS 47 19.044 6.219 -1.827 368 HZ2 LYS 47 1HZ LYS 47 19.627 4.809 -1.250 369 HZ3 LYS 47 2HZ LYS 47 20.204 6.193 -0.635 370 H GLN 48 H GLN 48 16.205 9.291 -2.232 371 HA GLN 48 HA GLN 48 13.614 9.933 -3.505 372 HB2 GLN 48 1HB GLN 48 15.181 9.916 -5.582 373 HB3 GLN 48 2HB GLN 48 15.285 11.275 -4.461 374 HG2 GLN 48 1HG GLN 48 17.319 10.462 -3.469 375 HG3 GLN 48 2HG GLN 48 17.143 8.892 -4.249 376 HE21 GLN 48 1HE2 GLN 48 18.084 12.257 -4.728 377 HE22 GLN 48 2HE2 GLN 48 18.936 11.904 -6.257 378 H SER 49 H SER 49 12.412 8.328 -4.249 379 HA SER 49 HA SER 49 13.473 5.611 -4.793 380 HB2 SER 49 1HB SER 49 11.241 5.608 -3.852 381 HB3 SER 49 2HB SER 49 10.701 6.863 -4.952 382 HG SER 49 HG SER 49 9.996 4.894 -5.780 383 H ILE 50 H ILE 50 13.552 4.924 -6.952 384 HA ILE 50 HA ILE 50 13.093 6.829 -9.131 385 HB ILE 50 HB ILE 50 15.218 6.288 -10.201 386 HG12 ILE 50 1HG1 ILE 50 15.920 4.768 -7.650 387 HG13 ILE 50 2HG1 ILE 50 15.648 4.061 -9.245 388 HG21 ILE 50 1HG2 ILE 50 15.824 7.344 -7.411 389 HG22 ILE 50 2HG2 ILE 50 16.628 7.756 -8.940 390 HG23 ILE 50 3HG2 ILE 50 14.967 8.271 -8.649 391 HD11 ILE 50 3HD1 ILE 50 17.929 5.859 -8.397 392 HD12 ILE 50 1HD1 ILE 50 18.011 4.174 -8.915 393 HD13 ILE 50 2HD1 ILE 50 17.608 5.436 -10.095 394 H GLN 51 H GLN 51 11.940 4.122 -7.846 395 HA GLN 51 HA GLN 51 12.075 2.435 -10.257 396 HB2 GLN 51 1HB GLN 51 11.129 0.733 -8.657 397 HB3 GLN 51 2HB GLN 51 12.781 1.219 -8.383 398 HG2 GLN 51 1HG GLN 51 12.029 2.733 -6.518 399 HG3 GLN 51 2HG GLN 51 10.368 2.172 -6.767 400 HE21 GLN 51 1HE2 GLN 51 10.922 -0.582 -7.185 401 HE22 GLN 51 2HE2 GLN 51 11.642 -1.284 -5.740 402 H ASP 52 H ASP 52 10.004 1.299 -10.534 403 HA ASP 52 HA ASP 52 7.532 2.880 -9.926 404 HB2 ASP 52 1HB ASP 52 8.702 2.131 -12.573 405 HB3 ASP 52 2HB ASP 52 7.023 1.699 -12.385 406 H TYR 53 H TYR 53 9.183 -0.069 -9.596 407 HA TYR 53 HA TYR 53 6.822 -1.649 -9.019 408 HB2 TYR 53 1HB TYR 53 8.729 -2.233 -11.324 409 HB3 TYR 53 2HB TYR 53 7.933 -3.538 -10.476 410 HD1 TYR 53 1HD TYR 53 7.364 -0.615 -12.646 411 HD2 TYR 53 2HD TYR 53 5.550 -3.970 -10.658 412 HE1 TYR 53 1HE TYR 53 5.229 -0.211 -13.882 413 HE2 TYR 53 2HE TYR 53 3.489 -3.662 -11.970 414 HH TYR 53 HH TYR 53 2.293 -1.820 -13.266 415 HA PRO 54 HA PRO 54 9.877 -3.250 -6.115 416 HB2 PRO 54 1HB PRO 54 8.838 -5.643 -5.363 417 HB3 PRO 54 2HB PRO 54 7.982 -4.100 -5.063 418 HG2 PRO 54 1HG PRO 54 7.540 -6.019 -7.368 419 HG3 PRO 54 2HG PRO 54 6.326 -5.347 -6.225 420 HD2 PRO 54 1HD PRO 54 6.816 -4.217 -8.661 421 HD3 PRO 54 2HD PRO 54 6.423 -3.220 -7.237 422 H SER 55 H SER 55 11.226 -5.369 -5.606 423 HA SER 55 HA SER 55 12.206 -6.595 -8.110 424 HB2 SER 55 1HB SER 55 13.497 -4.983 -6.304 425 HB3 SER 55 2HB SER 55 14.037 -6.601 -5.836 426 HG SER 55 HG SER 55 14.715 -5.026 -7.883 427 H ALA 56 H ALA 56 10.449 -7.243 -5.301 428 HA ALA 56 HA ALA 56 11.410 -9.971 -4.766 429 HB1 ALA 56 1HB ALA 56 10.292 -8.612 -2.997 430 HB2 ALA 56 2HB ALA 56 8.804 -8.582 -3.975 431 HB3 ALA 56 3HB ALA 56 9.419 -10.115 -3.330 432 H GLU 57 H GLU 57 10.350 -11.871 -5.357 433 HA GLU 57 HA GLU 57 8.812 -11.874 -7.866 434 HB2 GLU 57 1HB GLU 57 10.247 -13.785 -6.137 435 HB3 GLU 57 2HB GLU 57 8.665 -14.405 -6.623 436 HG2 GLU 57 1HG GLU 57 9.295 -13.895 -9.013 437 HG3 GLU 57 2HG GLU 57 10.932 -13.523 -8.438 438 H GLU 58 H GLU 58 8.253 -11.937 -4.379 439 HA GLU 58 HA GLU 58 5.373 -12.589 -4.725 440 HB2 GLU 58 1HB GLU 58 7.356 -13.160 -2.498 441 HB3 GLU 58 2HB GLU 58 5.601 -13.240 -2.264 442 HG2 GLU 58 1HG GLU 58 5.326 -14.982 -3.871 443 HG3 GLU 58 2HG GLU 58 6.964 -14.801 -4.480 444 H TYR 59 H TYR 59 4.306 -10.764 -4.755 445 HA TYR 59 HA TYR 59 4.458 -8.952 -2.479 446 HB2 TYR 59 1HB TYR 59 4.095 -7.004 -4.009 447 HB3 TYR 59 2HB TYR 59 5.697 -7.699 -4.124 448 HD1 TYR 59 1HD TYR 59 2.354 -7.548 -5.820 449 HD2 TYR 59 2HD TYR 59 6.555 -8.469 -6.247 450 HE1 TYR 59 1HE TYR 59 2.076 -7.656 -8.257 451 HE2 TYR 59 2HE TYR 59 6.289 -8.538 -8.690 452 HH TYR 59 HH TYR 59 4.678 -8.586 -10.493 453 H GLY 60 H GLY 60 2.277 -7.672 -2.499 454 HA2 GLY 60 1HA GLY 60 0.121 -9.150 -3.924 455 HA3 GLY 60 2HA GLY 60 -0.116 -8.360 -2.373 456 H THR 61 H THR 61 -1.631 -7.556 -4.519 457 HA THR 61 HA THR 61 -0.342 -5.103 -5.655 458 HB THR 61 HB THR 61 -2.267 -7.047 -6.986 459 HG1 THR 61 1HG THR 61 -0.389 -8.026 -6.976 460 HG21 THR 61 3HG2 THR 61 -2.647 -4.868 -7.920 461 HG22 THR 61 1HG2 THR 61 -1.602 -5.740 -9.053 462 HG23 THR 61 2HG2 THR 61 -0.912 -4.505 -7.972 463 H ILE 62 H ILE 62 -1.303 -3.270 -5.132 464 HA ILE 62 HA ILE 62 -4.001 -3.357 -3.898 465 HB ILE 62 HB ILE 62 -1.729 -1.350 -3.574 466 HG12 ILE 62 1HG1 ILE 62 -1.884 -2.391 -1.117 467 HG13 ILE 62 2HG1 ILE 62 -2.443 -3.816 -1.965 468 HG21 ILE 62 1HG2 ILE 62 -4.340 -1.680 -2.060 469 HG22 ILE 62 2HG2 ILE 62 -3.038 -0.517 -1.672 470 HG23 ILE 62 3HG2 ILE 62 -3.935 -0.358 -3.181 471 HD11 ILE 62 3HD1 ILE 62 -0.293 -3.857 -3.252 472 HD12 ILE 62 1HD1 ILE 62 0.174 -2.312 -2.513 473 HD13 ILE 62 2HD1 ILE 62 0.025 -3.784 -1.528 474 H ASN 63 H ASN 63 -5.601 -2.338 -4.973 475 HA ASN 63 HA ASN 63 -4.920 -0.151 -6.897 476 HB2 ASN 63 1HB ASN 63 -7.221 -2.150 -7.101 477 HB3 ASN 63 2HB ASN 63 -6.964 -0.753 -8.131 478 HD21 ASN 63 1HD2 ASN 63 -6.035 -4.117 -7.585 479 HD22 ASN 63 2HD2 ASN 63 -5.087 -4.213 -9.021 480 H ILE 64 H ILE 64 -5.837 1.759 -6.276 481 HA ILE 64 HA ILE 64 -8.186 1.601 -4.460 482 HB ILE 64 HB ILE 64 -6.217 3.894 -4.460 483 HG12 ILE 64 1HG1 ILE 64 -6.552 1.532 -2.540 484 HG13 ILE 64 2HG1 ILE 64 -5.132 1.923 -3.490 485 HG21 ILE 64 1HG2 ILE 64 -7.503 4.749 -2.596 486 HG22 ILE 64 2HG2 ILE 64 -8.590 4.469 -3.960 487 HG23 ILE 64 3HG2 ILE 64 -8.584 3.338 -2.630 488 HD11 ILE 64 3HD1 ILE 64 -6.206 3.430 -1.105 489 HD12 ILE 64 1HD1 ILE 64 -4.655 2.593 -1.272 490 HD13 ILE 64 2HD1 ILE 64 -4.948 4.092 -2.176 491 H GLU 65 H GLU 65 -9.615 1.549 -6.097 492 HA GLU 65 HA GLU 65 -9.964 3.364 -8.337 493 HB2 GLU 65 1HB GLU 65 -10.983 1.037 -8.043 494 HB3 GLU 65 2HB GLU 65 -11.934 1.681 -6.722 495 HG2 GLU 65 1HG GLU 65 -13.387 1.693 -8.555 496 HG3 GLU 65 2HG GLU 65 -12.893 3.378 -8.390 497 H ASN 66 H ASN 66 -10.148 5.551 -7.888 498 HA ASN 66 HA ASN 66 -12.075 6.484 -5.968 499 HB2 ASN 66 1HB ASN 66 -10.655 7.779 -4.558 500 HB3 ASN 66 2HB ASN 66 -10.004 6.153 -4.515 501 HD21 ASN 66 1HD2 ASN 66 -7.933 5.778 -5.867 502 HD22 ASN 66 2HD2 ASN 66 -6.969 7.186 -6.271 503 H ASN 67 H ASN 67 -12.692 8.602 -6.434 504 HA ASN 67 HA ASN 67 -13.018 10.485 -7.668 505 HB2 ASN 67 1HB ASN 67 -9.987 10.489 -7.650 506 HB3 ASN 67 2HB ASN 67 -11.015 11.831 -8.141 507 HD21 ASN 67 1HD2 ASN 67 -9.625 10.265 -5.424 508 HD22 ASN 67 2HD2 ASN 67 -10.509 11.118 -4.174 509 H GLY 68 H GLY 68 -12.952 7.943 -9.326 510 HA2 GLY 68 1HA GLY 68 -13.380 7.510 -11.529 511 HA3 GLY 68 2HA GLY 68 -13.194 9.224 -11.907 512 H GLY 69 H GLY 69 -10.861 7.041 -10.292 513 HA2 GLY 69 1HA GLY 69 -9.264 6.352 -12.536 514 HA3 GLY 69 2HA GLY 69 -8.520 7.687 -11.631 515 H MET 70 H MET 70 -6.881 5.676 -11.276 516 HA MET 70 HA MET 70 -7.512 4.863 -8.571 517 HB2 MET 70 1HB MET 70 -6.852 2.516 -8.832 518 HB3 MET 70 2HB MET 70 -8.332 2.872 -9.738 519 HG2 MET 70 1HG MET 70 -5.517 2.534 -10.826 520 HG3 MET 70 2HG MET 70 -6.827 1.384 -10.925 521 HE1 MET 70 3HE MET 70 -8.996 1.685 -12.485 522 HE2 MET 70 1HE MET 70 -9.354 3.293 -11.820 523 HE3 MET 70 2HE MET 70 -9.248 3.060 -13.572 524 H THR 71 H THR 71 -5.817 4.328 -7.277 525 HA THR 71 HA THR 71 -3.106 5.046 -8.306 526 HB THR 71 HB THR 71 -4.159 5.702 -5.907 527 HG1 THR 71 1HG THR 71 -1.996 5.757 -5.178 528 HG21 THR 71 3HG2 THR 71 -4.473 3.213 -5.343 529 HG22 THR 71 1HG2 THR 71 -3.658 4.236 -4.128 530 HG23 THR 71 2HG2 THR 71 -2.747 3.119 -5.169 531 H THR 72 H THR 72 -1.443 3.463 -7.838 532 HA THR 72 HA THR 72 -2.205 0.624 -7.590 533 HB THR 72 HB THR 72 -0.114 1.647 -9.515 534 HG1 THR 72 1HG THR 72 -2.604 0.788 -10.506 535 HG21 THR 72 3HG2 THR 72 0.155 -0.704 -8.918 536 HG22 THR 72 1HG2 THR 72 -0.392 -0.575 -10.590 537 HG23 THR 72 2HG2 THR 72 -1.546 -1.038 -9.317 538 H MET 73 H MET 73 -0.556 -0.528 -6.340 539 HA MET 73 HA MET 73 2.121 0.381 -6.078 540 HB2 MET 73 1HB MET 73 2.129 0.646 -3.581 541 HB3 MET 73 2HB MET 73 1.442 1.962 -4.494 542 HG2 MET 73 1HG MET 73 -0.876 0.884 -3.973 543 HG3 MET 73 2HG MET 73 0.003 -0.070 -2.787 544 HE1 MET 73 3HE MET 73 -0.819 4.457 -2.823 545 HE2 MET 73 1HE MET 73 0.667 3.918 -3.636 546 HE3 MET 73 2HE MET 73 -0.894 3.298 -4.174 547 H PHE 74 H PHE 74 3.289 -1.189 -4.558 548 HA PHE 74 HA PHE 74 1.945 -3.814 -4.252 549 HB2 PHE 74 1HB PHE 74 4.690 -3.367 -5.487 550 HB3 PHE 74 2HB PHE 74 3.840 -4.888 -5.326 551 HD1 PHE 74 2HD PHE 74 1.893 -5.410 -6.834 552 HD2 PHE 74 1HD PHE 74 4.211 -1.804 -7.308 553 HE1 PHE 74 2HE PHE 74 1.030 -5.152 -9.132 554 HE2 PHE 74 1HE PHE 74 3.296 -1.507 -9.577 555 HZ PHE 74 HZ PHE 74 1.679 -3.178 -10.497 556 H TYR 75 H TYR 75 2.815 -4.977 -2.351 557 HA TYR 75 HA TYR 75 5.088 -3.613 -0.990 558 HB2 TYR 75 1HB TYR 75 3.086 -4.973 0.717 559 HB3 TYR 75 2HB TYR 75 4.137 -3.650 1.072 560 HD1 TYR 75 1HD TYR 75 3.235 -1.593 -0.992 561 HD2 TYR 75 2HD TYR 75 1.039 -4.328 1.491 562 HE1 TYR 75 1HE TYR 75 1.379 0.041 -0.869 563 HE2 TYR 75 2HE TYR 75 -0.825 -2.746 1.563 564 HH TYR 75 HH TYR 75 -1.468 -0.694 1.183 565 H TYR 76 H TYR 76 6.371 -5.023 0.335 566 HA TYR 76 HA TYR 76 6.167 -7.901 0.030 567 HB2 TYR 76 1HB TYR 76 8.376 -8.093 -1.137 568 HB3 TYR 76 2HB TYR 76 7.084 -7.495 -2.133 569 HD1 TYR 76 1HD TYR 76 6.908 -4.979 -2.575 570 HD2 TYR 76 2HD TYR 76 10.445 -6.828 -0.923 571 HE1 TYR 76 1HE TYR 76 8.143 -2.843 -2.848 572 HE2 TYR 76 2HE TYR 76 11.687 -4.718 -1.255 573 HH TYR 76 HH TYR 76 11.288 -2.408 -1.363 574 H GLU 77 H GLU 77 8.598 -8.678 0.948 575 HA GLU 77 HA GLU 77 9.324 -6.963 3.304 576 HB2 GLU 77 1HB GLU 77 8.268 -9.319 3.676 577 HB3 GLU 77 2HB GLU 77 9.743 -9.957 2.957 578 HG2 GLU 77 1HG GLU 77 11.060 -8.748 4.744 579 HG3 GLU 77 2HG GLU 77 9.539 -8.247 5.481 580 H GLU 78 H GLU 78 11.514 -6.507 3.593 581 HA GLU 78 HA GLU 78 13.391 -7.771 1.757 582 HB2 GLU 78 1HB GLU 78 12.470 -5.822 0.539 583 HB3 GLU 78 2HB GLU 78 13.164 -4.751 1.764 584 HG2 GLU 78 1HG GLU 78 15.271 -5.010 0.947 585 HG3 GLU 78 2HG GLU 78 15.089 -6.740 0.778 586 H ASN 79 H ASN 79 14.770 -8.641 3.088 587 HA ASN 79 HA ASN 79 16.459 -8.889 4.518 588 HB2 ASN 79 1HB ASN 79 16.760 -6.150 3.709 589 HB3 ASN 79 2HB ASN 79 17.113 -6.239 5.425 590 HD21 ASN 79 1HD2 ASN 79 18.400 -6.670 2.324 591 HD22 ASN 79 2HD2 ASN 79 19.792 -7.619 2.773 592 H GLY 80 H GLY 80 13.505 -8.013 5.526 593 HA2 GLY 80 1HA GLY 80 12.903 -9.192 7.561 594 HA3 GLY 80 2HA GLY 80 14.239 -8.413 8.396 595 H LYS 81 H LYS 81 13.045 -5.941 6.495 596 HA LYS 81 HA LYS 81 10.787 -5.258 8.294 597 HB2 LYS 81 1HB LYS 81 13.015 -3.646 7.134 598 HB3 LYS 81 2HB LYS 81 11.409 -3.014 6.791 599 HG2 LYS 81 1HG LYS 81 12.112 -2.007 8.792 600 HG3 LYS 81 2HG LYS 81 10.829 -3.150 9.197 601 HD2 LYS 81 1HD LYS 81 12.396 -3.376 10.915 602 HD3 LYS 81 2HD LYS 81 12.692 -4.789 9.896 603 HE2 LYS 81 1HE LYS 81 14.599 -3.600 8.814 604 HE3 LYS 81 2HE LYS 81 14.229 -2.150 9.771 605 HZ1 LYS 81 3HZ LYS 81 14.653 -3.520 11.767 606 HZ2 LYS 81 1HZ LYS 81 15.966 -3.276 10.828 607 HZ3 LYS 81 2HZ LYS 81 15.212 -4.738 10.761 608 H TYR 82 H TYR 82 8.912 -4.373 7.153 609 HA TYR 82 HA TYR 82 8.680 -5.382 4.366 610 HB2 TYR 82 1HB TYR 82 6.621 -4.400 6.343 611 HB3 TYR 82 2HB TYR 82 6.275 -4.865 4.688 612 HD1 TYR 82 2HD TYR 82 6.438 -7.269 4.001 613 HD2 TYR 82 1HD TYR 82 7.036 -6.019 8.092 614 HE1 TYR 82 2HE TYR 82 6.095 -9.600 4.774 615 HE2 TYR 82 1HE TYR 82 6.635 -8.315 8.870 616 HH TYR 82 HH TYR 82 6.575 -10.613 8.091 617 H TYR 83 H TYR 83 7.947 -3.940 2.708 618 HA TYR 83 HA TYR 83 8.017 -1.092 3.321 619 HB2 TYR 83 1HB TYR 83 9.749 -2.275 1.120 620 HB3 TYR 83 2HB TYR 83 9.574 -0.577 1.483 621 HD1 TYR 83 1HD TYR 83 10.959 -3.783 2.836 622 HD2 TYR 83 2HD TYR 83 10.938 0.509 3.142 623 HE1 TYR 83 1HE TYR 83 12.801 -3.979 4.208 624 HE2 TYR 83 2HE TYR 83 12.832 0.377 4.739 625 HH TYR 83 HH TYR 83 14.565 -2.674 5.394 626 H ILE 84 H ILE 84 7.374 0.194 1.489 627 HA ILE 84 HA ILE 84 5.361 -1.164 -0.256 628 HB ILE 84 HB ILE 84 5.240 1.511 1.180 629 HG12 ILE 84 1HG1 ILE 84 2.951 0.493 1.889 630 HG13 ILE 84 2HG1 ILE 84 3.683 -1.052 1.476 631 HG21 ILE 84 1HG2 ILE 84 2.958 1.740 0.048 632 HG22 ILE 84 2HG2 ILE 84 4.409 2.126 -0.865 633 HG23 ILE 84 3HG2 ILE 84 3.594 0.592 -1.141 634 HD11 ILE 84 3HD1 ILE 84 5.228 -0.935 3.218 635 HD12 ILE 84 1HD1 ILE 84 4.997 0.829 3.429 636 HD13 ILE 84 2HD1 ILE 84 3.716 -0.310 3.873 637 H GLU 85 H GLU 85 5.720 -0.960 -2.378 638 HA GLU 85 HA GLU 85 7.748 0.781 -3.488 639 HB2 GLU 85 1HB GLU 85 7.121 -1.446 -4.460 640 HB3 GLU 85 2HB GLU 85 5.478 -0.857 -4.717 641 HG2 GLU 85 1HG GLU 85 7.888 0.396 -6.085 642 HG3 GLU 85 2HG GLU 85 7.013 -1.003 -6.734 643 H CYS 86 H CYS 86 7.305 2.463 -4.913 644 HA CYS 86 HA CYS 86 4.931 3.435 -5.749 645 HB2 CYS 86 1HB CYS 86 5.729 4.537 -3.110 646 HB3 CYS 86 2HB CYS 86 5.483 5.794 -4.325 647 HG CYS 86 HG CYS 86 3.547 3.216 -3.683 648 HA PRO 87 HA PRO 87 8.019 5.702 -8.292 649 HB2 PRO 87 1HB PRO 87 6.862 8.085 -8.855 650 HB3 PRO 87 2HB PRO 87 6.207 6.550 -9.497 651 HG2 PRO 87 1HG PRO 87 5.325 8.004 -6.971 652 HG3 PRO 87 2HG PRO 87 4.302 7.486 -8.359 653 HD2 PRO 87 1HD PRO 87 4.518 5.927 -6.199 654 HD3 PRO 87 2HD PRO 87 4.571 5.221 -7.815 655 H TYR 88 H TYR 88 8.794 8.349 -8.089 656 HA TYR 88 HA TYR 88 10.702 8.520 -6.406 657 HB2 TYR 88 1HB TYR 88 8.905 10.932 -6.798 658 HB3 TYR 88 2HB TYR 88 10.612 10.955 -6.411 659 HD1 TYR 88 2HD TYR 88 8.178 10.347 -9.162 660 HD2 TYR 88 1HD TYR 88 12.360 10.500 -8.027 661 HE1 TYR 88 2HE TYR 88 8.837 10.327 -11.537 662 HE2 TYR 88 1HE TYR 88 12.981 10.583 -10.394 663 HH TYR 88 HH TYR 88 10.668 10.093 -13.021 664 H LYS 89 H LYS 89 7.572 8.413 -4.994 665 HA LYS 89 HA LYS 89 8.793 9.013 -2.382 666 HB2 LYS 89 1HB LYS 89 5.885 9.472 -3.116 667 HB3 LYS 89 2HB LYS 89 6.513 9.560 -1.501 668 HG2 LYS 89 1HG LYS 89 7.367 11.604 -1.784 669 HG3 LYS 89 2HG LYS 89 8.210 11.207 -3.223 670 HD2 LYS 89 1HD LYS 89 5.292 11.966 -3.076 671 HD3 LYS 89 2HD LYS 89 6.612 13.011 -3.642 672 HE2 LYS 89 1HE LYS 89 7.154 11.436 -5.438 673 HE3 LYS 89 2HE LYS 89 5.947 10.299 -4.856 674 HZ1 LYS 89 3HZ LYS 89 5.490 12.914 -6.131 675 HZ2 LYS 89 1HZ LYS 89 4.280 12.147 -5.287 676 HZ3 LYS 89 2HZ LYS 89 4.955 11.461 -6.634 677 H GLY 90 H GLY 90 9.280 6.541 -3.360 678 HA2 GLY 90 1HA GLY 90 7.389 4.787 -1.872 679 HA3 GLY 90 2HA GLY 90 8.013 4.451 -3.493 680 H ILE 91 H ILE 91 9.286 5.337 -0.271 681 HA ILE 91 HA ILE 91 10.864 2.844 -0.231 682 HB ILE 91 HB ILE 91 12.121 5.496 0.575 683 HG12 ILE 91 1HG1 ILE 91 12.350 3.994 -2.053 684 HG13 ILE 91 2HG1 ILE 91 11.826 5.667 -1.800 685 HG21 ILE 91 1HG2 ILE 91 12.795 3.117 1.509 686 HG22 ILE 91 2HG2 ILE 91 13.533 2.901 -0.073 687 HG23 ILE 91 3HG2 ILE 91 14.068 4.238 0.981 688 HD11 ILE 91 3HD1 ILE 91 14.160 5.263 -2.754 689 HD12 ILE 91 1HD1 ILE 91 13.959 6.455 -1.466 690 HD13 ILE 91 2HD1 ILE 91 14.675 4.851 -1.134 691 H TYR 92 H TYR 92 8.480 3.022 0.882 692 HA TYR 92 HA TYR 92 8.559 4.309 3.507 693 HB2 TYR 92 1HB TYR 92 6.484 2.387 2.535 694 HB3 TYR 92 2HB TYR 92 6.385 3.375 3.954 695 HD1 TYR 92 1HD TYR 92 6.241 3.442 0.232 696 HD2 TYR 92 2HD TYR 92 5.849 5.708 3.889 697 HE1 TYR 92 1HE TYR 92 5.195 5.250 -0.995 698 HE2 TYR 92 2HE TYR 92 4.938 7.594 2.656 699 HH TYR 92 HH TYR 92 4.120 7.318 -0.821 700 H GLU 93 H GLU 93 9.822 3.515 5.059 701 HA GLU 93 HA GLU 93 10.003 0.592 5.467 702 HB2 GLU 93 1HB GLU 93 11.868 2.203 6.023 703 HB3 GLU 93 2HB GLU 93 10.816 2.965 7.195 704 HG2 GLU 93 1HG GLU 93 10.745 0.259 7.949 705 HG3 GLU 93 2HG GLU 93 12.400 0.475 7.377 706 H ILE 94 H ILE 94 8.388 -0.483 6.359 707 HA ILE 94 HA ILE 94 6.890 0.718 8.617 708 HB ILE 94 HB ILE 94 4.973 -0.628 8.233 709 HG12 ILE 94 1HG1 ILE 94 6.206 -1.709 5.679 710 HG13 ILE 94 2HG1 ILE 94 6.085 -2.572 7.211 711 HG21 ILE 94 1HG2 ILE 94 5.721 0.869 5.688 712 HG22 ILE 94 2HG2 ILE 94 4.075 0.443 6.198 713 HG23 ILE 94 3HG2 ILE 94 5.030 1.530 7.193 714 HD11 ILE 94 3HD1 ILE 94 3.704 -1.650 5.564 715 HD12 ILE 94 1HD1 ILE 94 4.287 -3.300 5.770 716 HD13 ILE 94 2HD1 ILE 94 3.620 -2.412 7.157 717 H GLU 95 H GLU 95 6.071 -1.419 9.985 718 HA GLU 95 HA GLU 95 8.464 -3.151 10.308 719 HB2 GLU 95 1HB GLU 95 8.579 -2.567 12.621 720 HB3 GLU 95 2HB GLU 95 8.629 -1.115 11.617 721 HG2 GLU 95 1HG GLU 95 6.116 -0.839 12.126 722 HG3 GLU 95 2HG GLU 95 6.327 -2.095 13.352 723 H ASN 96 H ASN 96 5.443 -3.361 9.600 724 HA ASN 96 HA ASN 96 5.077 -5.947 10.892 725 HB2 ASN 96 1HB ASN 96 2.685 -4.119 10.445 726 HB3 ASN 96 2HB ASN 96 2.766 -5.605 11.359 727 HD21 ASN 96 1HD2 ASN 96 2.904 -2.223 11.475 728 HD22 ASN 96 2HD2 ASN 96 3.270 -2.022 13.174 729 H ASN 97 H ASN 97 3.319 -7.247 9.583 730 HA ASN 97 HA ASN 97 3.733 -6.746 6.720 731 HB2 ASN 97 1HB ASN 97 3.738 -9.074 7.641 732 HB3 ASN 97 2HB ASN 97 2.089 -8.842 8.197 733 HD21 ASN 97 1HD2 ASN 97 4.145 -8.849 5.267 734 HD22 ASN 97 2HD2 ASN 97 2.815 -9.195 4.165 735 H PHE 98 H PHE 98 2.294 -5.534 5.535 736 HA PHE 98 HA PHE 98 0.197 -4.082 6.828 737 HB2 PHE 98 1HB PHE 98 1.472 -3.284 4.863 738 HB3 PHE 98 2HB PHE 98 0.781 -4.555 3.879 739 HD1 PHE 98 1HD PHE 98 -1.836 -4.603 3.600 740 HD2 PHE 98 2HD PHE 98 0.471 -1.147 4.778 741 HE1 PHE 98 1HE PHE 98 -3.601 -3.156 2.760 742 HE2 PHE 98 2HE PHE 98 -1.307 0.319 3.914 743 HZ PHE 98 HZ PHE 98 -3.358 -0.661 2.898 744 H GLU 99 H GLU 99 0.153 -6.932 4.614 745 HA GLU 99 HA GLU 99 -2.681 -7.077 4.480 746 HB2 GLU 99 1HB GLU 99 -0.370 -8.814 3.655 747 HB3 GLU 99 2HB GLU 99 -2.017 -9.457 3.556 748 HG2 GLU 99 1HG GLU 99 -2.765 -7.728 2.097 749 HG3 GLU 99 2HG GLU 99 -1.372 -6.704 2.456 750 H ASP 100 H ASP 100 -0.649 -7.931 7.054 751 HA ASP 100 HA ASP 100 -2.441 -9.995 8.185 752 HB2 ASP 100 1HB ASP 100 0.034 -10.207 8.347 753 HB3 ASP 100 2HB ASP 100 0.098 -8.656 9.188 754 H MET 101 H MET 101 -2.090 -6.605 8.081 755 HA MET 101 HA MET 101 -3.251 -6.110 10.765 756 HB2 MET 101 1HB MET 101 -1.592 -4.510 8.787 757 HB3 MET 101 2HB MET 101 -2.444 -3.733 10.118 758 HG2 MET 101 1HG MET 101 -0.632 -6.091 10.666 759 HG3 MET 101 2HG MET 101 0.001 -4.470 10.447 760 HE1 MET 101 3HE MET 101 0.138 -4.054 14.221 761 HE2 MET 101 1HE MET 101 0.890 -5.202 13.090 762 HE3 MET 101 2HE MET 101 0.728 -3.479 12.652 763 H ILE 102 H ILE 102 -4.344 -6.429 7.618 764 HA ILE 102 HA ILE 102 -6.527 -4.433 7.901 765 HB ILE 102 HB ILE 102 -7.040 -5.119 5.523 766 HG12 ILE 102 1HG1 ILE 102 -4.386 -6.599 5.730 767 HG13 ILE 102 2HG1 ILE 102 -5.954 -7.337 5.480 768 HG21 ILE 102 1HG2 ILE 102 -5.695 -3.083 6.125 769 HG22 ILE 102 2HG2 ILE 102 -4.215 -4.040 5.899 770 HG23 ILE 102 3HG2 ILE 102 -5.297 -3.748 4.531 771 HD11 ILE 102 3HD1 ILE 102 -4.374 -5.596 3.546 772 HD12 ILE 102 1HD1 ILE 102 -4.852 -7.281 3.359 773 HD13 ILE 102 2HD1 ILE 102 -6.079 -6.006 3.286 Start of MODEL 14 1 H1 GLY 1 H GLY 1 7.879 12.577 6.560 2 HA2 GLY 1 1HA GLY 1 7.218 9.786 7.284 3 HA3 GLY 1 2HA GLY 1 6.804 11.158 8.326 4 H SER 2 H SER 2 4.669 9.900 7.828 5 HA SER 2 HA SER 2 2.616 9.882 6.984 6 HB2 SER 2 1HB SER 2 3.272 12.081 8.255 7 HB3 SER 2 2HB SER 2 2.814 12.842 6.726 8 HG SER 2 HG SER 2 0.786 12.037 6.927 9 HA PRO 3 HA PRO 3 3.226 10.013 2.374 10 HB2 PRO 3 1HB PRO 3 1.285 8.113 1.812 11 HB3 PRO 3 2HB PRO 3 2.981 7.734 2.153 12 HG2 PRO 3 1HG PRO 3 0.641 7.610 4.011 13 HG3 PRO 3 2HG PRO 3 2.001 6.461 3.848 14 HD2 PRO 3 1HD PRO 3 1.869 8.315 5.833 15 HD3 PRO 3 2HD PRO 3 3.409 7.770 5.119 16 H ILE 4 H ILE 4 1.568 10.450 0.666 17 HA ILE 4 HA ILE 4 -0.843 11.830 1.725 18 HB ILE 4 HB ILE 4 0.577 12.056 -0.965 19 HG12 ILE 4 1HG1 ILE 4 0.287 13.963 1.419 20 HG13 ILE 4 2HG1 ILE 4 1.769 13.153 0.923 21 HG21 ILE 4 1HG2 ILE 4 -1.910 13.505 0.086 22 HG22 ILE 4 2HG2 ILE 4 -1.095 13.814 -1.461 23 HG23 ILE 4 3HG2 ILE 4 -1.892 12.275 -1.202 24 HD11 ILE 4 3HD1 ILE 4 1.918 15.403 0.197 25 HD12 ILE 4 1HD1 ILE 4 1.712 14.380 -1.239 26 HD13 ILE 4 2HD1 ILE 4 0.345 15.338 -0.607 27 H LEU 5 H LEU 5 -2.782 10.931 1.278 28 HA LEU 5 HA LEU 5 -3.084 8.530 -0.343 29 HB2 LEU 5 1HB LEU 5 -4.325 7.595 1.713 30 HB3 LEU 5 2HB LEU 5 -2.575 7.558 1.673 31 HG LEU 5 HG LEU 5 -3.445 9.992 3.032 32 HD11 LEU 5 1HD1 LEU 5 -5.434 8.784 3.671 33 HD12 LEU 5 2HD1 LEU 5 -4.365 8.984 5.056 34 HD13 LEU 5 3HD1 LEU 5 -4.455 7.403 4.248 35 HD21 LEU 5 3HD2 LEU 5 -1.203 8.850 3.173 36 HD22 LEU 5 1HD2 LEU 5 -1.961 7.554 4.124 37 HD23 LEU 5 2HD2 LEU 5 -1.926 9.213 4.747 38 HA PRO 6 HA PRO 6 -6.861 10.671 -1.232 39 HB2 PRO 6 1HB PRO 6 -8.620 8.646 -1.864 40 HB3 PRO 6 2HB PRO 6 -7.222 9.087 -2.881 41 HG2 PRO 6 1HG PRO 6 -7.425 6.871 -0.819 42 HG3 PRO 6 2HG PRO 6 -6.796 6.782 -2.506 43 HD2 PRO 6 1HD PRO 6 -5.148 7.056 -0.370 44 HD3 PRO 6 2HD PRO 6 -4.807 7.836 -1.939 45 H LYS 7 H LYS 7 -9.368 10.800 -0.590 46 HA LYS 7 HA LYS 7 -9.642 10.492 2.256 47 HB2 LYS 7 1HB LYS 7 -11.838 11.116 0.230 48 HB3 LYS 7 2HB LYS 7 -11.779 11.490 1.955 49 HG2 LYS 7 1HG LYS 7 -11.187 13.541 1.207 50 HG3 LYS 7 2HG LYS 7 -9.584 12.842 1.229 51 HD2 LYS 7 1HD LYS 7 -9.748 13.887 -0.920 52 HD3 LYS 7 2HD LYS 7 -10.089 12.165 -1.223 53 HE2 LYS 7 1HE LYS 7 -11.769 13.151 -2.415 54 HE3 LYS 7 2HE LYS 7 -12.557 12.775 -0.880 55 HZ1 LYS 7 3HZ LYS 7 -11.470 15.422 -1.602 56 HZ2 LYS 7 1HZ LYS 7 -12.492 15.045 -0.321 57 HZ3 LYS 7 2HZ LYS 7 -13.002 14.954 -1.877 58 H ALA 8 H ALA 8 -11.309 9.250 3.247 59 HA ALA 8 HA ALA 8 -11.667 6.541 2.146 60 HB1 ALA 8 1HB ALA 8 -11.239 7.232 4.650 61 HB2 ALA 8 2HB ALA 8 -12.929 7.679 4.677 62 HB3 ALA 8 3HB ALA 8 -12.480 6.005 4.342 63 H GLU 9 H GLU 9 -13.147 9.246 1.316 64 HA GLU 9 HA GLU 9 -15.905 8.120 1.225 65 HB2 GLU 9 1HB GLU 9 -16.793 10.192 2.004 66 HB3 GLU 9 2HB GLU 9 -15.549 9.630 3.128 67 HG2 GLU 9 1HG GLU 9 -13.959 11.145 1.611 68 HG3 GLU 9 2HG GLU 9 -15.468 11.875 1.133 69 H ASN 10 H ASN 10 -13.367 8.943 -0.646 70 HA ASN 10 HA ASN 10 -15.066 9.615 -2.935 71 HB2 ASN 10 1HB ASN 10 -13.555 11.032 -3.764 72 HB3 ASN 10 2HB ASN 10 -13.440 11.429 -2.068 73 HD21 ASN 10 1HD2 ASN 10 -11.665 8.906 -1.594 74 HD22 ASN 10 2HD2 ASN 10 -10.177 9.275 -2.398 75 H VAL 11 H VAL 11 -13.506 7.158 -1.442 76 HA VAL 11 HA VAL 11 -12.245 5.892 -3.776 77 HB VAL 11 HB VAL 11 -12.827 5.225 -0.877 78 HG11 VAL 11 1HG1 VAL 11 -13.237 3.094 -2.045 79 HG12 VAL 11 2HG1 VAL 11 -11.692 3.249 -2.907 80 HG13 VAL 11 3HG1 VAL 11 -11.729 3.043 -1.144 81 HG21 VAL 11 3HG2 VAL 11 -10.365 5.007 -0.806 82 HG22 VAL 11 1HG2 VAL 11 -10.311 5.413 -2.543 83 HG23 VAL 11 2HG2 VAL 11 -10.874 6.600 -1.380 84 H ASP 12 H ASP 12 -13.245 4.202 -4.914 85 HA ASP 12 HA ASP 12 -16.228 3.932 -4.706 86 HB2 ASP 12 1HB ASP 12 -15.367 4.087 -7.020 87 HB3 ASP 12 2HB ASP 12 -14.225 2.776 -6.672 88 H SER 13 H SER 13 -13.275 1.895 -5.071 89 HA SER 13 HA SER 13 -13.898 0.424 -2.611 90 HB2 SER 13 1HB SER 13 -13.845 -1.768 -3.946 91 HB3 SER 13 2HB SER 13 -15.322 -0.806 -4.054 92 HG SER 13 HG SER 13 -14.802 -0.122 -6.065 93 H ILE 14 H ILE 14 -12.132 -1.322 -2.298 94 HA ILE 14 HA ILE 14 -9.606 -0.572 -3.658 95 HB ILE 14 HB ILE 14 -9.836 -1.350 -0.730 96 HG12 ILE 14 1HG1 ILE 14 -9.369 1.351 -2.013 97 HG13 ILE 14 2HG1 ILE 14 -10.772 0.882 -1.067 98 HG21 ILE 14 1HG2 ILE 14 -7.448 -0.511 -2.425 99 HG22 ILE 14 2HG2 ILE 14 -7.402 -0.815 -0.673 100 HG23 ILE 14 3HG2 ILE 14 -7.763 -2.123 -1.780 101 HD11 ILE 14 3HD1 ILE 14 -9.325 2.310 0.207 102 HD12 ILE 14 1HD1 ILE 14 -9.454 0.696 0.961 103 HD13 ILE 14 2HD1 ILE 14 -7.982 1.179 0.079 104 H CYS 15 H CYS 15 -8.686 -2.303 -4.570 105 HA CYS 15 HA CYS 15 -9.729 -5.004 -3.851 106 HB2 CYS 15 1HB CYS 15 -9.907 -4.161 -6.286 107 HB3 CYS 15 2HB CYS 15 -8.135 -4.390 -6.380 108 HG CYS 15 HG CYS 15 -8.120 -6.810 -6.448 109 H ILE 16 H ILE 16 -8.304 -6.340 -2.846 110 HA ILE 16 HA ILE 16 -5.409 -5.819 -3.096 111 HB ILE 16 HB ILE 16 -6.805 -6.659 -0.538 112 HG12 ILE 16 1HG1 ILE 16 -5.421 -4.100 -1.446 113 HG13 ILE 16 2HG1 ILE 16 -7.086 -4.266 -0.889 114 HG21 ILE 16 1HG2 ILE 16 -3.860 -6.161 -1.044 115 HG22 ILE 16 2HG2 ILE 16 -4.599 -6.776 0.453 116 HG23 ILE 16 3HG2 ILE 16 -4.583 -7.783 -0.985 117 HD11 ILE 16 3HD1 ILE 16 -4.568 -4.455 0.785 118 HD12 ILE 16 1HD1 ILE 16 -5.774 -3.167 0.799 119 HD13 ILE 16 2HD1 ILE 16 -6.212 -4.781 1.407 120 H ASP 17 H ASP 17 -4.941 -7.308 -4.491 121 HA ASP 17 HA ASP 17 -6.065 -10.056 -4.388 122 HB2 ASP 17 1HB ASP 17 -4.635 -8.383 -6.422 123 HB3 ASP 17 2HB ASP 17 -4.237 -10.092 -6.376 124 H PHE 18 H PHE 18 -5.016 -11.328 -2.956 125 HA PHE 18 HA PHE 18 -2.568 -10.604 -1.603 126 HB2 PHE 18 1HB PHE 18 -4.536 -12.916 -1.602 127 HB3 PHE 18 2HB PHE 18 -3.054 -13.059 -0.753 128 HD1 PHE 18 1HD PHE 18 -6.116 -10.665 -0.955 129 HD2 PHE 18 2HD PHE 18 -2.855 -12.292 1.447 130 HE1 PHE 18 1HE PHE 18 -6.887 -9.451 0.934 131 HE2 PHE 18 2HE PHE 18 -3.765 -11.104 3.405 132 HZ PHE 18 HZ PHE 18 -5.790 -9.671 3.180 133 H THR 19 H THR 19 -0.714 -12.536 -1.569 134 HA THR 19 HA THR 19 0.263 -12.578 -4.311 135 HB THR 19 HB THR 19 2.024 -14.192 -3.278 136 HG1 THR 19 1HG THR 19 2.234 -13.843 -1.016 137 HG21 THR 19 3HG2 THR 19 2.622 -11.971 -3.890 138 HG22 THR 19 1HG2 THR 19 3.296 -12.307 -2.306 139 HG23 THR 19 2HG2 THR 19 1.838 -11.287 -2.428 140 H ASN 20 H ASN 20 -1.834 -14.701 -2.575 141 HA ASN 20 HA ASN 20 -1.272 -16.971 -4.382 142 HB2 ASN 20 1HB ASN 20 -2.747 -18.268 -3.029 143 HB3 ASN 20 2HB ASN 20 -1.577 -17.449 -2.011 144 HD21 ASN 20 1HD2 ASN 20 -3.245 -18.183 -0.407 145 HD22 ASN 20 2HD2 ASN 20 -4.470 -17.000 0.022 146 H SER 21 H SER 21 -4.037 -17.881 -4.641 147 HA SER 21 HA SER 21 -4.669 -16.219 -6.958 148 HB2 SER 21 1HB SER 21 -6.422 -17.927 -7.293 149 HB3 SER 21 2HB SER 21 -4.780 -18.568 -7.249 150 HG SER 21 HG SER 21 -6.657 -19.571 -5.966 151 H ILE 22 H ILE 22 -5.344 -15.633 -3.735 152 HA ILE 22 HA ILE 22 -8.245 -15.246 -4.069 153 HB ILE 22 HB ILE 22 -6.620 -15.209 -1.520 154 HG12 ILE 22 1HG1 ILE 22 -8.032 -17.606 -2.832 155 HG13 ILE 22 2HG1 ILE 22 -6.305 -17.415 -2.637 156 HG21 ILE 22 1HG2 ILE 22 -8.794 -15.726 -0.433 157 HG22 ILE 22 2HG2 ILE 22 -8.869 -14.223 -1.313 158 HG23 ILE 22 3HG2 ILE 22 -9.591 -15.691 -2.020 159 HD11 ILE 22 3HD1 ILE 22 -6.939 -18.928 -0.967 160 HD12 ILE 22 1HD1 ILE 22 -6.667 -17.388 -0.128 161 HD13 ILE 22 2HD1 ILE 22 -8.325 -17.948 -0.468 162 H GLN 23 H GLN 23 -9.193 -13.222 -3.558 163 HA GLN 23 HA GLN 23 -7.471 -11.000 -2.942 164 HB2 GLN 23 1HB GLN 23 -8.201 -9.993 -4.768 165 HB3 GLN 23 2HB GLN 23 -8.177 -11.600 -5.427 166 HG2 GLN 23 1HG GLN 23 -10.711 -11.621 -4.914 167 HG3 GLN 23 2HG GLN 23 -10.522 -9.892 -4.572 168 HE21 GLN 23 1HE2 GLN 23 -8.503 -11.102 -7.152 169 HE22 GLN 23 2HE2 GLN 23 -9.377 -10.306 -8.393 170 H LYS 24 H LYS 24 -8.715 -9.258 -2.072 171 HA LYS 24 HA LYS 24 -11.434 -9.873 -1.093 172 HB2 LYS 24 1HB LYS 24 -9.010 -9.795 0.530 173 HB3 LYS 24 2HB LYS 24 -9.981 -8.435 0.948 174 HG2 LYS 24 1HG LYS 24 -10.777 -11.370 0.955 175 HG3 LYS 24 2HG LYS 24 -10.416 -10.378 2.378 176 HD2 LYS 24 1HD LYS 24 -12.870 -10.330 0.635 177 HD3 LYS 24 2HD LYS 24 -12.753 -10.764 2.312 178 HE2 LYS 24 1HE LYS 24 -11.797 -7.997 1.985 179 HE3 LYS 24 2HE LYS 24 -13.260 -8.209 1.089 180 HZ1 LYS 24 3HZ LYS 24 -14.268 -9.054 3.202 181 HZ2 LYS 24 1HZ LYS 24 -13.757 -7.487 3.267 182 HZ3 LYS 24 2HZ LYS 24 -12.877 -8.635 4.002 183 H ILE 25 H ILE 25 -12.684 -8.079 -1.118 184 HA ILE 25 HA ILE 25 -11.428 -5.591 -2.189 185 HB ILE 25 HB ILE 25 -14.225 -6.609 -2.701 186 HG12 ILE 25 1HG1 ILE 25 -13.169 -6.345 -5.191 187 HG13 ILE 25 2HG1 ILE 25 -11.692 -6.737 -4.330 188 HG21 ILE 25 1HG2 ILE 25 -14.421 -4.693 -4.253 189 HG22 ILE 25 2HG2 ILE 25 -14.178 -4.152 -2.605 190 HG23 ILE 25 3HG2 ILE 25 -12.820 -4.122 -3.763 191 HD11 ILE 25 3HD1 ILE 25 -12.690 -8.881 -3.601 192 HD12 ILE 25 1HD1 ILE 25 -14.257 -8.397 -4.304 193 HD13 ILE 25 2HD1 ILE 25 -12.866 -8.688 -5.352 194 H TYR 26 H TYR 26 -11.854 -3.755 -1.114 195 HA TYR 26 HA TYR 26 -13.395 -3.914 1.425 196 HB2 TYR 26 1HB TYR 26 -11.103 -1.995 0.823 197 HB3 TYR 26 2HB TYR 26 -11.939 -2.223 2.340 198 HD1 TYR 26 2HD TYR 26 -9.919 -4.277 -0.154 199 HD2 TYR 26 1HD TYR 26 -10.802 -3.458 3.992 200 HE1 TYR 26 2HE TYR 26 -8.620 -6.241 0.511 201 HE2 TYR 26 1HE TYR 26 -9.455 -5.402 4.651 202 HH TYR 26 HH TYR 26 -8.275 -7.256 3.934 203 H ASP 27 H ASP 27 -15.237 -3.586 -0.026 204 HA ASP 27 HA ASP 27 -15.514 -0.958 -1.395 205 HB2 ASP 27 1HB ASP 27 -16.546 -2.965 -2.374 206 HB3 ASP 27 2HB ASP 27 -17.418 -3.279 -0.880 207 H ASP 28 H ASP 28 -16.211 -2.674 1.595 208 HA ASP 28 HA ASP 28 -18.417 -1.132 2.488 209 HB2 ASP 28 1HB ASP 28 -16.681 -2.557 4.485 210 HB3 ASP 28 2HB ASP 28 -18.427 -2.519 4.302 211 H SER 29 H SER 29 -18.443 0.775 3.747 212 HA SER 29 HA SER 29 -16.360 2.532 3.682 213 HB2 SER 29 1HB SER 29 -18.478 2.365 5.871 214 HB3 SER 29 2HB SER 29 -17.576 3.804 5.374 215 HG SER 29 HG SER 29 -19.617 3.783 4.482 216 H GLU 30 H GLU 30 -17.121 0.320 6.400 217 HA GLU 30 HA GLU 30 -15.087 1.462 8.109 218 HB2 GLU 30 1HB GLU 30 -17.384 0.383 8.628 219 HB3 GLU 30 2HB GLU 30 -16.545 -1.170 8.490 220 HG2 GLU 30 1HG GLU 30 -15.282 -0.792 10.428 221 HG3 GLU 30 2HG GLU 30 -15.489 0.964 10.336 222 H SER 31 H SER 31 -15.060 -0.911 5.614 223 HA SER 31 HA SER 31 -12.603 -2.303 6.490 224 HB2 SER 31 1HB SER 31 -14.357 -2.462 4.021 225 HB3 SER 31 2HB SER 31 -12.867 -3.385 4.240 226 HG SER 31 HG SER 31 -14.634 -3.515 6.378 227 H ILE 32 H ILE 32 -13.664 0.232 4.171 228 HA ILE 32 HA ILE 32 -11.026 0.699 3.138 229 HB ILE 32 HB ILE 32 -13.416 2.566 3.402 230 HG12 ILE 32 1HG1 ILE 32 -12.318 1.093 0.962 231 HG13 ILE 32 2HG1 ILE 32 -13.628 0.462 1.950 232 HG21 ILE 32 1HG2 ILE 32 -11.009 2.981 1.588 233 HG22 ILE 32 2HG2 ILE 32 -12.307 4.123 1.965 234 HG23 ILE 32 3HG2 ILE 32 -11.083 3.720 3.183 235 HD11 ILE 32 3HD1 ILE 32 -15.041 2.381 1.439 236 HD12 ILE 32 1HD1 ILE 32 -13.749 3.112 0.461 237 HD13 ILE 32 2HD1 ILE 32 -14.477 1.576 -0.042 238 H GLN 33 H GLN 33 -12.900 2.358 5.806 239 HA GLN 33 HA GLN 33 -10.932 4.093 6.509 240 HB2 GLN 33 1HB GLN 33 -13.485 3.594 7.208 241 HB3 GLN 33 2HB GLN 33 -12.734 2.958 8.647 242 HG2 GLN 33 1HG GLN 33 -11.781 5.653 7.650 243 HG3 GLN 33 2HG GLN 33 -13.466 5.537 8.082 244 HE21 GLN 33 1HE2 GLN 33 -12.161 7.317 9.521 245 HE22 GLN 33 2HE2 GLN 33 -11.945 6.719 11.177 246 H LYS 34 H LYS 34 -11.143 0.691 7.425 247 HA LYS 34 HA LYS 34 -9.129 0.652 9.435 248 HB2 LYS 34 1HB LYS 34 -10.798 -1.150 8.771 249 HB3 LYS 34 2HB LYS 34 -9.775 -1.538 7.404 250 HG2 LYS 34 1HG LYS 34 -8.917 -1.693 10.338 251 HG3 LYS 34 2HG LYS 34 -9.563 -3.014 9.389 252 HD2 LYS 34 1HD LYS 34 -7.444 -3.521 8.988 253 HD3 LYS 34 2HD LYS 34 -7.542 -2.299 7.737 254 HE2 LYS 34 1HE LYS 34 -5.616 -1.659 8.791 255 HE3 LYS 34 2HE LYS 34 -6.766 -0.657 9.685 256 HZ1 LYS 34 3HZ LYS 34 -5.163 -1.844 11.087 257 HZ2 LYS 34 1HZ LYS 34 -5.799 -3.295 10.591 258 HZ3 LYS 34 2HZ LYS 34 -6.707 -2.226 11.464 259 H ILE 35 H ILE 35 -8.822 -0.141 5.902 260 HA ILE 35 HA ILE 35 -6.146 -0.381 5.734 261 HB ILE 35 HB ILE 35 -8.228 0.584 3.785 262 HG12 ILE 35 1HG1 ILE 35 -6.546 -1.910 4.049 263 HG13 ILE 35 2HG1 ILE 35 -8.223 -1.756 4.525 264 HG21 ILE 35 1HG2 ILE 35 -5.305 0.145 3.069 265 HG22 ILE 35 2HG2 ILE 35 -6.649 0.513 1.951 266 HG23 ILE 35 3HG2 ILE 35 -6.118 1.724 3.082 267 HD11 ILE 35 3HD1 ILE 35 -8.933 -1.450 2.205 268 HD12 ILE 35 1HD1 ILE 35 -7.249 -1.532 1.636 269 HD13 ILE 35 2HD1 ILE 35 -7.975 -2.937 2.385 270 H LEU 36 H LEU 36 -7.746 2.908 5.277 271 HA LEU 36 HA LEU 36 -5.401 4.264 4.788 272 HB2 LEU 36 1HB LEU 36 -7.692 5.268 6.493 273 HB3 LEU 36 2HB LEU 36 -6.399 6.243 5.824 274 HG LEU 36 HG LEU 36 -7.433 4.749 3.633 275 HD11 LEU 36 1HD1 LEU 36 -9.794 5.536 3.650 276 HD12 LEU 36 2HD1 LEU 36 -9.552 6.112 5.329 277 HD13 LEU 36 3HD1 LEU 36 -9.445 4.393 4.955 278 HD21 LEU 36 3HD2 LEU 36 -6.460 6.837 3.271 279 HD22 LEU 36 1HD2 LEU 36 -7.654 7.688 4.301 280 HD23 LEU 36 2HD2 LEU 36 -8.129 6.949 2.750 281 H SER 37 H SER 37 -6.224 2.933 7.946 282 HA SER 37 HA SER 37 -4.503 4.494 9.605 283 HB2 SER 37 1HB SER 37 -6.283 2.845 10.340 284 HB3 SER 37 2HB SER 37 -5.135 1.547 9.959 285 HG SER 37 HG SER 37 -5.239 3.266 12.047 286 H GLU 38 H GLU 38 -3.912 1.223 8.252 287 HA GLU 38 HA GLU 38 -1.152 1.291 9.029 288 HB2 GLU 38 1HB GLU 38 -2.404 -0.703 7.149 289 HB3 GLU 38 2HB GLU 38 -1.109 -0.976 8.298 290 HG2 GLU 38 1HG GLU 38 -4.043 -0.446 8.985 291 HG3 GLU 38 2HG GLU 38 -3.287 -2.008 8.918 292 H ILE 39 H ILE 39 -2.779 2.401 6.233 293 HA ILE 39 HA ILE 39 -0.551 2.264 4.362 294 HB ILE 39 HB ILE 39 -3.065 3.970 4.598 295 HG12 ILE 39 1HG1 ILE 39 -3.429 1.614 3.968 296 HG13 ILE 39 2HG1 ILE 39 -3.892 2.723 2.692 297 HG21 ILE 39 1HG2 ILE 39 -1.099 4.037 2.303 298 HG22 ILE 39 2HG2 ILE 39 -2.701 4.831 2.366 299 HG23 ILE 39 3HG2 ILE 39 -1.425 5.369 3.436 300 HD11 ILE 39 3HD1 ILE 39 -1.309 1.088 2.748 301 HD12 ILE 39 1HD1 ILE 39 -2.786 0.685 1.879 302 HD13 ILE 39 2HD1 ILE 39 -1.865 2.128 1.422 303 H ALA 40 H ALA 40 -1.494 4.480 7.020 304 HA ALA 40 HA ALA 40 0.299 6.526 5.878 305 HB1 ALA 40 1HB ALA 40 -1.581 6.702 8.268 306 HB2 ALA 40 2HB ALA 40 -0.811 8.054 7.413 307 HB3 ALA 40 3HB ALA 40 -2.052 7.090 6.594 308 H THR 41 H THR 41 0.642 4.093 8.187 309 HA THR 41 HA THR 41 2.016 5.476 10.230 310 HB THR 41 HB THR 41 2.857 3.215 10.846 311 HG1 THR 41 1HG THR 41 2.344 1.478 9.709 312 HG21 THR 41 3HG2 THR 41 0.604 2.201 11.237 313 HG22 THR 41 1HG2 THR 41 -0.111 3.378 10.140 314 HG23 THR 41 2HG2 THR 41 0.651 3.925 11.646 315 H GLY 42 H GLY 42 3.270 3.973 7.237 316 HA2 GLY 42 1HA GLY 42 5.958 3.997 8.043 317 HA3 GLY 42 2HA GLY 42 5.336 3.736 6.406 318 H LYS 43 H LYS 43 7.734 4.926 6.911 319 HA LYS 43 HA LYS 43 7.387 7.784 6.178 320 HB2 LYS 43 1HB LYS 43 9.590 6.603 7.904 321 HB3 LYS 43 2HB LYS 43 9.382 8.280 7.407 322 HG2 LYS 43 1HG LYS 43 7.089 8.215 8.523 323 HG3 LYS 43 2HG LYS 43 7.517 6.664 9.222 324 HD2 LYS 43 1HD LYS 43 9.340 9.042 9.625 325 HD3 LYS 43 2HD LYS 43 7.862 8.934 10.567 326 HE2 LYS 43 1HE LYS 43 9.775 6.580 10.443 327 HE3 LYS 43 2HE LYS 43 10.073 7.946 11.529 328 HZ1 LYS 43 3HZ LYS 43 7.905 7.573 12.512 329 HZ2 LYS 43 1HZ LYS 43 8.891 6.276 12.661 330 HZ3 LYS 43 2HZ LYS 43 7.643 6.235 11.592 331 H ARG 44 H ARG 44 7.753 7.789 4.037 332 HA ARG 44 HA ARG 44 9.238 5.859 2.591 333 HB2 ARG 44 1HB ARG 44 9.189 7.486 0.721 334 HB3 ARG 44 2HB ARG 44 7.643 7.115 1.440 335 HG2 ARG 44 1HG ARG 44 7.958 9.289 2.858 336 HG3 ARG 44 2HG ARG 44 9.300 9.641 1.739 337 HD2 ARG 44 1HD ARG 44 7.735 9.311 -0.127 338 HD3 ARG 44 2HD ARG 44 6.401 9.053 1.013 339 HE ARG 44 HE ARG 44 7.706 11.538 0.232 340 HH11 ARG 44 1HH1 ARG 44 6.032 10.164 2.981 341 HH12 ARG 44 2HH1 ARG 44 5.329 11.659 3.503 342 HH21 ARG 44 1HH2 ARG 44 6.478 13.475 0.674 343 HH22 ARG 44 2HH2 ARG 44 5.488 13.537 2.119 344 H THR 45 H THR 45 10.451 7.920 4.707 345 HA THR 45 HA THR 45 12.496 8.647 5.336 346 HB THR 45 HB THR 45 14.469 7.489 4.736 347 HG1 THR 45 1HG THR 45 13.015 6.707 2.454 348 HG21 THR 45 3HG2 THR 45 12.654 6.186 5.987 349 HG22 THR 45 1HG2 THR 45 13.924 5.234 5.222 350 HG23 THR 45 2HG2 THR 45 12.309 5.345 4.475 351 H GLU 46 H GLU 46 14.789 9.436 3.732 352 HA GLU 46 HA GLU 46 13.559 11.496 1.962 353 HB2 GLU 46 1HB GLU 46 16.215 11.268 3.403 354 HB3 GLU 46 2HB GLU 46 15.987 12.390 2.059 355 HG2 GLU 46 1HG GLU 46 14.145 12.427 4.477 356 HG3 GLU 46 2HG GLU 46 15.674 13.303 4.434 357 H LYS 47 H LYS 47 14.703 8.330 1.744 358 HA LYS 47 HA LYS 47 16.597 8.466 -0.343 359 HB2 LYS 47 1HB LYS 47 14.548 6.332 0.423 360 HB3 LYS 47 2HB LYS 47 15.744 6.090 -0.837 361 HG2 LYS 47 1HG LYS 47 16.443 6.633 2.037 362 HG3 LYS 47 2HG LYS 47 16.339 5.040 1.325 363 HD2 LYS 47 1HD LYS 47 18.202 7.218 0.304 364 HD3 LYS 47 2HD LYS 47 18.675 6.031 1.526 365 HE2 LYS 47 1HE LYS 47 18.167 4.207 0.076 366 HE3 LYS 47 2HE LYS 47 17.562 5.249 -1.202 367 HZ1 LYS 47 3HZ LYS 47 19.733 6.171 -1.478 368 HZ2 LYS 47 1HZ LYS 47 19.796 4.543 -1.666 369 HZ3 LYS 47 2HZ LYS 47 20.390 5.226 -0.298 370 H GLN 48 H GLN 48 16.366 7.754 -2.533 371 HA GLN 48 HA GLN 48 14.114 9.214 -3.778 372 HB2 GLN 48 1HB GLN 48 16.966 8.704 -4.701 373 HB3 GLN 48 2HB GLN 48 15.738 9.594 -5.623 374 HG2 GLN 48 1HG GLN 48 15.481 11.148 -3.636 375 HG3 GLN 48 2HG GLN 48 16.864 10.351 -2.878 376 HE21 GLN 48 1HE2 GLN 48 18.928 10.267 -4.368 377 HE22 GLN 48 2HE2 GLN 48 19.264 11.775 -5.188 378 H SER 49 H SER 49 12.661 8.110 -4.912 379 HA SER 49 HA SER 49 13.136 5.224 -5.423 380 HB2 SER 49 1HB SER 49 11.501 6.005 -3.834 381 HB3 SER 49 2HB SER 49 10.454 6.641 -5.071 382 HG SER 49 HG SER 49 10.258 4.396 -5.743 383 H ILE 50 H ILE 50 14.404 5.964 -7.194 384 HA ILE 50 HA ILE 50 13.277 7.444 -9.406 385 HB ILE 50 HB ILE 50 15.491 7.094 -10.396 386 HG12 ILE 50 1HG1 ILE 50 16.255 5.441 -7.936 387 HG13 ILE 50 2HG1 ILE 50 15.843 4.725 -9.492 388 HG21 ILE 50 1HG2 ILE 50 15.834 7.818 -7.454 389 HG22 ILE 50 2HG2 ILE 50 16.749 8.425 -8.847 390 HG23 ILE 50 3HG2 ILE 50 15.052 8.869 -8.648 391 HD11 ILE 50 3HD1 ILE 50 18.184 6.579 -8.951 392 HD12 ILE 50 1HD1 ILE 50 18.231 4.850 -9.335 393 HD13 ILE 50 2HD1 ILE 50 17.699 6.003 -10.567 394 H GLN 51 H GLN 51 11.998 4.724 -8.595 395 HA GLN 51 HA GLN 51 12.479 3.174 -11.048 396 HB2 GLN 51 1HB GLN 51 11.947 1.272 -9.350 397 HB3 GLN 51 2HB GLN 51 13.527 1.986 -9.399 398 HG2 GLN 51 1HG GLN 51 13.060 1.697 -7.155 399 HG3 GLN 51 2HG GLN 51 12.837 3.443 -7.294 400 HE21 GLN 51 1HE2 GLN 51 11.424 0.470 -6.420 401 HE22 GLN 51 2HE2 GLN 51 9.851 1.159 -6.078 402 H ASP 52 H ASP 52 10.641 1.587 -11.322 403 HA ASP 52 HA ASP 52 8.018 2.906 -10.794 404 HB2 ASP 52 1HB ASP 52 8.983 1.404 -13.226 405 HB3 ASP 52 2HB ASP 52 7.297 1.744 -12.906 406 H TYR 53 H TYR 53 9.855 0.325 -9.720 407 HA TYR 53 HA TYR 53 7.455 -1.284 -9.174 408 HB2 TYR 53 1HB TYR 53 9.755 -2.170 -10.946 409 HB3 TYR 53 2HB TYR 53 8.948 -3.354 -9.932 410 HD1 TYR 53 1HD TYR 53 8.411 -0.918 -12.677 411 HD2 TYR 53 2HD TYR 53 6.726 -4.150 -10.389 412 HE1 TYR 53 1HE TYR 53 6.335 -0.794 -14.011 413 HE2 TYR 53 2HE TYR 53 4.738 -4.185 -11.878 414 HH TYR 53 HH TYR 53 3.476 -2.485 -13.322 415 HA PRO 54 HA PRO 54 9.830 -2.203 -5.469 416 HB2 PRO 54 1HB PRO 54 8.975 -4.782 -4.916 417 HB3 PRO 54 2HB PRO 54 8.010 -3.312 -4.595 418 HG2 PRO 54 1HG PRO 54 7.782 -5.151 -6.950 419 HG3 PRO 54 2HG PRO 54 6.486 -4.456 -5.942 420 HD2 PRO 54 1HD PRO 54 7.175 -3.367 -8.323 421 HD3 PRO 54 2HD PRO 54 6.731 -2.328 -6.941 422 H SER 55 H SER 55 11.412 -3.942 -4.691 423 HA SER 55 HA SER 55 13.080 -4.753 -6.988 424 HB2 SER 55 1HB SER 55 13.629 -2.872 -5.247 425 HB3 SER 55 2HB SER 55 14.013 -4.217 -4.149 426 HG SER 55 HG SER 55 15.596 -4.887 -5.504 427 H ALA 56 H ALA 56 10.771 -6.186 -5.823 428 HA ALA 56 HA ALA 56 11.975 -8.724 -4.796 429 HB1 ALA 56 1HB ALA 56 9.816 -9.080 -3.665 430 HB2 ALA 56 2HB ALA 56 10.535 -7.554 -3.112 431 HB3 ALA 56 3HB ALA 56 9.205 -7.538 -4.291 432 H GLU 57 H GLU 57 10.648 -10.580 -5.377 433 HA GLU 57 HA GLU 57 9.851 -10.508 -8.233 434 HB2 GLU 57 1HB GLU 57 10.835 -12.531 -6.218 435 HB3 GLU 57 2HB GLU 57 9.865 -13.082 -7.595 436 HG2 GLU 57 1HG GLU 57 11.538 -11.721 -9.056 437 HG3 GLU 57 2HG GLU 57 12.572 -11.717 -7.626 438 H GLU 58 H GLU 58 8.514 -10.992 -4.967 439 HA GLU 58 HA GLU 58 5.881 -11.683 -6.163 440 HB2 GLU 58 1HB GLU 58 7.376 -13.065 -3.911 441 HB3 GLU 58 2HB GLU 58 5.611 -13.124 -4.040 442 HG2 GLU 58 1HG GLU 58 5.718 -14.054 -6.248 443 HG3 GLU 58 2HG GLU 58 7.507 -14.006 -6.263 444 H TYR 59 H TYR 59 4.544 -10.132 -5.676 445 HA TYR 59 HA TYR 59 4.510 -8.955 -3.024 446 HB2 TYR 59 1HB TYR 59 4.250 -6.700 -4.188 447 HB3 TYR 59 2HB TYR 59 5.863 -7.360 -4.041 448 HD1 TYR 59 2HD TYR 59 3.133 -6.634 -6.441 449 HD2 TYR 59 1HD TYR 59 7.213 -7.940 -5.965 450 HE1 TYR 59 2HE TYR 59 3.604 -5.959 -8.762 451 HE2 TYR 59 1HE TYR 59 7.630 -7.552 -8.370 452 HH TYR 59 HH TYR 59 5.054 -6.550 -10.580 453 H GLY 60 H GLY 60 2.433 -7.752 -2.811 454 HA2 GLY 60 1HA GLY 60 0.246 -9.255 -4.160 455 HA3 GLY 60 2HA GLY 60 0.164 -8.400 -2.615 456 H THR 61 H THR 61 -1.737 -7.888 -4.584 457 HA THR 61 HA THR 61 -0.769 -5.564 -6.116 458 HB THR 61 HB THR 61 -3.088 -7.174 -7.049 459 HG1 THR 61 1HG THR 61 -0.504 -8.298 -7.316 460 HG21 THR 61 3HG2 THR 61 -2.026 -5.307 -8.341 461 HG22 THR 61 1HG2 THR 61 -2.065 -6.863 -9.193 462 HG23 THR 61 2HG2 THR 61 -0.550 -6.302 -8.463 463 H ILE 62 H ILE 62 -1.558 -3.668 -5.313 464 HA ILE 62 HA ILE 62 -4.294 -3.681 -4.155 465 HB ILE 62 HB ILE 62 -2.059 -1.692 -3.682 466 HG12 ILE 62 1HG1 ILE 62 -2.290 -2.864 -1.263 467 HG13 ILE 62 2HG1 ILE 62 -2.658 -4.281 -2.224 468 HG21 ILE 62 1HG2 ILE 62 -4.257 -0.738 -3.322 469 HG22 ILE 62 2HG2 ILE 62 -4.746 -2.115 -2.314 470 HG23 ILE 62 3HG2 ILE 62 -3.480 -1.001 -1.774 471 HD11 ILE 62 3HD1 ILE 62 -0.487 -4.003 -3.428 472 HD12 ILE 62 1HD1 ILE 62 -0.185 -2.467 -2.596 473 HD13 ILE 62 2HD1 ILE 62 -0.212 -4.013 -1.699 474 H ASN 63 H ASN 63 -5.800 -2.431 -5.149 475 HA ASN 63 HA ASN 63 -4.919 -0.002 -6.602 476 HB2 ASN 63 1HB ASN 63 -7.045 -1.973 -7.557 477 HB3 ASN 63 2HB ASN 63 -7.039 -0.272 -8.012 478 HD21 ASN 63 1HD2 ASN 63 -5.215 -3.290 -8.217 479 HD22 ASN 63 2HD2 ASN 63 -4.337 -2.868 -9.661 480 H ILE 64 H ILE 64 -5.701 1.615 -5.393 481 HA ILE 64 HA ILE 64 -8.347 1.341 -4.037 482 HB ILE 64 HB ILE 64 -6.358 3.658 -4.110 483 HG12 ILE 64 1HG1 ILE 64 -7.025 1.649 -1.930 484 HG13 ILE 64 2HG1 ILE 64 -5.479 1.827 -2.756 485 HG21 ILE 64 1HG2 ILE 64 -8.886 3.394 -2.433 486 HG22 ILE 64 2HG2 ILE 64 -7.835 4.803 -2.579 487 HG23 ILE 64 3HG2 ILE 64 -8.824 4.289 -3.945 488 HD11 ILE 64 3HD1 ILE 64 -5.256 4.107 -1.768 489 HD12 ILE 64 1HD1 ILE 64 -6.757 3.831 -0.841 490 HD13 ILE 64 2HD1 ILE 64 -5.362 2.802 -0.553 491 H GLU 65 H GLU 65 -10.028 1.621 -5.510 492 HA GLU 65 HA GLU 65 -9.619 3.295 -7.909 493 HB2 GLU 65 1HB GLU 65 -10.814 1.188 -8.154 494 HB3 GLU 65 2HB GLU 65 -11.986 1.648 -6.913 495 HG2 GLU 65 1HG GLU 65 -12.980 3.273 -8.258 496 HG3 GLU 65 2HG GLU 65 -11.555 3.498 -9.260 497 H ASN 66 H ASN 66 -10.305 5.414 -7.926 498 HA ASN 66 HA ASN 66 -12.083 6.499 -5.881 499 HB2 ASN 66 1HB ASN 66 -10.440 8.342 -5.332 500 HB3 ASN 66 2HB ASN 66 -10.180 6.789 -4.572 501 HD21 ASN 66 1HD2 ASN 66 -8.213 5.860 -4.754 502 HD22 ASN 66 2HD2 ASN 66 -6.850 6.517 -5.635 503 H ASN 67 H ASN 67 -13.329 7.953 -6.763 504 HA ASN 67 HA ASN 67 -14.397 9.099 -8.389 505 HB2 ASN 67 1HB ASN 67 -11.799 10.616 -8.720 506 HB3 ASN 67 2HB ASN 67 -13.435 11.199 -8.930 507 HD21 ASN 67 1HD2 ASN 67 -10.876 10.424 -6.528 508 HD22 ASN 67 2HD2 ASN 67 -11.832 10.911 -5.160 509 H GLY 68 H GLY 68 -13.756 6.736 -9.547 510 HA2 GLY 68 1HA GLY 68 -13.629 5.695 -11.565 511 HA3 GLY 68 2HA GLY 68 -13.710 7.279 -12.328 512 H GLY 69 H GLY 69 -10.987 7.359 -10.368 513 HA2 GLY 69 1HA GLY 69 -9.122 6.303 -12.442 514 HA3 GLY 69 2HA GLY 69 -8.765 7.649 -11.336 515 H MET 70 H MET 70 -6.908 5.816 -10.930 516 HA MET 70 HA MET 70 -7.628 4.609 -8.394 517 HB2 MET 70 1HB MET 70 -7.110 2.287 -9.000 518 HB3 MET 70 2HB MET 70 -8.417 2.873 -10.018 519 HG2 MET 70 1HG MET 70 -6.347 3.539 -11.623 520 HG3 MET 70 2HG MET 70 -5.555 2.276 -10.691 521 HE1 MET 70 3HE MET 70 -8.305 3.285 -13.236 522 HE2 MET 70 1HE MET 70 -9.125 1.755 -13.607 523 HE3 MET 70 2HE MET 70 -9.366 2.525 -12.029 524 H THR 71 H THR 71 -6.033 4.047 -7.131 525 HA THR 71 HA THR 71 -3.277 4.902 -7.844 526 HB THR 71 HB THR 71 -4.470 4.468 -5.062 527 HG1 THR 71 1HG THR 71 -4.972 6.554 -6.786 528 HG21 THR 71 3HG2 THR 71 -2.008 4.717 -5.236 529 HG22 THR 71 1HG2 THR 71 -2.763 6.067 -4.368 530 HG23 THR 71 2HG2 THR 71 -2.232 6.282 -6.050 531 H THR 72 H THR 72 -2.496 3.046 -8.801 532 HA THR 72 HA THR 72 -2.770 0.449 -7.518 533 HB THR 72 HB THR 72 -0.913 1.310 -9.729 534 HG1 THR 72 1HG THR 72 -3.585 0.405 -10.038 535 HG21 THR 72 3HG2 THR 72 -1.215 -1.059 -10.517 536 HG22 THR 72 1HG2 THR 72 -2.202 -1.396 -9.072 537 HG23 THR 72 2HG2 THR 72 -0.488 -0.979 -8.913 538 H MET 73 H MET 73 -0.978 -0.669 -6.559 539 HA MET 73 HA MET 73 1.672 0.341 -6.174 540 HB2 MET 73 1HB MET 73 1.457 0.560 -3.687 541 HB3 MET 73 2HB MET 73 0.878 1.862 -4.674 542 HG2 MET 73 1HG MET 73 -1.414 0.247 -4.328 543 HG3 MET 73 2HG MET 73 -0.576 0.231 -2.804 544 HE1 MET 73 3HE MET 73 0.762 3.132 -2.714 545 HE2 MET 73 1HE MET 73 -0.522 4.113 -1.968 546 HE3 MET 73 2HE MET 73 -0.177 2.475 -1.354 547 H PHE 74 H PHE 74 2.830 -1.205 -4.741 548 HA PHE 74 HA PHE 74 1.577 -3.855 -4.300 549 HB2 PHE 74 1HB PHE 74 4.379 -3.349 -5.348 550 HB3 PHE 74 2HB PHE 74 3.594 -4.873 -5.177 551 HD1 PHE 74 2HD PHE 74 0.982 -4.514 -6.531 552 HD2 PHE 74 1HD PHE 74 4.862 -3.080 -7.623 553 HE1 PHE 74 2HE PHE 74 0.235 -4.248 -8.882 554 HE2 PHE 74 1HE PHE 74 4.137 -2.803 -9.935 555 HZ PHE 74 HZ PHE 74 1.796 -3.381 -10.597 556 H TYR 75 H TYR 75 2.551 -4.928 -2.374 557 HA TYR 75 HA TYR 75 4.671 -3.403 -0.964 558 HB2 TYR 75 1HB TYR 75 2.704 -4.917 0.687 559 HB3 TYR 75 2HB TYR 75 3.712 -3.599 1.140 560 HD1 TYR 75 2HD TYR 75 2.895 -1.437 -0.769 561 HD2 TYR 75 1HD TYR 75 0.548 -4.399 1.284 562 HE1 TYR 75 2HE TYR 75 0.929 0.059 -0.907 563 HE2 TYR 75 1HE TYR 75 -1.421 -2.950 1.121 564 HH TYR 75 HH TYR 75 -2.256 -1.031 0.339 565 H TYR 76 H TYR 76 5.946 -4.879 0.503 566 HA TYR 76 HA TYR 76 5.857 -7.749 -0.030 567 HB2 TYR 76 1HB TYR 76 8.177 -7.768 -0.979 568 HB3 TYR 76 2HB TYR 76 6.986 -7.085 -2.058 569 HD1 TYR 76 2HD TYR 76 6.872 -4.616 -2.435 570 HD2 TYR 76 1HD TYR 76 9.960 -6.400 -0.042 571 HE1 TYR 76 2HE TYR 76 8.119 -2.466 -2.475 572 HE2 TYR 76 1HE TYR 76 11.256 -4.268 -0.100 573 HH TYR 76 HH TYR 76 10.066 -1.399 -1.911 574 H GLU 77 H GLU 77 7.676 -8.812 1.145 575 HA GLU 77 HA GLU 77 8.739 -7.326 3.477 576 HB2 GLU 77 1HB GLU 77 7.570 -9.506 3.860 577 HB3 GLU 77 2HB GLU 77 8.752 -10.299 2.815 578 HG2 GLU 77 1HG GLU 77 10.579 -9.645 4.366 579 HG3 GLU 77 2HG GLU 77 9.411 -8.774 5.370 580 H GLU 78 H GLU 78 11.021 -7.057 3.639 581 HA GLU 78 HA GLU 78 12.785 -8.529 1.872 582 HB2 GLU 78 1HB GLU 78 12.239 -6.621 0.449 583 HB3 GLU 78 2HB GLU 78 12.657 -5.470 1.724 584 HG2 GLU 78 1HG GLU 78 14.970 -6.078 1.647 585 HG3 GLU 78 2HG GLU 78 14.634 -7.515 0.724 586 H ASN 79 H ASN 79 14.816 -8.754 2.901 587 HA ASN 79 HA ASN 79 16.236 -8.984 4.604 588 HB2 ASN 79 1HB ASN 79 15.637 -6.040 5.034 589 HB3 ASN 79 2HB ASN 79 16.789 -6.906 6.024 590 HD21 ASN 79 1HD2 ASN 79 16.360 -5.311 2.963 591 HD22 ASN 79 2HD2 ASN 79 17.899 -5.749 2.292 592 H GLY 80 H GLY 80 13.051 -8.815 5.289 593 HA2 GLY 80 1HA GLY 80 11.972 -9.879 7.138 594 HA3 GLY 80 2HA GLY 80 13.381 -9.557 8.151 595 H LYS 81 H LYS 81 12.207 -6.775 6.130 596 HA LYS 81 HA LYS 81 10.395 -5.881 8.250 597 HB2 LYS 81 1HB LYS 81 12.445 -4.379 6.584 598 HB3 LYS 81 2HB LYS 81 10.971 -3.630 7.004 599 HG2 LYS 81 1HG LYS 81 12.432 -2.894 8.669 600 HG3 LYS 81 2HG LYS 81 11.350 -4.061 9.435 601 HD2 LYS 81 1HD LYS 81 13.290 -5.777 9.034 602 HD3 LYS 81 2HD LYS 81 14.285 -4.355 8.709 603 HE2 LYS 81 1HE LYS 81 13.627 -3.457 10.959 604 HE3 LYS 81 2HE LYS 81 12.648 -4.909 11.231 605 HZ1 LYS 81 3HZ LYS 81 15.559 -4.758 10.902 606 HZ2 LYS 81 1HZ LYS 81 14.700 -6.203 10.994 607 HZ3 LYS 81 2HZ LYS 81 14.730 -5.179 12.274 608 H TYR 82 H TYR 82 8.780 -4.334 7.097 609 HA TYR 82 HA TYR 82 8.104 -5.524 4.443 610 HB2 TYR 82 1HB TYR 82 6.345 -4.389 6.612 611 HB3 TYR 82 2HB TYR 82 5.799 -4.897 5.033 612 HD1 TYR 82 1HD TYR 82 5.849 -7.390 4.421 613 HD2 TYR 82 2HD TYR 82 6.910 -5.964 8.357 614 HE1 TYR 82 1HE TYR 82 5.516 -9.657 5.330 615 HE2 TYR 82 2HE TYR 82 6.549 -8.200 9.279 616 HH TYR 82 HH TYR 82 5.027 -10.781 7.379 617 H TYR 83 H TYR 83 7.530 -4.092 2.771 618 HA TYR 83 HA TYR 83 7.898 -1.209 3.273 619 HB2 TYR 83 1HB TYR 83 9.417 -2.798 1.210 620 HB3 TYR 83 2HB TYR 83 9.493 -1.061 1.376 621 HD1 TYR 83 2HD TYR 83 10.454 -4.330 2.929 622 HD2 TYR 83 1HD TYR 83 11.087 -0.058 2.944 623 HE1 TYR 83 2HE TYR 83 12.458 -4.651 4.172 624 HE2 TYR 83 1HE TYR 83 13.113 -0.397 4.380 625 HH TYR 83 HH TYR 83 13.951 -3.532 5.686 626 H ILE 84 H ILE 84 7.304 0.044 1.365 627 HA ILE 84 HA ILE 84 5.099 -1.198 -0.226 628 HB ILE 84 HB ILE 84 5.190 1.324 1.467 629 HG12 ILE 84 1HG1 ILE 84 2.770 0.182 1.955 630 HG13 ILE 84 2HG1 ILE 84 3.692 -1.255 1.553 631 HG21 ILE 84 1HG2 ILE 84 3.202 0.771 -0.744 632 HG22 ILE 84 2HG2 ILE 84 2.941 1.943 0.569 633 HG23 ILE 84 3HG2 ILE 84 4.270 2.159 -0.563 634 HD11 ILE 84 3HD1 ILE 84 5.259 -0.810 3.362 635 HD12 ILE 84 1HD1 ILE 84 4.447 0.745 3.708 636 HD13 ILE 84 2HD1 ILE 84 3.590 -0.794 3.938 637 H GLU 85 H GLU 85 5.266 -0.860 -2.411 638 HA GLU 85 HA GLU 85 7.338 0.926 -3.421 639 HB2 GLU 85 1HB GLU 85 7.138 -0.197 -5.410 640 HB3 GLU 85 2HB GLU 85 6.446 -1.411 -4.379 641 HG2 GLU 85 1HG GLU 85 4.914 -1.378 -6.086 642 HG3 GLU 85 2HG GLU 85 4.144 -0.290 -4.946 643 H CYS 86 H CYS 86 6.710 2.498 -5.143 644 HA CYS 86 HA CYS 86 4.305 3.546 -5.716 645 HB2 CYS 86 1HB CYS 86 5.380 4.568 -3.117 646 HB3 CYS 86 2HB CYS 86 5.060 5.857 -4.277 647 HG CYS 86 HG CYS 86 3.138 3.339 -3.433 648 HA PRO 87 HA PRO 87 7.397 5.764 -8.389 649 HB2 PRO 87 1HB PRO 87 6.433 8.297 -8.692 650 HB3 PRO 87 2HB PRO 87 5.617 6.882 -9.412 651 HG2 PRO 87 1HG PRO 87 4.996 8.192 -6.734 652 HG3 PRO 87 2HG PRO 87 3.867 7.864 -8.098 653 HD2 PRO 87 1HD PRO 87 4.037 6.129 -6.079 654 HD3 PRO 87 2HD PRO 87 3.961 5.566 -7.748 655 H TYR 88 H TYR 88 8.481 8.253 -8.106 656 HA TYR 88 HA TYR 88 10.486 8.387 -6.531 657 HB2 TYR 88 1HB TYR 88 8.641 10.776 -6.837 658 HB3 TYR 88 2HB TYR 88 10.335 10.847 -6.406 659 HD1 TYR 88 2HD TYR 88 8.041 9.922 -9.245 660 HD2 TYR 88 1HD TYR 88 12.060 10.850 -7.991 661 HE1 TYR 88 2HE TYR 88 8.760 9.957 -11.594 662 HE2 TYR 88 1HE TYR 88 12.786 10.927 -10.328 663 HH TYR 88 HH TYR 88 10.639 9.853 -12.959 664 H LYS 89 H LYS 89 7.432 8.277 -4.974 665 HA LYS 89 HA LYS 89 8.692 8.805 -2.398 666 HB2 LYS 89 1HB LYS 89 5.819 9.394 -3.314 667 HB3 LYS 89 2HB LYS 89 6.280 9.429 -1.637 668 HG2 LYS 89 1HG LYS 89 7.154 11.483 -1.806 669 HG3 LYS 89 2HG LYS 89 8.178 11.062 -3.133 670 HD2 LYS 89 1HD LYS 89 5.274 11.924 -3.343 671 HD3 LYS 89 2HD LYS 89 6.701 12.912 -3.676 672 HE2 LYS 89 1HE LYS 89 7.244 10.790 -5.260 673 HE3 LYS 89 2HE LYS 89 5.470 10.719 -5.299 674 HZ1 LYS 89 3HZ LYS 89 7.167 13.029 -6.064 675 HZ2 LYS 89 1HZ LYS 89 5.536 13.107 -6.020 676 HZ3 LYS 89 2HZ LYS 89 6.299 12.132 -7.099 677 H GLY 90 H GLY 90 9.035 6.304 -3.431 678 HA2 GLY 90 1HA GLY 90 7.069 4.648 -1.950 679 HA3 GLY 90 2HA GLY 90 7.755 4.276 -3.535 680 H ILE 91 H ILE 91 9.146 5.189 -0.317 681 HA ILE 91 HA ILE 91 10.533 2.566 -0.228 682 HB ILE 91 HB ILE 91 12.057 5.124 0.356 683 HG12 ILE 91 1HG1 ILE 91 11.956 3.528 -2.217 684 HG13 ILE 91 2HG1 ILE 91 11.458 5.210 -1.975 685 HG21 ILE 91 1HG2 ILE 91 12.704 2.758 1.302 686 HG22 ILE 91 2HG2 ILE 91 13.150 2.385 -0.361 687 HG23 ILE 91 3HG2 ILE 91 13.965 3.708 0.495 688 HD11 ILE 91 3HD1 ILE 91 14.340 4.305 -1.710 689 HD12 ILE 91 1HD1 ILE 91 13.614 4.986 -3.162 690 HD13 ILE 91 2HD1 ILE 91 13.657 5.965 -1.703 691 H TYR 92 H TYR 92 8.338 2.855 1.129 692 HA TYR 92 HA TYR 92 8.777 4.138 3.765 693 HB2 TYR 92 1HB TYR 92 6.473 2.302 3.034 694 HB3 TYR 92 2HB TYR 92 6.569 3.415 4.362 695 HD1 TYR 92 1HD TYR 92 6.182 3.219 0.625 696 HD2 TYR 92 2HD TYR 92 5.980 5.726 4.145 697 HE1 TYR 92 1HE TYR 92 5.159 5.020 -0.709 698 HE2 TYR 92 2HE TYR 92 5.114 7.562 2.757 699 HH TYR 92 HH TYR 92 4.313 7.264 -0.665 700 H GLU 93 H GLU 93 9.422 3.053 5.566 701 HA GLU 93 HA GLU 93 9.992 0.132 5.325 702 HB2 GLU 93 1HB GLU 93 12.002 1.350 5.279 703 HB3 GLU 93 2HB GLU 93 11.450 2.564 6.380 704 HG2 GLU 93 1HG GLU 93 11.579 -0.153 7.619 705 HG3 GLU 93 2HG GLU 93 13.108 0.380 6.940 706 H ILE 94 H ILE 94 8.135 -0.743 6.316 707 HA ILE 94 HA ILE 94 7.301 0.487 8.904 708 HB ILE 94 HB ILE 94 5.234 -0.490 8.777 709 HG12 ILE 94 1HG1 ILE 94 6.052 -1.833 6.182 710 HG13 ILE 94 2HG1 ILE 94 5.820 -2.594 7.730 711 HG21 ILE 94 1HG2 ILE 94 5.794 0.760 6.052 712 HG22 ILE 94 2HG2 ILE 94 4.273 0.781 6.965 713 HG23 ILE 94 3HG2 ILE 94 5.673 1.659 7.587 714 HD11 ILE 94 3HD1 ILE 94 3.822 -2.981 6.429 715 HD12 ILE 94 1HD1 ILE 94 3.430 -1.906 7.777 716 HD13 ILE 94 2HD1 ILE 94 3.607 -1.245 6.140 717 H GLU 95 H GLU 95 7.146 -1.000 10.704 718 HA GLU 95 HA GLU 95 9.053 -3.233 10.402 719 HB2 GLU 95 1HB GLU 95 9.566 -2.880 12.724 720 HB3 GLU 95 2HB GLU 95 9.639 -1.353 11.820 721 HG2 GLU 95 1HG GLU 95 7.383 -0.753 12.708 722 HG3 GLU 95 2HG GLU 95 7.385 -2.235 13.665 723 H ASN 96 H ASN 96 6.125 -3.203 9.953 724 HA ASN 96 HA ASN 96 5.424 -5.658 11.359 725 HB2 ASN 96 1HB ASN 96 3.339 -3.445 11.186 726 HB3 ASN 96 2HB ASN 96 3.410 -4.844 12.241 727 HD21 ASN 96 1HD2 ASN 96 4.282 -1.501 11.882 728 HD22 ASN 96 2HD2 ASN 96 5.024 -1.305 13.457 729 H ASN 97 H ASN 97 3.349 -6.666 10.423 730 HA ASN 97 HA ASN 97 3.674 -6.425 7.507 731 HB2 ASN 97 1HB ASN 97 3.651 -8.692 8.536 732 HB3 ASN 97 2HB ASN 97 2.015 -8.397 9.126 733 HD21 ASN 97 1HD2 ASN 97 3.781 -7.952 5.959 734 HD22 ASN 97 2HD2 ASN 97 2.537 -8.694 5.010 735 H PHE 98 H PHE 98 2.244 -5.483 6.162 736 HA PHE 98 HA PHE 98 -0.054 -4.050 7.119 737 HB2 PHE 98 1HB PHE 98 1.322 -3.382 5.143 738 HB3 PHE 98 2HB PHE 98 0.796 -4.823 4.298 739 HD1 PHE 98 2HD PHE 98 -1.487 -5.033 3.412 740 HD2 PHE 98 1HD PHE 98 -0.199 -1.453 5.460 741 HE1 PHE 98 2HE PHE 98 -3.463 -3.846 2.570 742 HE2 PHE 98 1HE PHE 98 -2.171 -0.245 4.580 743 HZ PHE 98 HZ PHE 98 -3.839 -1.455 3.154 744 H GLU 99 H GLU 99 0.327 -7.182 5.313 745 HA GLU 99 HA GLU 99 -2.435 -7.347 4.740 746 HB2 GLU 99 1HB GLU 99 -0.095 -9.183 4.406 747 HB3 GLU 99 2HB GLU 99 -1.742 -9.765 4.081 748 HG2 GLU 99 1HG GLU 99 -2.169 -7.956 2.508 749 HG3 GLU 99 2HG GLU 99 -0.621 -7.202 2.869 750 H ASP 100 H ASP 100 -0.662 -8.454 7.535 751 HA ASP 100 HA ASP 100 -3.037 -9.926 8.508 752 HB2 ASP 100 1HB ASP 100 -0.486 -10.537 8.867 753 HB3 ASP 100 2HB ASP 100 -0.642 -9.449 10.253 754 H MET 101 H MET 101 -2.128 -6.683 8.433 755 HA MET 101 HA MET 101 -3.597 -6.015 10.927 756 HB2 MET 101 1HB MET 101 -2.038 -4.352 8.924 757 HB3 MET 101 2HB MET 101 -3.113 -3.671 10.155 758 HG2 MET 101 1HG MET 101 -0.998 -5.595 11.015 759 HG3 MET 101 2HG MET 101 -0.587 -3.922 10.641 760 HE1 MET 101 3HE MET 101 -2.186 -5.424 14.550 761 HE2 MET 101 1HE MET 101 -2.446 -6.351 13.053 762 HE3 MET 101 2HE MET 101 -0.797 -5.911 13.561 763 H ILE 102 H ILE 102 -4.016 -6.153 7.392 764 HA ILE 102 HA ILE 102 -6.650 -4.878 7.538 765 HB ILE 102 HB ILE 102 -7.012 -5.834 5.254 766 HG12 ILE 102 1HG1 ILE 102 -4.216 -6.868 5.632 767 HG13 ILE 102 2HG1 ILE 102 -5.659 -7.823 5.308 768 HG21 ILE 102 1HG2 ILE 102 -4.435 -4.264 5.465 769 HG22 ILE 102 2HG2 ILE 102 -5.571 -4.299 4.101 770 HG23 ILE 102 3HG2 ILE 102 -6.117 -3.598 5.610 771 HD11 ILE 102 3HD1 ILE 102 -4.369 -7.765 3.304 772 HD12 ILE 102 1HD1 ILE 102 -5.758 -6.704 3.020 773 HD13 ILE 102 2HD1 ILE 102 -4.157 -6.019 3.381 Start of MODEL 15 1 H1 GLY 1 H GLY 1 8.468 12.555 7.723 2 HA2 GLY 1 1HA GLY 1 6.159 12.536 8.512 3 HA3 GLY 1 2HA GLY 1 6.244 13.057 6.828 4 H SER 2 H SER 2 3.810 12.086 7.610 5 HA SER 2 HA SER 2 3.349 9.354 7.085 6 HB2 SER 2 1HB SER 2 1.476 11.689 6.544 7 HB3 SER 2 2HB SER 2 1.040 10.045 7.033 8 HG SER 2 HG SER 2 2.159 10.470 9.046 9 HA PRO 3 HA PRO 3 2.986 9.451 2.486 10 HB2 PRO 3 1HB PRO 3 0.674 7.952 2.071 11 HB3 PRO 3 2HB PRO 3 2.278 7.271 2.323 12 HG2 PRO 3 1HG PRO 3 0.070 7.585 4.313 13 HG3 PRO 3 2HG PRO 3 1.265 6.254 4.122 14 HD2 PRO 3 1HD PRO 3 1.433 8.194 6.048 15 HD3 PRO 3 2HD PRO 3 2.838 7.367 5.345 16 H ILE 4 H ILE 4 1.231 10.053 0.771 17 HA ILE 4 HA ILE 4 -0.681 12.088 1.737 18 HB ILE 4 HB ILE 4 0.917 11.945 -0.851 19 HG12 ILE 4 1HG1 ILE 4 2.481 12.219 1.136 20 HG13 ILE 4 2HG1 ILE 4 2.556 13.334 -0.163 21 HG21 ILE 4 1HG2 ILE 4 -0.725 14.193 0.385 22 HG22 ILE 4 2HG2 ILE 4 0.323 14.366 -1.047 23 HG23 ILE 4 3HG2 ILE 4 -1.069 13.282 -1.101 24 HD11 ILE 4 3HD1 ILE 4 1.445 15.071 1.160 25 HD12 ILE 4 1HD1 ILE 4 1.013 13.881 2.397 26 HD13 ILE 4 2HD1 ILE 4 2.715 14.343 2.164 27 H LEU 5 H LEU 5 -2.285 10.238 1.832 28 HA LEU 5 HA LEU 5 -2.715 8.723 -0.687 29 HB2 LEU 5 1HB LEU 5 -3.916 8.564 2.116 30 HB3 LEU 5 2HB LEU 5 -4.674 7.780 0.763 31 HG LEU 5 HG LEU 5 -1.967 7.039 0.460 32 HD11 LEU 5 1HD1 LEU 5 -1.248 6.167 2.572 33 HD12 LEU 5 2HD1 LEU 5 -2.751 6.670 3.377 34 HD13 LEU 5 3HD1 LEU 5 -1.596 7.886 2.767 35 HD21 LEU 5 3HD2 LEU 5 -4.144 5.383 1.777 36 HD22 LEU 5 1HD2 LEU 5 -2.740 4.829 0.823 37 HD23 LEU 5 2HD2 LEU 5 -4.037 5.693 0.022 38 HA PRO 6 HA PRO 6 -6.428 11.112 -1.772 39 HB2 PRO 6 1HB PRO 6 -8.234 9.050 -2.299 40 HB3 PRO 6 2HB PRO 6 -7.064 9.667 -3.473 41 HG2 PRO 6 1HG PRO 6 -6.881 7.259 -1.657 42 HG3 PRO 6 2HG PRO 6 -6.451 7.374 -3.398 43 HD2 PRO 6 1HD PRO 6 -4.579 7.479 -1.473 44 HD3 PRO 6 2HD PRO 6 -4.452 8.509 -2.912 45 H LYS 7 H LYS 7 -8.620 11.505 -0.698 46 HA LYS 7 HA LYS 7 -8.837 11.085 1.995 47 HB2 LYS 7 1HB LYS 7 -11.191 11.195 0.094 48 HB3 LYS 7 2HB LYS 7 -11.104 11.759 1.728 49 HG2 LYS 7 1HG LYS 7 -9.226 13.084 -0.279 50 HG3 LYS 7 2HG LYS 7 -10.944 13.344 -0.427 51 HD2 LYS 7 1HD LYS 7 -9.800 15.058 0.986 52 HD3 LYS 7 2HD LYS 7 -11.134 14.158 1.721 53 HE2 LYS 7 1HE LYS 7 -9.472 12.647 2.819 54 HE3 LYS 7 2HE LYS 7 -8.176 13.702 2.224 55 HZ1 LYS 7 3HZ LYS 7 -10.365 14.519 4.019 56 HZ2 LYS 7 1HZ LYS 7 -9.211 15.513 3.455 57 HZ3 LYS 7 2HZ LYS 7 -8.779 14.293 4.477 58 H ALA 8 H ALA 8 -10.595 9.735 3.154 59 HA ALA 8 HA ALA 8 -10.898 7.018 2.075 60 HB1 ALA 8 1HB ALA 8 -12.330 8.460 4.365 61 HB2 ALA 8 2HB ALA 8 -12.436 6.737 3.939 62 HB3 ALA 8 3HB ALA 8 -10.902 7.388 4.505 63 H GLU 9 H GLU 9 -13.104 9.815 2.625 64 HA GLU 9 HA GLU 9 -15.327 8.794 1.561 65 HB2 GLU 9 1HB GLU 9 -16.194 11.051 1.545 66 HB3 GLU 9 2HB GLU 9 -15.102 10.851 2.914 67 HG2 GLU 9 1HG GLU 9 -13.273 11.902 1.511 68 HG3 GLU 9 2HG GLU 9 -14.488 12.244 0.287 69 H ASN 10 H ASN 10 -12.716 10.014 -0.449 70 HA ASN 10 HA ASN 10 -14.429 10.169 -2.786 71 HB2 ASN 10 1HB ASN 10 -12.679 11.234 -3.808 72 HB3 ASN 10 2HB ASN 10 -12.639 11.903 -2.188 73 HD21 ASN 10 1HD2 ASN 10 -11.266 9.225 -1.210 74 HD22 ASN 10 2HD2 ASN 10 -9.657 9.443 -1.709 75 H VAL 11 H VAL 11 -13.034 7.555 -1.328 76 HA VAL 11 HA VAL 11 -11.907 6.244 -3.728 77 HB VAL 11 HB VAL 11 -12.241 5.493 -0.795 78 HG11 VAL 11 1HG1 VAL 11 -12.606 3.411 -2.028 79 HG12 VAL 11 2HG1 VAL 11 -11.097 3.668 -2.933 80 HG13 VAL 11 3HG1 VAL 11 -11.071 3.408 -1.175 81 HG21 VAL 11 3HG2 VAL 11 -10.359 7.000 -1.390 82 HG22 VAL 11 1HG2 VAL 11 -9.768 5.429 -0.843 83 HG23 VAL 11 2HG2 VAL 11 -9.789 5.833 -2.583 84 H ASP 12 H ASP 12 -12.957 4.416 -4.599 85 HA ASP 12 HA ASP 12 -15.909 4.271 -4.028 86 HB2 ASP 12 1HB ASP 12 -15.401 4.979 -6.325 87 HB3 ASP 12 2HB ASP 12 -14.436 3.522 -6.545 88 H SER 13 H SER 13 -12.977 2.237 -4.894 89 HA SER 13 HA SER 13 -13.626 0.683 -2.550 90 HB2 SER 13 1HB SER 13 -13.594 -1.551 -3.820 91 HB3 SER 13 2HB SER 13 -15.090 -0.605 -3.861 92 HG SER 13 HG SER 13 -14.559 0.130 -5.913 93 H ILE 14 H ILE 14 -11.896 -0.981 -2.087 94 HA ILE 14 HA ILE 14 -9.342 -0.411 -3.508 95 HB ILE 14 HB ILE 14 -9.599 -1.149 -0.559 96 HG12 ILE 14 1HG1 ILE 14 -9.111 1.584 -1.832 97 HG13 ILE 14 2HG1 ILE 14 -10.514 1.112 -0.874 98 HG21 ILE 14 1HG2 ILE 14 -7.503 -1.838 -1.762 99 HG22 ILE 14 2HG2 ILE 14 -7.215 -0.149 -2.197 100 HG23 ILE 14 3HG2 ILE 14 -7.187 -0.665 -0.497 101 HD11 ILE 14 3HD1 ILE 14 -9.078 0.838 1.126 102 HD12 ILE 14 1HD1 ILE 14 -7.687 1.431 0.184 103 HD13 ILE 14 2HD1 ILE 14 -9.068 2.487 0.470 104 H CYS 15 H CYS 15 -8.632 -2.229 -4.546 105 HA CYS 15 HA CYS 15 -9.695 -4.865 -3.625 106 HB2 CYS 15 1HB CYS 15 -10.514 -4.799 -5.685 107 HB3 CYS 15 2HB CYS 15 -9.277 -3.681 -6.316 108 HG CYS 15 HG CYS 15 -9.025 -5.775 -7.724 109 H ILE 16 H ILE 16 -8.304 -6.289 -2.807 110 HA ILE 16 HA ILE 16 -5.381 -5.723 -3.196 111 HB ILE 16 HB ILE 16 -6.706 -6.412 -0.565 112 HG12 ILE 16 1HG1 ILE 16 -5.446 -3.880 -1.690 113 HG13 ILE 16 2HG1 ILE 16 -7.103 -4.093 -1.134 114 HG21 ILE 16 1HG2 ILE 16 -3.761 -5.923 -1.202 115 HG22 ILE 16 2HG2 ILE 16 -4.456 -6.243 0.406 116 HG23 ILE 16 3HG2 ILE 16 -4.482 -7.497 -0.815 117 HD11 ILE 16 3HD1 ILE 16 -6.266 -4.342 1.202 118 HD12 ILE 16 1HD1 ILE 16 -4.618 -3.980 0.603 119 HD13 ILE 16 2HD1 ILE 16 -5.890 -2.770 0.456 120 H ASP 17 H ASP 17 -4.444 -7.339 -4.184 121 HA ASP 17 HA ASP 17 -5.348 -10.142 -3.777 122 HB2 ASP 17 1HB ASP 17 -5.091 -9.141 -6.208 123 HB3 ASP 17 2HB ASP 17 -3.362 -9.312 -5.892 124 H PHE 18 H PHE 18 -4.160 -11.146 -2.358 125 HA PHE 18 HA PHE 18 -1.980 -9.849 -0.940 126 HB2 PHE 18 1HB PHE 18 -3.420 -12.532 -0.778 127 HB3 PHE 18 2HB PHE 18 -2.088 -12.132 0.266 128 HD1 PHE 18 1HD PHE 18 -5.295 -10.216 -0.762 129 HD2 PHE 18 2HD PHE 18 -2.766 -11.681 2.444 130 HE1 PHE 18 1HE PHE 18 -6.752 -9.194 0.881 131 HE2 PHE 18 2HE PHE 18 -4.328 -10.747 4.076 132 HZ PHE 18 HZ PHE 18 -6.354 -9.515 3.319 133 H THR 19 H THR 19 -0.030 -11.728 -0.403 134 HA THR 19 HA THR 19 1.438 -12.095 -2.860 135 HB THR 19 HB THR 19 2.859 -13.546 -1.226 136 HG1 THR 19 1HG THR 19 1.124 -13.886 0.295 137 HG21 THR 19 3HG2 THR 19 3.425 -11.227 -1.799 138 HG22 THR 19 1HG2 THR 19 3.753 -11.572 -0.097 139 HG23 THR 19 2HG2 THR 19 2.313 -10.627 -0.542 140 H ASN 20 H ASN 20 -1.316 -13.708 -2.206 141 HA ASN 20 HA ASN 20 -0.283 -16.491 -2.252 142 HB2 ASN 20 1HB ASN 20 -2.855 -15.212 -1.198 143 HB3 ASN 20 2HB ASN 20 -2.574 -16.958 -1.281 144 HD21 ASN 20 1HD2 ASN 20 -3.013 -17.287 0.790 145 HD22 ASN 20 2HD2 ASN 20 -1.884 -16.925 2.027 146 H SER 21 H SER 21 -2.821 -17.597 -2.851 147 HA SER 21 HA SER 21 -3.638 -17.016 -5.575 148 HB2 SER 21 1HB SER 21 -5.151 -18.884 -4.956 149 HB3 SER 21 2HB SER 21 -3.434 -19.278 -4.868 150 HG SER 21 HG SER 21 -5.296 -19.354 -2.906 151 H ILE 22 H ILE 22 -4.196 -15.392 -2.643 152 HA ILE 22 HA ILE 22 -7.161 -15.554 -2.723 153 HB ILE 22 HB ILE 22 -5.326 -14.592 -0.494 154 HG12 ILE 22 1HG1 ILE 22 -6.369 -17.427 -0.984 155 HG13 ILE 22 2HG1 ILE 22 -4.716 -16.909 -0.966 156 HG21 ILE 22 1HG2 ILE 22 -7.239 -15.017 0.999 157 HG22 ILE 22 2HG2 ILE 22 -7.649 -13.852 -0.225 158 HG23 ILE 22 3HG2 ILE 22 -8.204 -15.532 -0.399 159 HD11 ILE 22 3HD1 ILE 22 -5.077 -18.061 1.050 160 HD12 ILE 22 1HD1 ILE 22 -5.024 -16.345 1.500 161 HD13 ILE 22 2HD1 ILE 22 -6.580 -17.199 1.375 162 H GLN 23 H GLN 23 -8.446 -13.700 -2.529 163 HA GLN 23 HA GLN 23 -7.108 -11.064 -2.753 164 HB2 GLN 23 1HB GLN 23 -7.449 -12.020 -5.063 165 HB3 GLN 23 2HB GLN 23 -9.193 -11.935 -4.792 166 HG2 GLN 23 1HG GLN 23 -8.827 -9.442 -4.294 167 HG3 GLN 23 2HG GLN 23 -7.172 -9.646 -4.772 168 HE21 GLN 23 1HE2 GLN 23 -6.638 -10.159 -7.041 169 HE22 GLN 23 2HE2 GLN 23 -7.685 -9.385 -8.221 170 H LYS 24 H LYS 24 -8.181 -9.475 -1.728 171 HA LYS 24 HA LYS 24 -10.992 -9.950 -0.895 172 HB2 LYS 24 1HB LYS 24 -8.731 -10.183 0.843 173 HB3 LYS 24 2HB LYS 24 -9.425 -8.611 1.205 174 HG2 LYS 24 1HG LYS 24 -11.530 -10.637 1.051 175 HG3 LYS 24 2HG LYS 24 -10.215 -11.155 2.086 176 HD2 LYS 24 1HD LYS 24 -11.871 -9.989 3.427 177 HD3 LYS 24 2HD LYS 24 -10.329 -9.139 3.417 178 HE2 LYS 24 1HE LYS 24 -11.860 -7.413 3.079 179 HE3 LYS 24 2HE LYS 24 -11.303 -7.688 1.476 180 HZ1 LYS 24 3HZ LYS 24 -13.496 -7.661 1.176 181 HZ2 LYS 24 1HZ LYS 24 -13.895 -8.347 2.588 182 HZ3 LYS 24 2HZ LYS 24 -13.328 -9.303 1.348 183 H ILE 25 H ILE 25 -12.236 -8.099 -0.958 184 HA ILE 25 HA ILE 25 -10.874 -5.590 -1.780 185 HB ILE 25 HB ILE 25 -13.651 -6.510 -2.529 186 HG12 ILE 25 1HG1 ILE 25 -12.227 -8.237 -3.328 187 HG13 ILE 25 2HG1 ILE 25 -12.799 -7.312 -4.636 188 HG21 ILE 25 1HG2 ILE 25 -13.350 -4.150 -2.954 189 HG22 ILE 25 2HG2 ILE 25 -11.850 -4.460 -3.860 190 HG23 ILE 25 3HG2 ILE 25 -13.390 -5.025 -4.477 191 HD11 ILE 25 3HD1 ILE 25 -10.837 -6.755 -5.331 192 HD12 ILE 25 1HD1 ILE 25 -10.025 -6.891 -3.720 193 HD13 ILE 25 2HD1 ILE 25 -10.529 -8.311 -4.633 194 H TYR 26 H TYR 26 -11.982 -3.657 -1.194 195 HA TYR 26 HA TYR 26 -13.501 -3.857 1.344 196 HB2 TYR 26 1HB TYR 26 -10.925 -2.332 0.846 197 HB3 TYR 26 2HB TYR 26 -11.840 -2.315 2.333 198 HD1 TYR 26 2HD TYR 26 -9.706 -4.367 0.085 199 HD2 TYR 26 1HD TYR 26 -11.565 -4.169 3.981 200 HE1 TYR 26 2HE TYR 26 -8.405 -6.345 0.815 201 HE2 TYR 26 1HE TYR 26 -10.227 -6.087 4.718 202 HH TYR 26 HH TYR 26 -8.425 -7.439 4.263 203 H ASP 27 H ASP 27 -15.339 -3.068 0.127 204 HA ASP 27 HA ASP 27 -15.170 -0.413 -1.177 205 HB2 ASP 27 1HB ASP 27 -17.255 -0.969 -2.182 206 HB3 ASP 27 2HB ASP 27 -16.259 -2.421 -2.329 207 H ASP 28 H ASP 28 -16.239 -1.990 1.759 208 HA ASP 28 HA ASP 28 -18.384 -0.165 2.355 209 HB2 ASP 28 1HB ASP 28 -16.823 -1.554 4.557 210 HB3 ASP 28 2HB ASP 28 -18.521 -1.162 4.478 211 H SER 29 H SER 29 -18.300 1.710 3.648 212 HA SER 29 HA SER 29 -16.021 3.304 3.907 213 HB2 SER 29 1HB SER 29 -18.063 4.371 4.201 214 HB3 SER 29 2HB SER 29 -18.687 3.136 5.296 215 HG SER 29 HG SER 29 -17.562 3.959 6.963 216 H GLU 30 H GLU 30 -17.295 0.951 6.306 217 HA GLU 30 HA GLU 30 -15.288 1.573 8.249 218 HB2 GLU 30 1HB GLU 30 -17.606 0.383 8.487 219 HB3 GLU 30 2HB GLU 30 -16.753 -1.082 8.025 220 HG2 GLU 30 1HG GLU 30 -16.862 -1.013 10.412 221 HG3 GLU 30 2HG GLU 30 -15.184 -0.700 9.978 222 H SER 31 H SER 31 -15.289 -0.596 5.493 223 HA SER 31 HA SER 31 -12.996 -2.203 6.264 224 HB2 SER 31 1HB SER 31 -14.534 -1.835 3.658 225 HB3 SER 31 2HB SER 31 -13.247 -3.008 3.900 226 HG SER 31 HG SER 31 -15.674 -3.531 4.327 227 H ILE 32 H ILE 32 -13.615 0.521 3.996 228 HA ILE 32 HA ILE 32 -10.930 0.922 3.105 229 HB ILE 32 HB ILE 32 -13.377 2.706 3.369 230 HG12 ILE 32 1HG1 ILE 32 -12.162 1.483 0.853 231 HG13 ILE 32 2HG1 ILE 32 -13.447 0.708 1.768 232 HG21 ILE 32 1HG2 ILE 32 -11.369 4.131 3.347 233 HG22 ILE 32 2HG2 ILE 32 -10.764 3.285 1.898 234 HG23 ILE 32 3HG2 ILE 32 -12.236 4.296 1.830 235 HD11 ILE 32 3HD1 ILE 32 -14.912 2.691 1.425 236 HD12 ILE 32 1HD1 ILE 32 -13.662 3.423 0.401 237 HD13 ILE 32 2HD1 ILE 32 -14.426 1.901 -0.091 238 H GLN 33 H GLN 33 -12.796 2.368 5.858 239 HA GLN 33 HA GLN 33 -10.706 4.059 6.645 240 HB2 GLN 33 1HB GLN 33 -13.177 2.991 7.978 241 HB3 GLN 33 2HB GLN 33 -11.981 3.717 9.032 242 HG2 GLN 33 1HG GLN 33 -13.072 5.099 6.561 243 HG3 GLN 33 2HG GLN 33 -13.726 5.284 8.187 244 HE21 GLN 33 1HE2 GLN 33 -10.330 5.031 8.645 245 HE22 GLN 33 2HE2 GLN 33 -9.999 6.744 8.599 246 H LYS 34 H LYS 34 -10.968 0.609 7.328 247 HA LYS 34 HA LYS 34 -8.917 0.590 9.406 248 HB2 LYS 34 1HB LYS 34 -10.325 -1.377 9.122 249 HB3 LYS 34 2HB LYS 34 -9.927 -1.472 7.412 250 HG2 LYS 34 1HG LYS 34 -7.401 -1.661 8.523 251 HG3 LYS 34 2HG LYS 34 -8.366 -2.403 9.780 252 HD2 LYS 34 1HD LYS 34 -8.469 -3.136 6.815 253 HD3 LYS 34 2HD LYS 34 -7.428 -3.906 8.019 254 HE2 LYS 34 1HE LYS 34 -9.227 -4.690 9.358 255 HE3 LYS 34 2HE LYS 34 -10.440 -3.784 8.459 256 HZ1 LYS 34 3HZ LYS 34 -10.152 -6.273 8.096 257 HZ2 LYS 34 1HZ LYS 34 -8.914 -5.953 7.125 258 HZ3 LYS 34 2HZ LYS 34 -10.429 -5.335 6.788 259 H ILE 35 H ILE 35 -8.920 -0.075 5.877 260 HA ILE 35 HA ILE 35 -6.238 -0.553 5.692 261 HB ILE 35 HB ILE 35 -8.140 0.573 3.596 262 HG12 ILE 35 1HG1 ILE 35 -6.929 -2.191 4.098 263 HG13 ILE 35 2HG1 ILE 35 -8.561 -1.716 4.554 264 HG21 ILE 35 1HG2 ILE 35 -5.783 1.178 2.957 265 HG22 ILE 35 2HG2 ILE 35 -5.328 -0.527 3.120 266 HG23 ILE 35 3HG2 ILE 35 -6.473 0.002 1.874 267 HD11 ILE 35 3HD1 ILE 35 -7.570 -1.827 1.673 268 HD12 ILE 35 1HD1 ILE 35 -8.495 -3.043 2.521 269 HD13 ILE 35 2HD1 ILE 35 -9.211 -1.432 2.232 270 H LEU 36 H LEU 36 -7.850 2.684 5.153 271 HA LEU 36 HA LEU 36 -5.366 4.046 4.679 272 HB2 LEU 36 1HB LEU 36 -8.169 4.900 5.489 273 HB3 LEU 36 2HB LEU 36 -6.871 6.076 5.487 274 HG LEU 36 HG LEU 36 -6.712 4.560 2.995 275 HD11 LEU 36 1HD1 LEU 36 -9.435 5.755 3.579 276 HD12 LEU 36 2HD1 LEU 36 -9.028 4.057 3.241 277 HD13 LEU 36 3HD1 LEU 36 -8.842 5.274 1.971 278 HD21 LEU 36 3HD2 LEU 36 -5.836 6.872 3.412 279 HD22 LEU 36 1HD2 LEU 36 -7.523 7.444 3.513 280 HD23 LEU 36 2HD2 LEU 36 -6.903 6.788 1.990 281 H SER 37 H SER 37 -6.506 2.870 7.750 282 HA SER 37 HA SER 37 -4.720 4.667 9.255 283 HB2 SER 37 1HB SER 37 -6.845 3.507 10.218 284 HB3 SER 37 2HB SER 37 -5.849 2.038 10.272 285 HG SER 37 HG SER 37 -5.649 4.453 11.647 286 H GLU 38 H GLU 38 -4.911 1.173 8.408 287 HA GLU 38 HA GLU 38 -2.298 0.479 9.165 288 HB2 GLU 38 1HB GLU 38 -4.199 -0.805 7.143 289 HB3 GLU 38 2HB GLU 38 -2.762 -1.581 7.800 290 HG2 GLU 38 1HG GLU 38 -5.243 -0.752 9.343 291 HG3 GLU 38 2HG GLU 38 -4.706 -2.388 8.989 292 H ILE 39 H ILE 39 -3.188 2.270 6.451 293 HA ILE 39 HA ILE 39 -0.594 1.756 5.080 294 HB ILE 39 HB ILE 39 -3.326 2.711 4.174 295 HG12 ILE 39 1HG1 ILE 39 -3.078 0.318 4.267 296 HG13 ILE 39 2HG1 ILE 39 -3.221 0.832 2.609 297 HG21 ILE 39 1HG2 ILE 39 -0.803 2.866 2.582 298 HG22 ILE 39 2HG2 ILE 39 -2.438 2.782 1.868 299 HG23 ILE 39 3HG2 ILE 39 -2.025 4.126 2.957 300 HD11 ILE 39 3HD1 ILE 39 -1.504 -0.867 2.686 301 HD12 ILE 39 1HD1 ILE 39 -0.708 0.651 2.323 302 HD13 ILE 39 2HD1 ILE 39 -0.618 -0.038 3.958 303 H ALA 40 H ALA 40 -2.074 4.091 7.099 304 HA ALA 40 HA ALA 40 -0.357 6.300 6.062 305 HB1 ALA 40 1HB ALA 40 -2.613 6.898 6.810 306 HB2 ALA 40 2HB ALA 40 -2.278 6.185 8.414 307 HB3 ALA 40 3HB ALA 40 -1.386 7.624 7.871 308 H THR 41 H THR 41 -0.096 3.640 8.139 309 HA THR 41 HA THR 41 1.283 4.729 10.299 310 HB THR 41 HB THR 41 -0.008 2.690 10.256 311 HG1 THR 41 1HG THR 41 1.051 1.855 11.775 312 HG21 THR 41 3HG2 THR 41 0.867 0.608 9.368 313 HG22 THR 41 1HG2 THR 41 2.306 1.443 8.739 314 HG23 THR 41 2HG2 THR 41 0.705 1.808 8.082 315 H GLY 42 H GLY 42 2.578 3.699 7.136 316 HA2 GLY 42 1HA GLY 42 5.312 3.498 8.080 317 HA3 GLY 42 2HA GLY 42 4.702 3.341 6.423 318 H LYS 43 H LYS 43 7.057 4.656 6.877 319 HA LYS 43 HA LYS 43 6.392 7.478 6.205 320 HB2 LYS 43 1HB LYS 43 8.630 6.428 7.998 321 HB3 LYS 43 2HB LYS 43 8.542 8.058 7.354 322 HG2 LYS 43 1HG LYS 43 7.544 8.556 9.265 323 HG3 LYS 43 2HG LYS 43 6.076 7.991 8.499 324 HD2 LYS 43 1HD LYS 43 6.276 5.823 9.606 325 HD3 LYS 43 2HD LYS 43 7.867 6.235 10.248 326 HE2 LYS 43 1HE LYS 43 5.351 7.824 10.918 327 HE3 LYS 43 2HE LYS 43 5.863 6.406 11.837 328 HZ1 LYS 43 3HZ LYS 43 6.658 8.408 12.864 329 HZ2 LYS 43 1HZ LYS 43 7.497 8.858 11.529 330 HZ3 LYS 43 2HZ LYS 43 7.931 7.502 12.339 331 H ARG 44 H ARG 44 7.133 7.863 4.157 332 HA ARG 44 HA ARG 44 8.786 5.972 2.811 333 HB2 ARG 44 1HB ARG 44 8.751 7.398 0.882 334 HB3 ARG 44 2HB ARG 44 7.180 7.200 1.574 335 HG2 ARG 44 1HG ARG 44 7.899 9.502 2.842 336 HG3 ARG 44 2HG ARG 44 8.897 9.653 1.373 337 HD2 ARG 44 1HD ARG 44 6.738 9.043 0.110 338 HD3 ARG 44 2HD ARG 44 5.900 9.254 1.654 339 HE ARG 44 HE ARG 44 7.415 11.605 1.130 340 HH11 ARG 44 1HH1 ARG 44 4.565 9.844 0.005 341 HH12 ARG 44 2HH1 ARG 44 3.893 11.134 -0.915 342 HH21 ARG 44 1HH2 ARG 44 6.463 13.427 0.207 343 HH22 ARG 44 2HH2 ARG 44 4.951 13.379 -0.615 344 H THR 45 H THR 45 9.826 7.944 5.112 345 HA THR 45 HA THR 45 11.793 8.837 5.741 346 HB THR 45 HB THR 45 13.805 7.734 5.136 347 HG1 THR 45 1HG THR 45 12.434 6.965 2.809 348 HG21 THR 45 3HG2 THR 45 13.316 5.403 5.373 349 HG22 THR 45 1HG2 THR 45 11.646 5.598 4.826 350 HG23 THR 45 2HG2 THR 45 12.158 6.307 6.371 351 H GLU 46 H GLU 46 13.995 9.859 4.263 352 HA GLU 46 HA GLU 46 12.753 11.370 2.031 353 HB2 GLU 46 1HB GLU 46 14.870 12.152 4.043 354 HB3 GLU 46 2HB GLU 46 14.819 12.868 2.427 355 HG2 GLU 46 1HG GLU 46 12.435 13.475 2.748 356 HG3 GLU 46 2HG GLU 46 12.486 12.824 4.384 357 H LYS 47 H LYS 47 14.203 8.518 2.332 358 HA LYS 47 HA LYS 47 16.205 8.733 0.245 359 HB2 LYS 47 1HB LYS 47 14.269 6.492 0.962 360 HB3 LYS 47 2HB LYS 47 15.606 6.341 -0.148 361 HG2 LYS 47 1HG LYS 47 16.414 7.302 2.538 362 HG3 LYS 47 2HG LYS 47 15.645 5.723 2.502 363 HD2 LYS 47 1HD LYS 47 18.169 5.749 2.407 364 HD3 LYS 47 2HD LYS 47 17.349 4.747 1.194 365 HE2 LYS 47 1HE LYS 47 17.823 6.183 -0.559 366 HE3 LYS 47 2HE LYS 47 17.940 7.589 0.493 367 HZ1 LYS 47 3HZ LYS 47 20.115 6.922 1.148 368 HZ2 LYS 47 1HZ LYS 47 20.064 6.787 -0.481 369 HZ3 LYS 47 2HZ LYS 47 19.967 5.436 0.429 370 H GLN 48 H GLN 48 15.736 8.088 -2.020 371 HA GLN 48 HA GLN 48 12.999 8.865 -2.896 372 HB2 GLN 48 1HB GLN 48 13.807 9.997 -4.786 373 HB3 GLN 48 2HB GLN 48 14.472 10.708 -3.317 374 HG2 GLN 48 1HG GLN 48 16.627 9.474 -3.798 375 HG3 GLN 48 2HG GLN 48 15.910 8.918 -5.310 376 HE21 GLN 48 1HE2 GLN 48 15.751 12.232 -3.763 377 HE22 GLN 48 2HE2 GLN 48 16.729 12.950 -5.034 378 H SER 49 H SER 49 12.020 7.580 -4.183 379 HA SER 49 HA SER 49 13.203 5.093 -5.190 380 HB2 SER 49 1HB SER 49 11.082 4.519 -4.848 381 HB3 SER 49 2HB SER 49 10.486 6.216 -4.709 382 HG SER 49 HG SER 49 9.776 4.717 -6.514 383 H ILE 50 H ILE 50 13.249 4.796 -7.529 384 HA ILE 50 HA ILE 50 13.048 7.189 -9.231 385 HB ILE 50 HB ILE 50 15.077 6.549 -10.456 386 HG12 ILE 50 1HG1 ILE 50 15.975 4.858 -8.102 387 HG13 ILE 50 2HG1 ILE 50 15.030 4.115 -9.392 388 HG21 ILE 50 1HG2 ILE 50 16.683 7.581 -8.979 389 HG22 ILE 50 2HG2 ILE 50 15.114 8.361 -8.755 390 HG23 ILE 50 3HG2 ILE 50 15.705 7.199 -7.552 391 HD11 ILE 50 3HD1 ILE 50 17.568 5.678 -9.914 392 HD12 ILE 50 1HD1 ILE 50 17.476 3.911 -9.726 393 HD13 ILE 50 2HD1 ILE 50 16.626 4.712 -11.070 394 H GLN 51 H GLN 51 11.624 4.389 -8.546 395 HA GLN 51 HA GLN 51 11.439 3.452 -11.341 396 HB2 GLN 51 1HB GLN 51 10.961 1.209 -9.938 397 HB3 GLN 51 2HB GLN 51 12.532 1.681 -10.555 398 HG2 GLN 51 1HG GLN 51 12.735 0.792 -8.409 399 HG3 GLN 51 2HG GLN 51 13.166 2.502 -8.281 400 HE21 GLN 51 1HE2 GLN 51 10.179 0.382 -7.880 401 HE22 GLN 51 2HE2 GLN 51 9.617 1.253 -6.516 402 H ASP 52 H ASP 52 9.510 1.885 -11.435 403 HA ASP 52 HA ASP 52 7.106 3.410 -10.511 404 HB2 ASP 52 1HB ASP 52 7.859 2.017 -13.113 405 HB3 ASP 52 2HB ASP 52 6.176 2.213 -12.682 406 H TYR 53 H TYR 53 8.763 0.456 -10.102 407 HA TYR 53 HA TYR 53 6.359 -1.029 -9.327 408 HB2 TYR 53 1HB TYR 53 8.132 -1.671 -11.697 409 HB3 TYR 53 2HB TYR 53 7.691 -3.006 -10.668 410 HD1 TYR 53 1HD TYR 53 6.099 -0.177 -12.557 411 HD2 TYR 53 2HD TYR 53 5.716 -4.197 -11.052 412 HE1 TYR 53 1HE TYR 53 3.937 -0.318 -13.622 413 HE2 TYR 53 2HE TYR 53 3.558 -4.422 -12.177 414 HH TYR 53 HH TYR 53 2.149 -1.792 -14.176 415 HA PRO 54 HA PRO 54 9.050 -2.289 -6.159 416 HB2 PRO 54 1HB PRO 54 8.312 -4.817 -5.468 417 HB3 PRO 54 2HB PRO 54 7.223 -3.386 -5.280 418 HG2 PRO 54 1HG PRO 54 7.264 -5.400 -7.510 419 HG3 PRO 54 2HG PRO 54 5.894 -4.842 -6.465 420 HD2 PRO 54 1HD PRO 54 6.480 -3.773 -8.964 421 HD3 PRO 54 2HD PRO 54 5.819 -2.764 -7.654 422 H SER 55 H SER 55 10.696 -3.825 -5.363 423 HA SER 55 HA SER 55 12.390 -4.669 -7.593 424 HB2 SER 55 1HB SER 55 12.810 -3.155 -5.366 425 HB3 SER 55 2HB SER 55 13.403 -4.733 -4.798 426 HG SER 55 HG SER 55 14.164 -3.195 -7.058 427 H ALA 56 H ALA 56 10.021 -6.289 -6.288 428 HA ALA 56 HA ALA 56 11.503 -8.676 -5.261 429 HB1 ALA 56 1HB ALA 56 8.783 -7.502 -4.675 430 HB2 ALA 56 2HB ALA 56 9.135 -9.202 -4.314 431 HB3 ALA 56 3HB ALA 56 10.127 -7.942 -3.590 432 H GLU 57 H GLU 57 10.634 -10.810 -5.642 433 HA GLU 57 HA GLU 57 9.527 -11.333 -8.304 434 HB2 GLU 57 1HB GLU 57 11.158 -12.719 -6.354 435 HB3 GLU 57 2HB GLU 57 9.653 -13.617 -6.478 436 HG2 GLU 57 1HG GLU 57 11.440 -12.802 -8.772 437 HG3 GLU 57 2HG GLU 57 11.406 -14.402 -8.020 438 H GLU 58 H GLU 58 8.570 -11.139 -4.893 439 HA GLU 58 HA GLU 58 5.840 -12.116 -5.532 440 HB2 GLU 58 1HB GLU 58 5.932 -13.346 -3.419 441 HB3 GLU 58 2HB GLU 58 7.137 -13.885 -4.586 442 HG2 GLU 58 1HG GLU 58 8.533 -11.977 -3.067 443 HG3 GLU 58 2HG GLU 58 7.494 -12.749 -1.895 444 H TYR 59 H TYR 59 4.494 -10.476 -5.301 445 HA TYR 59 HA TYR 59 4.526 -8.837 -2.870 446 HB2 TYR 59 1HB TYR 59 4.293 -6.774 -4.330 447 HB3 TYR 59 2HB TYR 59 5.893 -7.461 -4.232 448 HD1 TYR 59 2HD TYR 59 2.913 -7.245 -6.449 449 HD2 TYR 59 1HD TYR 59 7.119 -8.115 -6.172 450 HE1 TYR 59 2HE TYR 59 3.101 -7.127 -8.917 451 HE2 TYR 59 1HE TYR 59 7.329 -7.958 -8.631 452 HH TYR 59 HH TYR 59 4.556 -7.870 -10.756 453 H GLY 60 H GLY 60 2.472 -7.646 -2.658 454 HA2 GLY 60 1HA GLY 60 0.196 -9.113 -3.879 455 HA3 GLY 60 2HA GLY 60 0.121 -7.931 -2.562 456 H THR 61 H THR 61 -1.558 -7.858 -4.832 457 HA THR 61 HA THR 61 -0.633 -5.453 -6.332 458 HB THR 61 HB THR 61 -3.203 -6.867 -6.988 459 HG1 THR 61 1HG THR 61 -0.668 -7.957 -7.519 460 HG21 THR 61 3HG2 THR 61 -1.038 -5.550 -8.685 461 HG22 THR 61 1HG2 THR 61 -2.561 -4.815 -8.153 462 HG23 THR 61 2HG2 THR 61 -2.592 -6.175 -9.283 463 H ILE 62 H ILE 62 -1.654 -3.498 -5.872 464 HA ILE 62 HA ILE 62 -4.226 -3.583 -4.371 465 HB ILE 62 HB ILE 62 -1.947 -1.647 -3.889 466 HG12 ILE 62 1HG1 ILE 62 -2.339 -2.853 -1.483 467 HG13 ILE 62 2HG1 ILE 62 -2.704 -4.212 -2.506 468 HG21 ILE 62 1HG2 ILE 62 -3.336 -0.835 -2.030 469 HG22 ILE 62 2HG2 ILE 62 -4.119 -0.588 -3.579 470 HG23 ILE 62 3HG2 ILE 62 -4.652 -1.914 -2.527 471 HD11 ILE 62 3HD1 ILE 62 -0.498 -3.968 -3.627 472 HD12 ILE 62 1HD1 ILE 62 -0.163 -2.515 -2.675 473 HD13 ILE 62 2HD1 ILE 62 -0.294 -4.118 -1.891 474 H ASN 63 H ASN 63 -5.760 -2.589 -5.491 475 HA ASN 63 HA ASN 63 -5.036 -0.168 -7.054 476 HB2 ASN 63 1HB ASN 63 -7.784 -0.870 -7.480 477 HB3 ASN 63 2HB ASN 63 -6.532 -0.595 -8.623 478 HD21 ASN 63 1HD2 ASN 63 -4.928 -2.862 -8.654 479 HD22 ASN 63 2HD2 ASN 63 -5.957 -4.286 -8.773 480 H ILE 64 H ILE 64 -5.890 1.675 -6.239 481 HA ILE 64 HA ILE 64 -8.152 1.508 -4.289 482 HB ILE 64 HB ILE 64 -6.121 3.742 -4.662 483 HG12 ILE 64 1HG1 ILE 64 -6.422 2.042 -2.161 484 HG13 ILE 64 2HG1 ILE 64 -5.201 1.742 -3.397 485 HG21 ILE 64 1HG2 ILE 64 -8.352 3.537 -2.605 486 HG22 ILE 64 2HG2 ILE 64 -7.264 4.916 -2.862 487 HG23 ILE 64 3HG2 ILE 64 -8.455 4.479 -4.090 488 HD11 ILE 64 3HD1 ILE 64 -4.292 4.039 -3.071 489 HD12 ILE 64 1HD1 ILE 64 -5.419 4.259 -1.712 490 HD13 ILE 64 2HD1 ILE 64 -4.173 3.003 -1.638 491 H GLU 65 H GLU 65 -9.909 1.701 -5.670 492 HA GLU 65 HA GLU 65 -9.733 3.326 -8.124 493 HB2 GLU 65 1HB GLU 65 -10.954 1.189 -8.199 494 HB3 GLU 65 2HB GLU 65 -12.033 1.708 -6.900 495 HG2 GLU 65 1HG GLU 65 -13.146 3.209 -8.229 496 HG3 GLU 65 2HG GLU 65 -11.775 3.555 -9.266 497 H ASN 66 H ASN 66 -10.521 5.367 -8.193 498 HA ASN 66 HA ASN 66 -12.172 6.546 -6.085 499 HB2 ASN 66 1HB ASN 66 -10.584 8.344 -5.577 500 HB3 ASN 66 2HB ASN 66 -10.127 6.793 -4.963 501 HD21 ASN 66 1HD2 ASN 66 -8.160 5.967 -5.468 502 HD22 ASN 66 2HD2 ASN 66 -6.960 6.779 -6.443 503 H ASN 67 H ASN 67 -11.831 9.057 -6.865 504 HA ASN 67 HA ASN 67 -13.844 9.331 -8.697 505 HB2 ASN 67 1HB ASN 67 -13.311 11.797 -8.324 506 HB3 ASN 67 2HB ASN 67 -13.837 10.823 -6.958 507 HD21 ASN 67 1HD2 ASN 67 -12.051 9.953 -5.475 508 HD22 ASN 67 2HD2 ASN 67 -10.777 11.060 -5.121 509 H GLY 68 H GLY 68 -12.862 8.266 -10.412 510 HA2 GLY 68 1HA GLY 68 -12.292 8.511 -12.725 511 HA3 GLY 68 2HA GLY 68 -11.690 10.140 -12.344 512 H GLY 69 H GLY 69 -10.521 8.119 -10.004 513 HA2 GLY 69 1HA GLY 69 -7.895 8.033 -11.421 514 HA3 GLY 69 2HA GLY 69 -8.102 8.384 -9.705 515 H MET 70 H MET 70 -6.413 6.438 -10.854 516 HA MET 70 HA MET 70 -7.277 4.341 -9.015 517 HB2 MET 70 1HB MET 70 -6.558 2.512 -10.261 518 HB3 MET 70 2HB MET 70 -7.542 3.446 -11.397 519 HG2 MET 70 1HG MET 70 -5.202 4.482 -12.058 520 HG3 MET 70 2HG MET 70 -4.557 3.051 -11.254 521 HE1 MET 70 3HE MET 70 -7.310 1.091 -12.470 522 HE2 MET 70 1HE MET 70 -6.230 0.209 -13.566 523 HE3 MET 70 2HE MET 70 -5.701 0.596 -11.913 524 H THR 71 H THR 71 -5.772 4.001 -7.561 525 HA THR 71 HA THR 71 -3.100 5.293 -7.935 526 HB THR 71 HB THR 71 -4.629 4.979 -5.345 527 HG1 THR 71 1HG THR 71 -4.767 7.391 -5.708 528 HG21 THR 71 3HG2 THR 71 -2.345 6.859 -6.031 529 HG22 THR 71 1HG2 THR 71 -2.132 5.300 -5.211 530 HG23 THR 71 2HG2 THR 71 -3.077 6.581 -4.438 531 H THR 72 H THR 72 -2.089 3.464 -8.745 532 HA THR 72 HA THR 72 -2.503 0.856 -7.568 533 HB THR 72 HB THR 72 -0.575 1.814 -9.726 534 HG1 THR 72 1HG THR 72 -2.986 0.609 -10.430 535 HG21 THR 72 3HG2 THR 72 -0.051 -0.462 -9.022 536 HG22 THR 72 1HG2 THR 72 -0.873 -0.551 -10.583 537 HG23 THR 72 2HG2 THR 72 -1.756 -0.926 -9.088 538 H MET 73 H MET 73 -1.090 -0.275 -6.252 539 HA MET 73 HA MET 73 1.685 0.520 -5.967 540 HB2 MET 73 1HB MET 73 1.576 0.633 -3.463 541 HB3 MET 73 2HB MET 73 0.885 1.974 -4.321 542 HG2 MET 73 1HG MET 73 -1.415 0.790 -3.950 543 HG3 MET 73 2HG MET 73 -0.549 -0.193 -2.789 544 HE1 MET 73 3HE MET 73 -1.960 3.087 -3.860 545 HE2 MET 73 1HE MET 73 -1.533 4.285 -2.602 546 HE3 MET 73 2HE MET 73 -0.285 3.688 -3.727 547 H PHE 74 H PHE 74 2.752 -1.120 -4.321 548 HA PHE 74 HA PHE 74 1.507 -3.783 -4.398 549 HB2 PHE 74 1HB PHE 74 4.307 -3.207 -5.443 550 HB3 PHE 74 2HB PHE 74 3.497 -4.759 -5.375 551 HD1 PHE 74 1HD PHE 74 3.772 -1.548 -7.196 552 HD2 PHE 74 2HD PHE 74 1.831 -5.399 -7.088 553 HE1 PHE 74 1HE PHE 74 3.001 -1.222 -9.522 554 HE2 PHE 74 2HE PHE 74 1.137 -5.110 -9.443 555 HZ PHE 74 HZ PHE 74 1.674 -3.001 -10.659 556 H TYR 75 H TYR 75 2.474 -5.074 -2.530 557 HA TYR 75 HA TYR 75 4.536 -3.601 -0.963 558 HB2 TYR 75 1HB TYR 75 2.510 -5.177 0.541 559 HB3 TYR 75 2HB TYR 75 3.490 -3.851 1.069 560 HD1 TYR 75 1HD TYR 75 2.671 -1.619 -0.785 561 HD2 TYR 75 2HD TYR 75 0.329 -4.688 1.108 562 HE1 TYR 75 1HE TYR 75 0.694 -0.129 -0.837 563 HE2 TYR 75 2HE TYR 75 -1.639 -3.225 1.015 564 HH TYR 75 HH TYR 75 -2.415 -1.158 0.564 565 H TYR 76 H TYR 76 5.973 -5.042 0.238 566 HA TYR 76 HA TYR 76 5.628 -7.894 -0.048 567 HB2 TYR 76 1HB TYR 76 7.791 -8.310 -1.187 568 HB3 TYR 76 2HB TYR 76 6.526 -7.644 -2.173 569 HD1 TYR 76 2HD TYR 76 6.606 -5.130 -2.802 570 HD2 TYR 76 1HD TYR 76 9.927 -7.314 -1.129 571 HE1 TYR 76 2HE TYR 76 8.157 -3.266 -3.376 572 HE2 TYR 76 1HE TYR 76 11.507 -5.617 -2.034 573 HH TYR 76 HH TYR 76 11.082 -2.806 -2.623 574 H GLU 77 H GLU 77 7.576 -9.088 1.086 575 HA GLU 77 HA GLU 77 8.762 -7.443 3.274 576 HB2 GLU 77 1HB GLU 77 7.913 -9.911 3.626 577 HB3 GLU 77 2HB GLU 77 9.345 -10.389 2.741 578 HG2 GLU 77 1HG GLU 77 10.770 -9.102 4.371 579 HG3 GLU 77 2HG GLU 77 9.328 -8.710 5.295 580 H GLU 78 H GLU 78 10.940 -6.915 3.253 581 HA GLU 78 HA GLU 78 12.670 -8.479 1.543 582 HB2 GLU 78 1HB GLU 78 12.211 -6.571 0.099 583 HB3 GLU 78 2HB GLU 78 12.750 -5.435 1.348 584 HG2 GLU 78 1HG GLU 78 15.004 -6.145 1.187 585 HG3 GLU 78 2HG GLU 78 14.554 -7.711 0.541 586 H ASN 79 H ASN 79 13.938 -9.354 2.987 587 HA ASN 79 HA ASN 79 15.673 -9.596 4.378 588 HB2 ASN 79 1HB ASN 79 16.085 -6.815 3.454 589 HB3 ASN 79 2HB ASN 79 16.756 -7.108 5.041 590 HD21 ASN 79 1HD2 ASN 79 16.863 -8.279 1.653 591 HD22 ASN 79 2HD2 ASN 79 18.416 -9.079 1.840 592 H GLY 80 H GLY 80 12.832 -8.625 5.358 593 HA2 GLY 80 1HA GLY 80 12.228 -9.492 7.530 594 HA3 GLY 80 2HA GLY 80 13.616 -8.683 8.239 595 H LYS 81 H LYS 81 12.596 -6.429 6.079 596 HA LYS 81 HA LYS 81 10.509 -5.243 7.838 597 HB2 LYS 81 1HB LYS 81 12.846 -4.102 6.389 598 HB3 LYS 81 2HB LYS 81 11.309 -3.310 6.060 599 HG2 LYS 81 1HG LYS 81 12.231 -2.145 7.833 600 HG3 LYS 81 2HG LYS 81 10.927 -3.106 8.539 601 HD2 LYS 81 1HD LYS 81 12.681 -4.736 9.345 602 HD3 LYS 81 2HD LYS 81 13.915 -3.638 8.665 603 HE2 LYS 81 1HE LYS 81 12.696 -1.783 10.069 604 HE3 LYS 81 2HE LYS 81 11.944 -3.128 10.933 605 HZ1 LYS 81 3HZ LYS 81 14.347 -3.895 11.282 606 HZ2 LYS 81 1HZ LYS 81 13.864 -2.526 12.101 607 HZ3 LYS 81 2HZ LYS 81 14.781 -2.408 10.754 608 H TYR 82 H TYR 82 8.701 -4.293 6.705 609 HA TYR 82 HA TYR 82 8.373 -5.341 3.927 610 HB2 TYR 82 1HB TYR 82 6.283 -4.491 5.942 611 HB3 TYR 82 2HB TYR 82 5.972 -5.127 4.346 612 HD1 TYR 82 2HD TYR 82 7.274 -5.889 7.762 613 HD2 TYR 82 1HD TYR 82 6.005 -7.590 3.994 614 HE1 TYR 82 2HE TYR 82 7.457 -8.112 8.736 615 HE2 TYR 82 1HE TYR 82 6.202 -9.851 4.973 616 HH TYR 82 HH TYR 82 7.698 -10.897 6.689 617 H TYR 83 H TYR 83 7.498 -3.879 2.357 618 HA TYR 83 HA TYR 83 7.595 -1.070 3.089 619 HB2 TYR 83 1HB TYR 83 9.182 -2.037 0.705 620 HB3 TYR 83 2HB TYR 83 9.117 -0.420 1.345 621 HD1 TYR 83 2HD TYR 83 10.280 -3.907 2.181 622 HD2 TYR 83 1HD TYR 83 10.742 0.316 2.949 623 HE1 TYR 83 2HE TYR 83 12.273 -4.409 3.452 624 HE2 TYR 83 1HE TYR 83 12.742 -0.187 4.360 625 HH TYR 83 HH TYR 83 14.018 -3.538 4.581 626 H ILE 84 H ILE 84 6.792 0.324 1.325 627 HA ILE 84 HA ILE 84 4.584 -1.030 -0.151 628 HB ILE 84 HB ILE 84 4.532 1.461 1.586 629 HG12 ILE 84 1HG1 ILE 84 2.369 0.273 2.383 630 HG13 ILE 84 2HG1 ILE 84 3.016 -1.163 1.613 631 HG21 ILE 84 1HG2 ILE 84 2.104 1.707 0.749 632 HG22 ILE 84 2HG2 ILE 84 3.408 2.298 -0.276 633 HG23 ILE 84 3HG2 ILE 84 2.657 0.758 -0.656 634 HD11 ILE 84 3HD1 ILE 84 3.379 -0.944 4.058 635 HD12 ILE 84 1HD1 ILE 84 4.837 -1.275 3.151 636 HD13 ILE 84 2HD1 ILE 84 4.521 0.380 3.739 637 H GLU 85 H GLU 85 5.188 -0.968 -2.251 638 HA GLU 85 HA GLU 85 6.958 0.979 -3.316 639 HB2 GLU 85 1HB GLU 85 6.916 -1.137 -4.330 640 HB3 GLU 85 2HB GLU 85 5.160 -1.150 -4.487 641 HG2 GLU 85 1HG GLU 85 6.198 -0.925 -6.629 642 HG3 GLU 85 2HG GLU 85 5.176 0.436 -6.262 643 H CYS 86 H CYS 86 6.636 2.613 -4.734 644 HA CYS 86 HA CYS 86 4.190 3.787 -5.566 645 HB2 CYS 86 1HB CYS 86 5.315 4.512 -2.939 646 HB3 CYS 86 2HB CYS 86 5.170 5.954 -3.963 647 HG CYS 86 HG CYS 86 3.005 3.516 -3.394 648 HA PRO 87 HA PRO 87 7.412 5.709 -8.241 649 HB2 PRO 87 1HB PRO 87 6.679 8.308 -8.565 650 HB3 PRO 87 2HB PRO 87 5.664 6.984 -9.206 651 HG2 PRO 87 1HG PRO 87 5.388 8.351 -6.491 652 HG3 PRO 87 2HG PRO 87 4.143 8.229 -7.771 653 HD2 PRO 87 1HD PRO 87 4.190 6.426 -5.802 654 HD3 PRO 87 2HD PRO 87 3.956 5.879 -7.471 655 H TYR 88 H TYR 88 8.623 8.196 -7.927 656 HA TYR 88 HA TYR 88 10.705 7.917 -6.463 657 HB2 TYR 88 1HB TYR 88 9.468 10.681 -6.526 658 HB3 TYR 88 2HB TYR 88 11.166 10.234 -6.704 659 HD1 TYR 88 2HD TYR 88 11.805 8.831 -8.752 660 HD2 TYR 88 1HD TYR 88 8.018 10.874 -8.445 661 HE1 TYR 88 2HE TYR 88 11.310 8.252 -11.099 662 HE2 TYR 88 1HE TYR 88 7.554 10.370 -10.824 663 HH TYR 88 HH TYR 88 9.502 8.041 -12.604 664 H LYS 89 H LYS 89 7.750 8.374 -4.919 665 HA LYS 89 HA LYS 89 8.853 8.793 -2.320 666 HB2 LYS 89 1HB LYS 89 6.402 9.432 -1.924 667 HB3 LYS 89 2HB LYS 89 7.655 10.612 -2.412 668 HG2 LYS 89 1HG LYS 89 6.459 9.745 -4.865 669 HG3 LYS 89 2HG LYS 89 5.294 9.441 -3.637 670 HD2 LYS 89 1HD LYS 89 4.963 11.679 -4.713 671 HD3 LYS 89 2HD LYS 89 5.509 11.973 -3.037 672 HE2 LYS 89 1HE LYS 89 7.863 12.130 -3.822 673 HE3 LYS 89 2HE LYS 89 7.357 11.720 -5.472 674 HZ1 LYS 89 3HZ LYS 89 6.627 14.173 -4.021 675 HZ2 LYS 89 1HZ LYS 89 6.161 13.768 -5.587 676 HZ3 LYS 89 2HZ LYS 89 7.734 14.019 -5.229 677 H GLY 90 H GLY 90 9.141 6.376 -3.186 678 HA2 GLY 90 1HA GLY 90 6.944 4.795 -1.995 679 HA3 GLY 90 2HA GLY 90 8.027 4.252 -3.264 680 H ILE 91 H ILE 91 9.911 5.684 -0.840 681 HA ILE 91 HA ILE 91 10.589 2.994 0.024 682 HB ILE 91 HB ILE 91 12.055 5.603 0.521 683 HG12 ILE 91 1HG1 ILE 91 11.848 3.670 -1.814 684 HG13 ILE 91 2HG1 ILE 91 11.797 5.411 -1.826 685 HG21 ILE 91 1HG2 ILE 91 14.008 4.027 0.804 686 HG22 ILE 91 2HG2 ILE 91 12.770 3.840 2.042 687 HG23 ILE 91 3HG2 ILE 91 12.826 2.663 0.725 688 HD11 ILE 91 3HD1 ILE 91 14.354 3.836 -1.379 689 HD12 ILE 91 1HD1 ILE 91 13.797 4.527 -2.901 690 HD13 ILE 91 2HD1 ILE 91 14.167 5.604 -1.551 691 H TYR 92 H TYR 92 8.261 3.283 0.999 692 HA TYR 92 HA TYR 92 8.269 4.235 3.816 693 HB2 TYR 92 1HB TYR 92 6.089 2.550 2.619 694 HB3 TYR 92 2HB TYR 92 6.044 3.454 4.095 695 HD1 TYR 92 1HD TYR 92 5.997 3.724 0.412 696 HD2 TYR 92 2HD TYR 92 5.409 5.777 4.145 697 HE1 TYR 92 1HE TYR 92 4.967 5.559 -0.795 698 HE2 TYR 92 2HE TYR 92 4.569 7.735 2.940 699 HH TYR 92 HH TYR 92 3.871 7.692 -0.581 700 H GLU 93 H GLU 93 9.594 3.218 5.007 701 HA GLU 93 HA GLU 93 9.697 0.253 5.118 702 HB2 GLU 93 1HB GLU 93 11.725 1.620 5.565 703 HB3 GLU 93 2HB GLU 93 10.829 2.581 6.706 704 HG2 GLU 93 1HG GLU 93 10.563 0.176 7.936 705 HG3 GLU 93 2HG GLU 93 12.003 -0.156 6.952 706 H ILE 94 H ILE 94 8.118 -0.795 6.229 707 HA ILE 94 HA ILE 94 6.928 0.551 8.611 708 HB ILE 94 HB ILE 94 5.017 -0.899 8.499 709 HG12 ILE 94 1HG1 ILE 94 6.003 -1.894 5.811 710 HG13 ILE 94 2HG1 ILE 94 6.074 -2.801 7.316 711 HG21 ILE 94 1HG2 ILE 94 3.847 0.217 6.687 712 HG22 ILE 94 2HG2 ILE 94 4.931 1.311 7.529 713 HG23 ILE 94 3HG2 ILE 94 5.389 0.674 5.928 714 HD11 ILE 94 3HD1 ILE 94 3.614 -2.736 7.510 715 HD12 ILE 94 1HD1 ILE 94 3.529 -1.907 5.945 716 HD13 ILE 94 2HD1 ILE 94 4.160 -3.544 6.027 717 H GLU 95 H GLU 95 6.396 -1.247 10.310 718 HA GLU 95 HA GLU 95 8.538 -3.296 10.315 719 HB2 GLU 95 1HB GLU 95 7.757 -1.544 12.682 720 HB3 GLU 95 2HB GLU 95 9.017 -2.778 12.592 721 HG2 GLU 95 1HG GLU 95 10.211 -1.381 10.895 722 HG3 GLU 95 2HG GLU 95 8.977 -0.132 11.072 723 H ASN 96 H ASN 96 6.083 -3.877 9.463 724 HA ASN 96 HA ASN 96 5.642 -6.172 10.988 725 HB2 ASN 96 1HB ASN 96 3.437 -4.035 11.029 726 HB3 ASN 96 2HB ASN 96 2.932 -5.667 10.798 727 HD21 ASN 96 1HD2 ASN 96 3.094 -3.478 13.205 728 HD22 ASN 96 2HD2 ASN 96 3.146 -4.611 14.524 729 H ASN 97 H ASN 97 4.117 -7.600 9.887 730 HA ASN 97 HA ASN 97 4.039 -7.355 6.981 731 HB2 ASN 97 1HB ASN 97 4.136 -9.576 8.089 732 HB3 ASN 97 2HB ASN 97 2.621 -9.224 8.941 733 HD21 ASN 97 1HD2 ASN 97 4.033 -9.672 5.692 734 HD22 ASN 97 2HD2 ASN 97 2.525 -10.164 4.937 735 H PHE 98 H PHE 98 2.339 -6.531 5.793 736 HA PHE 98 HA PHE 98 0.373 -4.874 7.177 737 HB2 PHE 98 1HB PHE 98 1.459 -4.063 5.170 738 HB3 PHE 98 2HB PHE 98 0.989 -5.502 4.263 739 HD1 PHE 98 2HD PHE 98 -0.402 -2.492 5.989 740 HD2 PHE 98 1HD PHE 98 -1.065 -5.632 3.108 741 HE1 PHE 98 2HE PHE 98 -2.432 -1.349 5.220 742 HE2 PHE 98 1HE PHE 98 -3.102 -4.509 2.340 743 HZ PHE 98 HZ PHE 98 -3.839 -2.360 3.406 744 H GLU 99 H GLU 99 0.286 -7.782 5.107 745 HA GLU 99 HA GLU 99 -2.433 -7.999 4.708 746 HB2 GLU 99 1HB GLU 99 -0.119 -9.927 4.562 747 HB3 GLU 99 2HB GLU 99 -1.774 -10.453 4.232 748 HG2 GLU 99 1HG GLU 99 -2.040 -8.790 2.470 749 HG3 GLU 99 2HG GLU 99 -0.498 -8.045 2.855 750 H ASP 100 H ASP 100 -0.673 -8.869 7.648 751 HA ASP 100 HA ASP 100 -2.752 -10.691 8.604 752 HB2 ASP 100 1HB ASP 100 -0.433 -10.825 9.433 753 HB3 ASP 100 2HB ASP 100 -0.597 -9.206 10.146 754 H MET 101 H MET 101 -2.412 -7.269 8.388 755 HA MET 101 HA MET 101 -4.090 -6.647 10.701 756 HB2 MET 101 1HB MET 101 -2.888 -4.794 8.615 757 HB3 MET 101 2HB MET 101 -3.489 -4.364 10.206 758 HG2 MET 101 1HG MET 101 -1.128 -6.257 9.797 759 HG3 MET 101 2HG MET 101 -0.956 -4.549 9.919 760 HE1 MET 101 3HE MET 101 0.747 -4.799 11.923 761 HE2 MET 101 1HE MET 101 0.461 -5.828 13.340 762 HE3 MET 101 2HE MET 101 0.612 -6.563 11.730 763 H ILE 102 H ILE 102 -4.567 -7.372 7.361 764 HA ILE 102 HA ILE 102 -7.003 -5.719 7.191 765 HB ILE 102 HB ILE 102 -6.701 -5.863 4.734 766 HG12 ILE 102 1HG1 ILE 102 -3.766 -6.356 5.041 767 HG13 ILE 102 2HG1 ILE 102 -4.755 -7.793 5.075 768 HG21 ILE 102 1HG2 ILE 102 -6.066 -3.860 6.094 769 HG22 ILE 102 2HG2 ILE 102 -4.401 -4.493 6.191 770 HG23 ILE 102 3HG2 ILE 102 -5.112 -4.070 4.616 771 HD11 ILE 102 3HD1 ILE 102 -5.764 -7.212 2.914 772 HD12 ILE 102 1HD1 ILE 102 -4.878 -5.693 2.880 773 HD13 ILE 102 2HD1 ILE 102 -3.994 -7.236 2.787 Start of MODEL 16 1 H1 GLY 1 H GLY 1 6.877 12.947 9.702 2 HA2 GLY 1 1HA GLY 1 4.767 13.461 8.518 3 HA3 GLY 1 2HA GLY 1 6.180 13.486 7.441 4 H SER 2 H SER 2 3.140 11.860 8.168 5 HA SER 2 HA SER 2 3.571 9.422 6.937 6 HB2 SER 2 1HB SER 2 0.848 10.610 6.744 7 HB3 SER 2 2HB SER 2 1.360 9.078 7.448 8 HG SER 2 HG SER 2 1.414 9.947 9.311 9 HA PRO 3 HA PRO 3 3.170 10.086 2.496 10 HB2 PRO 3 1HB PRO 3 1.184 8.242 1.742 11 HB3 PRO 3 2HB PRO 3 2.890 7.869 2.017 12 HG2 PRO 3 1HG PRO 3 0.618 7.480 3.868 13 HG3 PRO 3 2HG PRO 3 2.054 6.424 3.572 14 HD2 PRO 3 1HD PRO 3 1.840 8.031 5.745 15 HD3 PRO 3 2HD PRO 3 3.396 7.686 4.964 16 H ILE 4 H ILE 4 1.597 10.669 0.714 17 HA ILE 4 HA ILE 4 -0.869 12.016 1.604 18 HB ILE 4 HB ILE 4 0.329 11.636 -1.178 19 HG12 ILE 4 1HG1 ILE 4 2.001 12.841 0.148 20 HG13 ILE 4 2HG1 ILE 4 1.286 13.823 -1.089 21 HG21 ILE 4 1HG2 ILE 4 -1.797 13.554 -0.129 22 HG22 ILE 4 2HG2 ILE 4 -1.066 13.626 -1.749 23 HG23 ILE 4 3HG2 ILE 4 -2.015 12.216 -1.279 24 HD11 ILE 4 3HD1 ILE 4 1.558 15.115 0.940 25 HD12 ILE 4 1HD1 ILE 4 -0.163 14.942 0.636 26 HD13 ILE 4 2HD1 ILE 4 0.622 13.940 1.890 27 H LEU 5 H LEU 5 -2.820 10.871 1.471 28 HA LEU 5 HA LEU 5 -3.203 8.799 -0.503 29 HB2 LEU 5 1HB LEU 5 -4.367 7.460 1.163 30 HB3 LEU 5 2HB LEU 5 -2.624 7.484 1.201 31 HG LEU 5 HG LEU 5 -3.946 7.312 3.299 32 HD11 LEU 5 1HD1 LEU 5 -1.759 9.412 3.321 33 HD12 LEU 5 2HD1 LEU 5 -1.518 7.651 3.248 34 HD13 LEU 5 3HD1 LEU 5 -2.277 8.379 4.668 35 HD21 LEU 5 3HD2 LEU 5 -5.468 9.224 2.989 36 HD22 LEU 5 1HD2 LEU 5 -4.102 10.343 3.174 37 HD23 LEU 5 2HD2 LEU 5 -4.599 9.296 4.522 38 HA PRO 6 HA PRO 6 -6.976 11.077 -1.013 39 HB2 PRO 6 1HB PRO 6 -8.890 9.131 -1.488 40 HB3 PRO 6 2HB PRO 6 -7.655 9.612 -2.670 41 HG2 PRO 6 1HG PRO 6 -7.640 7.290 -0.716 42 HG3 PRO 6 2HG PRO 6 -7.274 7.273 -2.484 43 HD2 PRO 6 1HD PRO 6 -5.289 7.358 -0.740 44 HD3 PRO 6 2HD PRO 6 -5.226 8.392 -2.163 45 H LYS 7 H LYS 7 -9.522 11.262 -0.217 46 HA LYS 7 HA LYS 7 -9.813 10.844 2.591 47 HB2 LYS 7 1HB LYS 7 -11.998 10.931 0.448 48 HB3 LYS 7 2HB LYS 7 -12.126 11.349 2.147 49 HG2 LYS 7 1HG LYS 7 -10.078 13.070 1.111 50 HG3 LYS 7 2HG LYS 7 -11.319 12.996 -0.152 51 HD2 LYS 7 1HD LYS 7 -11.848 13.492 2.753 52 HD3 LYS 7 2HD LYS 7 -11.538 14.827 1.622 53 HE2 LYS 7 1HE LYS 7 -13.453 14.327 0.298 54 HE3 LYS 7 2HE LYS 7 -13.751 12.793 1.110 55 HZ1 LYS 7 3HZ LYS 7 -13.851 15.236 2.722 56 HZ2 LYS 7 1HZ LYS 7 -14.729 13.844 2.853 57 HZ3 LYS 7 2HZ LYS 7 -15.091 14.915 1.677 58 H ALA 8 H ALA 8 -11.564 9.265 3.446 59 HA ALA 8 HA ALA 8 -11.362 6.599 2.206 60 HB1 ALA 8 1HB ALA 8 -13.247 7.499 4.437 61 HB2 ALA 8 2HB ALA 8 -12.802 5.860 3.982 62 HB3 ALA 8 3HB ALA 8 -11.587 6.919 4.731 63 H GLU 9 H GLU 9 -13.943 9.057 2.796 64 HA GLU 9 HA GLU 9 -15.871 7.518 1.577 65 HB2 GLU 9 1HB GLU 9 -17.307 9.428 1.778 66 HB3 GLU 9 2HB GLU 9 -16.211 9.368 3.168 67 HG2 GLU 9 1HG GLU 9 -14.693 10.992 1.796 68 HG3 GLU 9 2HG GLU 9 -16.122 11.204 0.777 69 H ASN 10 H ASN 10 -13.600 9.532 -0.190 70 HA ASN 10 HA ASN 10 -15.255 9.525 -2.598 71 HB2 ASN 10 1HB ASN 10 -13.675 10.887 -3.545 72 HB3 ASN 10 2HB ASN 10 -13.598 11.409 -1.843 73 HD21 ASN 10 1HD2 ASN 10 -11.937 8.824 -1.191 74 HD22 ASN 10 2HD2 ASN 10 -10.388 9.354 -1.688 75 H VAL 11 H VAL 11 -13.618 7.059 -1.145 76 HA VAL 11 HA VAL 11 -12.312 5.908 -3.509 77 HB VAL 11 HB VAL 11 -12.777 5.039 -0.626 78 HG11 VAL 11 1HG1 VAL 11 -11.920 3.378 -2.924 79 HG12 VAL 11 2HG1 VAL 11 -11.361 3.033 -1.259 80 HG13 VAL 11 3HG1 VAL 11 -13.083 3.006 -1.664 81 HG21 VAL 11 3HG2 VAL 11 -10.234 5.443 -2.270 82 HG22 VAL 11 1HG2 VAL 11 -10.902 6.652 -1.163 83 HG23 VAL 11 2HG2 VAL 11 -10.335 5.111 -0.524 84 H ASP 12 H ASP 12 -13.167 4.219 -4.644 85 HA ASP 12 HA ASP 12 -16.091 3.768 -4.435 86 HB2 ASP 12 1HB ASP 12 -14.332 4.092 -6.653 87 HB3 ASP 12 2HB ASP 12 -14.757 2.382 -6.629 88 H SER 13 H SER 13 -13.015 1.896 -4.967 89 HA SER 13 HA SER 13 -13.722 -0.012 -2.887 90 HB2 SER 13 1HB SER 13 -13.794 -1.937 -4.632 91 HB3 SER 13 2HB SER 13 -15.236 -0.964 -4.374 92 HG SER 13 HG SER 13 -13.479 -1.014 -6.567 93 H ILE 14 H ILE 14 -11.823 -0.819 -2.132 94 HA ILE 14 HA ILE 14 -9.356 -0.377 -3.764 95 HB ILE 14 HB ILE 14 -9.530 -1.395 -0.921 96 HG12 ILE 14 1HG1 ILE 14 -8.793 1.446 -1.673 97 HG13 ILE 14 2HG1 ILE 14 -10.444 0.999 -1.222 98 HG21 ILE 14 1HG2 ILE 14 -7.210 -0.219 -2.495 99 HG22 ILE 14 2HG2 ILE 14 -7.144 -0.854 -0.829 100 HG23 ILE 14 3HG2 ILE 14 -7.450 -1.936 -2.171 101 HD11 ILE 14 3HD1 ILE 14 -8.050 0.632 0.590 102 HD12 ILE 14 1HD1 ILE 14 -9.246 1.930 0.674 103 HD13 ILE 14 2HD1 ILE 14 -9.745 0.256 0.964 104 H CYS 15 H CYS 15 -8.394 -2.111 -4.710 105 HA CYS 15 HA CYS 15 -9.584 -4.827 -4.155 106 HB2 CYS 15 1HB CYS 15 -9.871 -4.023 -6.537 107 HB3 CYS 15 2HB CYS 15 -8.093 -4.048 -6.686 108 HG CYS 15 HG CYS 15 -7.934 -6.380 -7.224 109 H ILE 16 H ILE 16 -8.204 -6.160 -3.068 110 HA ILE 16 HA ILE 16 -5.310 -5.700 -3.349 111 HB ILE 16 HB ILE 16 -6.686 -6.416 -0.761 112 HG12 ILE 16 1HG1 ILE 16 -5.390 -3.842 -1.766 113 HG13 ILE 16 2HG1 ILE 16 -7.077 -4.072 -1.297 114 HG21 ILE 16 1HG2 ILE 16 -3.741 -5.886 -1.354 115 HG22 ILE 16 2HG2 ILE 16 -4.448 -6.289 0.236 116 HG23 ILE 16 3HG2 ILE 16 -4.455 -7.484 -1.058 117 HD11 ILE 16 3HD1 ILE 16 -6.007 -2.857 0.426 118 HD12 ILE 16 1HD1 ILE 16 -6.322 -4.500 1.054 119 HD13 ILE 16 2HD1 ILE 16 -4.678 -4.009 0.522 120 H ASP 17 H ASP 17 -4.755 -7.321 -4.635 121 HA ASP 17 HA ASP 17 -6.042 -9.998 -4.394 122 HB2 ASP 17 1HB ASP 17 -5.289 -8.639 -6.672 123 HB3 ASP 17 2HB ASP 17 -3.890 -9.668 -6.395 124 H PHE 18 H PHE 18 -5.118 -11.088 -2.751 125 HA PHE 18 HA PHE 18 -2.803 -10.202 -1.326 126 HB2 PHE 18 1HB PHE 18 -4.732 -12.546 -1.170 127 HB3 PHE 18 2HB PHE 18 -3.304 -12.571 -0.237 128 HD1 PHE 18 1HD PHE 18 -6.181 -10.135 -0.938 129 HD2 PHE 18 2HD PHE 18 -3.439 -11.780 1.981 130 HE1 PHE 18 1HE PHE 18 -7.118 -8.714 0.780 131 HE2 PHE 18 2HE PHE 18 -4.512 -10.437 3.728 132 HZ PHE 18 HZ PHE 18 -6.384 -8.938 3.171 133 H THR 19 H THR 19 -0.989 -11.888 -0.807 134 HA THR 19 HA THR 19 0.449 -12.357 -3.192 135 HB THR 19 HB THR 19 1.900 -13.796 -1.632 136 HG1 THR 19 1HG THR 19 1.152 -13.379 0.657 137 HG21 THR 19 3HG2 THR 19 1.115 -10.957 -0.854 138 HG22 THR 19 1HG2 THR 19 2.419 -11.462 -1.933 139 HG23 THR 19 2HG2 THR 19 2.510 -11.818 -0.199 140 H ASN 20 H ASN 20 -1.652 -14.525 -1.311 141 HA ASN 20 HA ASN 20 -1.181 -16.918 -2.768 142 HB2 ASN 20 1HB ASN 20 -1.712 -16.712 -0.364 143 HB3 ASN 20 2HB ASN 20 -3.279 -15.961 -0.786 144 HD21 ASN 20 1HD2 ASN 20 -4.417 -17.658 0.450 145 HD22 ASN 20 2HD2 ASN 20 -4.563 -19.199 -0.364 146 H SER 21 H SER 21 -3.524 -18.027 -3.440 147 HA SER 21 HA SER 21 -4.152 -16.836 -5.968 148 HB2 SER 21 1HB SER 21 -5.542 -18.880 -6.130 149 HB3 SER 21 2HB SER 21 -3.877 -19.196 -5.706 150 HG SER 21 HG SER 21 -5.924 -20.104 -4.472 151 H ILE 22 H ILE 22 -5.097 -15.130 -3.638 152 HA ILE 22 HA ILE 22 -8.029 -15.273 -3.911 153 HB ILE 22 HB ILE 22 -6.513 -15.133 -1.261 154 HG12 ILE 22 1HG1 ILE 22 -7.814 -17.518 -2.667 155 HG13 ILE 22 2HG1 ILE 22 -6.152 -17.342 -2.123 156 HG21 ILE 22 1HG2 ILE 22 -8.708 -14.070 -1.179 157 HG22 ILE 22 2HG2 ILE 22 -9.479 -15.516 -1.881 158 HG23 ILE 22 3HG2 ILE 22 -8.755 -15.532 -0.247 159 HD11 ILE 22 3HD1 ILE 22 -8.590 -17.876 -0.444 160 HD12 ILE 22 1HD1 ILE 22 -7.094 -18.806 -0.557 161 HD13 ILE 22 2HD1 ILE 22 -7.091 -17.246 0.264 162 H GLN 23 H GLN 23 -8.977 -13.213 -3.473 163 HA GLN 23 HA GLN 23 -7.242 -10.957 -2.963 164 HB2 GLN 23 1HB GLN 23 -8.228 -9.948 -4.748 165 HB3 GLN 23 2HB GLN 23 -8.050 -11.566 -5.407 166 HG2 GLN 23 1HG GLN 23 -10.525 -11.861 -4.606 167 HG3 GLN 23 2HG GLN 23 -10.507 -10.113 -4.437 168 HE21 GLN 23 1HE2 GLN 23 -8.530 -10.349 -7.121 169 HE22 GLN 23 2HE2 GLN 23 -9.812 -10.422 -8.298 170 H LYS 24 H LYS 24 -8.609 -9.112 -2.195 171 HA LYS 24 HA LYS 24 -11.329 -9.757 -1.344 172 HB2 LYS 24 1HB LYS 24 -9.065 -9.406 0.516 173 HB3 LYS 24 2HB LYS 24 -10.291 -8.213 0.778 174 HG2 LYS 24 1HG LYS 24 -10.780 -11.219 0.715 175 HG3 LYS 24 2HG LYS 24 -10.432 -10.279 2.179 176 HD2 LYS 24 1HD LYS 24 -12.843 -9.861 0.404 177 HD3 LYS 24 2HD LYS 24 -12.846 -10.754 1.927 178 HE2 LYS 24 1HE LYS 24 -11.750 -7.926 1.949 179 HE3 LYS 24 2HE LYS 24 -13.442 -8.097 1.701 180 HZ1 LYS 24 3HZ LYS 24 -12.048 -9.267 4.047 181 HZ2 LYS 24 1HZ LYS 24 -13.685 -9.148 3.770 182 HZ3 LYS 24 2HZ LYS 24 -12.805 -7.805 3.986 183 H ILE 25 H ILE 25 -12.580 -7.865 -1.326 184 HA ILE 25 HA ILE 25 -11.245 -5.455 -2.437 185 HB ILE 25 HB ILE 25 -13.975 -6.501 -3.273 186 HG12 ILE 25 1HG1 ILE 25 -12.547 -6.156 -5.586 187 HG13 ILE 25 2HG1 ILE 25 -11.214 -6.553 -4.510 188 HG21 ILE 25 1HG2 ILE 25 -12.465 -3.980 -4.111 189 HG22 ILE 25 2HG2 ILE 25 -13.982 -4.569 -4.802 190 HG23 ILE 25 3HG2 ILE 25 -13.955 -4.035 -3.124 191 HD11 ILE 25 3HD1 ILE 25 -12.106 -8.519 -5.673 192 HD12 ILE 25 1HD1 ILE 25 -12.369 -8.696 -3.929 193 HD13 ILE 25 2HD1 ILE 25 -13.716 -8.219 -4.990 194 H TYR 26 H TYR 26 -11.556 -3.714 -1.322 195 HA TYR 26 HA TYR 26 -13.194 -3.828 1.160 196 HB2 TYR 26 1HB TYR 26 -10.643 -2.286 0.565 197 HB3 TYR 26 2HB TYR 26 -11.518 -2.271 2.067 198 HD1 TYR 26 2HD TYR 26 -9.668 -4.583 -0.285 199 HD2 TYR 26 1HD TYR 26 -10.797 -3.758 3.802 200 HE1 TYR 26 2HE TYR 26 -8.442 -6.574 0.471 201 HE2 TYR 26 1HE TYR 26 -9.679 -5.830 4.530 202 HH TYR 26 HH TYR 26 -8.493 -7.751 3.870 203 H ASP 27 H ASP 27 -15.018 -3.185 -0.039 204 HA ASP 27 HA ASP 27 -15.046 -0.384 -1.030 205 HB2 ASP 27 1HB ASP 27 -16.972 -0.990 -2.280 206 HB3 ASP 27 2HB ASP 27 -15.777 -2.259 -2.578 207 H ASP 28 H ASP 28 -16.016 -2.486 1.585 208 HA ASP 28 HA ASP 28 -18.351 -0.942 2.404 209 HB2 ASP 28 1HB ASP 28 -16.599 -2.513 4.306 210 HB3 ASP 28 2HB ASP 28 -18.278 -2.024 4.474 211 H SER 29 H SER 29 -18.374 0.703 3.943 212 HA SER 29 HA SER 29 -16.318 2.523 3.784 213 HB2 SER 29 1HB SER 29 -18.838 2.674 4.558 214 HB3 SER 29 2HB SER 29 -18.154 2.557 6.191 215 HG SER 29 HG SER 29 -17.276 4.357 4.164 216 H GLU 30 H GLU 30 -16.864 0.256 6.526 217 HA GLU 30 HA GLU 30 -14.642 1.193 8.078 218 HB2 GLU 30 1HB GLU 30 -16.575 -1.112 8.053 219 HB3 GLU 30 2HB GLU 30 -15.127 -1.297 8.984 220 HG2 GLU 30 1HG GLU 30 -15.604 0.620 10.360 221 HG3 GLU 30 2HG GLU 30 -16.911 1.140 9.283 222 H SER 31 H SER 31 -14.950 -1.110 5.404 223 HA SER 31 HA SER 31 -12.489 -2.534 5.986 224 HB2 SER 31 1HB SER 31 -12.827 -3.655 3.922 225 HB3 SER 31 2HB SER 31 -14.407 -3.472 4.612 226 HG SER 31 HG SER 31 -14.583 -1.525 3.189 227 H ILE 32 H ILE 32 -13.453 0.196 3.908 228 HA ILE 32 HA ILE 32 -10.886 0.787 2.823 229 HB ILE 32 HB ILE 32 -13.402 2.454 3.263 230 HG12 ILE 32 1HG1 ILE 32 -12.281 1.399 0.636 231 HG13 ILE 32 2HG1 ILE 32 -13.383 0.436 1.620 232 HG21 ILE 32 1HG2 ILE 32 -12.297 4.036 1.575 233 HG22 ILE 32 2HG2 ILE 32 -11.585 4.001 3.187 234 HG23 ILE 32 3HG2 ILE 32 -10.781 3.143 1.871 235 HD11 ILE 32 3HD1 ILE 32 -15.132 2.117 1.464 236 HD12 ILE 32 1HD1 ILE 32 -14.075 3.192 0.533 237 HD13 ILE 32 2HD1 ILE 32 -14.577 1.643 -0.157 238 H GLN 33 H GLN 33 -12.666 2.265 5.627 239 HA GLN 33 HA GLN 33 -10.629 4.085 6.245 240 HB2 GLN 33 1HB GLN 33 -13.010 3.004 7.686 241 HB3 GLN 33 2HB GLN 33 -11.701 3.497 8.745 242 HG2 GLN 33 1HG GLN 33 -11.660 5.690 7.254 243 HG3 GLN 33 2HG GLN 33 -13.316 5.203 6.871 244 HE21 GLN 33 1HE2 GLN 33 -11.089 6.358 9.404 245 HE22 GLN 33 2HE2 GLN 33 -12.351 6.708 10.587 246 H LYS 34 H LYS 34 -10.909 0.703 7.292 247 HA LYS 34 HA LYS 34 -8.852 0.682 9.248 248 HB2 LYS 34 1HB LYS 34 -10.576 -1.101 8.556 249 HB3 LYS 34 2HB LYS 34 -9.463 -1.597 7.305 250 HG2 LYS 34 1HG LYS 34 -8.927 -1.590 10.321 251 HG3 LYS 34 2HG LYS 34 -9.555 -2.928 9.405 252 HD2 LYS 34 1HD LYS 34 -7.398 -3.553 9.539 253 HD3 LYS 34 2HD LYS 34 -7.427 -2.765 7.959 254 HE2 LYS 34 1HE LYS 34 -5.397 -2.314 9.240 255 HE3 LYS 34 2HE LYS 34 -6.273 -0.873 8.761 256 HZ1 LYS 34 3HZ LYS 34 -6.349 -2.006 11.476 257 HZ2 LYS 34 1HZ LYS 34 -6.998 -0.576 11.021 258 HZ3 LYS 34 2HZ LYS 34 -5.348 -0.799 10.965 259 H ILE 35 H ILE 35 -8.677 -0.187 5.717 260 HA ILE 35 HA ILE 35 -5.921 -0.408 5.720 261 HB ILE 35 HB ILE 35 -7.774 0.463 3.425 262 HG12 ILE 35 1HG1 ILE 35 -6.666 -2.315 3.940 263 HG13 ILE 35 2HG1 ILE 35 -8.258 -1.836 4.484 264 HG21 ILE 35 1HG2 ILE 35 -5.609 0.989 2.701 265 HG22 ILE 35 2HG2 ILE 35 -4.860 -0.367 3.574 266 HG23 ILE 35 3HG2 ILE 35 -5.746 -0.643 2.078 267 HD11 ILE 35 3HD1 ILE 35 -9.114 -1.583 2.322 268 HD12 ILE 35 1HD1 ILE 35 -7.552 -1.528 1.523 269 HD13 ILE 35 2HD1 ILE 35 -8.088 -3.041 2.210 270 H LEU 36 H LEU 36 -7.836 2.631 4.938 271 HA LEU 36 HA LEU 36 -5.655 4.228 4.251 272 HB2 LEU 36 1HB LEU 36 -8.284 4.786 5.609 273 HB3 LEU 36 2HB LEU 36 -7.092 6.064 5.589 274 HG LEU 36 HG LEU 36 -7.151 4.910 2.929 275 HD11 LEU 36 1HD1 LEU 36 -9.335 4.120 3.429 276 HD12 LEU 36 2HD1 LEU 36 -9.428 5.460 2.275 277 HD13 LEU 36 3HD1 LEU 36 -9.851 5.723 3.995 278 HD21 LEU 36 3HD2 LEU 36 -8.193 7.604 3.900 279 HD22 LEU 36 1HD2 LEU 36 -7.647 7.178 2.262 280 HD23 LEU 36 2HD2 LEU 36 -6.473 7.226 3.587 281 H SER 37 H SER 37 -6.116 2.931 7.480 282 HA SER 37 HA SER 37 -4.337 4.865 8.732 283 HB2 SER 37 1HB SER 37 -6.226 2.811 9.506 284 HB3 SER 37 2HB SER 37 -4.664 2.422 10.206 285 HG SER 37 HG SER 37 -5.936 3.939 11.482 286 H GLU 38 H GLU 38 -4.055 1.356 7.765 287 HA GLU 38 HA GLU 38 -1.306 1.092 8.331 288 HB2 GLU 38 1HB GLU 38 -2.879 -0.293 6.115 289 HB3 GLU 38 2HB GLU 38 -1.417 -0.867 6.901 290 HG2 GLU 38 1HG GLU 38 -4.217 -0.656 8.024 291 HG3 GLU 38 2HG GLU 38 -3.258 -2.113 7.807 292 H ILE 39 H ILE 39 -3.021 2.294 5.461 293 HA ILE 39 HA ILE 39 -0.772 2.581 3.739 294 HB ILE 39 HB ILE 39 -3.389 4.113 3.942 295 HG12 ILE 39 1HG1 ILE 39 -3.474 1.620 3.436 296 HG13 ILE 39 2HG1 ILE 39 -4.215 2.677 2.242 297 HG21 ILE 39 1HG2 ILE 39 -1.937 5.525 2.658 298 HG22 ILE 39 2HG2 ILE 39 -1.402 4.139 1.675 299 HG23 ILE 39 3HG2 ILE 39 -3.082 4.733 1.573 300 HD11 ILE 39 3HD1 ILE 39 -2.430 2.275 0.683 301 HD12 ILE 39 1HD1 ILE 39 -1.426 1.493 1.934 302 HD13 ILE 39 2HD1 ILE 39 -2.917 0.721 1.373 303 H ALA 40 H ALA 40 -1.644 4.466 6.598 304 HA ALA 40 HA ALA 40 0.237 6.626 5.807 305 HB1 ALA 40 1HB ALA 40 -0.769 7.877 7.648 306 HB2 ALA 40 2HB ALA 40 -2.069 7.232 6.626 307 HB3 ALA 40 3HB ALA 40 -1.682 6.452 8.172 308 H THR 41 H THR 41 0.331 3.664 7.503 309 HA THR 41 HA THR 41 1.621 4.515 9.859 310 HB THR 41 HB THR 41 0.282 2.401 9.267 311 HG1 THR 41 1HG THR 41 0.831 2.392 11.217 312 HG21 THR 41 3HG2 THR 41 3.027 1.191 8.897 313 HG22 THR 41 1HG2 THR 41 2.004 1.621 7.518 314 HG23 THR 41 2HG2 THR 41 1.409 0.441 8.691 315 H GLY 42 H GLY 42 2.957 3.643 6.652 316 HA2 GLY 42 1HA GLY 42 5.664 3.401 7.651 317 HA3 GLY 42 2HA GLY 42 5.126 3.342 5.961 318 H LYS 43 H LYS 43 7.473 4.480 6.594 319 HA LYS 43 HA LYS 43 7.031 7.431 6.259 320 HB2 LYS 43 1HB LYS 43 9.206 6.029 7.871 321 HB3 LYS 43 2HB LYS 43 9.039 7.771 7.628 322 HG2 LYS 43 1HG LYS 43 6.819 7.696 8.816 323 HG3 LYS 43 2HG LYS 43 7.054 5.968 9.084 324 HD2 LYS 43 1HD LYS 43 7.864 6.681 11.063 325 HD3 LYS 43 2HD LYS 43 9.373 6.771 10.149 326 HE2 LYS 43 1HE LYS 43 8.371 9.247 9.638 327 HE3 LYS 43 2HE LYS 43 7.525 8.931 11.159 328 HZ1 LYS 43 3HZ LYS 43 9.817 8.435 12.083 329 HZ2 LYS 43 1HZ LYS 43 9.568 10.000 11.673 330 HZ3 LYS 43 2HZ LYS 43 10.441 9.034 10.690 331 H ARG 44 H ARG 44 7.623 7.829 4.175 332 HA ARG 44 HA ARG 44 9.005 6.032 2.493 333 HB2 ARG 44 1HB ARG 44 9.050 7.832 0.846 334 HB3 ARG 44 2HB ARG 44 7.492 7.533 1.548 335 HG2 ARG 44 1HG ARG 44 8.163 9.546 3.163 336 HG3 ARG 44 2HG ARG 44 9.299 9.924 1.869 337 HD2 ARG 44 1HD ARG 44 7.656 10.226 0.275 338 HD3 ARG 44 2HD ARG 44 6.425 9.339 1.192 339 HE ARG 44 HE ARG 44 6.889 12.149 1.226 340 HH11 ARG 44 1HH1 ARG 44 6.445 9.724 3.638 341 HH12 ARG 44 2HH1 ARG 44 5.440 10.706 4.654 342 HH21 ARG 44 1HH2 ARG 44 5.122 13.289 2.285 343 HH22 ARG 44 2HH2 ARG 44 4.401 12.574 3.688 344 H THR 45 H THR 45 10.292 7.923 4.808 345 HA THR 45 HA THR 45 12.188 8.809 5.406 346 HB THR 45 HB THR 45 14.150 7.637 5.178 347 HG1 THR 45 1HG THR 45 14.384 6.082 3.429 348 HG21 THR 45 3HG2 THR 45 13.619 5.294 5.401 349 HG22 THR 45 1HG2 THR 45 12.080 5.491 4.541 350 HG23 THR 45 2HG2 THR 45 12.316 6.235 6.132 351 H GLU 46 H GLU 46 14.261 10.080 4.508 352 HA GLU 46 HA GLU 46 13.124 11.916 2.517 353 HB2 GLU 46 1HB GLU 46 15.501 12.031 4.393 354 HB3 GLU 46 2HB GLU 46 15.244 13.237 3.114 355 HG2 GLU 46 1HG GLU 46 12.929 13.632 3.975 356 HG3 GLU 46 2HG GLU 46 13.223 12.488 5.275 357 H LYS 47 H LYS 47 14.576 9.054 2.061 358 HA LYS 47 HA LYS 47 16.572 9.650 0.012 359 HB2 LYS 47 1HB LYS 47 14.786 7.216 0.575 360 HB3 LYS 47 2HB LYS 47 16.092 7.241 -0.600 361 HG2 LYS 47 1HG LYS 47 16.957 8.043 2.115 362 HG3 LYS 47 2HG LYS 47 16.275 6.434 2.044 363 HD2 LYS 47 1HD LYS 47 18.458 7.367 0.159 364 HD3 LYS 47 2HD LYS 47 18.775 6.628 1.749 365 HE2 LYS 47 1HE LYS 47 17.915 4.555 1.174 366 HE3 LYS 47 2HE LYS 47 16.871 5.237 -0.076 367 HZ1 LYS 47 3HZ LYS 47 19.814 5.083 -0.344 368 HZ2 LYS 47 1HZ LYS 47 18.715 5.452 -1.522 369 HZ3 LYS 47 2HZ LYS 47 18.766 3.937 -0.933 370 H GLN 48 H GLN 48 16.292 9.219 -2.205 371 HA GLN 48 HA GLN 48 13.603 9.792 -3.344 372 HB2 GLN 48 1HB GLN 48 14.874 9.892 -5.498 373 HB3 GLN 48 2HB GLN 48 15.256 11.172 -4.339 374 HG2 GLN 48 1HG GLN 48 17.361 10.126 -3.736 375 HG3 GLN 48 2HG GLN 48 16.969 8.679 -4.676 376 HE21 GLN 48 1HE2 GLN 48 18.026 11.992 -4.841 377 HE22 GLN 48 2HE2 GLN 48 18.489 11.891 -6.562 378 H SER 49 H SER 49 12.419 8.126 -4.129 379 HA SER 49 HA SER 49 13.618 5.469 -4.676 380 HB2 SER 49 1HB SER 49 10.840 6.713 -4.996 381 HB3 SER 49 2HB SER 49 11.328 5.129 -5.696 382 HG SER 49 HG SER 49 10.675 4.421 -4.005 383 H ILE 50 H ILE 50 13.687 4.778 -6.933 384 HA ILE 50 HA ILE 50 13.277 6.795 -9.047 385 HB ILE 50 HB ILE 50 15.456 6.186 -10.098 386 HG12 ILE 50 1HG1 ILE 50 16.167 5.016 -7.389 387 HG13 ILE 50 2HG1 ILE 50 15.769 4.025 -8.796 388 HG21 ILE 50 1HG2 ILE 50 15.131 8.282 -8.752 389 HG22 ILE 50 2HG2 ILE 50 15.860 7.459 -7.364 390 HG23 ILE 50 3HG2 ILE 50 16.800 7.730 -8.838 391 HD11 ILE 50 3HD1 ILE 50 18.147 4.111 -8.591 392 HD12 ILE 50 1HD1 ILE 50 17.711 5.087 -10.007 393 HD13 ILE 50 2HD1 ILE 50 18.146 5.871 -8.464 394 H GLN 51 H GLN 51 11.638 4.477 -8.240 395 HA GLN 51 HA GLN 51 11.819 2.811 -10.663 396 HB2 GLN 51 1HB GLN 51 10.987 0.939 -9.088 397 HB3 GLN 51 2HB GLN 51 12.687 1.324 -9.033 398 HG2 GLN 51 1HG GLN 51 12.350 2.689 -6.974 399 HG3 GLN 51 2HG GLN 51 10.603 2.455 -7.112 400 HE21 GLN 51 1HE2 GLN 51 9.925 0.096 -7.051 401 HE22 GLN 51 2HE2 GLN 51 10.765 -0.953 -5.938 402 H ASP 52 H ASP 52 9.700 1.676 -10.851 403 HA ASP 52 HA ASP 52 7.369 3.210 -9.735 404 HB2 ASP 52 1HB ASP 52 8.289 3.409 -12.398 405 HB3 ASP 52 2HB ASP 52 6.936 2.303 -12.498 406 H TYR 53 H TYR 53 8.863 0.268 -9.802 407 HA TYR 53 HA TYR 53 6.454 -1.284 -9.301 408 HB2 TYR 53 1HB TYR 53 8.295 -1.736 -11.675 409 HB3 TYR 53 2HB TYR 53 7.665 -3.127 -10.827 410 HD1 TYR 53 2HD TYR 53 6.593 -0.035 -12.634 411 HD2 TYR 53 1HD TYR 53 5.416 -3.883 -11.093 412 HE1 TYR 53 2HE TYR 53 4.321 0.328 -13.490 413 HE2 TYR 53 1HE TYR 53 3.177 -3.594 -12.042 414 HH TYR 53 HH TYR 53 2.025 -0.489 -13.181 415 HA PRO 54 HA PRO 54 9.477 -2.908 -6.404 416 HB2 PRO 54 1HB PRO 54 8.482 -5.322 -5.646 417 HB3 PRO 54 2HB PRO 54 7.582 -3.809 -5.350 418 HG2 PRO 54 1HG PRO 54 7.199 -5.767 -7.618 419 HG3 PRO 54 2HG PRO 54 5.972 -5.054 -6.512 420 HD2 PRO 54 1HD PRO 54 6.559 -4.044 -9.030 421 HD3 PRO 54 2HD PRO 54 6.004 -3.013 -7.684 422 H SER 55 H SER 55 10.915 -4.941 -5.883 423 HA SER 55 HA SER 55 11.691 -6.363 -8.358 424 HB2 SER 55 1HB SER 55 13.153 -4.423 -7.124 425 HB3 SER 55 2HB SER 55 13.793 -5.885 -6.350 426 HG SER 55 HG SER 55 14.381 -6.655 -8.343 427 H ALA 56 H ALA 56 10.145 -6.869 -5.535 428 HA ALA 56 HA ALA 56 11.351 -9.339 -4.569 429 HB1 ALA 56 1HB ALA 56 9.162 -9.578 -3.422 430 HB2 ALA 56 2HB ALA 56 9.897 -7.996 -3.122 431 HB3 ALA 56 3HB ALA 56 8.548 -8.157 -4.279 432 H GLU 57 H GLU 57 10.630 -11.463 -4.996 433 HA GLU 57 HA GLU 57 9.469 -11.949 -7.624 434 HB2 GLU 57 1HB GLU 57 11.020 -13.407 -5.682 435 HB3 GLU 57 2HB GLU 57 9.507 -14.297 -5.941 436 HG2 GLU 57 1HG GLU 57 9.926 -14.234 -8.408 437 HG3 GLU 57 2HG GLU 57 11.483 -13.463 -8.084 438 H GLU 58 H GLU 58 8.279 -11.675 -4.288 439 HA GLU 58 HA GLU 58 5.554 -12.312 -5.216 440 HB2 GLU 58 1HB GLU 58 5.105 -13.522 -3.207 441 HB3 GLU 58 2HB GLU 58 6.526 -14.219 -3.999 442 HG2 GLU 58 1HG GLU 58 7.950 -12.876 -2.352 443 HG3 GLU 58 2HG GLU 58 6.467 -12.447 -1.520 444 H TYR 59 H TYR 59 4.159 -10.723 -4.841 445 HA TYR 59 HA TYR 59 4.282 -8.987 -2.517 446 HB2 TYR 59 1HB TYR 59 4.084 -6.942 -4.030 447 HB3 TYR 59 2HB TYR 59 5.675 -7.652 -3.879 448 HD1 TYR 59 1HD TYR 59 6.809 -8.734 -5.770 449 HD2 TYR 59 2HD TYR 59 2.860 -7.041 -6.160 450 HE1 TYR 59 1HE TYR 59 7.039 -8.793 -8.213 451 HE2 TYR 59 2HE TYR 59 3.111 -7.038 -8.635 452 HH TYR 59 HH TYR 59 5.752 -8.770 -10.182 453 H GLY 60 H GLY 60 2.185 -7.695 -2.433 454 HA2 GLY 60 1HA GLY 60 -0.056 -9.175 -3.724 455 HA3 GLY 60 2HA GLY 60 -0.170 -8.018 -2.396 456 H THR 61 H THR 61 -1.768 -7.847 -4.815 457 HA THR 61 HA THR 61 -0.604 -5.496 -6.234 458 HB THR 61 HB THR 61 -3.286 -6.681 -6.908 459 HG1 THR 61 1HG THR 61 -0.873 -7.929 -7.743 460 HG21 THR 61 3HG2 THR 61 -2.336 -4.686 -8.069 461 HG22 THR 61 1HG2 THR 61 -2.612 -6.040 -9.175 462 HG23 THR 61 2HG2 THR 61 -0.974 -5.681 -8.605 463 H ILE 62 H ILE 62 -1.513 -3.418 -5.806 464 HA ILE 62 HA ILE 62 -4.143 -3.367 -4.413 465 HB ILE 62 HB ILE 62 -1.846 -1.466 -3.921 466 HG12 ILE 62 1HG1 ILE 62 -2.263 -2.639 -1.509 467 HG13 ILE 62 2HG1 ILE 62 -2.677 -4.003 -2.510 468 HG21 ILE 62 1HG2 ILE 62 -3.272 -0.649 -2.074 469 HG22 ILE 62 2HG2 ILE 62 -4.028 -0.409 -3.648 470 HG23 ILE 62 3HG2 ILE 62 -4.576 -1.744 -2.600 471 HD11 ILE 62 3HD1 ILE 62 -0.442 -3.882 -3.600 472 HD12 ILE 62 1HD1 ILE 62 -0.058 -2.413 -2.689 473 HD13 ILE 62 2HD1 ILE 62 -0.274 -3.985 -1.858 474 H ASN 63 H ASN 63 -5.616 -2.195 -5.480 475 HA ASN 63 HA ASN 63 -4.785 0.141 -7.125 476 HB2 ASN 63 1HB ASN 63 -7.055 -1.820 -7.738 477 HB3 ASN 63 2HB ASN 63 -7.022 -0.179 -8.321 478 HD21 ASN 63 1HD2 ASN 63 -4.912 -3.155 -8.353 479 HD22 ASN 63 2HD2 ASN 63 -4.264 -2.746 -9.938 480 H ILE 64 H ILE 64 -5.666 1.944 -6.224 481 HA ILE 64 HA ILE 64 -7.968 1.615 -4.379 482 HB ILE 64 HB ILE 64 -6.017 3.939 -4.546 483 HG12 ILE 64 1HG1 ILE 64 -6.270 1.892 -2.319 484 HG13 ILE 64 2HG1 ILE 64 -5.037 1.809 -3.572 485 HG21 ILE 64 1HG2 ILE 64 -8.397 4.514 -3.823 486 HG22 ILE 64 2HG2 ILE 64 -8.235 3.375 -2.514 487 HG23 ILE 64 3HG2 ILE 64 -7.186 4.808 -2.559 488 HD11 ILE 64 3HD1 ILE 64 -4.048 2.815 -1.629 489 HD12 ILE 64 1HD1 ILE 64 -4.190 4.058 -2.890 490 HD13 ILE 64 2HD1 ILE 64 -5.331 4.025 -1.528 491 H GLU 65 H GLU 65 -9.523 1.518 -6.234 492 HA GLU 65 HA GLU 65 -9.759 3.569 -8.223 493 HB2 GLU 65 1HB GLU 65 -10.802 1.281 -8.270 494 HB3 GLU 65 2HB GLU 65 -11.859 1.769 -6.956 495 HG2 GLU 65 1HG GLU 65 -13.279 2.797 -8.325 496 HG3 GLU 65 2HG GLU 65 -12.012 3.748 -9.085 497 H ASN 66 H ASN 66 -10.239 5.669 -7.808 498 HA ASN 66 HA ASN 66 -12.233 6.410 -5.799 499 HB2 ASN 66 1HB ASN 66 -10.905 8.176 -4.810 500 HB3 ASN 66 2HB ASN 66 -10.226 6.611 -4.434 501 HD21 ASN 66 1HD2 ASN 66 -8.085 6.053 -5.386 502 HD22 ASN 66 2HD2 ASN 66 -7.077 7.332 -6.008 503 H ASN 67 H ASN 67 -13.631 7.595 -6.894 504 HA ASN 67 HA ASN 67 -14.583 8.983 -8.342 505 HB2 ASN 67 1HB ASN 67 -11.924 10.451 -8.579 506 HB3 ASN 67 2HB ASN 67 -13.524 11.068 -8.933 507 HD21 ASN 67 1HD2 ASN 67 -11.291 10.183 -6.308 508 HD22 ASN 67 2HD2 ASN 67 -12.261 10.817 -5.004 509 H GLY 68 H GLY 68 -13.172 6.575 -9.371 510 HA2 GLY 68 1HA GLY 68 -12.875 5.535 -11.395 511 HA3 GLY 68 2HA GLY 68 -13.378 7.016 -12.221 512 H GLY 69 H GLY 69 -10.906 7.924 -10.182 513 HA2 GLY 69 1HA GLY 69 -8.662 7.381 -12.051 514 HA3 GLY 69 2HA GLY 69 -8.653 8.515 -10.674 515 H MET 70 H MET 70 -6.644 6.788 -10.436 516 HA MET 70 HA MET 70 -7.394 5.311 -8.159 517 HB2 MET 70 1HB MET 70 -6.750 3.000 -8.930 518 HB3 MET 70 2HB MET 70 -8.132 3.627 -9.794 519 HG2 MET 70 1HG MET 70 -6.505 4.471 -11.588 520 HG3 MET 70 2HG MET 70 -5.274 3.525 -10.786 521 HE1 MET 70 3HE MET 70 -8.358 3.651 -13.098 522 HE2 MET 70 1HE MET 70 -8.903 1.964 -13.214 523 HE3 MET 70 2HE MET 70 -9.146 2.869 -11.709 524 H THR 71 H THR 71 -5.571 4.194 -7.131 525 HA THR 71 HA THR 71 -2.860 5.218 -7.872 526 HB THR 71 HB THR 71 -4.121 5.031 -5.100 527 HG1 THR 71 1HG THR 71 -4.337 7.012 -6.322 528 HG21 THR 71 3HG2 THR 71 -1.187 5.536 -5.764 529 HG22 THR 71 1HG2 THR 71 -1.830 4.082 -4.967 530 HG23 THR 71 2HG2 THR 71 -1.949 5.638 -4.156 531 H THR 72 H THR 72 -1.816 3.453 -8.680 532 HA THR 72 HA THR 72 -2.343 0.762 -7.630 533 HB THR 72 HB THR 72 -0.261 1.751 -9.626 534 HG1 THR 72 1HG THR 72 -2.292 0.266 -10.617 535 HG21 THR 72 3HG2 THR 72 -1.315 -1.069 -9.066 536 HG22 THR 72 1HG2 THR 72 0.330 -0.477 -8.756 537 HG23 THR 72 2HG2 THR 72 -0.239 -0.622 -10.414 538 H MET 73 H MET 73 -0.789 -0.378 -6.366 539 HA MET 73 HA MET 73 1.866 0.507 -6.017 540 HB2 MET 73 1HB MET 73 1.781 0.649 -3.475 541 HB3 MET 73 2HB MET 73 1.215 2.004 -4.403 542 HG2 MET 73 1HG MET 73 -1.157 1.302 -4.039 543 HG3 MET 73 2HG MET 73 -0.553 -0.004 -3.027 544 HE1 MET 73 3HE MET 73 1.576 3.072 -2.423 545 HE2 MET 73 1HE MET 73 0.227 3.861 -3.282 546 HE3 MET 73 2HE MET 73 0.528 4.207 -1.549 547 H PHE 74 H PHE 74 2.953 -1.138 -4.421 548 HA PHE 74 HA PHE 74 1.623 -3.780 -4.324 549 HB2 PHE 74 1HB PHE 74 4.430 -3.325 -5.407 550 HB3 PHE 74 2HB PHE 74 3.537 -4.834 -5.335 551 HD1 PHE 74 2HD PHE 74 1.723 -5.307 -7.009 552 HD2 PHE 74 1HD PHE 74 4.012 -1.654 -7.138 553 HE1 PHE 74 2HE PHE 74 0.945 -4.880 -9.318 554 HE2 PHE 74 1HE PHE 74 3.183 -1.200 -9.411 555 HZ PHE 74 HZ PHE 74 1.605 -2.795 -10.495 556 H TYR 75 H TYR 75 2.568 -5.004 -2.414 557 HA TYR 75 HA TYR 75 4.754 -3.558 -1.008 558 HB2 TYR 75 1HB TYR 75 2.771 -4.911 0.721 559 HB3 TYR 75 2HB TYR 75 3.781 -3.549 1.037 560 HD1 TYR 75 2HD TYR 75 3.033 -1.487 -0.810 561 HD2 TYR 75 1HD TYR 75 0.525 -4.423 1.068 562 HE1 TYR 75 2HE TYR 75 1.146 0.051 -1.008 563 HE2 TYR 75 1HE TYR 75 -1.406 -2.921 0.796 564 HH TYR 75 HH TYR 75 -1.043 0.350 -0.639 565 H TYR 76 H TYR 76 6.091 -4.916 0.338 566 HA TYR 76 HA TYR 76 5.960 -7.811 -0.044 567 HB2 TYR 76 1HB TYR 76 8.218 -7.855 -1.126 568 HB3 TYR 76 2HB TYR 76 6.931 -7.260 -2.133 569 HD1 TYR 76 1HD TYR 76 9.963 -6.395 -0.294 570 HD2 TYR 76 2HD TYR 76 6.868 -4.933 -2.894 571 HE1 TYR 76 1HE TYR 76 11.312 -4.344 -0.703 572 HE2 TYR 76 2HE TYR 76 8.156 -2.823 -3.253 573 HH TYR 76 HH TYR 76 9.974 -1.515 -2.308 574 H GLU 77 H GLU 77 8.071 -8.759 0.938 575 HA GLU 77 HA GLU 77 8.981 -7.244 3.346 576 HB2 GLU 77 1HB GLU 77 7.778 -9.501 3.652 577 HB3 GLU 77 2HB GLU 77 9.136 -10.235 2.809 578 HG2 GLU 77 1HG GLU 77 10.673 -9.283 4.585 579 HG3 GLU 77 2HG GLU 77 9.251 -8.687 5.441 580 H GLU 78 H GLU 78 11.228 -7.029 3.640 581 HA GLU 78 HA GLU 78 13.043 -8.325 1.781 582 HB2 GLU 78 1HB GLU 78 12.180 -6.308 0.576 583 HB3 GLU 78 2HB GLU 78 12.867 -5.277 1.827 584 HG2 GLU 78 1HG GLU 78 15.065 -5.739 1.174 585 HG3 GLU 78 2HG GLU 78 14.627 -7.280 0.449 586 H ASN 79 H ASN 79 14.852 -8.830 2.948 587 HA ASN 79 HA ASN 79 16.277 -9.043 4.691 588 HB2 ASN 79 1HB ASN 79 16.151 -6.120 4.290 589 HB3 ASN 79 2HB ASN 79 16.660 -6.562 5.903 590 HD21 ASN 79 1HD2 ASN 79 17.673 -6.443 2.550 591 HD22 ASN 79 2HD2 ASN 79 19.220 -7.164 2.834 592 H GLY 80 H GLY 80 13.149 -8.913 5.257 593 HA2 GLY 80 1HA GLY 80 12.046 -9.819 7.098 594 HA3 GLY 80 2HA GLY 80 13.456 -9.524 8.122 595 H LYS 81 H LYS 81 12.557 -6.806 6.158 596 HA LYS 81 HA LYS 81 10.788 -5.594 8.176 597 HB2 LYS 81 1HB LYS 81 13.223 -4.601 6.743 598 HB3 LYS 81 2HB LYS 81 11.792 -3.639 6.476 599 HG2 LYS 81 1HG LYS 81 12.980 -2.749 8.377 600 HG3 LYS 81 2HG LYS 81 11.420 -3.411 8.857 601 HD2 LYS 81 1HD LYS 81 12.834 -4.005 10.581 602 HD3 LYS 81 2HD LYS 81 12.665 -5.498 9.691 603 HE2 LYS 81 1HE LYS 81 15.012 -3.559 9.382 604 HE3 LYS 81 2HE LYS 81 14.990 -4.856 10.567 605 HZ1 LYS 81 3HZ LYS 81 14.984 -6.475 8.820 606 HZ2 LYS 81 1HZ LYS 81 16.187 -5.406 8.579 607 HZ3 LYS 81 2HZ LYS 81 14.832 -5.314 7.657 608 H TYR 82 H TYR 82 9.099 -4.143 6.937 609 HA TYR 82 HA TYR 82 8.481 -5.478 4.333 610 HB2 TYR 82 1HB TYR 82 6.709 -4.322 6.472 611 HB3 TYR 82 2HB TYR 82 6.142 -4.867 4.903 612 HD1 TYR 82 2HD TYR 82 6.290 -7.391 4.372 613 HD2 TYR 82 1HD TYR 82 7.149 -5.758 8.285 614 HE1 TYR 82 2HE TYR 82 6.189 -9.650 5.347 615 HE2 TYR 82 1HE TYR 82 7.018 -8.027 9.261 616 HH TYR 82 HH TYR 82 7.193 -10.759 7.273 617 H TYR 83 H TYR 83 7.705 -4.105 2.635 618 HA TYR 83 HA TYR 83 8.017 -1.219 3.100 619 HB2 TYR 83 1HB TYR 83 9.489 -2.681 0.882 620 HB3 TYR 83 2HB TYR 83 9.458 -0.943 1.110 621 HD1 TYR 83 1HD TYR 83 10.760 -4.147 2.419 622 HD2 TYR 83 2HD TYR 83 10.789 0.124 2.900 623 HE1 TYR 83 1HE TYR 83 12.615 -4.383 3.947 624 HE2 TYR 83 2HE TYR 83 12.636 -0.064 4.551 625 HH TYR 83 HH TYR 83 13.852 -1.610 5.855 626 H ILE 84 H ILE 84 7.216 0.093 1.376 627 HA ILE 84 HA ILE 84 5.075 -1.188 -0.251 628 HB ILE 84 HB ILE 84 5.089 1.436 1.270 629 HG12 ILE 84 1HG1 ILE 84 2.684 0.396 1.824 630 HG13 ILE 84 2HG1 ILE 84 3.527 -1.114 1.479 631 HG21 ILE 84 1HG2 ILE 84 3.265 0.754 -1.013 632 HG22 ILE 84 2HG2 ILE 84 2.854 1.943 0.247 633 HG23 ILE 84 3HG2 ILE 84 4.270 2.184 -0.769 634 HD11 ILE 84 3HD1 ILE 84 5.035 -0.817 3.254 635 HD12 ILE 84 1HD1 ILE 84 4.573 0.899 3.470 636 HD13 ILE 84 2HD1 ILE 84 3.419 -0.392 3.846 637 H GLU 85 H GLU 85 5.181 -0.893 -2.380 638 HA GLU 85 HA GLU 85 7.235 0.745 -3.593 639 HB2 GLU 85 1HB GLU 85 6.483 -1.489 -4.455 640 HB3 GLU 85 2HB GLU 85 4.891 -0.821 -4.784 641 HG2 GLU 85 1HG GLU 85 7.467 0.187 -6.071 642 HG3 GLU 85 2HG GLU 85 6.447 -1.084 -6.758 643 H CYS 86 H CYS 86 6.814 2.402 -5.069 644 HA CYS 86 HA CYS 86 4.500 3.699 -5.585 645 HB2 CYS 86 1HB CYS 86 5.763 4.471 -3.011 646 HB3 CYS 86 2HB CYS 86 5.652 5.859 -4.127 647 HG CYS 86 HG CYS 86 3.353 3.635 -3.377 648 HA PRO 87 HA PRO 87 7.726 5.626 -8.273 649 HB2 PRO 87 1HB PRO 87 6.834 8.139 -8.785 650 HB3 PRO 87 2HB PRO 87 6.007 6.682 -9.428 651 HG2 PRO 87 1HG PRO 87 5.306 8.290 -6.951 652 HG3 PRO 87 2HG PRO 87 4.219 7.702 -8.262 653 HD2 PRO 87 1HD PRO 87 4.565 6.398 -5.877 654 HD3 PRO 87 2HD PRO 87 4.169 5.565 -7.377 655 H TYR 88 H TYR 88 8.792 8.168 -8.059 656 HA TYR 88 HA TYR 88 10.809 8.131 -6.552 657 HB2 TYR 88 1HB TYR 88 9.133 10.636 -6.901 658 HB3 TYR 88 2HB TYR 88 10.789 10.635 -6.355 659 HD1 TYR 88 1HD TYR 88 8.688 9.878 -9.357 660 HD2 TYR 88 2HD TYR 88 12.670 10.395 -7.748 661 HE1 TYR 88 1HE TYR 88 9.617 9.910 -11.637 662 HE2 TYR 88 2HE TYR 88 13.583 10.519 -10.006 663 HH TYR 88 HH TYR 88 11.598 9.742 -12.854 664 H LYS 89 H LYS 89 7.889 8.160 -4.815 665 HA LYS 89 HA LYS 89 9.255 9.018 -2.323 666 HB2 LYS 89 1HB LYS 89 6.307 9.277 -3.095 667 HB3 LYS 89 2HB LYS 89 6.865 9.557 -1.482 668 HG2 LYS 89 1HG LYS 89 7.618 11.619 -1.924 669 HG3 LYS 89 2HG LYS 89 8.493 11.135 -3.346 670 HD2 LYS 89 1HD LYS 89 5.482 11.604 -3.264 671 HD3 LYS 89 2HD LYS 89 6.675 12.807 -3.807 672 HE2 LYS 89 1HE LYS 89 7.384 11.503 -5.642 673 HE3 LYS 89 2HE LYS 89 6.679 10.034 -4.982 674 HZ1 LYS 89 3HZ LYS 89 5.294 11.036 -6.828 675 HZ2 LYS 89 1HZ LYS 89 5.111 12.374 -5.926 676 HZ3 LYS 89 2HZ LYS 89 4.458 10.990 -5.401 677 H GLY 90 H GLY 90 9.132 6.299 -3.633 678 HA2 GLY 90 1HA GLY 90 7.393 4.965 -1.703 679 HA3 GLY 90 2HA GLY 90 7.978 4.306 -3.252 680 H ILE 91 H ILE 91 9.878 5.663 -0.441 681 HA ILE 91 HA ILE 91 10.951 2.882 -0.093 682 HB ILE 91 HB ILE 91 12.476 5.325 0.815 683 HG12 ILE 91 1HG1 ILE 91 12.330 4.099 -1.956 684 HG13 ILE 91 2HG1 ILE 91 12.397 5.809 -1.467 685 HG21 ILE 91 1HG2 ILE 91 13.350 2.505 0.098 686 HG22 ILE 91 2HG2 ILE 91 14.270 3.740 0.989 687 HG23 ILE 91 3HG2 ILE 91 12.856 2.954 1.717 688 HD11 ILE 91 3HD1 ILE 91 14.829 5.365 -0.824 689 HD12 ILE 91 1HD1 ILE 91 14.660 3.735 -1.505 690 HD13 ILE 91 2HD1 ILE 91 14.470 5.134 -2.537 691 H TYR 92 H TYR 92 8.530 3.274 0.864 692 HA TYR 92 HA TYR 92 8.589 4.207 3.637 693 HB2 TYR 92 1HB TYR 92 6.532 2.418 2.321 694 HB3 TYR 92 2HB TYR 92 6.350 3.251 3.843 695 HD1 TYR 92 2HD TYR 92 5.911 5.662 3.931 696 HD2 TYR 92 1HD TYR 92 6.203 3.556 0.168 697 HE1 TYR 92 2HE TYR 92 4.990 7.631 2.778 698 HE2 TYR 92 1HE TYR 92 5.208 5.473 -0.978 699 HH TYR 92 HH TYR 92 4.096 7.558 -0.672 700 H GLU 93 H GLU 93 9.956 3.202 4.848 701 HA GLU 93 HA GLU 93 10.009 0.292 5.250 702 HB2 GLU 93 1HB GLU 93 11.872 1.915 5.789 703 HB3 GLU 93 2HB GLU 93 10.777 2.746 6.885 704 HG2 GLU 93 1HG GLU 93 10.752 0.465 8.199 705 HG3 GLU 93 2HG GLU 93 12.143 0.059 7.187 706 H ILE 94 H ILE 94 8.377 -0.741 6.206 707 HA ILE 94 HA ILE 94 7.060 0.555 8.508 708 HB ILE 94 HB ILE 94 5.072 -0.715 8.323 709 HG12 ILE 94 1HG1 ILE 94 6.256 -2.046 5.874 710 HG13 ILE 94 2HG1 ILE 94 5.835 -2.741 7.456 711 HG21 ILE 94 1HG2 ILE 94 5.604 0.619 5.639 712 HG22 ILE 94 2HG2 ILE 94 4.008 0.277 6.361 713 HG23 ILE 94 3HG2 ILE 94 5.104 1.381 7.171 714 HD11 ILE 94 3HD1 ILE 94 3.417 -2.150 6.955 715 HD12 ILE 94 1HD1 ILE 94 3.944 -1.851 5.287 716 HD13 ILE 94 2HD1 ILE 94 4.146 -3.454 5.975 717 H GLU 95 H GLU 95 6.712 -1.088 10.256 718 HA GLU 95 HA GLU 95 9.017 -2.992 10.225 719 HB2 GLU 95 1HB GLU 95 7.574 -1.815 12.623 720 HB3 GLU 95 2HB GLU 95 9.057 -2.785 12.609 721 HG2 GLU 95 1HG GLU 95 10.000 -0.921 11.039 722 HG3 GLU 95 2HG GLU 95 8.655 0.056 11.612 723 H ASN 96 H ASN 96 5.646 -3.018 9.864 724 HA ASN 96 HA ASN 96 5.455 -5.795 10.823 725 HB2 ASN 96 1HB ASN 96 3.398 -3.602 11.341 726 HB3 ASN 96 2HB ASN 96 3.255 -5.278 11.841 727 HD21 ASN 96 1HD2 ASN 96 4.891 -6.129 13.436 728 HD22 ASN 96 2HD2 ASN 96 5.947 -5.004 14.277 729 H ASN 97 H ASN 97 3.979 -7.024 9.786 730 HA ASN 97 HA ASN 97 3.806 -6.606 7.001 731 HB2 ASN 97 1HB ASN 97 3.988 -8.849 8.103 732 HB3 ASN 97 2HB ASN 97 2.335 -8.669 8.707 733 HD21 ASN 97 1HD2 ASN 97 4.258 -8.557 5.639 734 HD22 ASN 97 2HD2 ASN 97 3.006 -9.183 4.636 735 H PHE 98 H PHE 98 2.339 -5.609 5.780 736 HA PHE 98 HA PHE 98 0.017 -4.319 6.781 737 HB2 PHE 98 1HB PHE 98 1.386 -3.573 4.871 738 HB3 PHE 98 2HB PHE 98 0.913 -4.994 3.946 739 HD1 PHE 98 2HD PHE 98 -1.534 -5.295 3.291 740 HD2 PHE 98 1HD PHE 98 0.083 -1.572 4.756 741 HE1 PHE 98 2HE PHE 98 -3.423 -4.100 2.305 742 HE2 PHE 98 1HE PHE 98 -1.767 -0.327 3.635 743 HZ PHE 98 HZ PHE 98 -3.526 -1.616 2.404 744 H GLU 99 H GLU 99 0.385 -7.371 4.826 745 HA GLU 99 HA GLU 99 -2.403 -7.727 4.463 746 HB2 GLU 99 1HB GLU 99 0.053 -9.353 3.940 747 HB3 GLU 99 2HB GLU 99 -1.490 -10.211 3.997 748 HG2 GLU 99 1HG GLU 99 -2.461 -8.698 2.320 749 HG3 GLU 99 2HG GLU 99 -0.988 -7.757 2.286 750 H ASP 100 H ASP 100 -0.667 -8.215 7.383 751 HA ASP 100 HA ASP 100 -2.878 -9.991 8.363 752 HB2 ASP 100 1HB ASP 100 -0.378 -10.657 8.615 753 HB3 ASP 100 2HB ASP 100 -0.353 -9.459 9.916 754 H MET 101 H MET 101 -1.943 -6.777 8.248 755 HA MET 101 HA MET 101 -3.114 -5.978 10.858 756 HB2 MET 101 1HB MET 101 -1.676 -4.504 8.611 757 HB3 MET 101 2HB MET 101 -2.496 -3.671 9.932 758 HG2 MET 101 1HG MET 101 -0.476 -5.820 10.570 759 HG3 MET 101 2HG MET 101 0.057 -4.215 10.091 760 HE1 MET 101 3HE MET 101 1.265 -3.532 12.349 761 HE2 MET 101 1HE MET 101 0.656 -4.069 13.928 762 HE3 MET 101 2HE MET 101 1.063 -5.271 12.689 763 H ILE 102 H ILE 102 -3.961 -6.378 7.497 764 HA ILE 102 HA ILE 102 -6.315 -4.645 7.710 765 HB ILE 102 HB ILE 102 -6.741 -5.363 5.374 766 HG12 ILE 102 1HG1 ILE 102 -4.171 -6.960 5.690 767 HG13 ILE 102 2HG1 ILE 102 -5.781 -7.584 5.357 768 HG21 ILE 102 1HG2 ILE 102 -5.010 -3.988 4.412 769 HG22 ILE 102 2HG2 ILE 102 -5.377 -3.336 6.016 770 HG23 ILE 102 3HG2 ILE 102 -3.911 -4.303 5.764 771 HD11 ILE 102 3HD1 ILE 102 -4.076 -5.869 3.513 772 HD12 ILE 102 1HD1 ILE 102 -4.462 -7.562 3.318 773 HD13 ILE 102 2HD1 ILE 102 -5.755 -6.351 3.161 Start of MODEL 17 1 H1 GLY 1 H GLY 1 5.220 14.401 8.445 2 HA2 GLY 1 1HA GLY 1 6.081 13.834 5.681 3 HA3 GLY 1 2HA GLY 1 6.414 12.797 7.083 4 H SER 2 H SER 2 5.290 10.954 6.566 5 HA SER 2 HA SER 2 3.608 9.495 6.243 6 HB2 SER 2 1HB SER 2 1.653 11.795 5.782 7 HB3 SER 2 2HB SER 2 1.255 10.107 5.977 8 HG SER 2 HG SER 2 2.748 10.889 8.087 9 HA PRO 3 HA PRO 3 3.260 9.519 1.643 10 HB2 PRO 3 1HB PRO 3 0.878 8.071 1.342 11 HB3 PRO 3 2HB PRO 3 2.464 7.338 1.586 12 HG2 PRO 3 1HG PRO 3 0.335 7.885 3.624 13 HG3 PRO 3 2HG PRO 3 1.397 6.450 3.414 14 HD2 PRO 3 1HD PRO 3 1.901 8.283 5.306 15 HD3 PRO 3 2HD PRO 3 3.187 7.449 4.415 16 H ILE 4 H ILE 4 1.183 9.875 0.087 17 HA ILE 4 HA ILE 4 -0.731 11.806 1.220 18 HB ILE 4 HB ILE 4 0.345 11.883 -1.633 19 HG12 ILE 4 1HG1 ILE 4 1.108 13.663 0.697 20 HG13 ILE 4 2HG1 ILE 4 2.168 12.517 -0.098 21 HG21 ILE 4 1HG2 ILE 4 -1.963 12.713 -1.310 22 HG22 ILE 4 2HG2 ILE 4 -1.386 13.826 -0.039 23 HG23 ILE 4 3HG2 ILE 4 -0.876 14.026 -1.728 24 HD11 ILE 4 3HD1 ILE 4 1.099 15.039 -1.393 25 HD12 ILE 4 1HD1 ILE 4 2.752 14.692 -0.877 26 HD13 ILE 4 2HD1 ILE 4 2.037 13.771 -2.213 27 H LEU 5 H LEU 5 -2.733 10.757 1.110 28 HA LEU 5 HA LEU 5 -3.238 8.821 -1.057 29 HB2 LEU 5 1HB LEU 5 -4.540 7.505 0.621 30 HB3 LEU 5 2HB LEU 5 -2.806 7.401 0.795 31 HG LEU 5 HG LEU 5 -4.010 9.544 2.472 32 HD11 LEU 5 1HD1 LEU 5 -5.880 7.963 2.584 33 HD12 LEU 5 2HD1 LEU 5 -5.024 8.044 4.125 34 HD13 LEU 5 3HD1 LEU 5 -4.767 6.654 3.045 35 HD21 LEU 5 3HD2 LEU 5 -2.578 8.598 4.166 36 HD22 LEU 5 1HD2 LEU 5 -1.659 8.623 2.645 37 HD23 LEU 5 2HD2 LEU 5 -2.366 7.088 3.240 38 HA PRO 6 HA PRO 6 -6.950 11.231 -1.400 39 HB2 PRO 6 1HB PRO 6 -8.764 9.430 -2.425 40 HB3 PRO 6 2HB PRO 6 -7.368 10.036 -3.351 41 HG2 PRO 6 1HG PRO 6 -7.596 7.458 -1.764 42 HG3 PRO 6 2HG PRO 6 -7.053 7.669 -3.466 43 HD2 PRO 6 1HD PRO 6 -5.288 7.488 -1.447 44 HD3 PRO 6 2HD PRO 6 -5.011 8.624 -2.792 45 H LYS 7 H LYS 7 -9.311 11.446 -0.505 46 HA LYS 7 HA LYS 7 -9.355 10.845 2.258 47 HB2 LYS 7 1HB LYS 7 -11.716 11.493 0.408 48 HB3 LYS 7 2HB LYS 7 -11.590 11.784 2.140 49 HG2 LYS 7 1HG LYS 7 -9.377 13.182 0.936 50 HG3 LYS 7 2HG LYS 7 -10.774 13.459 -0.114 51 HD2 LYS 7 1HD LYS 7 -10.741 13.811 2.877 52 HD3 LYS 7 2HD LYS 7 -10.412 15.150 1.766 53 HE2 LYS 7 1HE LYS 7 -12.953 13.525 1.530 54 HE3 LYS 7 2HE LYS 7 -12.838 14.817 2.736 55 HZ1 LYS 7 3HZ LYS 7 -12.781 15.084 -0.177 56 HZ2 LYS 7 1HZ LYS 7 -12.233 16.300 0.829 57 HZ3 LYS 7 2HZ LYS 7 -13.768 15.792 0.908 58 H ALA 8 H ALA 8 -10.788 9.375 3.471 59 HA ALA 8 HA ALA 8 -11.445 6.863 2.304 60 HB1 ALA 8 1HB ALA 8 -12.655 6.419 4.340 61 HB2 ALA 8 2HB ALA 8 -11.325 7.481 4.804 62 HB3 ALA 8 3HB ALA 8 -12.945 8.155 4.633 63 H GLU 9 H GLU 9 -13.500 9.754 2.896 64 HA GLU 9 HA GLU 9 -15.805 8.595 1.898 65 HB2 GLU 9 1HB GLU 9 -16.802 10.773 2.006 66 HB3 GLU 9 2HB GLU 9 -15.717 10.540 3.380 67 HG2 GLU 9 1HG GLU 9 -13.973 11.874 2.223 68 HG3 GLU 9 2HG GLU 9 -15.083 12.171 0.881 69 H ASN 10 H ASN 10 -13.225 9.759 -0.130 70 HA ASN 10 HA ASN 10 -15.085 9.998 -2.420 71 HB2 ASN 10 1HB ASN 10 -13.625 11.312 -3.500 72 HB3 ASN 10 2HB ASN 10 -13.480 11.924 -1.818 73 HD21 ASN 10 1HD2 ASN 10 -11.619 9.450 -1.244 74 HD22 ASN 10 2HD2 ASN 10 -10.150 10.092 -1.846 75 H VAL 11 H VAL 11 -13.486 7.567 -1.008 76 HA VAL 11 HA VAL 11 -12.356 6.345 -3.454 77 HB VAL 11 HB VAL 11 -12.307 5.733 -0.486 78 HG11 VAL 11 1HG1 VAL 11 -11.199 3.673 -0.861 79 HG12 VAL 11 2HG1 VAL 11 -12.732 3.607 -1.733 80 HG13 VAL 11 3HG1 VAL 11 -11.237 3.867 -2.628 81 HG21 VAL 11 3HG2 VAL 11 -9.869 5.836 -0.861 82 HG22 VAL 11 1HG2 VAL 11 -10.151 6.082 -2.606 83 HG23 VAL 11 2HG2 VAL 11 -10.622 7.318 -1.473 84 H ASP 12 H ASP 12 -13.385 4.750 -4.426 85 HA ASP 12 HA ASP 12 -16.324 4.636 -4.082 86 HB2 ASP 12 1HB ASP 12 -14.997 5.068 -6.293 87 HB3 ASP 12 2HB ASP 12 -14.668 3.345 -6.273 88 H SER 13 H SER 13 -13.577 2.378 -4.678 89 HA SER 13 HA SER 13 -14.277 0.786 -2.355 90 HB2 SER 13 1HB SER 13 -14.228 -1.342 -3.677 91 HB3 SER 13 2HB SER 13 -15.649 -0.349 -3.952 92 HG SER 13 HG SER 13 -14.901 -1.079 -5.902 93 H ILE 14 H ILE 14 -12.435 -0.917 -2.060 94 HA ILE 14 HA ILE 14 -9.894 -0.183 -3.415 95 HB ILE 14 HB ILE 14 -10.401 -0.735 -0.468 96 HG12 ILE 14 1HG1 ILE 14 -8.694 1.430 -1.737 97 HG13 ILE 14 2HG1 ILE 14 -10.418 1.628 -1.464 98 HG21 ILE 14 1HG2 ILE 14 -8.524 -2.182 -1.044 99 HG22 ILE 14 2HG2 ILE 14 -7.725 -0.870 -1.935 100 HG23 ILE 14 3HG2 ILE 14 -7.896 -0.797 -0.173 101 HD11 ILE 14 3HD1 ILE 14 -9.284 2.661 0.374 102 HD12 ILE 14 1HD1 ILE 14 -10.062 1.183 0.979 103 HD13 ILE 14 2HD1 ILE 14 -8.310 1.220 0.683 104 H CYS 15 H CYS 15 -8.708 -1.981 -3.984 105 HA CYS 15 HA CYS 15 -9.891 -4.654 -3.448 106 HB2 CYS 15 1HB CYS 15 -10.079 -3.417 -5.862 107 HB3 CYS 15 2HB CYS 15 -8.477 -4.155 -6.032 108 HG CYS 15 HG CYS 15 -9.088 -6.500 -5.904 109 H ILE 16 H ILE 16 -8.306 -6.221 -3.057 110 HA ILE 16 HA ILE 16 -5.450 -5.453 -3.045 111 HB ILE 16 HB ILE 16 -6.915 -6.664 -0.657 112 HG12 ILE 16 1HG1 ILE 16 -5.582 -3.975 -1.151 113 HG13 ILE 16 2HG1 ILE 16 -7.262 -4.256 -0.738 114 HG21 ILE 16 1HG2 ILE 16 -4.689 -7.696 -1.016 115 HG22 ILE 16 2HG2 ILE 16 -3.961 -6.074 -0.967 116 HG23 ILE 16 3HG2 ILE 16 -4.749 -6.758 0.471 117 HD11 ILE 16 3HD1 ILE 16 -4.862 -4.554 1.098 118 HD12 ILE 16 1HD1 ILE 16 -6.134 -3.340 1.167 119 HD13 ILE 16 2HD1 ILE 16 -6.518 -5.036 1.542 120 H ASP 17 H ASP 17 -4.668 -6.861 -4.463 121 HA ASP 17 HA ASP 17 -5.835 -9.549 -4.946 122 HB2 ASP 17 1HB ASP 17 -4.088 -7.634 -6.465 123 HB3 ASP 17 2HB ASP 17 -3.762 -9.341 -6.684 124 H PHE 18 H PHE 18 -4.904 -10.973 -3.525 125 HA PHE 18 HA PHE 18 -2.445 -10.400 -2.034 126 HB2 PHE 18 1HB PHE 18 -4.307 -12.786 -2.229 127 HB3 PHE 18 2HB PHE 18 -2.797 -12.854 -1.354 128 HD1 PHE 18 1HD PHE 18 -5.806 -10.481 -1.485 129 HD2 PHE 18 2HD PHE 18 -2.893 -12.544 0.960 130 HE1 PHE 18 1HE PHE 18 -6.791 -9.517 0.518 131 HE2 PHE 18 2HE PHE 18 -3.925 -11.595 2.969 132 HZ PHE 18 HZ PHE 18 -5.896 -10.083 2.781 133 H THR 19 H THR 19 -0.679 -12.224 -2.139 134 HA THR 19 HA THR 19 0.589 -12.158 -4.663 135 HB THR 19 HB THR 19 1.925 -14.179 -3.613 136 HG1 THR 19 1HG THR 19 0.613 -13.229 -1.270 137 HG21 THR 19 3HG2 THR 19 2.796 -11.947 -3.725 138 HG22 THR 19 1HG2 THR 19 3.131 -12.629 -2.142 139 HG23 THR 19 2HG2 THR 19 1.811 -11.440 -2.329 140 H ASN 20 H ASN 20 -1.984 -14.186 -3.750 141 HA ASN 20 HA ASN 20 -1.379 -16.156 -5.892 142 HB2 ASN 20 1HB ASN 20 -3.532 -17.185 -4.314 143 HB3 ASN 20 2HB ASN 20 -1.914 -17.795 -4.522 144 HD21 ASN 20 1HD2 ASN 20 -3.919 -15.613 -2.435 145 HD22 ASN 20 2HD2 ASN 20 -2.836 -15.812 -1.068 146 H SER 21 H SER 21 -3.818 -17.144 -6.487 147 HA SER 21 HA SER 21 -4.934 -15.102 -8.175 148 HB2 SER 21 1HB SER 21 -6.240 -17.099 -8.869 149 HB3 SER 21 2HB SER 21 -4.511 -17.104 -9.142 150 HG SER 21 HG SER 21 -5.767 -18.488 -6.958 151 H ILE 22 H ILE 22 -5.360 -14.207 -5.562 152 HA ILE 22 HA ILE 22 -8.235 -14.575 -5.107 153 HB ILE 22 HB ILE 22 -6.330 -14.455 -2.771 154 HG12 ILE 22 1HG1 ILE 22 -7.195 -17.083 -4.007 155 HG13 ILE 22 2HG1 ILE 22 -5.573 -16.399 -3.983 156 HG21 ILE 22 1HG2 ILE 22 -8.810 -14.036 -2.607 157 HG22 ILE 22 2HG2 ILE 22 -9.058 -15.705 -3.123 158 HG23 ILE 22 3HG2 ILE 22 -8.228 -15.326 -1.567 159 HD11 ILE 22 3HD1 ILE 22 -5.725 -16.420 -1.421 160 HD12 ILE 22 1HD1 ILE 22 -7.174 -17.429 -1.625 161 HD13 ILE 22 2HD1 ILE 22 -5.616 -17.997 -2.233 162 H GLN 23 H GLN 23 -9.045 -12.625 -4.771 163 HA GLN 23 HA GLN 23 -7.449 -10.442 -3.722 164 HB2 GLN 23 1HB GLN 23 -7.944 -9.308 -5.573 165 HB3 GLN 23 2HB GLN 23 -7.973 -10.871 -6.294 166 HG2 GLN 23 1HG GLN 23 -10.559 -10.697 -5.706 167 HG3 GLN 23 2HG GLN 23 -10.188 -8.966 -5.775 168 HE21 GLN 23 1HE2 GLN 23 -8.091 -9.589 -8.016 169 HE22 GLN 23 2HE2 GLN 23 -9.069 -9.852 -9.431 170 H LYS 24 H LYS 24 -8.644 -8.901 -2.517 171 HA LYS 24 HA LYS 24 -11.392 -9.717 -1.650 172 HB2 LYS 24 1HB LYS 24 -9.113 -9.852 -0.052 173 HB3 LYS 24 2HB LYS 24 -9.660 -8.240 0.295 174 HG2 LYS 24 1HG LYS 24 -11.925 -10.078 0.406 175 HG3 LYS 24 2HG LYS 24 -10.576 -10.743 1.311 176 HD2 LYS 24 1HD LYS 24 -12.042 -9.560 2.785 177 HD3 LYS 24 2HD LYS 24 -10.489 -8.709 2.719 178 HE2 LYS 24 1HE LYS 24 -11.386 -7.007 1.279 179 HE3 LYS 24 2HE LYS 24 -12.791 -7.990 0.878 180 HZ1 LYS 24 3HZ LYS 24 -13.727 -7.589 2.972 181 HZ2 LYS 24 1HZ LYS 24 -13.237 -6.167 2.397 182 HZ3 LYS 24 2HZ LYS 24 -12.370 -6.881 3.596 183 H ILE 25 H ILE 25 -12.887 -7.947 -1.484 184 HA ILE 25 HA ILE 25 -11.793 -5.327 -2.363 185 HB ILE 25 HB ILE 25 -14.580 -6.385 -2.919 186 HG12 ILE 25 1HG1 ILE 25 -13.261 -6.260 -5.387 187 HG13 ILE 25 2HG1 ILE 25 -12.038 -6.950 -4.332 188 HG21 ILE 25 1HG2 ILE 25 -14.534 -4.559 -4.623 189 HG22 ILE 25 2HG2 ILE 25 -14.420 -3.944 -2.982 190 HG23 ILE 25 3HG2 ILE 25 -12.968 -4.038 -4.023 191 HD11 ILE 25 3HD1 ILE 25 -14.828 -8.077 -4.648 192 HD12 ILE 25 1HD1 ILE 25 -13.382 -8.641 -5.509 193 HD13 ILE 25 2HD1 ILE 25 -13.464 -8.796 -3.746 194 H TYR 26 H TYR 26 -12.620 -3.475 -1.351 195 HA TYR 26 HA TYR 26 -13.944 -3.948 1.284 196 HB2 TYR 26 1HB TYR 26 -11.629 -2.075 0.798 197 HB3 TYR 26 2HB TYR 26 -12.457 -2.460 2.301 198 HD1 TYR 26 2HD TYR 26 -10.349 -3.971 -0.423 199 HD2 TYR 26 1HD TYR 26 -11.536 -4.190 3.723 200 HE1 TYR 26 2HE TYR 26 -8.821 -5.836 -0.084 201 HE2 TYR 26 1HE TYR 26 -9.901 -6.014 4.088 202 HH TYR 26 HH TYR 26 -7.634 -7.048 1.589 203 H ASP 27 H ASP 27 -15.926 -3.413 0.185 204 HA ASP 27 HA ASP 27 -16.259 -0.712 -0.858 205 HB2 ASP 27 1HB ASP 27 -18.588 -1.503 -1.258 206 HB3 ASP 27 2HB ASP 27 -17.340 -2.406 -2.087 207 H ASP 28 H ASP 28 -16.598 -2.312 2.210 208 HA ASP 28 HA ASP 28 -18.615 -0.427 3.179 209 HB2 ASP 28 1HB ASP 28 -17.628 -2.019 5.338 210 HB3 ASP 28 2HB ASP 28 -19.208 -2.042 4.595 211 H SER 29 H SER 29 -18.342 1.152 4.657 212 HA SER 29 HA SER 29 -16.124 2.695 4.815 213 HB2 SER 29 1HB SER 29 -18.357 3.393 5.588 214 HB3 SER 29 2HB SER 29 -18.227 2.333 6.985 215 HG SER 29 HG SER 29 -16.877 3.645 7.936 216 H GLU 30 H GLU 30 -16.918 0.231 7.317 217 HA GLU 30 HA GLU 30 -14.598 1.034 8.893 218 HB2 GLU 30 1HB GLU 30 -16.652 -0.018 9.872 219 HB3 GLU 30 2HB GLU 30 -16.166 -1.581 9.159 220 HG2 GLU 30 1HG GLU 30 -14.098 -1.547 10.428 221 HG3 GLU 30 2HG GLU 30 -14.409 0.098 11.020 222 H SER 31 H SER 31 -15.233 -1.480 6.507 223 HA SER 31 HA SER 31 -12.646 -2.746 6.499 224 HB2 SER 31 1HB SER 31 -14.855 -2.617 4.415 225 HB3 SER 31 2HB SER 31 -13.495 -3.725 4.418 226 HG SER 31 HG SER 31 -15.781 -4.158 5.408 227 H ILE 32 H ILE 32 -13.591 0.391 5.432 228 HA ILE 32 HA ILE 32 -11.217 0.498 3.624 229 HB ILE 32 HB ILE 32 -13.494 2.448 4.176 230 HG12 ILE 32 1HG1 ILE 32 -12.681 0.888 1.716 231 HG13 ILE 32 2HG1 ILE 32 -13.883 0.293 2.790 232 HG21 ILE 32 1HG2 ILE 32 -12.432 3.763 2.275 233 HG22 ILE 32 2HG2 ILE 32 -11.508 3.743 3.776 234 HG23 ILE 32 3HG2 ILE 32 -10.996 2.718 2.445 235 HD11 ILE 32 3HD1 ILE 32 -15.017 1.347 0.926 236 HD12 ILE 32 1HD1 ILE 32 -15.363 2.222 2.434 237 HD13 ILE 32 2HD1 ILE 32 -14.209 2.888 1.258 238 H GLN 33 H GLN 33 -12.542 1.932 6.599 239 HA GLN 33 HA GLN 33 -10.437 3.758 7.044 240 HB2 GLN 33 1HB GLN 33 -12.861 2.867 8.325 241 HB3 GLN 33 2HB GLN 33 -11.600 3.071 9.549 242 HG2 GLN 33 1HG GLN 33 -12.130 5.132 7.398 243 HG3 GLN 33 2HG GLN 33 -13.170 5.045 8.818 244 HE21 GLN 33 1HE2 GLN 33 -10.671 6.844 7.706 245 HE22 GLN 33 2HE2 GLN 33 -9.915 7.241 9.233 246 H LYS 34 H LYS 34 -10.574 0.340 7.920 247 HA LYS 34 HA LYS 34 -8.262 0.511 9.637 248 HB2 LYS 34 1HB LYS 34 -10.068 -1.436 9.256 249 HB3 LYS 34 2HB LYS 34 -8.817 -2.063 8.211 250 HG2 LYS 34 1HG LYS 34 -8.256 -1.320 11.069 251 HG3 LYS 34 2HG LYS 34 -8.798 -2.909 10.562 252 HD2 LYS 34 1HD LYS 34 -6.742 -3.488 10.048 253 HD3 LYS 34 2HD LYS 34 -6.648 -2.264 8.787 254 HE2 LYS 34 1HE LYS 34 -5.077 -1.222 9.933 255 HE3 LYS 34 2HE LYS 34 -6.261 -0.800 11.171 256 HZ1 LYS 34 3HZ LYS 34 -4.573 -3.205 11.064 257 HZ2 LYS 34 1HZ LYS 34 -5.697 -2.945 12.247 258 HZ3 LYS 34 2HZ LYS 34 -4.399 -1.946 12.139 259 H ILE 35 H ILE 35 -8.472 -0.704 6.152 260 HA ILE 35 HA ILE 35 -5.840 -0.765 5.631 261 HB ILE 35 HB ILE 35 -8.207 0.149 3.929 262 HG12 ILE 35 1HG1 ILE 35 -6.530 -2.375 3.860 263 HG13 ILE 35 2HG1 ILE 35 -7.923 -2.257 4.843 264 HG21 ILE 35 1HG2 ILE 35 -6.800 -0.192 1.901 265 HG22 ILE 35 2HG2 ILE 35 -6.251 1.159 2.866 266 HG23 ILE 35 3HG2 ILE 35 -5.376 -0.391 2.935 267 HD11 ILE 35 3HD1 ILE 35 -7.989 -2.035 1.808 268 HD12 ILE 35 1HD1 ILE 35 -8.506 -3.389 2.793 269 HD13 ILE 35 2HD1 ILE 35 -9.390 -1.854 2.880 270 H LEU 36 H LEU 36 -7.808 2.299 5.364 271 HA LEU 36 HA LEU 36 -5.728 3.992 4.597 272 HB2 LEU 36 1HB LEU 36 -8.090 4.506 6.434 273 HB3 LEU 36 2HB LEU 36 -7.074 5.792 5.800 274 HG LEU 36 HG LEU 36 -8.491 3.878 3.893 275 HD11 LEU 36 1HD1 LEU 36 -10.251 5.641 3.795 276 HD12 LEU 36 2HD1 LEU 36 -9.502 6.420 5.220 277 HD13 LEU 36 3HD1 LEU 36 -10.221 4.797 5.329 278 HD21 LEU 36 3HD2 LEU 36 -6.778 5.447 2.931 279 HD22 LEU 36 1HD2 LEU 36 -7.708 6.817 3.624 280 HD23 LEU 36 2HD2 LEU 36 -8.420 5.797 2.373 281 H SER 37 H SER 37 -6.060 2.583 7.819 282 HA SER 37 HA SER 37 -4.268 4.445 9.169 283 HB2 SER 37 1HB SER 37 -5.733 3.153 10.551 284 HB3 SER 37 2HB SER 37 -5.247 1.638 9.795 285 HG SER 37 HG SER 37 -3.475 1.536 10.849 286 H GLU 38 H GLU 38 -3.825 1.037 8.007 287 HA GLU 38 HA GLU 38 -1.035 1.124 8.483 288 HB2 GLU 38 1HB GLU 38 -2.434 -0.758 6.545 289 HB3 GLU 38 2HB GLU 38 -0.908 -1.021 7.392 290 HG2 GLU 38 1HG GLU 38 -3.741 -1.016 8.476 291 HG3 GLU 38 2HG GLU 38 -2.553 -2.330 8.501 292 H ILE 39 H ILE 39 -2.913 1.899 5.589 293 HA ILE 39 HA ILE 39 -0.741 2.144 3.737 294 HB ILE 39 HB ILE 39 -3.490 3.432 3.941 295 HG12 ILE 39 1HG1 ILE 39 -3.425 0.930 3.592 296 HG13 ILE 39 2HG1 ILE 39 -4.152 1.798 2.258 297 HG21 ILE 39 1HG2 ILE 39 -1.622 3.630 1.601 298 HG22 ILE 39 2HG2 ILE 39 -3.387 3.912 1.536 299 HG23 ILE 39 3HG2 ILE 39 -2.364 4.934 2.548 300 HD11 ILE 39 3HD1 ILE 39 -2.072 1.499 0.947 301 HD12 ILE 39 1HD1 ILE 39 -1.328 0.639 2.291 302 HD13 ILE 39 2HD1 ILE 39 -2.748 -0.040 1.475 303 H ALA 40 H ALA 40 -1.568 4.149 6.494 304 HA ALA 40 HA ALA 40 0.061 6.384 5.372 305 HB1 ALA 40 1HB ALA 40 -1.451 7.879 6.479 306 HB2 ALA 40 2HB ALA 40 -2.459 6.697 5.617 307 HB3 ALA 40 3HB ALA 40 -2.206 6.533 7.369 308 H THR 41 H THR 41 0.085 4.027 7.807 309 HA THR 41 HA THR 41 1.253 5.491 9.923 310 HB THR 41 HB THR 41 0.181 3.209 9.887 311 HG1 THR 41 1HG THR 41 2.526 3.089 11.360 312 HG21 THR 41 3HG2 THR 41 1.569 1.269 9.729 313 HG22 THR 41 1HG2 THR 41 3.002 2.256 9.362 314 HG23 THR 41 2HG2 THR 41 1.665 2.161 8.200 315 H GLY 42 H GLY 42 2.693 3.923 7.051 316 HA2 GLY 42 1HA GLY 42 5.361 4.065 7.899 317 HA3 GLY 42 2HA GLY 42 4.750 3.722 6.267 318 H LYS 43 H LYS 43 7.066 4.882 6.396 319 HA LYS 43 HA LYS 43 6.597 7.711 5.590 320 HB2 LYS 43 1HB LYS 43 8.509 6.617 7.675 321 HB3 LYS 43 2HB LYS 43 8.841 8.114 6.805 322 HG2 LYS 43 1HG LYS 43 6.536 8.942 7.533 323 HG3 LYS 43 2HG LYS 43 6.432 7.516 8.595 324 HD2 LYS 43 1HD LYS 43 8.489 8.230 9.769 325 HD3 LYS 43 2HD LYS 43 8.674 9.568 8.619 326 HE2 LYS 43 1HE LYS 43 7.737 10.524 10.566 327 HE3 LYS 43 2HE LYS 43 6.440 10.458 9.369 328 HZ1 LYS 43 3HZ LYS 43 6.854 8.587 11.619 329 HZ2 LYS 43 1HZ LYS 43 5.656 8.428 10.493 330 HZ3 LYS 43 2HZ LYS 43 5.678 9.711 11.501 331 H ARG 44 H ARG 44 7.372 7.954 3.658 332 HA ARG 44 HA ARG 44 8.888 6.060 2.225 333 HB2 ARG 44 1HB ARG 44 8.950 7.775 0.472 334 HB3 ARG 44 2HB ARG 44 7.386 7.383 1.119 335 HG2 ARG 44 1HG ARG 44 7.684 9.521 2.601 336 HG3 ARG 44 2HG ARG 44 9.009 9.919 1.458 337 HD2 ARG 44 1HD ARG 44 7.580 9.905 -0.373 338 HD3 ARG 44 2HD ARG 44 6.284 9.064 0.503 339 HE ARG 44 HE ARG 44 7.012 11.805 1.328 340 HH11 ARG 44 1HH1 ARG 44 4.713 9.713 -0.403 341 HH12 ARG 44 2HH1 ARG 44 3.717 11.012 -0.954 342 HH21 ARG 44 1HH2 ARG 44 5.447 13.440 1.056 343 HH22 ARG 44 2HH2 ARG 44 4.010 13.164 0.165 344 H THR 45 H THR 45 9.988 8.051 4.525 345 HA THR 45 HA THR 45 11.955 8.876 5.243 346 HB THR 45 HB THR 45 13.903 7.567 4.924 347 HG1 THR 45 1HG THR 45 12.647 6.587 2.605 348 HG21 THR 45 3HG2 THR 45 13.181 5.350 5.452 349 HG22 THR 45 1HG2 THR 45 11.623 5.568 4.654 350 HG23 THR 45 2HG2 THR 45 11.998 6.457 6.150 351 H GLU 46 H GLU 46 14.423 9.618 3.852 352 HA GLU 46 HA GLU 46 13.320 11.491 1.812 353 HB2 GLU 46 1HB GLU 46 15.817 11.587 3.538 354 HB3 GLU 46 2HB GLU 46 15.487 12.656 2.175 355 HG2 GLU 46 1HG GLU 46 13.082 12.758 3.555 356 HG3 GLU 46 2HG GLU 46 14.224 12.560 4.874 357 H LYS 47 H LYS 47 14.302 8.458 1.602 358 HA LYS 47 HA LYS 47 16.379 8.633 -0.404 359 HB2 LYS 47 1HB LYS 47 14.202 6.545 0.017 360 HB3 LYS 47 2HB LYS 47 15.596 6.400 -1.041 361 HG2 LYS 47 1HG LYS 47 16.555 6.993 1.592 362 HG3 LYS 47 2HG LYS 47 15.311 5.758 1.694 363 HD2 LYS 47 1HD LYS 47 17.430 4.630 1.473 364 HD3 LYS 47 2HD LYS 47 16.459 4.374 0.027 365 HE2 LYS 47 1HE LYS 47 18.384 4.940 -1.020 366 HE3 LYS 47 2HE LYS 47 17.769 6.582 -0.794 367 HZ1 LYS 47 3HZ LYS 47 19.781 5.188 0.844 368 HZ2 LYS 47 1HZ LYS 47 19.115 6.614 1.316 369 HZ3 LYS 47 2HZ LYS 47 20.002 6.540 -0.067 370 H GLN 48 H GLN 48 16.100 8.359 -2.627 371 HA GLN 48 HA GLN 48 13.512 9.266 -3.841 372 HB2 GLN 48 1HB GLN 48 16.249 8.876 -5.144 373 HB3 GLN 48 2HB GLN 48 14.783 9.477 -5.916 374 HG2 GLN 48 1HG GLN 48 14.802 11.408 -4.309 375 HG3 GLN 48 2HG GLN 48 16.352 10.835 -3.688 376 HE21 GLN 48 1HE2 GLN 48 18.256 11.406 -4.786 377 HE22 GLN 48 2HE2 GLN 48 18.250 12.133 -6.378 378 H SER 49 H SER 49 12.230 7.630 -4.575 379 HA SER 49 HA SER 49 13.436 5.112 -5.548 380 HB2 SER 49 1HB SER 49 11.429 4.374 -5.035 381 HB3 SER 49 2HB SER 49 10.581 5.973 -5.134 382 HG SER 49 HG SER 49 10.308 4.061 -6.686 383 H ILE 50 H ILE 50 13.484 4.793 -7.726 384 HA ILE 50 HA ILE 50 13.238 7.032 -9.627 385 HB ILE 50 HB ILE 50 15.475 6.644 -10.517 386 HG12 ILE 50 1HG1 ILE 50 16.893 5.317 -8.473 387 HG13 ILE 50 2HG1 ILE 50 15.479 4.326 -8.648 388 HG21 ILE 50 1HG2 ILE 50 15.157 8.404 -8.812 389 HG22 ILE 50 2HG2 ILE 50 15.718 7.276 -7.558 390 HG23 ILE 50 3HG2 ILE 50 16.806 7.764 -8.875 391 HD11 ILE 50 3HD1 ILE 50 17.380 3.606 -10.087 392 HD12 ILE 50 1HD1 ILE 50 15.929 3.984 -11.027 393 HD13 ILE 50 2HD1 ILE 50 17.272 5.143 -10.961 394 H GLN 51 H GLN 51 12.240 4.114 -8.789 395 HA GLN 51 HA GLN 51 12.310 2.888 -11.473 396 HB2 GLN 51 1HB GLN 51 12.128 0.703 -9.928 397 HB3 GLN 51 2HB GLN 51 13.637 1.389 -10.484 398 HG2 GLN 51 1HG GLN 51 13.937 0.806 -8.228 399 HG3 GLN 51 2HG GLN 51 13.938 2.556 -8.301 400 HE21 GLN 51 1HE2 GLN 51 11.241 0.092 -7.761 401 HE22 GLN 51 2HE2 GLN 51 10.584 1.090 -6.512 402 H ASP 52 H ASP 52 10.593 1.413 -11.805 403 HA ASP 52 HA ASP 52 7.999 2.426 -10.684 404 HB2 ASP 52 1HB ASP 52 8.490 0.781 -13.195 405 HB3 ASP 52 2HB ASP 52 6.937 1.380 -12.652 406 H TYR 53 H TYR 53 10.125 -0.097 -10.038 407 HA TYR 53 HA TYR 53 7.914 -1.891 -9.295 408 HB2 TYR 53 1HB TYR 53 10.233 -2.560 -11.137 409 HB3 TYR 53 2HB TYR 53 9.441 -3.814 -10.216 410 HD1 TYR 53 2HD TYR 53 7.070 -4.399 -10.600 411 HD2 TYR 53 1HD TYR 53 9.199 -1.678 -13.174 412 HE1 TYR 53 2HE TYR 53 5.431 -4.834 -12.377 413 HE2 TYR 53 1HE TYR 53 7.544 -2.085 -14.973 414 HH TYR 53 HH TYR 53 5.010 -4.585 -14.634 415 HA PRO 54 HA PRO 54 10.246 -2.316 -5.614 416 HB2 PRO 54 1HB PRO 54 9.404 -4.844 -4.740 417 HB3 PRO 54 2HB PRO 54 8.469 -3.350 -4.563 418 HG2 PRO 54 1HG PRO 54 8.086 -5.515 -6.509 419 HG3 PRO 54 2HG PRO 54 6.887 -4.412 -5.806 420 HD2 PRO 54 1HD PRO 54 7.959 -4.214 -8.376 421 HD3 PRO 54 2HD PRO 54 7.253 -2.845 -7.484 422 H SER 55 H SER 55 11.928 -3.494 -4.530 423 HA SER 55 HA SER 55 13.634 -5.157 -6.251 424 HB2 SER 55 1HB SER 55 14.099 -2.892 -4.831 425 HB3 SER 55 2HB SER 55 14.456 -4.097 -3.583 426 HG SER 55 HG SER 55 15.542 -4.060 -6.219 427 H ALA 56 H ALA 56 11.258 -6.297 -5.271 428 HA ALA 56 HA ALA 56 12.278 -8.473 -3.486 429 HB1 ALA 56 1HB ALA 56 10.033 -8.705 -2.511 430 HB2 ALA 56 2HB ALA 56 10.724 -7.118 -2.138 431 HB3 ALA 56 3HB ALA 56 9.477 -7.273 -3.405 432 H GLU 57 H GLU 57 11.394 -10.496 -3.861 433 HA GLU 57 HA GLU 57 11.052 -10.913 -6.739 434 HB2 GLU 57 1HB GLU 57 11.826 -12.586 -4.356 435 HB3 GLU 57 2HB GLU 57 11.393 -13.336 -5.924 436 HG2 GLU 57 1HG GLU 57 13.111 -11.890 -7.036 437 HG3 GLU 57 2HG GLU 57 13.585 -11.266 -5.456 438 H GLU 58 H GLU 58 9.153 -11.194 -3.733 439 HA GLU 58 HA GLU 58 6.805 -11.961 -5.389 440 HB2 GLU 58 1HB GLU 58 7.766 -13.196 -2.802 441 HB3 GLU 58 2HB GLU 58 6.023 -13.148 -3.199 442 HG2 GLU 58 1HG GLU 58 6.296 -14.384 -5.166 443 HG3 GLU 58 2HG GLU 58 8.047 -14.185 -5.208 444 H TYR 59 H TYR 59 5.396 -10.376 -5.372 445 HA TYR 59 HA TYR 59 4.898 -8.802 -2.959 446 HB2 TYR 59 1HB TYR 59 4.819 -6.728 -4.254 447 HB3 TYR 59 2HB TYR 59 6.431 -7.386 -4.099 448 HD1 TYR 59 1HD TYR 59 3.629 -6.657 -6.397 449 HD2 TYR 59 2HD TYR 59 7.705 -7.991 -6.050 450 HE1 TYR 59 1HE TYR 59 3.965 -6.218 -8.788 451 HE2 TYR 59 2HE TYR 59 7.999 -7.746 -8.507 452 HH TYR 59 HH TYR 59 7.005 -7.112 -10.506 453 H GLY 60 H GLY 60 2.753 -7.908 -3.049 454 HA2 GLY 60 1HA GLY 60 0.888 -8.976 -5.149 455 HA3 GLY 60 2HA GLY 60 0.427 -8.853 -3.445 456 H THR 61 H THR 61 -1.338 -7.505 -4.750 457 HA THR 61 HA THR 61 -0.306 -4.790 -5.388 458 HB THR 61 HB THR 61 -2.196 -6.564 -6.982 459 HG1 THR 61 1HG THR 61 -0.336 -6.587 -8.436 460 HG21 THR 61 3HG2 THR 61 -1.791 -4.820 -8.789 461 HG22 THR 61 1HG2 THR 61 -1.035 -3.798 -7.546 462 HG23 THR 61 2HG2 THR 61 -2.749 -4.236 -7.432 463 H ILE 62 H ILE 62 -1.503 -3.050 -4.893 464 HA ILE 62 HA ILE 62 -4.208 -3.422 -3.695 465 HB ILE 62 HB ILE 62 -2.201 -1.218 -3.118 466 HG12 ILE 62 1HG1 ILE 62 -2.206 -2.500 -0.750 467 HG13 ILE 62 2HG1 ILE 62 -2.423 -3.907 -1.785 468 HG21 ILE 62 1HG2 ILE 62 -3.617 -0.777 -1.156 469 HG22 ILE 62 2HG2 ILE 62 -4.487 -0.569 -2.679 470 HG23 ILE 62 3HG2 ILE 62 -4.755 -2.028 -1.702 471 HD11 ILE 62 3HD1 ILE 62 -0.030 -3.393 -1.249 472 HD12 ILE 62 1HD1 ILE 62 -0.308 -3.323 -2.981 473 HD13 ILE 62 2HD1 ILE 62 -0.183 -1.821 -2.031 474 H ASN 63 H ASN 63 -5.837 -2.195 -4.696 475 HA ASN 63 HA ASN 63 -5.058 0.026 -6.502 476 HB2 ASN 63 1HB ASN 63 -7.429 -1.837 -6.953 477 HB3 ASN 63 2HB ASN 63 -6.895 -0.505 -7.939 478 HD21 ASN 63 1HD2 ASN 63 -7.072 -3.745 -8.144 479 HD22 ASN 63 2HD2 ASN 63 -5.573 -4.123 -8.959 480 H ILE 64 H ILE 64 -6.038 1.924 -5.721 481 HA ILE 64 HA ILE 64 -8.470 1.666 -3.991 482 HB ILE 64 HB ILE 64 -6.763 4.127 -4.516 483 HG12 ILE 64 1HG1 ILE 64 -6.614 2.378 -2.043 484 HG13 ILE 64 2HG1 ILE 64 -5.365 2.468 -3.282 485 HG21 ILE 64 1HG2 ILE 64 -7.981 5.168 -2.749 486 HG22 ILE 64 2HG2 ILE 64 -9.150 4.444 -3.848 487 HG23 ILE 64 3HG2 ILE 64 -8.781 3.641 -2.314 488 HD11 ILE 64 3HD1 ILE 64 -5.113 4.927 -2.805 489 HD12 ILE 64 1HD1 ILE 64 -6.223 4.730 -1.428 490 HD13 ILE 64 2HD1 ILE 64 -4.687 3.876 -1.444 491 H GLU 65 H GLU 65 -10.354 1.968 -5.185 492 HA GLU 65 HA GLU 65 -10.266 3.365 -7.782 493 HB2 GLU 65 1HB GLU 65 -11.649 1.188 -7.233 494 HB3 GLU 65 2HB GLU 65 -12.661 2.259 -6.278 495 HG2 GLU 65 1HG GLU 65 -13.789 2.380 -8.263 496 HG3 GLU 65 2HG GLU 65 -12.668 3.729 -8.542 497 H ASN 66 H ASN 66 -10.911 5.548 -7.829 498 HA ASN 66 HA ASN 66 -12.588 6.656 -5.659 499 HB2 ASN 66 1HB ASN 66 -11.147 8.589 -5.316 500 HB3 ASN 66 2HB ASN 66 -10.471 7.101 -4.731 501 HD21 ASN 66 1HD2 ASN 66 -8.593 6.251 -5.682 502 HD22 ASN 66 2HD2 ASN 66 -7.491 7.243 -6.554 503 H ASN 67 H ASN 67 -12.362 9.217 -6.603 504 HA ASN 67 HA ASN 67 -14.707 9.505 -7.659 505 HB2 ASN 67 1HB ASN 67 -12.319 11.265 -8.409 506 HB3 ASN 67 2HB ASN 67 -13.994 11.714 -8.524 507 HD21 ASN 67 1HD2 ASN 67 -11.294 11.061 -6.360 508 HD22 ASN 67 2HD2 ASN 67 -12.088 11.504 -4.855 509 H GLY 68 H GLY 68 -11.908 8.945 -9.625 510 HA2 GLY 68 1HA GLY 68 -13.197 8.524 -12.082 511 HA3 GLY 68 2HA GLY 68 -12.648 10.219 -12.016 512 H GLY 69 H GLY 69 -10.907 7.795 -10.214 513 HA2 GLY 69 1HA GLY 69 -9.176 6.887 -12.261 514 HA3 GLY 69 2HA GLY 69 -8.358 8.148 -11.307 515 H MET 70 H MET 70 -7.306 5.727 -11.262 516 HA MET 70 HA MET 70 -8.020 4.564 -8.640 517 HB2 MET 70 1HB MET 70 -7.217 2.394 -9.446 518 HB3 MET 70 2HB MET 70 -8.455 3.010 -10.555 519 HG2 MET 70 1HG MET 70 -6.558 3.965 -11.951 520 HG3 MET 70 2HG MET 70 -5.437 3.084 -10.918 521 HE1 MET 70 3HE MET 70 -5.382 2.960 -14.047 522 HE2 MET 70 1HE MET 70 -6.297 1.638 -14.813 523 HE3 MET 70 2HE MET 70 -7.132 3.097 -14.246 524 H THR 71 H THR 71 -6.278 3.797 -7.402 525 HA THR 71 HA THR 71 -3.631 5.096 -7.910 526 HB THR 71 HB THR 71 -4.982 4.730 -5.220 527 HG1 THR 71 1HG THR 71 -5.057 6.957 -6.948 528 HG21 THR 71 3HG2 THR 71 -2.530 5.143 -5.201 529 HG22 THR 71 1HG2 THR 71 -3.483 6.391 -4.381 530 HG23 THR 71 2HG2 THR 71 -2.821 6.708 -5.995 531 H THR 72 H THR 72 -2.273 3.410 -8.408 532 HA THR 72 HA THR 72 -2.750 0.794 -7.130 533 HB THR 72 HB THR 72 -1.157 1.502 -9.610 534 HG1 THR 72 1HG THR 72 -3.490 0.276 -10.122 535 HG21 THR 72 3HG2 THR 72 -1.554 -0.905 -10.160 536 HG22 THR 72 1HG2 THR 72 -2.291 -1.130 -8.554 537 HG23 THR 72 2HG2 THR 72 -0.592 -0.705 -8.696 538 H MET 73 H MET 73 -1.084 -0.329 -6.091 539 HA MET 73 HA MET 73 1.687 0.441 -6.288 540 HB2 MET 73 1HB MET 73 1.853 0.576 -3.698 541 HB3 MET 73 2HB MET 73 1.433 2.022 -4.600 542 HG2 MET 73 1HG MET 73 -0.687 0.254 -3.388 543 HG3 MET 73 2HG MET 73 0.169 1.423 -2.413 544 HE1 MET 73 3HE MET 73 -0.673 3.835 -2.065 545 HE2 MET 73 1HE MET 73 0.483 3.959 -3.406 546 HE3 MET 73 2HE MET 73 -1.068 4.836 -3.467 547 H PHE 74 H PHE 74 3.032 -1.105 -4.993 548 HA PHE 74 HA PHE 74 1.696 -3.701 -4.465 549 HB2 PHE 74 1HB PHE 74 4.591 -3.260 -5.289 550 HB3 PHE 74 2HB PHE 74 3.812 -4.792 -5.104 551 HD1 PHE 74 1HD PHE 74 1.209 -4.186 -6.676 552 HD2 PHE 74 2HD PHE 74 5.337 -3.551 -7.518 553 HE1 PHE 74 1HE PHE 74 0.714 -4.180 -9.082 554 HE2 PHE 74 2HE PHE 74 4.856 -3.397 -9.932 555 HZ PHE 74 HZ PHE 74 2.542 -3.771 -10.743 556 H TYR 75 H TYR 75 3.247 -4.986 -2.783 557 HA TYR 75 HA TYR 75 4.663 -3.234 -0.918 558 HB2 TYR 75 1HB TYR 75 3.500 -3.985 1.042 559 HB3 TYR 75 2HB TYR 75 2.238 -3.476 -0.074 560 HD1 TYR 75 2HD TYR 75 1.129 -5.342 -1.543 561 HD2 TYR 75 1HD TYR 75 3.620 -6.175 1.879 562 HE1 TYR 75 2HE TYR 75 0.363 -7.680 -1.549 563 HE2 TYR 75 1HE TYR 75 2.736 -8.522 1.931 564 HH TYR 75 HH TYR 75 0.079 -9.489 0.311 565 H TYR 76 H TYR 76 5.990 -4.716 0.668 566 HA TYR 76 HA TYR 76 6.181 -7.468 -0.098 567 HB2 TYR 76 1HB TYR 76 8.565 -7.446 -0.787 568 HB3 TYR 76 2HB TYR 76 7.477 -6.722 -1.936 569 HD1 TYR 76 2HD TYR 76 7.379 -4.256 -2.187 570 HD2 TYR 76 1HD TYR 76 10.388 -6.126 0.275 571 HE1 TYR 76 2HE TYR 76 8.630 -2.097 -2.090 572 HE2 TYR 76 1HE TYR 76 11.645 -4.020 0.366 573 HH TYR 76 HH TYR 76 11.651 -1.801 -0.171 574 H GLU 77 H GLU 77 8.062 -8.565 1.064 575 HA GLU 77 HA GLU 77 8.883 -7.215 3.593 576 HB2 GLU 77 1HB GLU 77 7.445 -9.413 3.714 577 HB3 GLU 77 2HB GLU 77 8.893 -10.220 3.119 578 HG2 GLU 77 1HG GLU 77 10.116 -9.291 5.158 579 HG3 GLU 77 2HG GLU 77 8.661 -8.526 5.650 580 H GLU 78 H GLU 78 10.950 -6.955 3.776 581 HA GLU 78 HA GLU 78 13.001 -7.882 1.881 582 HB2 GLU 78 1HB GLU 78 12.912 -5.555 2.897 583 HB3 GLU 78 2HB GLU 78 13.414 -6.295 4.424 584 HG2 GLU 78 1HG GLU 78 14.987 -6.901 1.937 585 HG3 GLU 78 2HG GLU 78 15.032 -5.240 2.458 586 H ASN 79 H ASN 79 14.880 -8.511 3.982 587 HA ASN 79 HA ASN 79 13.937 -11.176 4.724 588 HB2 ASN 79 1HB ASN 79 16.499 -9.656 5.305 589 HB3 ASN 79 2HB ASN 79 16.086 -11.264 5.840 590 HD21 ASN 79 1HD2 ASN 79 16.667 -9.225 3.054 591 HD22 ASN 79 2HD2 ASN 79 17.050 -10.404 1.850 592 H GLY 80 H GLY 80 12.175 -9.426 5.812 593 HA2 GLY 80 1HA GLY 80 11.180 -10.149 7.818 594 HA3 GLY 80 2HA GLY 80 12.657 -9.832 8.731 595 H LYS 81 H LYS 81 12.782 -7.306 6.846 596 HA LYS 81 HA LYS 81 10.821 -5.626 8.444 597 HB2 LYS 81 1HB LYS 81 13.285 -5.011 6.857 598 HB3 LYS 81 2HB LYS 81 11.940 -3.914 6.639 599 HG2 LYS 81 1HG LYS 81 13.329 -3.062 8.379 600 HG3 LYS 81 2HG LYS 81 11.750 -3.533 9.035 601 HD2 LYS 81 1HD LYS 81 12.674 -5.534 10.046 602 HD3 LYS 81 2HD LYS 81 14.212 -5.302 9.182 603 HE2 LYS 81 1HE LYS 81 14.524 -3.129 10.381 604 HE3 LYS 81 2HE LYS 81 13.036 -3.417 11.285 605 HZ1 LYS 81 3HZ LYS 81 15.428 -5.149 11.348 606 HZ2 LYS 81 1HZ LYS 81 14.056 -5.341 12.277 607 HZ3 LYS 81 2HZ LYS 81 15.022 -4.060 12.514 608 H TYR 82 H TYR 82 9.154 -4.263 7.376 609 HA TYR 82 HA TYR 82 8.270 -5.472 4.792 610 HB2 TYR 82 1HB TYR 82 6.714 -4.260 7.070 611 HB3 TYR 82 2HB TYR 82 6.008 -4.845 5.567 612 HD1 TYR 82 1HD TYR 82 6.070 -7.291 5.029 613 HD2 TYR 82 2HD TYR 82 7.321 -5.751 8.855 614 HE1 TYR 82 1HE TYR 82 5.962 -9.562 5.967 615 HE2 TYR 82 2HE TYR 82 7.119 -8.001 9.845 616 HH TYR 82 HH TYR 82 7.356 -10.607 8.058 617 H TYR 83 H TYR 83 7.267 -4.094 3.246 618 HA TYR 83 HA TYR 83 7.758 -1.191 3.481 619 HB2 TYR 83 1HB TYR 83 8.980 -3.127 1.509 620 HB3 TYR 83 2HB TYR 83 9.041 -1.397 1.304 621 HD1 TYR 83 2HD TYR 83 10.355 -4.264 3.146 622 HD2 TYR 83 1HD TYR 83 10.600 0.027 2.652 623 HE1 TYR 83 2HE TYR 83 12.367 -4.248 4.497 624 HE2 TYR 83 1HE TYR 83 12.644 0.051 4.082 625 HH TYR 83 HH TYR 83 14.072 -2.892 5.477 626 H ILE 84 H ILE 84 6.954 -0.014 1.558 627 HA ILE 84 HA ILE 84 4.901 -1.419 -0.064 628 HB ILE 84 HB ILE 84 4.537 1.249 1.320 629 HG12 ILE 84 1HG1 ILE 84 2.414 -0.227 2.121 630 HG13 ILE 84 2HG1 ILE 84 3.550 -1.544 1.921 631 HG21 ILE 84 1HG2 ILE 84 2.657 -0.259 -0.530 632 HG22 ILE 84 2HG2 ILE 84 2.260 1.193 0.413 633 HG23 ILE 84 3HG2 ILE 84 3.458 1.295 -0.866 634 HD11 ILE 84 3HD1 ILE 84 3.996 0.950 3.634 635 HD12 ILE 84 1HD1 ILE 84 3.395 -0.615 4.211 636 HD13 ILE 84 2HD1 ILE 84 5.046 -0.484 3.595 637 H GLU 85 H GLU 85 4.837 -0.885 -2.193 638 HA GLU 85 HA GLU 85 7.050 0.680 -3.344 639 HB2 GLU 85 1HB GLU 85 6.786 -1.572 -4.125 640 HB3 GLU 85 2HB GLU 85 5.047 -1.375 -4.243 641 HG2 GLU 85 1HG GLU 85 6.013 -1.565 -6.417 642 HG3 GLU 85 2HG GLU 85 5.133 -0.082 -6.180 643 H CYS 86 H CYS 86 6.379 1.994 -5.334 644 HA CYS 86 HA CYS 86 4.035 3.480 -5.640 645 HB2 CYS 86 1HB CYS 86 5.537 4.055 -3.179 646 HB3 CYS 86 2HB CYS 86 5.471 5.486 -4.221 647 HG CYS 86 HG CYS 86 3.096 3.453 -3.197 648 HA PRO 87 HA PRO 87 7.092 5.331 -8.526 649 HB2 PRO 87 1HB PRO 87 6.359 7.928 -8.849 650 HB3 PRO 87 2HB PRO 87 5.306 6.611 -9.437 651 HG2 PRO 87 1HG PRO 87 5.093 8.096 -6.803 652 HG3 PRO 87 2HG PRO 87 3.808 7.779 -8.013 653 HD2 PRO 87 1HD PRO 87 4.228 6.204 -5.805 654 HD3 PRO 87 2HD PRO 87 3.603 5.562 -7.326 655 H TYR 88 H TYR 88 8.381 7.772 -8.250 656 HA TYR 88 HA TYR 88 10.511 7.563 -6.976 657 HB2 TYR 88 1HB TYR 88 9.053 10.207 -6.606 658 HB3 TYR 88 2HB TYR 88 10.769 9.943 -6.902 659 HD1 TYR 88 2HD TYR 88 11.610 9.397 -9.176 660 HD2 TYR 88 1HD TYR 88 7.461 10.348 -8.415 661 HE1 TYR 88 2HE TYR 88 11.277 9.895 -11.575 662 HE2 TYR 88 1HE TYR 88 7.129 10.846 -10.798 663 HH TYR 88 HH TYR 88 8.104 10.997 -12.880 664 H LYS 89 H LYS 89 7.772 7.656 -5.008 665 HA LYS 89 HA LYS 89 9.117 8.469 -2.574 666 HB2 LYS 89 1HB LYS 89 6.580 8.853 -2.007 667 HB3 LYS 89 2HB LYS 89 7.759 10.063 -2.552 668 HG2 LYS 89 1HG LYS 89 6.711 9.441 -4.975 669 HG3 LYS 89 2HG LYS 89 5.527 8.724 -3.923 670 HD2 LYS 89 1HD LYS 89 4.884 11.015 -4.632 671 HD3 LYS 89 2HD LYS 89 5.302 11.118 -2.907 672 HE2 LYS 89 1HE LYS 89 7.567 11.892 -3.432 673 HE3 LYS 89 2HE LYS 89 7.339 11.563 -5.152 674 HZ1 LYS 89 3HZ LYS 89 5.671 13.292 -5.209 675 HZ2 LYS 89 1HZ LYS 89 7.104 13.892 -4.650 676 HZ3 LYS 89 2HZ LYS 89 5.891 13.662 -3.604 677 H GLY 90 H GLY 90 8.718 5.886 -4.091 678 HA2 GLY 90 1HA GLY 90 7.196 4.411 -2.161 679 HA3 GLY 90 2HA GLY 90 7.839 3.764 -3.699 680 H ILE 91 H ILE 91 9.221 5.178 -0.702 681 HA ILE 91 HA ILE 91 10.588 2.605 -0.179 682 HB ILE 91 HB ILE 91 12.059 5.215 0.174 683 HG12 ILE 91 1HG1 ILE 91 12.070 3.214 -2.139 684 HG13 ILE 91 2HG1 ILE 91 11.601 4.901 -2.241 685 HG21 ILE 91 1HG2 ILE 91 12.648 3.184 1.592 686 HG22 ILE 91 2HG2 ILE 91 12.877 2.259 0.123 687 HG23 ILE 91 3HG2 ILE 91 13.961 3.630 0.488 688 HD11 ILE 91 3HD1 ILE 91 13.781 4.425 -3.239 689 HD12 ILE 91 1HD1 ILE 91 13.780 5.684 -2.018 690 HD13 ILE 91 2HD1 ILE 91 14.448 4.066 -1.641 691 H TYR 92 H TYR 92 8.218 3.014 0.794 692 HA TYR 92 HA TYR 92 8.265 4.313 3.435 693 HB2 TYR 92 1HB TYR 92 6.135 2.459 2.313 694 HB3 TYR 92 2HB TYR 92 6.010 3.434 3.758 695 HD1 TYR 92 2HD TYR 92 5.585 5.836 3.639 696 HD2 TYR 92 1HD TYR 92 5.937 3.442 0.081 697 HE1 TYR 92 2HE TYR 92 4.770 7.738 2.304 698 HE2 TYR 92 1HE TYR 92 5.055 5.270 -1.255 699 HH TYR 92 HH TYR 92 3.768 7.345 -1.046 700 H GLU 93 H GLU 93 9.731 3.426 4.645 701 HA GLU 93 HA GLU 93 9.923 0.508 5.102 702 HB2 GLU 93 1HB GLU 93 11.921 1.960 5.222 703 HB3 GLU 93 2HB GLU 93 11.119 3.008 6.353 704 HG2 GLU 93 1HG GLU 93 11.002 0.427 7.571 705 HG3 GLU 93 2HG GLU 93 12.556 0.464 6.753 706 H ILE 94 H ILE 94 8.400 -0.440 6.345 707 HA ILE 94 HA ILE 94 7.228 1.083 8.593 708 HB ILE 94 HB ILE 94 5.221 -0.166 8.537 709 HG12 ILE 94 1HG1 ILE 94 6.109 -1.521 5.964 710 HG13 ILE 94 2HG1 ILE 94 6.128 -2.274 7.554 711 HG21 ILE 94 1HG2 ILE 94 4.146 0.892 6.721 712 HG22 ILE 94 2HG2 ILE 94 5.506 1.913 7.200 713 HG23 ILE 94 3HG2 ILE 94 5.643 0.916 5.734 714 HD11 ILE 94 3HD1 ILE 94 3.577 -1.245 6.259 715 HD12 ILE 94 1HD1 ILE 94 4.134 -2.924 6.248 716 HD13 ILE 94 2HD1 ILE 94 3.725 -2.136 7.772 717 H GLU 95 H GLU 95 6.563 -0.496 10.399 718 HA GLU 95 HA GLU 95 8.531 -2.717 10.581 719 HB2 GLU 95 1HB GLU 95 7.882 -0.748 12.789 720 HB3 GLU 95 2HB GLU 95 8.999 -2.119 12.852 721 HG2 GLU 95 1HG GLU 95 10.283 -0.964 10.962 722 HG3 GLU 95 2HG GLU 95 9.291 0.464 11.265 723 H ASN 96 H ASN 96 6.146 -3.281 9.674 724 HA ASN 96 HA ASN 96 5.450 -5.371 11.400 725 HB2 ASN 96 1HB ASN 96 3.724 -3.056 11.693 726 HB3 ASN 96 2HB ASN 96 2.800 -4.311 10.947 727 HD21 ASN 96 1HD2 ASN 96 1.670 -3.863 12.949 728 HD22 ASN 96 2HD2 ASN 96 2.029 -4.836 14.369 729 H ASN 97 H ASN 97 3.690 -6.687 10.498 730 HA ASN 97 HA ASN 97 3.980 -6.976 7.582 731 HB2 ASN 97 1HB ASN 97 3.877 -8.951 9.168 732 HB3 ASN 97 2HB ASN 97 2.221 -8.505 9.563 733 HD21 ASN 97 1HD2 ASN 97 4.249 -10.039 7.265 734 HD22 ASN 97 2HD2 ASN 97 2.982 -10.509 6.125 735 H PHE 98 H PHE 98 2.484 -6.146 6.076 736 HA PHE 98 HA PHE 98 0.351 -4.462 7.044 737 HB2 PHE 98 1HB PHE 98 1.630 -4.024 4.988 738 HB3 PHE 98 2HB PHE 98 0.971 -5.476 4.245 739 HD1 PHE 98 1HD PHE 98 -1.520 -5.621 3.762 740 HD2 PHE 98 2HD PHE 98 0.419 -1.954 4.949 741 HE1 PHE 98 1HE PHE 98 -3.423 -4.368 2.924 742 HE2 PHE 98 2HE PHE 98 -1.519 -0.656 4.090 743 HZ PHE 98 HZ PHE 98 -3.460 -1.854 3.080 744 H GLU 99 H GLU 99 0.359 -7.764 5.556 745 HA GLU 99 HA GLU 99 -2.499 -7.676 5.150 746 HB2 GLU 99 1HB GLU 99 -0.372 -9.757 4.654 747 HB3 GLU 99 2HB GLU 99 -2.095 -10.217 4.624 748 HG2 GLU 99 1HG GLU 99 -2.558 -8.371 3.020 749 HG3 GLU 99 2HG GLU 99 -0.847 -7.965 3.002 750 H ASP 100 H ASP 100 -0.504 -8.861 7.786 751 HA ASP 100 HA ASP 100 -2.688 -10.299 9.074 752 HB2 ASP 100 1HB ASP 100 -0.179 -10.550 9.562 753 HB3 ASP 100 2HB ASP 100 -0.309 -9.062 10.514 754 H MET 101 H MET 101 -1.961 -6.964 8.638 755 HA MET 101 HA MET 101 -3.477 -6.057 11.011 756 HB2 MET 101 1HB MET 101 -1.460 -4.643 9.249 757 HB3 MET 101 2HB MET 101 -2.273 -3.926 10.635 758 HG2 MET 101 1HG MET 101 -0.495 -6.367 10.876 759 HG3 MET 101 2HG MET 101 0.076 -4.715 10.988 760 HE1 MET 101 3HE MET 101 -2.022 -7.106 14.234 761 HE2 MET 101 1HE MET 101 -3.143 -6.626 12.957 762 HE3 MET 101 2HE MET 101 -1.714 -7.611 12.560 763 H ILE 102 H ILE 102 -4.704 -7.005 8.355 764 HA ILE 102 HA ILE 102 -6.436 -4.603 8.055 765 HB ILE 102 HB ILE 102 -7.035 -5.619 5.773 766 HG12 ILE 102 1HG1 ILE 102 -4.296 -6.905 5.978 767 HG13 ILE 102 2HG1 ILE 102 -5.762 -7.817 6.296 768 HG21 ILE 102 1HG2 ILE 102 -5.215 -4.423 4.643 769 HG22 ILE 102 2HG2 ILE 102 -5.717 -3.533 6.094 770 HG23 ILE 102 3HG2 ILE 102 -4.219 -4.482 6.114 771 HD11 ILE 102 3HD1 ILE 102 -5.082 -6.502 3.630 772 HD12 ILE 102 1HD1 ILE 102 -4.927 -8.223 4.023 773 HD13 ILE 102 2HD1 ILE 102 -6.529 -7.478 4.000 Start of MODEL 18 1 H1 GLY 1 H GLY 1 4.403 14.809 6.544 2 HA2 GLY 1 1HA GLY 1 6.578 13.979 4.705 3 HA3 GLY 1 2HA GLY 1 6.341 13.399 6.376 4 H SER 2 H SER 2 5.691 11.249 6.199 5 HA SER 2 HA SER 2 4.221 9.565 5.985 6 HB2 SER 2 1HB SER 2 2.241 11.817 5.587 7 HB3 SER 2 2HB SER 2 1.899 10.248 6.316 8 HG SER 2 HG SER 2 2.848 10.838 8.151 9 HA PRO 3 HA PRO 3 2.994 8.636 1.745 10 HB2 PRO 3 1HB PRO 3 0.729 7.097 1.941 11 HB3 PRO 3 2HB PRO 3 2.369 6.475 2.278 12 HG2 PRO 3 1HG PRO 3 0.283 7.413 4.222 13 HG3 PRO 3 2HG PRO 3 1.400 6.004 4.311 14 HD2 PRO 3 1HD PRO 3 1.834 8.328 5.668 15 HD3 PRO 3 2HD PRO 3 3.112 7.260 5.074 16 H ILE 4 H ILE 4 1.366 9.105 0.170 17 HA ILE 4 HA ILE 4 -0.509 11.256 1.009 18 HB ILE 4 HB ILE 4 1.007 10.990 -1.612 19 HG12 ILE 4 1HG1 ILE 4 1.436 12.878 0.749 20 HG13 ILE 4 2HG1 ILE 4 2.520 11.583 0.258 21 HG21 ILE 4 1HG2 ILE 4 -1.247 12.052 -1.810 22 HG22 ILE 4 2HG2 ILE 4 -0.787 13.218 -0.548 23 HG23 ILE 4 3HG2 ILE 4 0.044 13.199 -2.114 24 HD11 ILE 4 3HD1 ILE 4 3.473 13.602 -0.528 25 HD12 ILE 4 1HD1 ILE 4 2.867 12.732 -1.949 26 HD13 ILE 4 2HD1 ILE 4 1.964 14.117 -1.293 27 H LEU 5 H LEU 5 -2.441 10.314 1.111 28 HA LEU 5 HA LEU 5 -3.401 8.561 -1.039 29 HB2 LEU 5 1HB LEU 5 -4.624 7.290 0.661 30 HB3 LEU 5 2HB LEU 5 -2.914 7.010 0.506 31 HG LEU 5 HG LEU 5 -4.073 6.928 2.714 32 HD11 LEU 5 1HD1 LEU 5 -1.587 6.842 2.379 33 HD12 LEU 5 2HD1 LEU 5 -2.119 7.331 3.983 34 HD13 LEU 5 3HD1 LEU 5 -1.528 8.555 2.820 35 HD21 LEU 5 3HD2 LEU 5 -3.588 9.926 2.821 36 HD22 LEU 5 1HD2 LEU 5 -4.239 8.889 4.107 37 HD23 LEU 5 2HD2 LEU 5 -5.175 9.151 2.643 38 HA PRO 6 HA PRO 6 -6.927 11.299 -1.093 39 HB2 PRO 6 1HB PRO 6 -8.992 9.639 -1.753 40 HB3 PRO 6 2HB PRO 6 -7.705 10.027 -2.893 41 HG2 PRO 6 1HG PRO 6 -7.920 7.586 -1.126 42 HG3 PRO 6 2HG PRO 6 -7.620 7.662 -2.899 43 HD2 PRO 6 1HD PRO 6 -5.582 7.406 -1.205 44 HD3 PRO 6 2HD PRO 6 -5.427 8.496 -2.588 45 H LYS 7 H LYS 7 -9.445 11.425 -0.151 46 HA LYS 7 HA LYS 7 -9.516 10.858 2.647 47 HB2 LYS 7 1HB LYS 7 -11.812 11.136 0.652 48 HB3 LYS 7 2HB LYS 7 -11.872 11.380 2.389 49 HG2 LYS 7 1HG LYS 7 -9.835 13.159 1.292 50 HG3 LYS 7 2HG LYS 7 -11.289 13.279 0.301 51 HD2 LYS 7 1HD LYS 7 -11.288 13.414 3.288 52 HD3 LYS 7 2HD LYS 7 -11.057 14.881 2.300 53 HE2 LYS 7 1HE LYS 7 -13.195 14.658 1.243 54 HE3 LYS 7 2HE LYS 7 -13.409 13.037 1.870 55 HZ1 LYS 7 3HZ LYS 7 -13.540 15.546 3.494 56 HZ2 LYS 7 1HZ LYS 7 -13.727 13.999 4.095 57 HZ3 LYS 7 2HZ LYS 7 -14.770 14.557 3.033 58 H ALA 8 H ALA 8 -11.315 9.248 3.521 59 HA ALA 8 HA ALA 8 -11.196 6.651 2.167 60 HB1 ALA 8 1HB ALA 8 -11.214 6.846 4.629 61 HB2 ALA 8 2HB ALA 8 -12.820 7.608 4.567 62 HB3 ALA 8 3HB ALA 8 -12.614 5.931 4.022 63 H GLU 9 H GLU 9 -13.682 9.149 2.890 64 HA GLU 9 HA GLU 9 -15.888 7.824 1.890 65 HB2 GLU 9 1HB GLU 9 -16.970 10.069 1.943 66 HB3 GLU 9 2HB GLU 9 -16.010 9.736 3.395 67 HG2 GLU 9 1HG GLU 9 -14.158 11.084 2.562 68 HG3 GLU 9 2HG GLU 9 -14.936 11.300 1.001 69 H ASN 10 H ASN 10 -13.458 9.148 -0.063 70 HA ASN 10 HA ASN 10 -15.180 9.469 -2.461 71 HB2 ASN 10 1HB ASN 10 -13.425 10.757 -3.363 72 HB3 ASN 10 2HB ASN 10 -13.565 11.337 -1.691 73 HD21 ASN 10 1HD2 ASN 10 -12.058 8.537 -1.080 74 HD22 ASN 10 2HD2 ASN 10 -10.488 9.209 -0.936 75 H VAL 11 H VAL 11 -13.557 6.953 -1.031 76 HA VAL 11 HA VAL 11 -12.325 5.838 -3.486 77 HB VAL 11 HB VAL 11 -12.364 5.009 -0.559 78 HG11 VAL 11 1HG1 VAL 11 -10.914 3.174 -1.073 79 HG12 VAL 11 2HG1 VAL 11 -12.426 2.977 -1.952 80 HG13 VAL 11 3HG1 VAL 11 -10.974 3.525 -2.811 81 HG21 VAL 11 3HG2 VAL 11 -10.773 6.812 -0.999 82 HG22 VAL 11 1HG2 VAL 11 -9.881 5.325 -0.747 83 HG23 VAL 11 2HG2 VAL 11 -10.108 5.965 -2.390 84 H ASP 12 H ASP 12 -13.458 4.363 -4.579 85 HA ASP 12 HA ASP 12 -16.291 3.790 -3.987 86 HB2 ASP 12 1HB ASP 12 -15.675 4.099 -6.313 87 HB3 ASP 12 2HB ASP 12 -14.350 2.947 -6.179 88 H SER 13 H SER 13 -13.358 1.809 -4.659 89 HA SER 13 HA SER 13 -13.788 0.216 -2.206 90 HB2 SER 13 1HB SER 13 -13.823 -0.895 -5.034 91 HB3 SER 13 2HB SER 13 -13.828 -1.870 -3.551 92 HG SER 13 HG SER 13 -15.814 -0.150 -4.618 93 H ILE 14 H ILE 14 -11.959 -1.503 -2.097 94 HA ILE 14 HA ILE 14 -9.549 -0.811 -3.668 95 HB ILE 14 HB ILE 14 -9.477 -1.294 -0.625 96 HG12 ILE 14 1HG1 ILE 14 -9.061 1.365 -2.040 97 HG13 ILE 14 2HG1 ILE 14 -10.450 0.929 -1.044 98 HG21 ILE 14 1HG2 ILE 14 -7.450 -2.041 -1.876 99 HG22 ILE 14 2HG2 ILE 14 -7.244 -0.398 -2.508 100 HG23 ILE 14 3HG2 ILE 14 -7.081 -0.739 -0.772 101 HD11 ILE 14 3HD1 ILE 14 -8.996 2.334 0.246 102 HD12 ILE 14 1HD1 ILE 14 -8.977 0.699 0.940 103 HD13 ILE 14 2HD1 ILE 14 -7.606 1.288 -0.038 104 H CYS 15 H CYS 15 -8.509 -2.265 -4.367 105 HA CYS 15 HA CYS 15 -9.510 -5.022 -4.082 106 HB2 CYS 15 1HB CYS 15 -7.480 -4.056 -6.090 107 HB3 CYS 15 2HB CYS 15 -8.810 -5.189 -6.205 108 HG CYS 15 HG CYS 15 -10.693 -3.380 -6.172 109 H ILE 16 H ILE 16 -8.062 -6.509 -3.027 110 HA ILE 16 HA ILE 16 -5.182 -5.886 -3.114 111 HB ILE 16 HB ILE 16 -6.581 -6.832 -0.598 112 HG12 ILE 16 1HG1 ILE 16 -5.271 -4.209 -1.415 113 HG13 ILE 16 2HG1 ILE 16 -6.950 -4.438 -0.924 114 HG21 ILE 16 1HG2 ILE 16 -4.370 -7.886 -0.956 115 HG22 ILE 16 2HG2 ILE 16 -3.633 -6.280 -1.123 116 HG23 ILE 16 3HG2 ILE 16 -4.357 -6.794 0.423 117 HD11 ILE 16 3HD1 ILE 16 -6.104 -4.967 1.398 118 HD12 ILE 16 1HD1 ILE 16 -4.486 -4.488 0.811 119 HD13 ILE 16 2HD1 ILE 16 -5.799 -3.309 0.814 120 H ASP 17 H ASP 17 -4.534 -7.378 -4.471 121 HA ASP 17 HA ASP 17 -5.794 -10.065 -4.614 122 HB2 ASP 17 1HB ASP 17 -5.451 -8.442 -6.660 123 HB3 ASP 17 2HB ASP 17 -3.793 -9.019 -6.625 124 H PHE 18 H PHE 18 -4.866 -11.296 -3.130 125 HA PHE 18 HA PHE 18 -2.465 -10.660 -1.749 126 HB2 PHE 18 1HB PHE 18 -4.495 -12.906 -1.759 127 HB3 PHE 18 2HB PHE 18 -3.016 -13.172 -0.911 128 HD1 PHE 18 1HD PHE 18 -5.768 -10.616 -1.159 129 HD2 PHE 18 2HD PHE 18 -2.757 -12.441 1.331 130 HE1 PHE 18 1HE PHE 18 -6.583 -9.329 0.776 131 HE2 PHE 18 2HE PHE 18 -3.649 -11.230 3.287 132 HZ PHE 18 HZ PHE 18 -5.591 -9.702 3.041 133 H THR 19 H THR 19 -0.772 -12.511 -1.308 134 HA THR 19 HA THR 19 0.812 -12.976 -3.565 135 HB THR 19 HB THR 19 1.705 -14.846 -1.925 136 HG1 THR 19 1HG THR 19 0.876 -14.674 0.154 137 HG21 THR 19 3HG2 THR 19 1.639 -11.950 -0.956 138 HG22 THR 19 1HG2 THR 19 2.749 -12.599 -2.193 139 HG23 THR 19 2HG2 THR 19 2.828 -13.206 -0.532 140 H ASN 20 H ASN 20 -1.692 -14.906 -1.981 141 HA ASN 20 HA ASN 20 -1.507 -17.055 -3.963 142 HB2 ASN 20 1HB ASN 20 -2.634 -18.418 -2.481 143 HB3 ASN 20 2HB ASN 20 -1.574 -17.479 -1.465 144 HD21 ASN 20 1HD2 ASN 20 -3.880 -18.896 -0.592 145 HD22 ASN 20 2HD2 ASN 20 -4.890 -17.702 0.203 146 H SER 21 H SER 21 -4.147 -17.958 -4.189 147 HA SER 21 HA SER 21 -4.556 -16.373 -6.529 148 HB2 SER 21 1HB SER 21 -6.109 -18.119 -7.182 149 HB3 SER 21 2HB SER 21 -4.613 -18.810 -6.555 150 HG SER 21 HG SER 21 -6.904 -19.563 -5.887 151 H ILE 22 H ILE 22 -5.450 -15.011 -3.943 152 HA ILE 22 HA ILE 22 -8.401 -14.925 -4.345 153 HB ILE 22 HB ILE 22 -6.881 -14.694 -1.735 154 HG12 ILE 22 1HG1 ILE 22 -8.154 -17.192 -2.988 155 HG13 ILE 22 2HG1 ILE 22 -6.455 -16.968 -2.572 156 HG21 ILE 22 1HG2 ILE 22 -9.077 -15.081 -0.699 157 HG22 ILE 22 2HG2 ILE 22 -9.170 -13.715 -1.797 158 HG23 ILE 22 3HG2 ILE 22 -9.814 -15.298 -2.304 159 HD11 ILE 22 3HD1 ILE 22 -7.119 -16.815 -0.150 160 HD12 ILE 22 1HD1 ILE 22 -8.747 -17.352 -0.638 161 HD13 ILE 22 2HD1 ILE 22 -7.350 -18.398 -0.925 162 H GLN 23 H GLN 23 -9.314 -12.993 -4.176 163 HA GLN 23 HA GLN 23 -7.625 -10.613 -3.684 164 HB2 GLN 23 1HB GLN 23 -7.920 -10.776 -6.098 165 HB3 GLN 23 2HB GLN 23 -9.680 -10.757 -5.911 166 HG2 GLN 23 1HG GLN 23 -9.433 -8.515 -4.715 167 HG3 GLN 23 2HG GLN 23 -7.710 -8.567 -5.065 168 HE21 GLN 23 1HE2 GLN 23 -7.240 -8.947 -7.599 169 HE22 GLN 23 2HE2 GLN 23 -8.093 -7.775 -8.552 170 H LYS 24 H LYS 24 -8.320 -9.829 -1.930 171 HA LYS 24 HA LYS 24 -11.174 -10.004 -1.110 172 HB2 LYS 24 1HB LYS 24 -8.689 -9.720 0.333 173 HB3 LYS 24 2HB LYS 24 -9.580 -8.231 0.539 174 HG2 LYS 24 1HG LYS 24 -10.579 -11.030 1.160 175 HG3 LYS 24 2HG LYS 24 -9.993 -9.855 2.331 176 HD2 LYS 24 1HD LYS 24 -12.500 -9.512 0.642 177 HD3 LYS 24 2HD LYS 24 -12.431 -10.052 2.320 178 HE2 LYS 24 1HE LYS 24 -11.435 -7.850 2.993 179 HE3 LYS 24 2HE LYS 24 -11.525 -7.310 1.321 180 HZ1 LYS 24 3HZ LYS 24 -13.373 -6.724 2.912 181 HZ2 LYS 24 1HZ LYS 24 -13.916 -8.257 2.746 182 HZ3 LYS 24 2HZ LYS 24 -13.803 -7.247 1.430 183 H ILE 25 H ILE 25 -12.495 -8.214 -1.370 184 HA ILE 25 HA ILE 25 -11.282 -5.684 -2.347 185 HB ILE 25 HB ILE 25 -13.954 -6.911 -3.076 186 HG12 ILE 25 1HG1 ILE 25 -12.089 -5.801 -5.162 187 HG13 ILE 25 2HG1 ILE 25 -11.553 -7.290 -4.420 188 HG21 ILE 25 1HG2 ILE 25 -12.891 -4.102 -3.628 189 HG22 ILE 25 2HG2 ILE 25 -14.309 -4.806 -4.425 190 HG23 ILE 25 3HG2 ILE 25 -14.338 -4.536 -2.691 191 HD11 ILE 25 3HD1 ILE 25 -13.560 -8.461 -5.070 192 HD12 ILE 25 1HD1 ILE 25 -14.389 -6.953 -5.505 193 HD13 ILE 25 2HD1 ILE 25 -13.045 -7.513 -6.494 194 H TYR 26 H TYR 26 -11.837 -3.970 -1.141 195 HA TYR 26 HA TYR 26 -13.430 -4.389 1.342 196 HB2 TYR 26 1HB TYR 26 -11.108 -2.498 0.770 197 HB3 TYR 26 2HB TYR 26 -11.983 -2.617 2.283 198 HD1 TYR 26 2HD TYR 26 -9.723 -4.410 -0.071 199 HD2 TYR 26 1HD TYR 26 -11.340 -4.356 3.953 200 HE1 TYR 26 2HE TYR 26 -8.261 -6.276 0.542 201 HE2 TYR 26 1HE TYR 26 -9.866 -6.249 4.518 202 HH TYR 26 HH TYR 26 -8.446 -7.894 3.757 203 H ASP 27 H ASP 27 -15.325 -3.948 -0.207 204 HA ASP 27 HA ASP 27 -15.463 -1.329 -1.500 205 HB2 ASP 27 1HB ASP 27 -17.594 -2.090 -2.373 206 HB3 ASP 27 2HB ASP 27 -16.339 -3.275 -2.679 207 H ASP 28 H ASP 28 -15.376 -1.696 1.547 208 HA ASP 28 HA ASP 28 -18.021 -0.531 2.258 209 HB2 ASP 28 1HB ASP 28 -16.651 -1.791 4.479 210 HB3 ASP 28 2HB ASP 28 -18.275 -1.966 3.893 211 H SER 29 H SER 29 -18.067 1.219 3.548 212 HA SER 29 HA SER 29 -15.983 3.005 3.529 213 HB2 SER 29 1HB SER 29 -18.506 3.285 3.928 214 HB3 SER 29 2HB SER 29 -18.175 3.000 5.642 215 HG SER 29 HG SER 29 -18.180 5.235 4.507 216 H GLU 30 H GLU 30 -16.830 0.804 6.242 217 HA GLU 30 HA GLU 30 -14.869 1.953 8.027 218 HB2 GLU 30 1HB GLU 30 -17.030 0.819 8.636 219 HB3 GLU 30 2HB GLU 30 -16.293 -0.736 8.226 220 HG2 GLU 30 1HG GLU 30 -14.602 -0.434 9.973 221 HG3 GLU 30 2HG GLU 30 -15.162 1.213 10.279 222 H SER 31 H SER 31 -14.855 -0.751 5.773 223 HA SER 31 HA SER 31 -12.412 -2.128 6.405 224 HB2 SER 31 1HB SER 31 -13.928 -1.796 3.828 225 HB3 SER 31 2HB SER 31 -12.799 -3.064 4.280 226 HG SER 31 HG SER 31 -15.151 -3.367 4.514 227 H ILE 32 H ILE 32 -13.255 0.535 4.136 228 HA ILE 32 HA ILE 32 -10.560 0.997 3.196 229 HB ILE 32 HB ILE 32 -13.083 2.714 3.251 230 HG12 ILE 32 1HG1 ILE 32 -11.777 1.391 0.835 231 HG13 ILE 32 2HG1 ILE 32 -12.954 0.525 1.809 232 HG21 ILE 32 1HG2 ILE 32 -10.369 3.182 1.949 233 HG22 ILE 32 2HG2 ILE 32 -11.838 4.119 1.547 234 HG23 ILE 32 3HG2 ILE 32 -11.159 4.177 3.177 235 HD11 ILE 32 3HD1 ILE 32 -14.658 2.255 1.390 236 HD12 ILE 32 1HD1 ILE 32 -13.514 3.141 0.361 237 HD13 ILE 32 2HD1 ILE 32 -14.055 1.521 -0.107 238 H GLN 33 H GLN 33 -12.589 2.627 5.748 239 HA GLN 33 HA GLN 33 -10.477 4.345 6.577 240 HB2 GLN 33 1HB GLN 33 -12.999 3.380 7.979 241 HB3 GLN 33 2HB GLN 33 -11.799 4.378 8.790 242 HG2 GLN 33 1HG GLN 33 -12.021 5.792 6.497 243 HG3 GLN 33 2HG GLN 33 -13.647 5.110 6.553 244 HE21 GLN 33 1HE2 GLN 33 -14.710 7.110 7.015 245 HE22 GLN 33 2HE2 GLN 33 -14.400 8.019 8.495 246 H LYS 34 H LYS 34 -10.901 0.922 7.302 247 HA LYS 34 HA LYS 34 -8.942 0.887 9.432 248 HB2 LYS 34 1HB LYS 34 -10.536 -1.044 8.858 249 HB3 LYS 34 2HB LYS 34 -9.554 -1.311 7.429 250 HG2 LYS 34 1HG LYS 34 -7.593 -1.150 9.332 251 HG3 LYS 34 2HG LYS 34 -8.875 -1.821 10.302 252 HD2 LYS 34 1HD LYS 34 -8.000 -2.949 7.634 253 HD3 LYS 34 2HD LYS 34 -7.332 -3.438 9.208 254 HE2 LYS 34 1HE LYS 34 -9.909 -3.699 9.881 255 HE3 LYS 34 2HE LYS 34 -10.112 -4.013 8.164 256 HZ1 LYS 34 3HZ LYS 34 -9.673 -6.011 9.573 257 HZ2 LYS 34 1HZ LYS 34 -8.199 -5.422 9.939 258 HZ3 LYS 34 2HZ LYS 34 -8.565 -5.851 8.392 259 H ILE 35 H ILE 35 -8.626 -0.124 5.967 260 HA ILE 35 HA ILE 35 -5.960 -0.481 5.962 261 HB ILE 35 HB ILE 35 -7.823 0.564 3.744 262 HG12 ILE 35 1HG1 ILE 35 -6.647 -2.205 4.133 263 HG13 ILE 35 2HG1 ILE 35 -8.189 -1.730 4.793 264 HG21 ILE 35 1HG2 ILE 35 -4.966 -0.393 3.448 265 HG22 ILE 35 2HG2 ILE 35 -6.086 -0.244 2.084 266 HG23 ILE 35 3HG2 ILE 35 -5.617 1.181 2.978 267 HD11 ILE 35 3HD1 ILE 35 -8.518 -2.947 2.723 268 HD12 ILE 35 1HD1 ILE 35 -9.109 -1.286 2.549 269 HD13 ILE 35 2HD1 ILE 35 -7.580 -1.791 1.810 270 H LEU 36 H LEU 36 -7.607 2.714 5.202 271 HA LEU 36 HA LEU 36 -5.277 4.218 4.655 272 HB2 LEU 36 1HB LEU 36 -8.013 4.843 5.745 273 HB3 LEU 36 2HB LEU 36 -6.786 6.086 5.815 274 HG LEU 36 HG LEU 36 -6.594 4.911 3.178 275 HD11 LEU 36 1HD1 LEU 36 -8.818 5.481 2.271 276 HD12 LEU 36 2HD1 LEU 36 -9.429 5.595 3.946 277 HD13 LEU 36 3HD1 LEU 36 -8.772 4.063 3.318 278 HD21 LEU 36 3HD2 LEU 36 -6.078 7.244 3.955 279 HD22 LEU 36 1HD2 LEU 36 -7.836 7.574 3.934 280 HD23 LEU 36 2HD2 LEU 36 -6.990 7.140 2.431 281 H SER 37 H SER 37 -5.876 2.764 7.707 282 HA SER 37 HA SER 37 -4.095 4.549 9.206 283 HB2 SER 37 1HB SER 37 -6.237 3.291 10.065 284 HB3 SER 37 2HB SER 37 -5.173 1.880 10.170 285 HG SER 37 HG SER 37 -5.455 3.637 11.946 286 H GLU 38 H GLU 38 -4.127 0.925 8.517 287 HA GLU 38 HA GLU 38 -1.406 0.560 8.958 288 HB2 GLU 38 1HB GLU 38 -1.702 -1.466 7.387 289 HB3 GLU 38 2HB GLU 38 -2.674 -1.400 8.852 290 HG2 GLU 38 1HG GLU 38 -3.860 -0.499 6.309 291 HG3 GLU 38 2HG GLU 38 -3.576 -2.203 6.583 292 H ILE 39 H ILE 39 -2.794 2.128 6.255 293 HA ILE 39 HA ILE 39 -0.353 1.986 4.634 294 HB ILE 39 HB ILE 39 -2.970 3.494 4.462 295 HG12 ILE 39 1HG1 ILE 39 -3.070 1.091 3.932 296 HG13 ILE 39 2HG1 ILE 39 -3.390 2.071 2.528 297 HG21 ILE 39 1HG2 ILE 39 -2.372 4.313 2.298 298 HG22 ILE 39 2HG2 ILE 39 -1.249 4.932 3.508 299 HG23 ILE 39 3HG2 ILE 39 -0.717 3.611 2.453 300 HD11 ILE 39 3HD1 ILE 39 -0.760 0.618 3.115 301 HD12 ILE 39 1HD1 ILE 39 -2.044 0.094 2.033 302 HD13 ILE 39 2HD1 ILE 39 -1.107 1.553 1.658 303 H ALA 40 H ALA 40 -1.859 4.437 6.822 304 HA ALA 40 HA ALA 40 -0.079 6.565 6.158 305 HB1 ALA 40 1HB ALA 40 -0.941 7.605 8.210 306 HB2 ALA 40 2HB ALA 40 -2.252 6.890 7.257 307 HB3 ALA 40 3HB ALA 40 -1.654 6.059 8.713 308 H THR 41 H THR 41 0.396 3.827 8.045 309 HA THR 41 HA THR 41 2.312 4.841 9.905 310 HB THR 41 HB THR 41 0.894 2.807 10.185 311 HG1 THR 41 1HG THR 41 2.174 2.321 11.687 312 HG21 THR 41 3HG2 THR 41 3.064 1.317 8.708 313 HG22 THR 41 1HG2 THR 41 1.577 1.847 7.905 314 HG23 THR 41 2HG2 THR 41 1.500 0.713 9.274 315 H GLY 42 H GLY 42 2.741 4.036 6.549 316 HA2 GLY 42 1HA GLY 42 5.531 3.417 6.567 317 HA3 GLY 42 2HA GLY 42 4.626 4.128 5.236 318 H LYS 43 H LYS 43 7.310 4.583 6.647 319 HA LYS 43 HA LYS 43 7.092 7.554 6.320 320 HB2 LYS 43 1HB LYS 43 9.471 7.499 7.202 321 HB3 LYS 43 2HB LYS 43 8.111 7.324 8.292 322 HG2 LYS 43 1HG LYS 43 8.560 4.875 8.464 323 HG3 LYS 43 2HG LYS 43 9.899 5.041 7.336 324 HD2 LYS 43 1HD LYS 43 10.931 4.957 9.416 325 HD3 LYS 43 2HD LYS 43 10.931 6.676 9.011 326 HE2 LYS 43 1HE LYS 43 10.278 6.587 11.287 327 HE3 LYS 43 2HE LYS 43 8.750 6.820 10.419 328 HZ1 LYS 43 3HZ LYS 43 8.571 5.135 12.088 329 HZ2 LYS 43 1HZ LYS 43 9.785 4.245 11.467 330 HZ3 LYS 43 2HZ LYS 43 8.352 4.442 10.638 331 H ARG 44 H ARG 44 7.260 7.826 4.030 332 HA ARG 44 HA ARG 44 8.937 6.219 2.401 333 HB2 ARG 44 1HB ARG 44 8.798 8.019 0.777 334 HB3 ARG 44 2HB ARG 44 7.246 7.570 1.447 335 HG2 ARG 44 1HG ARG 44 7.594 9.560 3.118 336 HG3 ARG 44 2HG ARG 44 8.912 10.023 1.997 337 HD2 ARG 44 1HD ARG 44 7.488 10.318 0.218 338 HD3 ARG 44 2HD ARG 44 6.174 9.401 1.013 339 HE ARG 44 HE ARG 44 5.444 11.219 2.060 340 HH11 ARG 44 1HH1 ARG 44 8.753 12.112 0.889 341 HH12 ARG 44 2HH1 ARG 44 8.506 13.777 1.254 342 HH21 ARG 44 1HH2 ARG 44 5.161 13.410 2.390 343 HH22 ARG 44 2HH2 ARG 44 6.403 14.550 1.928 344 H THR 45 H THR 45 9.871 8.077 4.942 345 HA THR 45 HA THR 45 11.727 9.105 5.667 346 HB THR 45 HB THR 45 13.757 7.951 5.248 347 HG1 THR 45 1HG THR 45 12.578 7.177 2.824 348 HG21 THR 45 3HG2 THR 45 11.780 6.630 6.276 349 HG22 THR 45 1HG2 THR 45 13.180 5.724 5.731 350 HG23 THR 45 2HG2 THR 45 11.730 5.761 4.723 351 H GLU 46 H GLU 46 14.041 10.239 4.682 352 HA GLU 46 HA GLU 46 13.015 12.421 3.058 353 HB2 GLU 46 1HB GLU 46 15.756 11.674 4.153 354 HB3 GLU 46 2HB GLU 46 15.532 13.088 3.131 355 HG2 GLU 46 1HG GLU 46 14.031 12.670 5.743 356 HG3 GLU 46 2HG GLU 46 15.556 13.537 5.590 357 H LYS 47 H LYS 47 14.143 9.340 2.235 358 HA LYS 47 HA LYS 47 15.956 10.024 0.128 359 HB2 LYS 47 1HB LYS 47 14.458 7.421 0.703 360 HB3 LYS 47 2HB LYS 47 15.878 7.564 -0.331 361 HG2 LYS 47 1HG LYS 47 15.866 8.224 2.629 362 HG3 LYS 47 2HG LYS 47 16.304 6.653 1.985 363 HD2 LYS 47 1HD LYS 47 17.769 9.107 0.973 364 HD3 LYS 47 2HD LYS 47 18.125 8.477 2.585 365 HE2 LYS 47 1HE LYS 47 18.740 6.341 1.775 366 HE3 LYS 47 2HE LYS 47 18.119 6.656 0.152 367 HZ1 LYS 47 3HZ LYS 47 20.610 6.864 0.480 368 HZ2 LYS 47 1HZ LYS 47 20.339 8.203 1.358 369 HZ3 LYS 47 2HZ LYS 47 19.893 8.157 -0.238 370 H GLN 48 H GLN 48 15.665 8.951 -2.033 371 HA GLN 48 HA GLN 48 13.029 9.646 -3.239 372 HB2 GLN 48 1HB GLN 48 14.154 10.143 -5.307 373 HB3 GLN 48 2HB GLN 48 14.681 11.222 -4.012 374 HG2 GLN 48 1HG GLN 48 16.829 10.081 -3.842 375 HG3 GLN 48 2HG GLN 48 16.292 8.828 -4.970 376 HE21 GLN 48 1HE2 GLN 48 17.542 12.123 -4.768 377 HE22 GLN 48 2HE2 GLN 48 17.850 12.169 -6.490 378 H SER 49 H SER 49 12.022 8.041 -4.177 379 HA SER 49 HA SER 49 13.269 5.431 -4.810 380 HB2 SER 49 1HB SER 49 11.126 5.098 -3.945 381 HB3 SER 49 2HB SER 49 10.460 6.569 -4.640 382 HG SER 49 HG SER 49 9.739 4.627 -5.716 383 H ILE 50 H ILE 50 13.087 4.818 -7.131 384 HA ILE 50 HA ILE 50 12.851 6.933 -9.140 385 HB ILE 50 HB ILE 50 15.043 6.230 -10.157 386 HG12 ILE 50 1HG1 ILE 50 15.706 5.062 -7.420 387 HG13 ILE 50 2HG1 ILE 50 15.186 4.057 -8.769 388 HG21 ILE 50 1HG2 ILE 50 16.419 7.722 -8.897 389 HG22 ILE 50 2HG2 ILE 50 14.769 8.341 -8.825 390 HG23 ILE 50 3HG2 ILE 50 15.454 7.495 -7.426 391 HD11 ILE 50 3HD1 ILE 50 17.111 4.782 -10.104 392 HD12 ILE 50 1HD1 ILE 50 17.666 5.801 -8.753 393 HD13 ILE 50 2HD1 ILE 50 17.599 4.042 -8.567 394 H GLN 51 H GLN 51 11.166 4.519 -8.386 395 HA GLN 51 HA GLN 51 11.473 3.004 -10.904 396 HB2 GLN 51 1HB GLN 51 11.016 0.939 -9.412 397 HB3 GLN 51 2HB GLN 51 12.632 1.609 -9.436 398 HG2 GLN 51 1HG GLN 51 12.212 2.784 -7.279 399 HG3 GLN 51 2HG GLN 51 10.550 2.177 -7.278 400 HE21 GLN 51 1HE2 GLN 51 10.230 0.248 -6.274 401 HE22 GLN 51 2HE2 GLN 51 11.429 -0.933 -5.916 402 H ASP 52 H ASP 52 9.657 1.521 -11.193 403 HA ASP 52 HA ASP 52 7.035 2.794 -10.575 404 HB2 ASP 52 1HB ASP 52 7.810 0.836 -12.744 405 HB3 ASP 52 2HB ASP 52 6.232 1.582 -12.550 406 H TYR 53 H TYR 53 8.970 -0.056 -9.825 407 HA TYR 53 HA TYR 53 6.632 -1.612 -8.989 408 HB2 TYR 53 1HB TYR 53 8.369 -2.187 -11.398 409 HB3 TYR 53 2HB TYR 53 8.001 -3.529 -10.356 410 HD1 TYR 53 2HD TYR 53 6.196 -0.800 -12.211 411 HD2 TYR 53 1HD TYR 53 6.120 -4.845 -10.732 412 HE1 TYR 53 2HE TYR 53 4.043 -1.118 -13.294 413 HE2 TYR 53 1HE TYR 53 3.980 -5.226 -11.869 414 HH TYR 53 HH TYR 53 2.100 -2.657 -13.312 415 HA PRO 54 HA PRO 54 9.477 -3.045 -5.945 416 HB2 PRO 54 1HB PRO 54 8.552 -5.557 -5.330 417 HB3 PRO 54 2HB PRO 54 7.594 -4.087 -5.005 418 HG2 PRO 54 1HG PRO 54 7.338 -5.903 -7.392 419 HG3 PRO 54 2HG PRO 54 6.063 -5.323 -6.263 420 HD2 PRO 54 1HD PRO 54 6.551 -4.058 -8.617 421 HD3 PRO 54 2HD PRO 54 6.152 -3.136 -7.146 422 H SER 55 H SER 55 10.984 -4.947 -5.391 423 HA SER 55 HA SER 55 12.129 -6.206 -7.810 424 HB2 SER 55 1HB SER 55 13.235 -4.410 -6.059 425 HB3 SER 55 2HB SER 55 13.888 -5.953 -5.488 426 HG SER 55 HG SER 55 14.823 -4.535 -7.348 427 H ALA 56 H ALA 56 10.307 -6.871 -5.069 428 HA ALA 56 HA ALA 56 11.337 -9.505 -4.346 429 HB1 ALA 56 1HB ALA 56 8.610 -8.182 -3.960 430 HB2 ALA 56 2HB ALA 56 9.129 -9.709 -3.223 431 HB3 ALA 56 3HB ALA 56 9.943 -8.200 -2.780 432 H GLU 57 H GLU 57 10.294 -11.507 -4.943 433 HA GLU 57 HA GLU 57 8.950 -11.513 -7.579 434 HB2 GLU 57 1HB GLU 57 10.695 -13.286 -6.085 435 HB3 GLU 57 2HB GLU 57 9.175 -14.136 -6.347 436 HG2 GLU 57 1HG GLU 57 10.805 -12.742 -8.490 437 HG3 GLU 57 2HG GLU 57 10.876 -14.466 -8.138 438 H GLU 58 H GLU 58 8.192 -11.612 -4.176 439 HA GLU 58 HA GLU 58 5.477 -12.695 -4.711 440 HB2 GLU 58 1HB GLU 58 7.481 -13.416 -2.550 441 HB3 GLU 58 2HB GLU 58 5.726 -13.675 -2.379 442 HG2 GLU 58 1HG GLU 58 5.620 -15.238 -4.111 443 HG3 GLU 58 2HG GLU 58 7.113 -14.691 -4.868 444 H TYR 59 H TYR 59 4.290 -11.001 -4.603 445 HA TYR 59 HA TYR 59 4.104 -9.280 -2.263 446 HB2 TYR 59 1HB TYR 59 4.000 -7.228 -3.726 447 HB3 TYR 59 2HB TYR 59 5.585 -7.927 -3.507 448 HD1 TYR 59 2HD TYR 59 6.745 -9.152 -5.307 449 HD2 TYR 59 1HD TYR 59 3.056 -7.031 -5.978 450 HE1 TYR 59 2HE TYR 59 7.120 -9.281 -7.734 451 HE2 TYR 59 1HE TYR 59 3.509 -7.020 -8.426 452 HH TYR 59 HH TYR 59 6.091 -9.065 -9.749 453 H GLY 60 H GLY 60 1.999 -7.818 -2.821 454 HA2 GLY 60 1HA GLY 60 0.143 -9.362 -4.607 455 HA3 GLY 60 2HA GLY 60 -0.392 -8.710 -3.070 456 H THR 61 H THR 61 -1.676 -7.964 -5.387 457 HA THR 61 HA THR 61 -0.587 -5.346 -6.280 458 HB THR 61 HB THR 61 -3.177 -6.530 -7.258 459 HG1 THR 61 1HG THR 61 -0.646 -7.524 -8.099 460 HG21 THR 61 3HG2 THR 61 -2.470 -5.468 -9.386 461 HG22 THR 61 1HG2 THR 61 -0.958 -4.963 -8.622 462 HG23 THR 61 2HG2 THR 61 -2.507 -4.316 -8.050 463 H ILE 62 H ILE 62 -1.536 -3.407 -5.515 464 HA ILE 62 HA ILE 62 -4.165 -3.634 -4.130 465 HB ILE 62 HB ILE 62 -1.967 -1.702 -3.449 466 HG12 ILE 62 1HG1 ILE 62 -2.137 -3.182 -1.203 467 HG13 ILE 62 2HG1 ILE 62 -2.502 -4.450 -2.352 468 HG21 ILE 62 1HG2 ILE 62 -3.429 -1.341 -1.407 469 HG22 ILE 62 2HG2 ILE 62 -4.095 -0.767 -2.936 470 HG23 ILE 62 3HG2 ILE 62 -4.679 -2.282 -2.230 471 HD11 ILE 62 3HD1 ILE 62 -0.036 -4.178 -1.792 472 HD12 ILE 62 1HD1 ILE 62 -0.372 -4.061 -3.515 473 HD13 ILE 62 2HD1 ILE 62 -0.075 -2.583 -2.600 474 H ASN 63 H ASN 63 -5.716 -2.323 -5.070 475 HA ASN 63 HA ASN 63 -4.831 -0.016 -6.709 476 HB2 ASN 63 1HB ASN 63 -7.181 -1.780 -7.431 477 HB3 ASN 63 2HB ASN 63 -6.418 -0.516 -8.353 478 HD21 ASN 63 1HD2 ASN 63 -6.715 -3.826 -8.061 479 HD22 ASN 63 2HD2 ASN 63 -5.290 -4.348 -8.881 480 H ILE 64 H ILE 64 -5.656 1.747 -5.610 481 HA ILE 64 HA ILE 64 -8.148 1.488 -4.006 482 HB ILE 64 HB ILE 64 -6.419 3.942 -4.511 483 HG12 ILE 64 1HG1 ILE 64 -6.342 2.135 -2.065 484 HG13 ILE 64 2HG1 ILE 64 -5.112 2.192 -3.329 485 HG21 ILE 64 1HG2 ILE 64 -8.829 4.338 -3.789 486 HG22 ILE 64 2HG2 ILE 64 -8.438 3.505 -2.277 487 HG23 ILE 64 3HG2 ILE 64 -7.610 5.008 -2.711 488 HD11 ILE 64 3HD1 ILE 64 -4.278 3.566 -1.621 489 HD12 ILE 64 1HD1 ILE 64 -4.861 4.697 -2.838 490 HD13 ILE 64 2HD1 ILE 64 -5.823 4.398 -1.376 491 H GLU 65 H GLU 65 -9.991 1.481 -5.305 492 HA GLU 65 HA GLU 65 -10.082 2.985 -7.829 493 HB2 GLU 65 1HB GLU 65 -11.223 0.683 -7.293 494 HB3 GLU 65 2HB GLU 65 -12.346 1.607 -6.314 495 HG2 GLU 65 1HG GLU 65 -13.500 1.636 -8.258 496 HG3 GLU 65 2HG GLU 65 -12.542 3.099 -8.556 497 H ASN 66 H ASN 66 -10.659 5.166 -7.795 498 HA ASN 66 HA ASN 66 -12.437 6.166 -5.638 499 HB2 ASN 66 1HB ASN 66 -10.909 7.970 -5.039 500 HB3 ASN 66 2HB ASN 66 -10.244 6.400 -4.686 501 HD21 ASN 66 1HD2 ASN 66 -8.273 5.735 -5.749 502 HD22 ASN 66 2HD2 ASN 66 -7.296 6.989 -6.486 503 H ASN 67 H ASN 67 -11.888 8.849 -6.359 504 HA ASN 67 HA ASN 67 -14.169 9.602 -7.336 505 HB2 ASN 67 1HB ASN 67 -11.465 10.937 -7.854 506 HB3 ASN 67 2HB ASN 67 -12.986 11.726 -8.075 507 HD21 ASN 67 1HD2 ASN 67 -10.536 10.780 -5.695 508 HD22 ASN 67 2HD2 ASN 67 -11.417 11.265 -4.293 509 H GLY 68 H GLY 68 -11.808 8.349 -9.388 510 HA2 GLY 68 1HA GLY 68 -12.709 8.354 -11.862 511 HA3 GLY 68 2HA GLY 68 -12.277 10.089 -11.698 512 H GLY 69 H GLY 69 -10.640 7.430 -10.020 513 HA2 GLY 69 1HA GLY 69 -8.556 7.026 -11.916 514 HA3 GLY 69 2HA GLY 69 -8.061 8.170 -10.648 515 H MET 70 H MET 70 -6.633 6.032 -10.788 516 HA MET 70 HA MET 70 -7.422 4.321 -8.512 517 HB2 MET 70 1HB MET 70 -6.301 2.465 -9.515 518 HB3 MET 70 2HB MET 70 -7.314 3.154 -10.782 519 HG2 MET 70 1HG MET 70 -5.094 4.533 -11.337 520 HG3 MET 70 2HG MET 70 -4.312 3.268 -10.419 521 HE1 MET 70 3HE MET 70 -7.297 3.252 -13.053 522 HE2 MET 70 1HE MET 70 -6.072 4.323 -13.768 523 HE3 MET 70 2HE MET 70 -6.434 2.755 -14.518 524 H THR 71 H THR 71 -5.666 3.678 -7.177 525 HA THR 71 HA THR 71 -3.034 4.969 -7.680 526 HB THR 71 HB THR 71 -4.467 4.705 -5.021 527 HG1 THR 71 1HG THR 71 -4.680 6.671 -6.233 528 HG21 THR 71 3HG2 THR 71 -2.388 5.441 -3.938 529 HG22 THR 71 1HG2 THR 71 -1.518 5.338 -5.486 530 HG23 THR 71 2HG2 THR 71 -2.145 3.867 -4.702 531 H THR 72 H THR 72 -2.106 3.217 -8.663 532 HA THR 72 HA THR 72 -2.428 0.499 -7.690 533 HB THR 72 HB THR 72 -0.480 1.676 -9.710 534 HG1 THR 72 1HG THR 72 -2.898 0.567 -10.587 535 HG21 THR 72 3HG2 THR 72 -0.606 -0.577 -10.748 536 HG22 THR 72 1HG2 THR 72 -1.637 -1.128 -9.401 537 HG23 THR 72 2HG2 THR 72 0.040 -0.632 -9.107 538 H MET 73 H MET 73 -0.829 -0.604 -6.474 539 HA MET 73 HA MET 73 1.851 0.390 -6.005 540 HB2 MET 73 1HB MET 73 1.542 0.641 -3.547 541 HB3 MET 73 2HB MET 73 0.785 1.864 -4.532 542 HG2 MET 73 1HG MET 73 -1.391 0.393 -4.279 543 HG3 MET 73 2HG MET 73 -0.517 -0.277 -2.927 544 HE1 MET 73 3HE MET 73 0.230 3.630 -3.313 545 HE2 MET 73 1HE MET 73 -0.255 3.938 -1.640 546 HE3 MET 73 2HE MET 73 0.949 2.673 -1.982 547 H PHE 74 H PHE 74 2.910 -1.246 -4.346 548 HA PHE 74 HA PHE 74 1.699 -3.935 -4.345 549 HB2 PHE 74 1HB PHE 74 4.467 -3.299 -5.453 550 HB3 PHE 74 2HB PHE 74 3.676 -4.854 -5.394 551 HD1 PHE 74 1HD PHE 74 1.873 -5.426 -7.039 552 HD2 PHE 74 2HD PHE 74 3.975 -1.660 -7.221 553 HE1 PHE 74 1HE PHE 74 1.171 -5.135 -9.377 554 HE2 PHE 74 2HE PHE 74 3.184 -1.332 -9.543 555 HZ PHE 74 HZ PHE 74 1.762 -3.059 -10.625 556 H TYR 75 H TYR 75 2.524 -5.090 -2.375 557 HA TYR 75 HA TYR 75 4.605 -3.579 -0.859 558 HB2 TYR 75 1HB TYR 75 2.393 -5.029 0.550 559 HB3 TYR 75 2HB TYR 75 3.465 -3.789 1.146 560 HD1 TYR 75 2HD TYR 75 2.948 -1.634 -1.011 561 HD2 TYR 75 1HD TYR 75 0.360 -4.144 1.322 562 HE1 TYR 75 2HE TYR 75 1.137 -0.002 -1.309 563 HE2 TYR 75 1HE TYR 75 -1.459 -2.481 1.072 564 HH TYR 75 HH TYR 75 -1.147 0.321 -1.104 565 H TYR 76 H TYR 76 6.112 -4.829 0.275 566 HA TYR 76 HA TYR 76 5.983 -7.764 0.081 567 HB2 TYR 76 1HB TYR 76 8.186 -7.848 -1.045 568 HB3 TYR 76 2HB TYR 76 6.890 -7.211 -2.025 569 HD1 TYR 76 2HD TYR 76 6.811 -4.838 -2.656 570 HD2 TYR 76 1HD TYR 76 10.081 -6.406 -0.344 571 HE1 TYR 76 2HE TYR 76 8.164 -2.802 -3.192 572 HE2 TYR 76 1HE TYR 76 11.442 -4.385 -0.879 573 HH TYR 76 HH TYR 76 11.626 -2.584 -2.494 574 H GLU 77 H GLU 77 8.108 -8.701 1.099 575 HA GLU 77 HA GLU 77 9.139 -6.999 3.324 576 HB2 GLU 77 1HB GLU 77 8.061 -9.287 3.826 577 HB3 GLU 77 2HB GLU 77 9.463 -10.014 3.045 578 HG2 GLU 77 1HG GLU 77 10.963 -8.880 4.672 579 HG3 GLU 77 2HG GLU 77 9.576 -8.077 5.408 580 H GLU 78 H GLU 78 11.373 -6.683 3.484 581 HA GLU 78 HA GLU 78 13.126 -8.102 1.654 582 HB2 GLU 78 1HB GLU 78 12.392 -6.152 0.384 583 HB3 GLU 78 2HB GLU 78 13.007 -5.068 1.634 584 HG2 GLU 78 1HG GLU 78 15.226 -5.505 1.104 585 HG3 GLU 78 2HG GLU 78 14.896 -7.117 0.497 586 H ASN 79 H ASN 79 14.778 -8.785 2.776 587 HA ASN 79 HA ASN 79 16.438 -9.037 4.236 588 HB2 ASN 79 1HB ASN 79 16.460 -6.205 3.717 589 HB3 ASN 79 2HB ASN 79 16.810 -6.441 5.421 590 HD21 ASN 79 1HD2 ASN 79 18.164 -6.437 2.302 591 HD22 ASN 79 2HD2 ASN 79 19.610 -7.318 2.667 592 H GLY 80 H GLY 80 13.417 -8.561 5.318 593 HA2 GLY 80 1HA GLY 80 12.913 -9.633 7.536 594 HA3 GLY 80 2HA GLY 80 14.153 -8.578 8.228 595 H LYS 81 H LYS 81 12.697 -6.579 5.924 596 HA LYS 81 HA LYS 81 10.812 -5.541 7.908 597 HB2 LYS 81 1HB LYS 81 13.403 -4.685 7.415 598 HB3 LYS 81 2HB LYS 81 12.498 -3.776 6.205 599 HG2 LYS 81 1HG LYS 81 12.649 -2.474 8.121 600 HG3 LYS 81 2HG LYS 81 10.959 -3.036 8.046 601 HD2 LYS 81 1HD LYS 81 11.426 -4.726 9.797 602 HD3 LYS 81 2HD LYS 81 13.115 -4.203 9.861 603 HE2 LYS 81 1HE LYS 81 12.375 -1.891 10.418 604 HE3 LYS 81 2HE LYS 81 10.688 -2.374 10.251 605 HZ1 LYS 81 3HZ LYS 81 10.940 -3.780 12.197 606 HZ2 LYS 81 1HZ LYS 81 11.410 -2.246 12.534 607 HZ3 LYS 81 2HZ LYS 81 12.560 -3.357 12.302 608 H TYR 82 H TYR 82 9.109 -4.154 7.022 609 HA TYR 82 HA TYR 82 8.342 -5.330 4.389 610 HB2 TYR 82 1HB TYR 82 6.753 -4.213 6.693 611 HB3 TYR 82 2HB TYR 82 6.036 -4.689 5.164 612 HD1 TYR 82 1HD TYR 82 6.252 -7.127 4.394 613 HD2 TYR 82 2HD TYR 82 7.337 -5.818 8.366 614 HE1 TYR 82 1HE TYR 82 6.292 -9.471 5.161 615 HE2 TYR 82 2HE TYR 82 7.284 -8.114 9.167 616 HH TYR 82 HH TYR 82 7.468 -10.747 6.927 617 H TYR 83 H TYR 83 7.859 -4.039 2.622 618 HA TYR 83 HA TYR 83 8.005 -1.114 3.050 619 HB2 TYR 83 1HB TYR 83 9.453 -2.605 0.838 620 HB3 TYR 83 2HB TYR 83 9.384 -0.861 1.061 621 HD1 TYR 83 2HD TYR 83 10.797 -4.001 2.428 622 HD2 TYR 83 1HD TYR 83 10.742 0.300 2.707 623 HE1 TYR 83 2HE TYR 83 12.764 -4.120 3.815 624 HE2 TYR 83 1HE TYR 83 12.703 0.238 4.222 625 HH TYR 83 HH TYR 83 14.060 -2.749 5.397 626 H ILE 84 H ILE 84 7.201 0.127 1.316 627 HA ILE 84 HA ILE 84 4.974 -1.179 -0.194 628 HB ILE 84 HB ILE 84 4.921 1.429 1.353 629 HG12 ILE 84 1HG1 ILE 84 2.727 0.480 2.180 630 HG13 ILE 84 2HG1 ILE 84 3.216 -1.069 1.505 631 HG21 ILE 84 1HG2 ILE 84 3.222 0.636 -0.972 632 HG22 ILE 84 2HG2 ILE 84 2.543 1.643 0.321 633 HG23 ILE 84 3HG2 ILE 84 3.959 2.179 -0.597 634 HD11 ILE 84 3HD1 ILE 84 4.999 -1.272 3.097 635 HD12 ILE 84 1HD1 ILE 84 4.829 0.439 3.588 636 HD13 ILE 84 2HD1 ILE 84 3.560 -0.755 3.935 637 H GLU 85 H GLU 85 5.365 -1.094 -2.307 638 HA GLU 85 HA GLU 85 7.213 0.674 -3.511 639 HB2 GLU 85 1HB GLU 85 6.401 -1.561 -4.449 640 HB3 GLU 85 2HB GLU 85 4.844 -0.785 -4.756 641 HG2 GLU 85 1HG GLU 85 6.179 -0.958 -6.797 642 HG3 GLU 85 2HG GLU 85 5.734 0.686 -6.397 643 H CYS 86 H CYS 86 6.854 2.425 -4.812 644 HA CYS 86 HA CYS 86 4.429 3.631 -5.481 645 HB2 CYS 86 1HB CYS 86 5.558 4.314 -2.827 646 HB3 CYS 86 2HB CYS 86 5.425 5.761 -3.829 647 HG CYS 86 HG CYS 86 3.203 3.395 -3.276 648 HA PRO 87 HA PRO 87 7.514 5.701 -8.065 649 HB2 PRO 87 1HB PRO 87 6.527 8.188 -8.602 650 HB3 PRO 87 2HB PRO 87 5.727 6.698 -9.179 651 HG2 PRO 87 1HG PRO 87 5.067 8.319 -6.702 652 HG3 PRO 87 2HG PRO 87 3.952 7.715 -7.974 653 HD2 PRO 87 1HD PRO 87 4.347 6.394 -5.621 654 HD3 PRO 87 2HD PRO 87 4.037 5.542 -7.142 655 H TYR 88 H TYR 88 8.602 8.294 -7.979 656 HA TYR 88 HA TYR 88 10.607 8.181 -6.414 657 HB2 TYR 88 1HB TYR 88 9.153 10.828 -6.633 658 HB3 TYR 88 2HB TYR 88 10.870 10.609 -6.380 659 HD1 TYR 88 1HD TYR 88 8.132 10.465 -8.875 660 HD2 TYR 88 2HD TYR 88 12.383 10.094 -8.209 661 HE1 TYR 88 1HE TYR 88 8.538 10.792 -11.287 662 HE2 TYR 88 2HE TYR 88 12.789 10.484 -10.616 663 HH TYR 88 HH TYR 88 10.096 11.034 -12.914 664 H LYS 89 H LYS 89 7.647 8.474 -4.797 665 HA LYS 89 HA LYS 89 8.931 9.167 -2.214 666 HB2 LYS 89 1HB LYS 89 6.059 9.585 -3.161 667 HB3 LYS 89 2HB LYS 89 6.509 9.782 -1.501 668 HG2 LYS 89 1HG LYS 89 7.347 11.830 -1.789 669 HG3 LYS 89 2HG LYS 89 8.302 11.380 -3.184 670 HD2 LYS 89 1HD LYS 89 5.313 11.971 -3.244 671 HD3 LYS 89 2HD LYS 89 6.580 13.122 -3.713 672 HE2 LYS 89 1HE LYS 89 7.240 11.889 -5.590 673 HE3 LYS 89 2HE LYS 89 6.581 10.384 -4.948 674 HZ1 LYS 89 3HZ LYS 89 4.936 12.673 -5.862 675 HZ2 LYS 89 1HZ LYS 89 4.330 11.284 -5.330 676 HZ3 LYS 89 2HZ LYS 89 5.153 11.318 -6.763 677 H GLY 90 H GLY 90 8.854 6.563 -3.593 678 HA2 GLY 90 1HA GLY 90 7.273 5.030 -1.624 679 HA3 GLY 90 2HA GLY 90 7.738 4.515 -3.255 680 H ILE 91 H ILE 91 9.175 5.525 -0.148 681 HA ILE 91 HA ILE 91 10.674 3.014 -0.155 682 HB ILE 91 HB ILE 91 12.101 5.585 0.643 683 HG12 ILE 91 1HG1 ILE 91 12.181 3.980 -1.927 684 HG13 ILE 91 2HG1 ILE 91 11.901 5.725 -1.733 685 HG21 ILE 91 1HG2 ILE 91 14.039 4.150 0.944 686 HG22 ILE 91 2HG2 ILE 91 12.699 3.372 1.800 687 HG23 ILE 91 3HG2 ILE 91 13.175 2.761 0.217 688 HD11 ILE 91 3HD1 ILE 91 14.569 4.291 -1.238 689 HD12 ILE 91 1HD1 ILE 91 14.103 5.106 -2.705 690 HD13 ILE 91 2HD1 ILE 91 14.265 6.048 -1.204 691 H TYR 92 H TYR 92 8.359 3.103 0.927 692 HA TYR 92 HA TYR 92 8.363 4.327 3.594 693 HB2 TYR 92 1HB TYR 92 6.396 2.339 2.461 694 HB3 TYR 92 2HB TYR 92 6.195 3.243 3.938 695 HD1 TYR 92 1HD TYR 92 5.701 5.661 3.919 696 HD2 TYR 92 2HD TYR 92 6.012 3.394 0.269 697 HE1 TYR 92 1HE TYR 92 4.777 7.564 2.673 698 HE2 TYR 92 2HE TYR 92 5.038 5.264 -0.968 699 HH TYR 92 HH TYR 92 5.019 7.733 -0.716 700 H GLU 93 H GLU 93 9.671 3.500 5.049 701 HA GLU 93 HA GLU 93 9.813 0.563 5.322 702 HB2 GLU 93 1HB GLU 93 11.836 2.039 5.621 703 HB3 GLU 93 2HB GLU 93 11.017 2.877 6.901 704 HG2 GLU 93 1HG GLU 93 10.975 0.437 8.033 705 HG3 GLU 93 2HG GLU 93 12.277 0.156 6.870 706 H ILE 94 H ILE 94 8.291 -0.428 6.509 707 HA ILE 94 HA ILE 94 6.896 1.013 8.701 708 HB ILE 94 HB ILE 94 5.011 -0.414 8.547 709 HG12 ILE 94 1HG1 ILE 94 6.201 -1.646 6.063 710 HG13 ILE 94 2HG1 ILE 94 6.060 -2.422 7.634 711 HG21 ILE 94 1HG2 ILE 94 5.592 0.934 5.887 712 HG22 ILE 94 2HG2 ILE 94 3.986 0.519 6.531 713 HG23 ILE 94 3HG2 ILE 94 4.980 1.666 7.405 714 HD11 ILE 94 3HD1 ILE 94 3.719 -1.581 5.885 715 HD12 ILE 94 1HD1 ILE 94 4.307 -3.222 6.146 716 HD13 ILE 94 2HD1 ILE 94 3.591 -2.307 7.482 717 H GLU 95 H GLU 95 6.300 -0.584 10.512 718 HA GLU 95 HA GLU 95 8.528 -2.551 10.800 719 HB2 GLU 95 1HB GLU 95 7.519 -0.612 12.914 720 HB3 GLU 95 2HB GLU 95 8.747 -1.866 13.119 721 HG2 GLU 95 1HG GLU 95 9.964 -0.597 11.136 722 HG3 GLU 95 2HG GLU 95 8.935 0.751 11.612 723 H ASN 96 H ASN 96 6.253 -3.408 9.808 724 HA ASN 96 HA ASN 96 5.838 -5.725 11.253 725 HB2 ASN 96 1HB ASN 96 3.896 -3.592 11.962 726 HB3 ASN 96 2HB ASN 96 3.071 -4.929 11.242 727 HD21 ASN 96 1HD2 ASN 96 2.873 -3.952 13.875 728 HD22 ASN 96 2HD2 ASN 96 2.977 -5.448 14.815 729 H ASN 97 H ASN 97 3.914 -6.994 10.256 730 HA ASN 97 HA ASN 97 4.187 -6.851 7.330 731 HB2 ASN 97 1HB ASN 97 4.231 -9.052 8.504 732 HB3 ASN 97 2HB ASN 97 2.625 -8.737 9.167 733 HD21 ASN 97 1HD2 ASN 97 4.414 -9.181 6.148 734 HD22 ASN 97 2HD2 ASN 97 3.049 -9.682 5.170 735 H PHE 98 H PHE 98 2.548 -6.182 5.926 736 HA PHE 98 HA PHE 98 0.405 -4.541 7.044 737 HB2 PHE 98 1HB PHE 98 1.718 -3.834 5.097 738 HB3 PHE 98 2HB PHE 98 1.204 -5.260 4.201 739 HD1 PHE 98 1HD PHE 98 -1.039 -5.480 3.299 740 HD2 PHE 98 2HD PHE 98 0.153 -1.940 5.459 741 HE1 PHE 98 1HE PHE 98 -3.034 -4.307 2.473 742 HE2 PHE 98 2HE PHE 98 -1.834 -0.741 4.595 743 HZ PHE 98 HZ PHE 98 -3.460 -1.945 3.122 744 H GLU 99 H GLU 99 0.625 -7.654 5.261 745 HA GLU 99 HA GLU 99 -2.159 -7.819 4.669 746 HB2 GLU 99 1HB GLU 99 0.198 -9.690 4.471 747 HB3 GLU 99 2HB GLU 99 -1.445 -10.294 4.182 748 HG2 GLU 99 1HG GLU 99 -1.851 -8.683 2.440 749 HG3 GLU 99 2HG GLU 99 -0.363 -7.819 2.780 750 H ASP 100 H ASP 100 -0.491 -8.552 7.567 751 HA ASP 100 HA ASP 100 -2.667 -10.174 8.697 752 HB2 ASP 100 1HB ASP 100 -0.365 -10.608 9.392 753 HB3 ASP 100 2HB ASP 100 -0.131 -8.915 9.831 754 H MET 101 H MET 101 -2.014 -6.771 8.405 755 HA MET 101 HA MET 101 -3.570 -6.069 10.812 756 HB2 MET 101 1HB MET 101 -2.409 -4.274 8.651 757 HB3 MET 101 2HB MET 101 -3.137 -3.752 10.174 758 HG2 MET 101 1HG MET 101 -1.163 -5.723 10.833 759 HG3 MET 101 2HG MET 101 -0.442 -4.670 9.644 760 HE1 MET 101 3HE MET 101 -0.852 -2.073 9.850 761 HE2 MET 101 1HE MET 101 -1.098 -1.208 11.381 762 HE3 MET 101 2HE MET 101 0.525 -1.752 10.927 763 H ILE 102 H ILE 102 -4.071 -6.547 7.399 764 HA ILE 102 HA ILE 102 -6.564 -4.990 7.323 765 HB ILE 102 HB ILE 102 -6.722 -5.837 4.973 766 HG12 ILE 102 1HG1 ILE 102 -4.003 -7.085 5.540 767 HG13 ILE 102 2HG1 ILE 102 -5.490 -7.977 5.240 768 HG21 ILE 102 1HG2 ILE 102 -5.590 -3.699 5.675 769 HG22 ILE 102 2HG2 ILE 102 -4.035 -4.536 5.614 770 HG23 ILE 102 3HG2 ILE 102 -5.014 -4.337 4.143 771 HD11 ILE 102 3HD1 ILE 102 -4.105 -7.939 3.236 772 HD12 ILE 102 1HD1 ILE 102 -5.586 -7.003 2.940 773 HD13 ILE 102 2HD1 ILE 102 -4.036 -6.186 3.249 Start of MODEL 19 1 H1 GLY 1 H GLY 1 7.468 12.505 9.409 2 HA2 GLY 1 1HA GLY 1 5.358 13.183 8.477 3 HA3 GLY 1 2HA GLY 1 6.590 13.261 7.197 4 H SER 2 H SER 2 3.486 12.528 7.359 5 HA SER 2 HA SER 2 3.386 9.727 6.773 6 HB2 SER 2 1HB SER 2 1.186 11.742 6.279 7 HB3 SER 2 2HB SER 2 1.045 10.062 6.809 8 HG SER 2 HG SER 2 2.051 10.733 8.800 9 HA PRO 3 HA PRO 3 2.948 9.976 2.197 10 HB2 PRO 3 1HB PRO 3 0.874 8.171 1.822 11 HB3 PRO 3 2HB PRO 3 2.599 7.780 1.922 12 HG2 PRO 3 1HG PRO 3 0.479 7.598 3.973 13 HG3 PRO 3 2HG PRO 3 1.906 6.518 3.726 14 HD2 PRO 3 1HD PRO 3 1.737 8.376 5.726 15 HD3 PRO 3 2HD PRO 3 3.264 7.844 4.984 16 H ILE 4 H ILE 4 0.960 10.173 0.602 17 HA ILE 4 HA ILE 4 -1.163 11.924 1.693 18 HB ILE 4 HB ILE 4 0.360 12.261 -0.930 19 HG12 ILE 4 1HG1 ILE 4 0.493 13.814 1.694 20 HG13 ILE 4 2HG1 ILE 4 1.788 12.874 0.960 21 HG21 ILE 4 1HG2 ILE 4 -2.019 12.925 -1.059 22 HG22 ILE 4 2HG2 ILE 4 -1.831 13.943 0.383 23 HG23 ILE 4 3HG2 ILE 4 -0.983 14.339 -1.129 24 HD11 ILE 4 3HD1 ILE 4 2.301 15.141 0.550 25 HD12 ILE 4 1HD1 ILE 4 1.800 14.422 -0.993 26 HD13 ILE 4 2HD1 ILE 4 0.687 15.487 -0.090 27 H LEU 5 H LEU 5 -2.695 10.390 1.768 28 HA LEU 5 HA LEU 5 -3.138 8.527 -0.489 29 HB2 LEU 5 1HB LEU 5 -4.622 7.403 1.313 30 HB3 LEU 5 2HB LEU 5 -2.891 7.174 1.364 31 HG LEU 5 HG LEU 5 -4.005 9.440 3.013 32 HD11 LEU 5 1HD1 LEU 5 -5.603 7.745 3.554 33 HD12 LEU 5 2HD1 LEU 5 -4.486 7.899 4.902 34 HD13 LEU 5 3HD1 LEU 5 -4.333 6.517 3.791 35 HD21 LEU 5 3HD2 LEU 5 -2.238 8.814 4.547 36 HD22 LEU 5 1HD2 LEU 5 -1.523 8.837 2.931 37 HD23 LEU 5 2HD2 LEU 5 -1.946 7.290 3.681 38 HA PRO 6 HA PRO 6 -6.856 10.733 -1.422 39 HB2 PRO 6 1HB PRO 6 -8.549 8.705 -2.319 40 HB3 PRO 6 2HB PRO 6 -7.191 9.369 -3.262 41 HG2 PRO 6 1HG PRO 6 -7.317 6.903 -1.525 42 HG3 PRO 6 2HG PRO 6 -6.636 7.064 -3.183 43 HD2 PRO 6 1HD PRO 6 -5.074 7.081 -1.006 44 HD3 PRO 6 2HD PRO 6 -4.715 8.162 -2.380 45 H LYS 7 H LYS 7 -9.159 11.155 -0.715 46 HA LYS 7 HA LYS 7 -9.482 10.737 2.058 47 HB2 LYS 7 1HB LYS 7 -11.696 11.345 0.026 48 HB3 LYS 7 2HB LYS 7 -11.692 11.692 1.769 49 HG2 LYS 7 1HG LYS 7 -11.028 13.769 1.198 50 HG3 LYS 7 2HG LYS 7 -9.431 13.060 0.998 51 HD2 LYS 7 1HD LYS 7 -9.873 14.236 -1.062 52 HD3 LYS 7 2HD LYS 7 -10.157 12.513 -1.375 53 HE2 LYS 7 1HE LYS 7 -11.951 13.618 -2.413 54 HE3 LYS 7 2HE LYS 7 -12.589 12.854 -0.942 55 HZ1 LYS 7 3HZ LYS 7 -12.780 14.974 0.082 56 HZ2 LYS 7 1HZ LYS 7 -13.389 15.073 -1.420 57 HZ3 LYS 7 2HZ LYS 7 -11.937 15.736 -1.126 58 H ALA 8 H ALA 8 -11.001 9.495 3.215 59 HA ALA 8 HA ALA 8 -11.426 6.838 2.214 60 HB1 ALA 8 1HB ALA 8 -12.747 8.189 4.616 61 HB2 ALA 8 2HB ALA 8 -12.433 6.451 4.385 62 HB3 ALA 8 3HB ALA 8 -11.079 7.575 4.607 63 H GLU 9 H GLU 9 -13.096 9.562 1.277 64 HA GLU 9 HA GLU 9 -15.704 8.089 1.046 65 HB2 GLU 9 1HB GLU 9 -16.791 10.250 1.263 66 HB3 GLU 9 2HB GLU 9 -15.768 9.916 2.667 67 HG2 GLU 9 1HG GLU 9 -13.961 11.354 1.612 68 HG3 GLU 9 2HG GLU 9 -15.069 11.727 0.310 69 H ASN 10 H ASN 10 -13.119 9.664 -0.704 70 HA ASN 10 HA ASN 10 -14.794 9.813 -3.129 71 HB2 ASN 10 1HB ASN 10 -13.145 11.053 -4.084 72 HB3 ASN 10 2HB ASN 10 -13.160 11.643 -2.443 73 HD21 ASN 10 1HD2 ASN 10 -11.442 8.977 -1.749 74 HD22 ASN 10 2HD2 ASN 10 -9.902 9.500 -2.363 75 H VAL 11 H VAL 11 -13.245 7.540 -1.361 76 HA VAL 11 HA VAL 11 -12.084 5.909 -3.453 77 HB VAL 11 HB VAL 11 -12.602 5.717 -0.465 78 HG11 VAL 11 1HG1 VAL 11 -11.882 3.484 -2.381 79 HG12 VAL 11 2HG1 VAL 11 -11.444 3.430 -0.654 80 HG13 VAL 11 3HG1 VAL 11 -13.144 3.507 -1.166 81 HG21 VAL 11 3HG2 VAL 11 -10.540 6.893 -1.490 82 HG22 VAL 11 1HG2 VAL 11 -10.193 5.575 -0.358 83 HG23 VAL 11 2HG2 VAL 11 -10.056 5.311 -2.107 84 H ASP 12 H ASP 12 -13.074 4.302 -4.459 85 HA ASP 12 HA ASP 12 -16.012 4.012 -4.234 86 HB2 ASP 12 1HB ASP 12 -14.343 4.354 -6.470 87 HB3 ASP 12 2HB ASP 12 -14.633 2.619 -6.441 88 H SER 13 H SER 13 -12.941 2.016 -4.711 89 HA SER 13 HA SER 13 -13.643 0.337 -2.491 90 HB2 SER 13 1HB SER 13 -13.834 -1.762 -4.019 91 HB3 SER 13 2HB SER 13 -15.246 -0.786 -3.658 92 HG SER 13 HG SER 13 -14.534 -1.514 -5.945 93 H ILE 14 H ILE 14 -11.649 -0.303 -1.789 94 HA ILE 14 HA ILE 14 -9.256 -0.344 -3.454 95 HB ILE 14 HB ILE 14 -9.693 -1.255 -0.574 96 HG12 ILE 14 1HG1 ILE 14 -8.228 1.281 -1.343 97 HG13 ILE 14 2HG1 ILE 14 -9.968 1.298 -1.124 98 HG21 ILE 14 1HG2 ILE 14 -7.130 -0.773 -2.164 99 HG22 ILE 14 2HG2 ILE 14 -7.181 -1.075 -0.414 100 HG23 ILE 14 3HG2 ILE 14 -7.712 -2.324 -1.532 101 HD11 ILE 14 3HD1 ILE 14 -7.985 0.530 1.005 102 HD12 ILE 14 1HD1 ILE 14 -8.954 2.008 0.917 103 HD13 ILE 14 2HD1 ILE 14 -9.753 0.444 1.171 104 H CYS 15 H CYS 15 -8.521 -2.136 -4.447 105 HA CYS 15 HA CYS 15 -9.698 -4.796 -3.772 106 HB2 CYS 15 1HB CYS 15 -9.862 -3.873 -6.211 107 HB3 CYS 15 2HB CYS 15 -8.131 -4.169 -6.293 108 HG CYS 15 HG CYS 15 -10.001 -6.037 -7.254 109 H ILE 16 H ILE 16 -8.196 -6.433 -3.358 110 HA ILE 16 HA ILE 16 -5.318 -5.883 -3.501 111 HB ILE 16 HB ILE 16 -6.660 -6.938 -0.982 112 HG12 ILE 16 1HG1 ILE 16 -5.305 -4.303 -1.651 113 HG13 ILE 16 2HG1 ILE 16 -6.956 -4.540 -1.090 114 HG21 ILE 16 1HG2 ILE 16 -3.699 -6.451 -1.474 115 HG22 ILE 16 2HG2 ILE 16 -4.479 -7.111 -0.028 116 HG23 ILE 16 3HG2 ILE 16 -4.481 -8.046 -1.511 117 HD11 ILE 16 3HD1 ILE 16 -4.405 -4.771 0.499 118 HD12 ILE 16 1HD1 ILE 16 -5.704 -3.591 0.681 119 HD13 ILE 16 2HD1 ILE 16 -6.000 -5.290 1.127 120 H ASP 17 H ASP 17 -4.836 -7.334 -4.956 121 HA ASP 17 HA ASP 17 -5.928 -10.102 -4.996 122 HB2 ASP 17 1HB ASP 17 -5.140 -8.297 -7.026 123 HB3 ASP 17 2HB ASP 17 -3.822 -9.466 -6.940 124 H PHE 18 H PHE 18 -4.838 -11.314 -3.481 125 HA PHE 18 HA PHE 18 -2.418 -10.401 -2.174 126 HB2 PHE 18 1HB PHE 18 -4.134 -12.911 -2.052 127 HB3 PHE 18 2HB PHE 18 -2.620 -12.815 -1.197 128 HD1 PHE 18 1HD PHE 18 -5.814 -10.745 -1.527 129 HD2 PHE 18 2HD PHE 18 -2.558 -12.090 0.991 130 HE1 PHE 18 1HE PHE 18 -6.832 -9.638 0.430 131 HE2 PHE 18 2HE PHE 18 -3.632 -11.030 2.937 132 HZ PHE 18 HZ PHE 18 -5.819 -9.843 2.656 133 H THR 19 H THR 19 -0.614 -12.384 -1.894 134 HA THR 19 HA THR 19 0.753 -12.583 -4.335 135 HB THR 19 HB THR 19 1.924 -14.558 -3.088 136 HG1 THR 19 1HG THR 19 1.114 -15.133 -1.282 137 HG21 THR 19 3HG2 THR 19 2.846 -12.277 -3.218 138 HG22 THR 19 1HG2 THR 19 3.172 -13.038 -1.657 139 HG23 THR 19 2HG2 THR 19 1.898 -11.798 -1.795 140 H ASN 20 H ASN 20 -1.349 -14.950 -2.678 141 HA ASN 20 HA ASN 20 -1.293 -16.812 -4.941 142 HB2 ASN 20 1HB ASN 20 -3.627 -17.135 -3.170 143 HB3 ASN 20 2HB ASN 20 -2.484 -18.308 -3.751 144 HD21 ASN 20 1HD2 ASN 20 -3.593 -16.516 -1.023 145 HD22 ASN 20 2HD2 ASN 20 -2.366 -17.193 0.025 146 H SER 21 H SER 21 -3.929 -17.508 -5.418 147 HA SER 21 HA SER 21 -4.659 -15.291 -7.196 148 HB2 SER 21 1HB SER 21 -5.925 -18.047 -7.017 149 HB3 SER 21 2HB SER 21 -5.864 -16.935 -8.393 150 HG SER 21 HG SER 21 -3.509 -17.262 -8.315 151 H ILE 22 H ILE 22 -5.162 -15.206 -4.187 152 HA ILE 22 HA ILE 22 -8.131 -15.301 -4.072 153 HB ILE 22 HB ILE 22 -6.323 -14.632 -1.767 154 HG12 ILE 22 1HG1 ILE 22 -7.241 -17.494 -2.306 155 HG13 ILE 22 2HG1 ILE 22 -5.628 -16.916 -2.614 156 HG21 ILE 22 1HG2 ILE 22 -8.791 -14.204 -1.665 157 HG22 ILE 22 2HG2 ILE 22 -9.064 -15.941 -1.927 158 HG23 ILE 22 3HG2 ILE 22 -8.270 -15.366 -0.444 159 HD11 ILE 22 3HD1 ILE 22 -5.573 -18.037 -0.519 160 HD12 ILE 22 1HD1 ILE 22 -5.427 -16.299 -0.174 161 HD13 ILE 22 2HD1 ILE 22 -6.970 -17.141 0.085 162 H GLN 23 H GLN 23 -9.145 -13.420 -4.071 163 HA GLN 23 HA GLN 23 -7.622 -10.866 -3.864 164 HB2 GLN 23 1HB GLN 23 -8.084 -11.344 -6.232 165 HB3 GLN 23 2HB GLN 23 -9.805 -11.572 -5.862 166 HG2 GLN 23 1HG GLN 23 -9.752 -9.107 -5.070 167 HG3 GLN 23 2HG GLN 23 -8.146 -9.022 -5.808 168 HE21 GLN 23 1HE2 GLN 23 -8.051 -9.423 -8.213 169 HE22 GLN 23 2HE2 GLN 23 -9.501 -9.200 -9.156 170 H LYS 24 H LYS 24 -8.664 -9.277 -2.722 171 HA LYS 24 HA LYS 24 -11.430 -9.819 -1.783 172 HB2 LYS 24 1HB LYS 24 -9.161 -10.098 -0.129 173 HB3 LYS 24 2HB LYS 24 -9.697 -8.479 0.203 174 HG2 LYS 24 1HG LYS 24 -12.062 -10.070 0.229 175 HG3 LYS 24 2HG LYS 24 -10.808 -11.059 0.966 176 HD2 LYS 24 1HD LYS 24 -11.972 -9.953 2.695 177 HD3 LYS 24 2HD LYS 24 -10.372 -9.187 2.603 178 HE2 LYS 24 1HE LYS 24 -11.254 -7.235 1.548 179 HE3 LYS 24 2HE LYS 24 -12.677 -8.100 0.970 180 HZ1 LYS 24 3HZ LYS 24 -13.607 -8.103 3.097 181 HZ2 LYS 24 1HZ LYS 24 -13.164 -6.575 2.808 182 HZ3 LYS 24 2HZ LYS 24 -12.271 -7.513 3.826 183 H ILE 25 H ILE 25 -12.693 -7.916 -1.390 184 HA ILE 25 HA ILE 25 -11.492 -5.372 -2.279 185 HB ILE 25 HB ILE 25 -14.314 -6.364 -2.857 186 HG12 ILE 25 1HG1 ILE 25 -13.298 -5.826 -5.315 187 HG13 ILE 25 2HG1 ILE 25 -11.800 -6.285 -4.528 188 HG21 ILE 25 1HG2 ILE 25 -12.902 -3.778 -3.638 189 HG22 ILE 25 2HG2 ILE 25 -14.507 -4.279 -4.187 190 HG23 ILE 25 3HG2 ILE 25 -14.275 -3.932 -2.498 191 HD11 ILE 25 3HD1 ILE 25 -12.918 -8.139 -5.716 192 HD12 ILE 25 1HD1 ILE 25 -12.790 -8.511 -3.988 193 HD13 ILE 25 2HD1 ILE 25 -14.343 -7.974 -4.675 194 H TYR 26 H TYR 26 -12.244 -3.583 -1.136 195 HA TYR 26 HA TYR 26 -13.378 -4.153 1.588 196 HB2 TYR 26 1HB TYR 26 -11.002 -2.451 0.755 197 HB3 TYR 26 2HB TYR 26 -11.600 -2.595 2.382 198 HD1 TYR 26 1HD TYR 26 -9.936 -4.370 -0.401 199 HD2 TYR 26 2HD TYR 26 -10.950 -4.527 3.806 200 HE1 TYR 26 1HE TYR 26 -8.542 -6.372 -0.146 201 HE2 TYR 26 2HE TYR 26 -9.477 -6.514 4.058 202 HH TYR 26 HH TYR 26 -7.313 -7.595 1.539 203 H ASP 27 H ASP 27 -15.411 -3.523 0.442 204 HA ASP 27 HA ASP 27 -15.606 -0.626 -0.124 205 HB2 ASP 27 1HB ASP 27 -17.574 -1.103 -1.400 206 HB3 ASP 27 2HB ASP 27 -16.213 -2.064 -1.951 207 H ASP 28 H ASP 28 -15.878 -2.355 2.579 208 HA ASP 28 HA ASP 28 -18.335 -1.045 3.643 209 HB2 ASP 28 1HB ASP 28 -16.108 -2.382 5.232 210 HB3 ASP 28 2HB ASP 28 -17.701 -1.945 5.794 211 H SER 29 H SER 29 -18.141 0.969 4.843 212 HA SER 29 HA SER 29 -15.857 2.539 4.602 213 HB2 SER 29 1HB SER 29 -17.913 3.574 5.081 214 HB3 SER 29 2HB SER 29 -18.143 2.654 6.570 215 HG SER 29 HG SER 29 -16.013 4.491 6.158 216 H GLU 30 H GLU 30 -16.613 0.345 7.350 217 HA GLU 30 HA GLU 30 -14.317 1.067 8.870 218 HB2 GLU 30 1HB GLU 30 -16.395 -1.001 8.998 219 HB3 GLU 30 2HB GLU 30 -14.832 -1.692 9.354 220 HG2 GLU 30 1HG GLU 30 -15.645 -0.986 11.447 221 HG3 GLU 30 2HG GLU 30 -14.428 0.199 11.015 222 H SER 31 H SER 31 -14.633 -1.148 6.139 223 HA SER 31 HA SER 31 -12.064 -2.486 6.384 224 HB2 SER 31 1HB SER 31 -12.520 -3.374 4.326 225 HB3 SER 31 2HB SER 31 -14.091 -3.230 5.070 226 HG SER 31 HG SER 31 -14.341 -1.247 3.790 227 H ILE 32 H ILE 32 -13.273 0.427 4.752 228 HA ILE 32 HA ILE 32 -10.815 1.099 3.472 229 HB ILE 32 HB ILE 32 -13.361 2.697 4.059 230 HG12 ILE 32 1HG1 ILE 32 -12.192 1.450 1.593 231 HG13 ILE 32 2HG1 ILE 32 -13.436 0.659 2.521 232 HG21 ILE 32 1HG2 ILE 32 -12.358 4.258 2.261 233 HG22 ILE 32 2HG2 ILE 32 -11.614 4.293 3.856 234 HG23 ILE 32 3HG2 ILE 32 -10.803 3.414 2.556 235 HD11 ILE 32 3HD1 ILE 32 -15.079 2.390 1.997 236 HD12 ILE 32 1HD1 ILE 32 -13.884 3.252 1.006 237 HD13 ILE 32 2HD1 ILE 32 -14.435 1.641 0.512 238 H GLN 33 H GLN 33 -12.434 2.412 6.439 239 HA GLN 33 HA GLN 33 -10.323 4.223 7.057 240 HB2 GLN 33 1HB GLN 33 -12.362 2.892 8.867 241 HB3 GLN 33 2HB GLN 33 -11.187 4.113 9.387 242 HG2 GLN 33 1HG GLN 33 -12.168 5.533 7.390 243 HG3 GLN 33 2HG GLN 33 -13.564 4.462 7.573 244 HE21 GLN 33 1HE2 GLN 33 -12.012 7.320 8.843 245 HE22 GLN 33 2HE2 GLN 33 -12.818 7.312 10.403 246 H LYS 34 H LYS 34 -10.621 0.735 7.751 247 HA LYS 34 HA LYS 34 -8.331 0.655 9.438 248 HB2 LYS 34 1HB LYS 34 -9.733 -1.263 9.425 249 HB3 LYS 34 2HB LYS 34 -9.663 -1.456 7.692 250 HG2 LYS 34 1HG LYS 34 -8.336 -3.114 9.092 251 HG3 LYS 34 2HG LYS 34 -7.524 -2.367 7.733 252 HD2 LYS 34 1HD LYS 34 -5.860 -1.672 9.014 253 HD3 LYS 34 2HD LYS 34 -6.928 -0.720 10.035 254 HE2 LYS 34 1HE LYS 34 -7.423 -2.641 11.446 255 HE3 LYS 34 2HE LYS 34 -6.337 -3.639 10.460 256 HZ1 LYS 34 3HZ LYS 34 -4.538 -2.067 11.025 257 HZ2 LYS 34 1HZ LYS 34 -5.187 -2.758 12.385 258 HZ3 LYS 34 2HZ LYS 34 -5.575 -1.232 11.987 259 H ILE 35 H ILE 35 -8.581 -0.272 5.958 260 HA ILE 35 HA ILE 35 -5.869 -0.612 5.603 261 HB ILE 35 HB ILE 35 -7.955 0.326 3.583 262 HG12 ILE 35 1HG1 ILE 35 -6.625 -2.369 4.096 263 HG13 ILE 35 2HG1 ILE 35 -8.220 -1.948 4.674 264 HG21 ILE 35 1HG2 ILE 35 -6.190 -0.489 1.874 265 HG22 ILE 35 2HG2 ILE 35 -5.840 1.016 2.690 266 HG23 ILE 35 3HG2 ILE 35 -5.037 -0.480 3.215 267 HD11 ILE 35 3HD1 ILE 35 -9.052 -1.732 2.369 268 HD12 ILE 35 1HD1 ILE 35 -7.454 -2.186 1.730 269 HD13 ILE 35 2HD1 ILE 35 -8.345 -3.335 2.699 270 H LEU 36 H LEU 36 -7.630 2.526 5.084 271 HA LEU 36 HA LEU 36 -5.468 4.091 4.324 272 HB2 LEU 36 1HB LEU 36 -7.745 4.766 6.181 273 HB3 LEU 36 2HB LEU 36 -6.699 5.973 5.440 274 HG LEU 36 HG LEU 36 -8.260 4.033 3.688 275 HD11 LEU 36 1HD1 LEU 36 -9.155 6.638 4.970 276 HD12 LEU 36 2HD1 LEU 36 -9.879 5.032 5.197 277 HD13 LEU 36 3HD1 LEU 36 -9.988 5.816 3.619 278 HD21 LEU 36 3HD2 LEU 36 -7.628 6.954 3.181 279 HD22 LEU 36 1HD2 LEU 36 -8.211 5.751 2.044 280 HD23 LEU 36 2HD2 LEU 36 -6.541 5.621 2.636 281 H SER 37 H SER 37 -5.950 2.753 7.566 282 HA SER 37 HA SER 37 -4.235 4.552 9.021 283 HB2 SER 37 1HB SER 37 -5.981 2.987 9.992 284 HB3 SER 37 2HB SER 37 -4.877 1.642 9.652 285 HG SER 37 HG SER 37 -4.780 2.572 11.785 286 H GLU 38 H GLU 38 -3.670 1.160 7.816 287 HA GLU 38 HA GLU 38 -0.868 1.309 8.435 288 HB2 GLU 38 1HB GLU 38 -2.168 -0.607 6.477 289 HB3 GLU 38 2HB GLU 38 -0.694 -0.849 7.410 290 HG2 GLU 38 1HG GLU 38 -3.564 -0.844 8.386 291 HG3 GLU 38 2HG GLU 38 -2.444 -2.188 8.341 292 H ILE 39 H ILE 39 -2.756 2.166 5.600 293 HA ILE 39 HA ILE 39 -0.537 2.499 3.786 294 HB ILE 39 HB ILE 39 -3.327 3.692 3.913 295 HG12 ILE 39 1HG1 ILE 39 -3.189 1.206 3.559 296 HG13 ILE 39 2HG1 ILE 39 -3.935 2.081 2.237 297 HG21 ILE 39 1HG2 ILE 39 -1.345 3.875 1.645 298 HG22 ILE 39 2HG2 ILE 39 -3.090 4.176 1.475 299 HG23 ILE 39 3HG2 ILE 39 -2.119 5.208 2.535 300 HD11 ILE 39 3HD1 ILE 39 -1.978 1.767 0.849 301 HD12 ILE 39 1HD1 ILE 39 -1.045 1.109 2.218 302 HD13 ILE 39 2HD1 ILE 39 -2.439 0.225 1.596 303 H ALA 40 H ALA 40 -1.380 4.247 6.626 304 HA ALA 40 HA ALA 40 0.148 6.621 5.718 305 HB1 ALA 40 1HB ALA 40 -2.270 7.001 6.216 306 HB2 ALA 40 2HB ALA 40 -1.946 6.476 7.886 307 HB3 ALA 40 3HB ALA 40 -1.167 7.939 7.248 308 H THR 41 H THR 41 0.520 3.947 7.855 309 HA THR 41 HA THR 41 1.770 5.319 10.007 310 HB THR 41 HB THR 41 2.725 2.938 10.359 311 HG1 THR 41 1HG THR 41 1.749 1.345 9.166 312 HG21 THR 41 3HG2 THR 41 0.774 3.734 11.570 313 HG22 THR 41 1HG2 THR 41 0.464 2.080 11.040 314 HG23 THR 41 2HG2 THR 41 -0.284 3.430 10.181 315 H GLY 42 H GLY 42 3.054 3.965 6.955 316 HA2 GLY 42 1HA GLY 42 5.724 3.938 7.838 317 HA3 GLY 42 2HA GLY 42 5.159 3.759 6.167 318 H LYS 43 H LYS 43 7.555 4.863 6.727 319 HA LYS 43 HA LYS 43 7.248 7.796 6.216 320 HB2 LYS 43 1HB LYS 43 9.643 6.366 7.420 321 HB3 LYS 43 2HB LYS 43 9.471 8.087 7.126 322 HG2 LYS 43 1HG LYS 43 7.718 8.287 8.786 323 HG3 LYS 43 2HG LYS 43 7.627 6.529 8.998 324 HD2 LYS 43 1HD LYS 43 9.947 6.481 9.842 325 HD3 LYS 43 2HD LYS 43 10.029 8.254 9.691 326 HE2 LYS 43 1HE LYS 43 8.144 8.506 11.250 327 HE3 LYS 43 2HE LYS 43 7.955 6.750 11.339 328 HZ1 LYS 43 3HZ LYS 43 10.340 8.235 12.294 329 HZ2 LYS 43 1HZ LYS 43 10.100 6.599 12.385 330 HZ3 LYS 43 2HZ LYS 43 9.121 7.588 13.214 331 H ARG 44 H ARG 44 7.363 7.930 3.985 332 HA ARG 44 HA ARG 44 8.610 6.145 2.204 333 HB2 ARG 44 1HB ARG 44 8.539 7.988 0.555 334 HB3 ARG 44 2HB ARG 44 7.049 7.727 1.413 335 HG2 ARG 44 1HG ARG 44 7.818 9.637 3.012 336 HG3 ARG 44 2HG ARG 44 8.995 10.006 1.715 337 HD2 ARG 44 1HD ARG 44 7.203 10.196 0.135 338 HD3 ARG 44 2HD ARG 44 6.001 9.704 1.351 339 HE ARG 44 HE ARG 44 7.679 12.145 1.712 340 HH11 ARG 44 1HH1 ARG 44 4.431 10.859 1.122 341 HH12 ARG 44 2HH1 ARG 44 3.653 12.129 2.024 342 HH21 ARG 44 1HH2 ARG 44 6.523 14.009 2.616 343 HH22 ARG 44 2HH2 ARG 44 4.788 13.959 2.703 344 H THR 45 H THR 45 10.194 7.834 4.443 345 HA THR 45 HA THR 45 12.207 8.581 4.945 346 HB THR 45 HB THR 45 14.175 7.555 4.022 347 HG1 THR 45 1HG THR 45 12.470 6.836 1.909 348 HG21 THR 45 3HG2 THR 45 13.665 5.185 4.326 349 HG22 THR 45 1HG2 THR 45 11.928 5.474 4.146 350 HG23 THR 45 2HG2 THR 45 12.802 6.154 5.530 351 H GLU 46 H GLU 46 14.165 9.865 4.065 352 HA GLU 46 HA GLU 46 13.151 12.058 2.422 353 HB2 GLU 46 1HB GLU 46 15.424 13.001 2.897 354 HB3 GLU 46 2HB GLU 46 14.440 12.615 4.317 355 HG2 GLU 46 1HG GLU 46 15.677 10.579 4.743 356 HG3 GLU 46 2HG GLU 46 16.577 10.745 3.239 357 H LYS 47 H LYS 47 14.439 9.041 1.680 358 HA LYS 47 HA LYS 47 16.256 9.666 -0.460 359 HB2 LYS 47 1HB LYS 47 14.549 7.153 0.030 360 HB3 LYS 47 2HB LYS 47 15.956 7.260 -1.026 361 HG2 LYS 47 1HG LYS 47 17.405 7.730 0.907 362 HG3 LYS 47 2HG LYS 47 15.990 7.595 1.976 363 HD2 LYS 47 1HD LYS 47 15.600 5.283 0.899 364 HD3 LYS 47 2HD LYS 47 17.224 5.432 0.227 365 HE2 LYS 47 1HE LYS 47 16.421 5.408 3.168 366 HE3 LYS 47 2HE LYS 47 17.184 4.111 2.243 367 HZ1 LYS 47 3HZ LYS 47 18.396 6.700 2.956 368 HZ2 LYS 47 1HZ LYS 47 19.110 5.636 1.946 369 HZ3 LYS 47 2HZ LYS 47 18.836 5.211 3.512 370 H GLN 48 H GLN 48 15.829 8.649 -2.619 371 HA GLN 48 HA GLN 48 13.302 9.665 -3.818 372 HB2 GLN 48 1HB GLN 48 16.131 9.406 -4.928 373 HB3 GLN 48 2HB GLN 48 14.742 9.872 -5.891 374 HG2 GLN 48 1HG GLN 48 15.318 11.493 -3.390 375 HG3 GLN 48 2HG GLN 48 16.388 11.679 -4.748 376 HE21 GLN 48 1HE2 GLN 48 12.876 11.755 -3.816 377 HE22 GLN 48 2HE2 GLN 48 12.425 12.845 -5.110 378 H SER 49 H SER 49 12.402 8.335 -5.417 379 HA SER 49 HA SER 49 12.995 5.448 -5.039 380 HB2 SER 49 1HB SER 49 10.201 6.599 -5.248 381 HB3 SER 49 2HB SER 49 10.753 5.086 -4.517 382 HG SER 49 HG SER 49 10.954 7.789 -3.634 383 H ILE 50 H ILE 50 14.166 5.438 -7.069 384 HA ILE 50 HA ILE 50 12.870 6.711 -9.396 385 HB ILE 50 HB ILE 50 15.056 6.608 -10.434 386 HG12 ILE 50 1HG1 ILE 50 16.167 5.476 -7.820 387 HG13 ILE 50 2HG1 ILE 50 15.919 4.524 -9.283 388 HG21 ILE 50 1HG2 ILE 50 16.095 8.323 -9.094 389 HG22 ILE 50 2HG2 ILE 50 14.345 8.521 -8.980 390 HG23 ILE 50 3HG2 ILE 50 15.249 7.793 -7.627 391 HD11 ILE 50 3HD1 ILE 50 17.458 6.134 -10.505 392 HD12 ILE 50 1HD1 ILE 50 17.864 6.824 -8.917 393 HD13 ILE 50 2HD1 ILE 50 18.211 5.122 -9.266 394 H GLN 51 H GLN 51 11.665 4.416 -8.481 395 HA GLN 51 HA GLN 51 12.222 2.333 -10.522 396 HB2 GLN 51 1HB GLN 51 11.223 0.826 -8.638 397 HB3 GLN 51 2HB GLN 51 12.902 1.295 -8.550 398 HG2 GLN 51 1HG GLN 51 12.434 3.027 -6.907 399 HG3 GLN 51 2HG GLN 51 10.691 2.825 -7.091 400 HE21 GLN 51 1HE2 GLN 51 10.446 -0.008 -6.923 401 HE22 GLN 51 2HE2 GLN 51 10.849 -0.404 -5.254 402 H ASP 52 H ASP 52 10.436 1.083 -11.023 403 HA ASP 52 HA ASP 52 7.766 2.413 -10.762 404 HB2 ASP 52 1HB ASP 52 9.365 1.681 -13.120 405 HB3 ASP 52 2HB ASP 52 7.782 0.963 -13.162 406 H TYR 53 H TYR 53 9.369 -0.268 -9.738 407 HA TYR 53 HA TYR 53 6.943 -1.750 -9.258 408 HB2 TYR 53 1HB TYR 53 9.159 -2.796 -11.067 409 HB3 TYR 53 2HB TYR 53 8.194 -3.903 -10.124 410 HD1 TYR 53 2HD TYR 53 5.616 -3.835 -10.345 411 HD2 TYR 53 1HD TYR 53 8.303 -1.963 -13.157 412 HE1 TYR 53 2HE TYR 53 3.790 -3.705 -11.977 413 HE2 TYR 53 1HE TYR 53 6.477 -1.798 -14.802 414 HH TYR 53 HH TYR 53 3.109 -2.657 -13.966 415 HA PRO 54 HA PRO 54 9.455 -2.712 -5.653 416 HB2 PRO 54 1HB PRO 54 8.615 -5.200 -4.884 417 HB3 PRO 54 2HB PRO 54 7.602 -3.727 -4.747 418 HG2 PRO 54 1HG PRO 54 7.589 -5.804 -6.944 419 HG3 PRO 54 2HG PRO 54 6.194 -5.144 -6.018 420 HD2 PRO 54 1HD PRO 54 6.893 -4.210 -8.468 421 HD3 PRO 54 2HD PRO 54 6.281 -3.113 -7.209 422 H SER 55 H SER 55 10.864 -4.536 -4.693 423 HA SER 55 HA SER 55 12.714 -5.517 -6.786 424 HB2 SER 55 1HB SER 55 13.175 -3.991 -4.597 425 HB3 SER 55 2HB SER 55 13.365 -5.587 -3.859 426 HG SER 55 HG SER 55 14.732 -4.484 -6.114 427 H ALA 56 H ALA 56 10.056 -6.785 -5.484 428 HA ALA 56 HA ALA 56 11.239 -9.369 -4.541 429 HB1 ALA 56 1HB ALA 56 9.707 -8.347 -2.985 430 HB2 ALA 56 2HB ALA 56 8.433 -8.230 -4.227 431 HB3 ALA 56 3HB ALA 56 8.978 -9.813 -3.631 432 H GLU 57 H GLU 57 10.394 -11.334 -5.239 433 HA GLU 57 HA GLU 57 9.339 -11.505 -7.991 434 HB2 GLU 57 1HB GLU 57 10.738 -13.253 -6.001 435 HB3 GLU 57 2HB GLU 57 9.545 -14.080 -6.992 436 HG2 GLU 57 1HG GLU 57 11.687 -12.309 -8.217 437 HG3 GLU 57 2HG GLU 57 11.990 -13.998 -7.818 438 H GLU 58 H GLU 58 8.130 -11.624 -4.626 439 HA GLU 58 HA GLU 58 5.498 -12.312 -5.692 440 HB2 GLU 58 1HB GLU 58 5.046 -13.914 -4.042 441 HB3 GLU 58 2HB GLU 58 6.572 -14.338 -4.821 442 HG2 GLU 58 1HG GLU 58 7.731 -13.255 -2.783 443 HG3 GLU 58 2HG GLU 58 6.142 -13.308 -2.004 444 H TYR 59 H TYR 59 4.238 -10.679 -5.295 445 HA TYR 59 HA TYR 59 4.283 -9.204 -2.792 446 HB2 TYR 59 1HB TYR 59 4.219 -7.045 -4.062 447 HB3 TYR 59 2HB TYR 59 5.753 -7.862 -4.116 448 HD1 TYR 59 1HD TYR 59 2.634 -7.342 -6.169 449 HD2 TYR 59 2HD TYR 59 6.845 -8.295 -6.168 450 HE1 TYR 59 1HE TYR 59 2.696 -7.052 -8.612 451 HE2 TYR 59 2HE TYR 59 6.935 -7.934 -8.595 452 HH TYR 59 HH TYR 59 5.761 -7.042 -10.451 453 H GLY 60 H GLY 60 2.087 -8.055 -2.651 454 HA2 GLY 60 1HA GLY 60 0.002 -9.348 -4.343 455 HA3 GLY 60 2HA GLY 60 -0.256 -8.504 -2.828 456 H THR 61 H THR 61 -1.673 -7.813 -5.145 457 HA THR 61 HA THR 61 -0.473 -5.239 -6.085 458 HB THR 61 HB THR 61 -2.289 -7.204 -7.545 459 HG1 THR 61 1HG THR 61 -0.139 -7.879 -7.495 460 HG21 THR 61 3HG2 THR 61 -1.182 -4.481 -8.368 461 HG22 THR 61 1HG2 THR 61 -2.884 -4.963 -8.231 462 HG23 THR 61 2HG2 THR 61 -1.880 -5.658 -9.502 463 H ILE 62 H ILE 62 -1.573 -3.460 -5.528 464 HA ILE 62 HA ILE 62 -4.300 -3.773 -4.392 465 HB ILE 62 HB ILE 62 -2.074 -1.902 -3.536 466 HG12 ILE 62 1HG1 ILE 62 -2.487 -3.323 -1.317 467 HG13 ILE 62 2HG1 ILE 62 -2.969 -4.573 -2.424 468 HG21 ILE 62 1HG2 ILE 62 -3.669 -1.481 -1.609 469 HG22 ILE 62 2HG2 ILE 62 -4.164 -0.821 -3.174 470 HG23 ILE 62 3HG2 ILE 62 -4.914 -2.305 -2.549 471 HD11 ILE 62 3HD1 ILE 62 -0.540 -4.643 -1.761 472 HD12 ILE 62 1HD1 ILE 62 -0.724 -4.493 -3.502 473 HD13 ILE 62 2HD1 ILE 62 -0.305 -3.064 -2.556 474 H ASN 63 H ASN 63 -5.796 -2.449 -5.265 475 HA ASN 63 HA ASN 63 -4.921 -0.145 -6.973 476 HB2 ASN 63 1HB ASN 63 -7.317 -1.986 -7.388 477 HB3 ASN 63 2HB ASN 63 -6.943 -0.547 -8.331 478 HD21 ASN 63 1HD2 ASN 63 -6.972 -3.699 -8.708 479 HD22 ASN 63 2HD2 ASN 63 -5.585 -3.945 -9.729 480 H ILE 64 H ILE 64 -5.515 1.715 -5.819 481 HA ILE 64 HA ILE 64 -7.856 1.524 -4.004 482 HB ILE 64 HB ILE 64 -5.941 3.854 -4.426 483 HG12 ILE 64 1HG1 ILE 64 -5.952 1.882 -2.113 484 HG13 ILE 64 2HG1 ILE 64 -4.780 1.848 -3.429 485 HG21 ILE 64 1HG2 ILE 64 -7.006 4.794 -2.431 486 HG22 ILE 64 2HG2 ILE 64 -8.286 4.373 -3.577 487 HG23 ILE 64 3HG2 ILE 64 -7.977 3.330 -2.204 488 HD11 ILE 64 3HD1 ILE 64 -5.101 4.162 -1.474 489 HD12 ILE 64 1HD1 ILE 64 -3.807 2.964 -1.506 490 HD13 ILE 64 2HD1 ILE 64 -3.980 4.106 -2.847 491 H GLU 65 H GLU 65 -9.544 1.376 -5.606 492 HA GLU 65 HA GLU 65 -9.667 3.202 -7.861 493 HB2 GLU 65 1HB GLU 65 -10.703 0.938 -7.874 494 HB3 GLU 65 2HB GLU 65 -11.856 1.486 -6.649 495 HG2 GLU 65 1HG GLU 65 -13.085 2.711 -8.114 496 HG3 GLU 65 2HG GLU 65 -11.676 3.257 -9.033 497 H ASN 66 H ASN 66 -10.071 5.310 -7.550 498 HA ASN 66 HA ASN 66 -12.087 6.196 -5.633 499 HB2 ASN 66 1HB ASN 66 -10.741 7.972 -4.695 500 HB3 ASN 66 2HB ASN 66 -10.027 6.440 -4.286 501 HD21 ASN 66 1HD2 ASN 66 -8.009 5.795 -5.572 502 HD22 ASN 66 2HD2 ASN 66 -6.994 7.080 -6.171 503 H ASN 67 H ASN 67 -13.219 7.866 -6.434 504 HA ASN 67 HA ASN 67 -14.180 9.201 -7.941 505 HB2 ASN 67 1HB ASN 67 -11.360 10.027 -8.715 506 HB3 ASN 67 2HB ASN 67 -12.835 10.941 -8.976 507 HD21 ASN 67 1HD2 ASN 67 -10.488 9.901 -6.517 508 HD22 ASN 67 2HD2 ASN 67 -11.097 10.985 -5.267 509 H GLY 68 H GLY 68 -12.581 6.589 -9.207 510 HA2 GLY 68 1HA GLY 68 -13.411 5.574 -11.203 511 HA3 GLY 68 2HA GLY 68 -13.578 7.149 -11.966 512 H GLY 69 H GLY 69 -10.683 6.792 -10.061 513 HA2 GLY 69 1HA GLY 69 -9.069 5.669 -12.258 514 HA3 GLY 69 2HA GLY 69 -8.523 7.149 -11.426 515 H MET 70 H MET 70 -6.688 5.358 -10.942 516 HA MET 70 HA MET 70 -7.250 4.576 -8.230 517 HB2 MET 70 1HB MET 70 -6.470 2.238 -8.474 518 HB3 MET 70 2HB MET 70 -8.023 2.531 -9.240 519 HG2 MET 70 1HG MET 70 -5.546 2.710 -10.953 520 HG3 MET 70 2HG MET 70 -6.080 1.149 -10.381 521 HE1 MET 70 3HE MET 70 -6.007 2.958 -13.506 522 HE2 MET 70 1HE MET 70 -7.677 3.306 -14.010 523 HE3 MET 70 2HE MET 70 -6.937 4.246 -12.708 524 H THR 71 H THR 71 -5.607 4.465 -6.945 525 HA THR 71 HA THR 71 -2.842 5.034 -7.877 526 HB THR 71 HB THR 71 -3.962 4.532 -5.080 527 HG1 THR 71 1HG THR 71 -4.446 6.600 -6.273 528 HG21 THR 71 3HG2 THR 71 -1.206 5.481 -5.975 529 HG22 THR 71 1HG2 THR 71 -1.580 3.921 -5.205 530 HG23 THR 71 2HG2 THR 71 -1.789 5.428 -4.297 531 H THR 72 H THR 72 -2.115 3.201 -8.945 532 HA THR 72 HA THR 72 -2.527 0.491 -7.942 533 HB THR 72 HB THR 72 -0.496 1.687 -9.878 534 HG1 THR 72 1HG THR 72 -2.720 0.367 -10.884 535 HG21 THR 72 3HG2 THR 72 0.152 -0.551 -9.208 536 HG22 THR 72 1HG2 THR 72 -0.448 -0.594 -10.864 537 HG23 THR 72 2HG2 THR 72 -1.475 -1.178 -9.526 538 H MET 73 H MET 73 -1.004 -0.576 -6.560 539 HA MET 73 HA MET 73 1.667 0.414 -6.164 540 HB2 MET 73 1HB MET 73 1.467 0.622 -3.696 541 HB3 MET 73 2HB MET 73 0.717 1.900 -4.625 542 HG2 MET 73 1HG MET 73 -1.514 0.616 -4.291 543 HG3 MET 73 2HG MET 73 -0.629 -0.339 -3.121 544 HE1 MET 73 3HE MET 73 1.213 2.310 -1.948 545 HE2 MET 73 1HE MET 73 0.455 3.500 -3.039 546 HE3 MET 73 2HE MET 73 0.181 3.600 -1.289 547 H PHE 74 H PHE 74 2.790 -1.160 -4.638 548 HA PHE 74 HA PHE 74 1.549 -3.857 -4.435 549 HB2 PHE 74 1HB PHE 74 4.348 -3.368 -5.524 550 HB3 PHE 74 2HB PHE 74 3.468 -4.882 -5.461 551 HD1 PHE 74 1HD PHE 74 1.620 -5.329 -7.105 552 HD2 PHE 74 2HD PHE 74 4.058 -1.787 -7.338 553 HE1 PHE 74 1HE PHE 74 0.893 -4.976 -9.446 554 HE2 PHE 74 2HE PHE 74 3.289 -1.400 -9.657 555 HZ PHE 74 HZ PHE 74 1.692 -2.994 -10.716 556 H TYR 75 H TYR 75 2.548 -5.096 -2.606 557 HA TYR 75 HA TYR 75 4.570 -3.569 -1.044 558 HB2 TYR 75 1HB TYR 75 2.447 -5.155 0.349 559 HB3 TYR 75 2HB TYR 75 3.478 -3.934 1.023 560 HD1 TYR 75 1HD TYR 75 2.847 -1.654 -0.983 561 HD2 TYR 75 2HD TYR 75 0.335 -4.473 1.075 562 HE1 TYR 75 1HE TYR 75 0.947 -0.151 -1.311 563 HE2 TYR 75 2HE TYR 75 -1.582 -2.954 0.772 564 HH TYR 75 HH TYR 75 -1.284 0.109 -1.079 565 H TYR 76 H TYR 76 6.078 -4.911 0.097 566 HA TYR 76 HA TYR 76 5.875 -7.822 -0.101 567 HB2 TYR 76 1HB TYR 76 7.905 -8.174 -1.272 568 HB3 TYR 76 2HB TYR 76 6.846 -7.256 -2.278 569 HD1 TYR 76 2HD TYR 76 7.276 -4.726 -2.485 570 HD2 TYR 76 1HD TYR 76 10.042 -7.481 -0.729 571 HE1 TYR 76 2HE TYR 76 9.129 -3.016 -2.702 572 HE2 TYR 76 1HE TYR 76 11.888 -5.925 -1.073 573 HH TYR 76 HH TYR 76 12.487 -3.768 -1.500 574 H GLU 77 H GLU 77 8.294 -8.635 0.822 575 HA GLU 77 HA GLU 77 8.829 -7.082 3.310 576 HB2 GLU 77 1HB GLU 77 7.572 -9.267 3.588 577 HB3 GLU 77 2HB GLU 77 8.997 -10.095 2.942 578 HG2 GLU 77 1HG GLU 77 10.318 -8.949 4.835 579 HG3 GLU 77 2HG GLU 77 8.784 -8.457 5.508 580 H GLU 78 H GLU 78 11.027 -6.720 3.805 581 HA GLU 78 HA GLU 78 13.093 -8.026 2.150 582 HB2 GLU 78 1HB GLU 78 12.216 -5.884 1.067 583 HB3 GLU 78 2HB GLU 78 12.988 -5.011 2.352 584 HG2 GLU 78 1HG GLU 78 15.120 -5.400 1.628 585 HG3 GLU 78 2HG GLU 78 14.683 -6.926 0.871 586 H ASN 79 H ASN 79 13.700 -9.112 3.996 587 HA ASN 79 HA ASN 79 14.902 -9.617 5.773 588 HB2 ASN 79 1HB ASN 79 15.983 -6.858 5.383 589 HB3 ASN 79 2HB ASN 79 16.194 -7.571 6.964 590 HD21 ASN 79 1HD2 ASN 79 16.351 -8.907 3.592 591 HD22 ASN 79 2HD2 ASN 79 18.003 -9.467 3.791 592 H GLY 80 H GLY 80 12.078 -8.442 5.787 593 HA2 GLY 80 1HA GLY 80 10.564 -9.150 7.438 594 HA3 GLY 80 2HA GLY 80 11.797 -8.991 8.676 595 H LYS 81 H LYS 81 12.042 -6.310 6.878 596 HA LYS 81 HA LYS 81 9.919 -4.704 8.218 597 HB2 LYS 81 1HB LYS 81 12.519 -4.069 6.780 598 HB3 LYS 81 2HB LYS 81 11.154 -2.991 6.572 599 HG2 LYS 81 1HG LYS 81 12.600 -2.254 8.434 600 HG3 LYS 81 2HG LYS 81 10.975 -2.657 9.012 601 HD2 LYS 81 1HD LYS 81 11.777 -4.844 9.838 602 HD3 LYS 81 2HD LYS 81 13.378 -4.512 9.149 603 HE2 LYS 81 1HE LYS 81 13.391 -2.437 10.694 604 HE3 LYS 81 2HE LYS 81 11.965 -3.137 11.471 605 HZ1 LYS 81 3HZ LYS 81 13.938 -3.776 12.607 606 HZ2 LYS 81 1HZ LYS 81 14.626 -4.390 11.227 607 HZ3 LYS 81 2HZ LYS 81 13.319 -5.140 11.887 608 H TYR 82 H TYR 82 8.275 -3.920 6.869 609 HA TYR 82 HA TYR 82 8.070 -5.330 4.253 610 HB2 TYR 82 1HB TYR 82 5.967 -4.120 6.049 611 HB3 TYR 82 2HB TYR 82 5.647 -4.843 4.508 612 HD1 TYR 82 2HD TYR 82 6.704 -5.400 8.002 613 HD2 TYR 82 1HD TYR 82 5.828 -7.357 4.256 614 HE1 TYR 82 2HE TYR 82 6.703 -7.574 9.162 615 HE2 TYR 82 1HE TYR 82 5.885 -9.547 5.385 616 HH TYR 82 HH TYR 82 6.658 -10.594 7.297 617 H TYR 83 H TYR 83 7.456 -4.110 2.391 618 HA TYR 83 HA TYR 83 8.055 -1.210 2.598 619 HB2 TYR 83 1HB TYR 83 9.373 -3.178 0.715 620 HB3 TYR 83 2HB TYR 83 9.449 -1.429 0.540 621 HD1 TYR 83 2HD TYR 83 10.369 -4.273 2.747 622 HD2 TYR 83 1HD TYR 83 10.948 -0.076 1.931 623 HE1 TYR 83 2HE TYR 83 12.238 -4.248 4.291 624 HE2 TYR 83 1HE TYR 83 12.899 -0.054 3.474 625 HH TYR 83 HH TYR 83 13.931 -3.029 5.191 626 H ILE 84 H ILE 84 6.911 0.040 1.388 627 HA ILE 84 HA ILE 84 4.813 -1.149 -0.348 628 HB ILE 84 HB ILE 84 4.924 1.372 1.344 629 HG12 ILE 84 1HG1 ILE 84 2.652 0.390 2.121 630 HG13 ILE 84 2HG1 ILE 84 3.175 -1.113 1.372 631 HG21 ILE 84 1HG2 ILE 84 2.631 1.915 0.462 632 HG22 ILE 84 2HG2 ILE 84 3.951 2.168 -0.674 633 HG23 ILE 84 3HG2 ILE 84 2.935 0.737 -0.835 634 HD11 ILE 84 3HD1 ILE 84 5.023 -1.315 2.925 635 HD12 ILE 84 1HD1 ILE 84 4.685 0.311 3.581 636 HD13 ILE 84 2HD1 ILE 84 3.523 -1.021 3.785 637 H GLU 85 H GLU 85 4.905 -0.790 -2.479 638 HA GLU 85 HA GLU 85 6.919 0.920 -3.657 639 HB2 GLU 85 1HB GLU 85 6.175 -1.338 -4.528 640 HB3 GLU 85 2HB GLU 85 4.588 -0.653 -4.860 641 HG2 GLU 85 1HG GLU 85 7.125 0.338 -6.153 642 HG3 GLU 85 2HG GLU 85 6.182 -0.985 -6.814 643 H CYS 86 H CYS 86 6.492 2.611 -5.033 644 HA CYS 86 HA CYS 86 4.042 3.807 -5.661 645 HB2 CYS 86 1HB CYS 86 5.340 4.618 -3.112 646 HB3 CYS 86 2HB CYS 86 5.055 5.978 -4.194 647 HG CYS 86 HG CYS 86 2.959 3.587 -3.381 648 HA PRO 87 HA PRO 87 7.119 6.015 -8.395 649 HB2 PRO 87 1HB PRO 87 6.215 8.551 -8.586 650 HB3 PRO 87 2HB PRO 87 5.296 7.189 -9.287 651 HG2 PRO 87 1HG PRO 87 4.901 8.452 -6.539 652 HG3 PRO 87 2HG PRO 87 3.671 8.228 -7.827 653 HD2 PRO 87 1HD PRO 87 3.903 6.415 -5.880 654 HD3 PRO 87 2HD PRO 87 3.673 5.907 -7.552 655 H TYR 88 H TYR 88 8.224 8.481 -8.048 656 HA TYR 88 HA TYR 88 10.331 8.370 -6.625 657 HB2 TYR 88 1HB TYR 88 8.630 10.889 -6.742 658 HB3 TYR 88 2HB TYR 88 10.316 10.872 -6.291 659 HD1 TYR 88 1HD TYR 88 12.129 10.208 -7.834 660 HD2 TYR 88 2HD TYR 88 8.061 10.792 -9.177 661 HE1 TYR 88 1HE TYR 88 12.914 10.305 -10.159 662 HE2 TYR 88 2HE TYR 88 8.860 10.902 -11.520 663 HH TYR 88 HH TYR 88 10.931 9.984 -12.838 664 H LYS 89 H LYS 89 7.356 8.498 -4.921 665 HA LYS 89 HA LYS 89 8.810 8.791 -2.380 666 HB2 LYS 89 1HB LYS 89 6.056 9.796 -3.230 667 HB3 LYS 89 2HB LYS 89 6.364 9.436 -1.557 668 HG2 LYS 89 1HG LYS 89 6.675 11.763 -1.895 669 HG3 LYS 89 2HG LYS 89 8.243 11.029 -1.503 670 HD2 LYS 89 1HD LYS 89 8.335 12.894 -3.111 671 HD3 LYS 89 2HD LYS 89 9.058 11.416 -3.681 672 HE2 LYS 89 1HE LYS 89 7.800 12.311 -5.493 673 HE3 LYS 89 2HE LYS 89 6.934 10.884 -4.895 674 HZ1 LYS 89 3HZ LYS 89 5.542 12.870 -5.370 675 HZ2 LYS 89 1HZ LYS 89 6.299 13.681 -4.144 676 HZ3 LYS 89 2HZ LYS 89 5.346 12.369 -3.840 677 H GLY 90 H GLY 90 8.986 6.371 -3.444 678 HA2 GLY 90 1HA GLY 90 6.996 4.735 -1.952 679 HA3 GLY 90 2HA GLY 90 7.674 4.333 -3.535 680 H ILE 91 H ILE 91 9.165 5.386 -0.382 681 HA ILE 91 HA ILE 91 10.357 2.662 -0.189 682 HB ILE 91 HB ILE 91 11.930 5.189 0.422 683 HG12 ILE 91 1HG1 ILE 91 11.854 3.464 -2.065 684 HG13 ILE 91 2HG1 ILE 91 11.613 5.210 -1.883 685 HG21 ILE 91 1HG2 ILE 91 13.812 3.745 0.707 686 HG22 ILE 91 2HG2 ILE 91 12.519 3.063 1.689 687 HG23 ILE 91 3HG2 ILE 91 12.904 2.320 0.129 688 HD11 ILE 91 3HD1 ILE 91 14.011 5.500 -1.410 689 HD12 ILE 91 1HD1 ILE 91 14.277 3.746 -1.579 690 HD13 ILE 91 2HD1 ILE 91 13.745 4.690 -2.965 691 H TYR 92 H TYR 92 8.152 2.763 1.032 692 HA TYR 92 HA TYR 92 8.453 4.041 3.687 693 HB2 TYR 92 1HB TYR 92 6.112 2.325 2.852 694 HB3 TYR 92 2HB TYR 92 6.232 3.396 4.194 695 HD1 TYR 92 2HD TYR 92 6.016 3.345 0.407 696 HD2 TYR 92 1HD TYR 92 5.651 5.658 4.055 697 HE1 TYR 92 2HE TYR 92 5.069 5.211 -0.857 698 HE2 TYR 92 1HE TYR 92 4.748 7.537 2.771 699 HH TYR 92 HH TYR 92 4.328 7.482 -0.760 700 H GLU 93 H GLU 93 9.982 2.939 4.754 701 HA GLU 93 HA GLU 93 10.111 0.022 4.933 702 HB2 GLU 93 1HB GLU 93 12.076 1.572 4.936 703 HB3 GLU 93 2HB GLU 93 11.405 2.415 6.319 704 HG2 GLU 93 1HG GLU 93 11.646 -0.193 7.292 705 HG3 GLU 93 2HG GLU 93 13.000 -0.080 6.170 706 H ILE 94 H ILE 94 7.908 -0.488 5.819 707 HA ILE 94 HA ILE 94 7.305 0.695 8.475 708 HB ILE 94 HB ILE 94 5.217 -0.396 8.476 709 HG12 ILE 94 1HG1 ILE 94 5.958 -1.690 5.852 710 HG13 ILE 94 2HG1 ILE 94 5.782 -2.502 7.389 711 HG21 ILE 94 1HG2 ILE 94 5.589 0.879 5.745 712 HG22 ILE 94 2HG2 ILE 94 4.146 0.904 6.805 713 HG23 ILE 94 3HG2 ILE 94 5.603 1.766 7.291 714 HD11 ILE 94 3HD1 ILE 94 3.406 -1.936 7.536 715 HD12 ILE 94 1HD1 ILE 94 3.483 -1.086 5.985 716 HD13 ILE 94 2HD1 ILE 94 3.764 -2.832 6.047 717 H GLU 95 H GLU 95 6.887 -0.779 10.296 718 HA GLU 95 HA GLU 95 8.792 -3.049 10.198 719 HB2 GLU 95 1HB GLU 95 9.260 -2.694 12.491 720 HB3 GLU 95 2HB GLU 95 9.400 -1.173 11.608 721 HG2 GLU 95 1HG GLU 95 7.168 -0.490 12.518 722 HG3 GLU 95 2HG GLU 95 7.143 -1.969 13.480 723 H ASN 96 H ASN 96 5.814 -2.854 9.713 724 HA ASN 96 HA ASN 96 5.074 -5.293 11.235 725 HB2 ASN 96 1HB ASN 96 3.015 -3.150 10.489 726 HB3 ASN 96 2HB ASN 96 2.833 -4.447 11.653 727 HD21 ASN 96 1HD2 ASN 96 3.974 -1.145 11.139 728 HD22 ASN 96 2HD2 ASN 96 4.469 -0.869 12.796 729 H ASN 97 H ASN 97 3.610 -6.762 10.333 730 HA ASN 97 HA ASN 97 3.799 -6.908 7.433 731 HB2 ASN 97 1HB ASN 97 3.955 -9.004 8.752 732 HB3 ASN 97 2HB ASN 97 2.349 -8.720 9.425 733 HD21 ASN 97 1HD2 ASN 97 3.885 -8.703 6.130 734 HD22 ASN 97 2HD2 ASN 97 2.554 -9.476 5.337 735 H PHE 98 H PHE 98 2.507 -5.619 6.245 736 HA PHE 98 HA PHE 98 0.164 -4.342 7.059 737 HB2 PHE 98 1HB PHE 98 1.571 -3.743 5.122 738 HB3 PHE 98 2HB PHE 98 1.073 -5.202 4.282 739 HD1 PHE 98 2HD PHE 98 -1.308 -5.461 3.502 740 HD2 PHE 98 1HD PHE 98 0.230 -1.734 5.033 741 HE1 PHE 98 2HE PHE 98 -3.188 -4.279 2.461 742 HE2 PHE 98 1HE PHE 98 -1.637 -0.519 3.942 743 HZ PHE 98 HZ PHE 98 -3.371 -1.798 2.674 744 H GLU 99 H GLU 99 0.511 -7.538 5.416 745 HA GLU 99 HA GLU 99 -2.281 -7.799 4.968 746 HB2 GLU 99 1HB GLU 99 0.177 -9.440 4.536 747 HB3 GLU 99 2HB GLU 99 -1.375 -10.284 4.468 748 HG2 GLU 99 1HG GLU 99 -2.293 -8.808 2.875 749 HG3 GLU 99 2HG GLU 99 -0.950 -7.662 3.013 750 H ASP 100 H ASP 100 -0.517 -8.492 7.834 751 HA ASP 100 HA ASP 100 -2.766 -10.063 8.965 752 HB2 ASP 100 1HB ASP 100 -0.418 -10.533 9.636 753 HB3 ASP 100 2HB ASP 100 -0.274 -8.894 10.276 754 H MET 101 H MET 101 -1.700 -6.760 8.598 755 HA MET 101 HA MET 101 -3.271 -5.740 10.873 756 HB2 MET 101 1HB MET 101 -1.074 -4.593 9.113 757 HB3 MET 101 2HB MET 101 -1.980 -3.610 10.265 758 HG2 MET 101 1HG MET 101 -0.565 -6.150 11.085 759 HG3 MET 101 2HG MET 101 0.205 -4.568 11.120 760 HE1 MET 101 3HE MET 101 -1.256 -7.111 13.267 761 HE2 MET 101 1HE MET 101 0.228 -6.240 13.688 762 HE3 MET 101 2HE MET 101 -1.188 -6.162 14.767 763 H ILE 102 H ILE 102 -4.088 -6.443 7.764 764 HA ILE 102 HA ILE 102 -5.924 -4.130 7.517 765 HB ILE 102 HB ILE 102 -6.789 -5.461 5.527 766 HG12 ILE 102 1HG1 ILE 102 -4.129 -6.911 5.584 767 HG13 ILE 102 2HG1 ILE 102 -5.508 -7.639 6.378 768 HG21 ILE 102 1HG2 ILE 102 -5.236 -3.492 5.406 769 HG22 ILE 102 2HG2 ILE 102 -3.861 -4.590 5.434 770 HG23 ILE 102 3HG2 ILE 102 -5.001 -4.643 4.074 771 HD11 ILE 102 3HD1 ILE 102 -5.088 -8.394 4.020 772 HD12 ILE 102 1HD1 ILE 102 -6.740 -7.854 4.369 773 HD13 ILE 102 2HD1 ILE 102 -5.633 -6.809 3.457 Start of MODEL 20 1 H1 GLY 1 H GLY 1 7.378 14.292 7.231 2 HA2 GLY 1 1HA GLY 1 5.996 12.376 7.928 3 HA3 GLY 1 2HA GLY 1 5.020 13.803 7.529 4 H SER 2 H SER 2 5.144 10.602 7.152 5 HA SER 2 HA SER 2 3.732 9.196 6.246 6 HB2 SER 2 1HB SER 2 2.005 11.567 5.637 7 HB3 SER 2 2HB SER 2 1.543 10.031 6.381 8 HG SER 2 HG SER 2 2.554 10.714 8.310 9 HA PRO 3 HA PRO 3 2.966 9.278 1.728 10 HB2 PRO 3 1HB PRO 3 0.582 7.848 1.590 11 HB3 PRO 3 2HB PRO 3 2.187 7.089 1.716 12 HG2 PRO 3 1HG PRO 3 0.207 7.634 3.916 13 HG3 PRO 3 2HG PRO 3 1.246 6.195 3.630 14 HD2 PRO 3 1HD PRO 3 1.849 8.084 5.472 15 HD3 PRO 3 2HD PRO 3 3.086 7.184 4.564 16 H ILE 4 H ILE 4 1.085 9.884 0.264 17 HA ILE 4 HA ILE 4 -0.724 11.918 1.437 18 HB ILE 4 HB ILE 4 0.737 11.995 -1.243 19 HG12 ILE 4 1HG1 ILE 4 1.139 13.560 1.343 20 HG13 ILE 4 2HG1 ILE 4 2.282 12.470 0.570 21 HG21 ILE 4 1HG2 ILE 4 -1.192 13.968 0.047 22 HG22 ILE 4 2HG2 ILE 4 -0.340 14.213 -1.497 23 HG23 ILE 4 3HG2 ILE 4 -1.542 12.943 -1.360 24 HD11 ILE 4 3HD1 ILE 4 3.034 14.677 0.132 25 HD12 ILE 4 1HD1 ILE 4 2.411 14.018 -1.390 26 HD13 ILE 4 2HD1 ILE 4 1.447 15.192 -0.453 27 H LEU 5 H LEU 5 -2.500 10.626 1.584 28 HA LEU 5 HA LEU 5 -3.272 8.839 -0.667 29 HB2 LEU 5 1HB LEU 5 -3.992 9.050 2.292 30 HB3 LEU 5 2HB LEU 5 -4.987 8.136 1.193 31 HG LEU 5 HG LEU 5 -2.209 7.382 0.743 32 HD11 LEU 5 1HD1 LEU 5 -1.911 8.140 3.094 33 HD12 LEU 5 2HD1 LEU 5 -1.604 6.417 2.874 34 HD13 LEU 5 3HD1 LEU 5 -3.124 6.950 3.620 35 HD21 LEU 5 3HD2 LEU 5 -4.344 6.103 0.220 36 HD22 LEU 5 1HD2 LEU 5 -4.435 5.702 1.947 37 HD23 LEU 5 2HD2 LEU 5 -3.046 5.186 0.951 38 HA PRO 6 HA PRO 6 -6.959 11.457 -1.356 39 HB2 PRO 6 1HB PRO 6 -8.900 9.546 -1.744 40 HB3 PRO 6 2HB PRO 6 -7.697 9.937 -2.982 41 HG2 PRO 6 1HG PRO 6 -7.626 7.695 -0.956 42 HG3 PRO 6 2HG PRO 6 -7.375 7.606 -2.735 43 HD2 PRO 6 1HD PRO 6 -5.291 7.724 -1.058 44 HD3 PRO 6 2HD PRO 6 -5.239 8.625 -2.578 45 H LYS 7 H LYS 7 -9.338 11.477 -0.359 46 HA LYS 7 HA LYS 7 -9.298 11.202 2.511 47 HB2 LYS 7 1HB LYS 7 -11.783 11.442 0.743 48 HB3 LYS 7 2HB LYS 7 -11.583 11.887 2.445 49 HG2 LYS 7 1HG LYS 7 -11.456 13.958 1.466 50 HG3 LYS 7 2HG LYS 7 -9.748 13.533 1.554 51 HD2 LYS 7 1HD LYS 7 -9.600 13.782 -0.724 52 HD3 LYS 7 2HD LYS 7 -10.736 12.416 -0.824 53 HE2 LYS 7 1HE LYS 7 -11.802 13.964 -2.077 54 HE3 LYS 7 2HE LYS 7 -12.615 13.990 -0.503 55 HZ1 LYS 7 3HZ LYS 7 -11.612 16.055 -0.036 56 HZ2 LYS 7 1HZ LYS 7 -12.078 16.159 -1.594 57 HZ3 LYS 7 2HZ LYS 7 -10.487 15.929 -1.276 58 H ALA 8 H ALA 8 -11.539 9.986 3.233 59 HA ALA 8 HA ALA 8 -11.323 7.140 2.342 60 HB1 ALA 8 1HB ALA 8 -12.549 6.584 4.255 61 HB2 ALA 8 2HB ALA 8 -11.440 7.830 4.868 62 HB3 ALA 8 3HB ALA 8 -13.134 8.219 4.552 63 H GLU 9 H GLU 9 -13.454 10.000 2.523 64 HA GLU 9 HA GLU 9 -15.834 8.585 1.984 65 HB2 GLU 9 1HB GLU 9 -16.876 10.765 2.071 66 HB3 GLU 9 2HB GLU 9 -15.625 10.652 3.299 67 HG2 GLU 9 1HG GLU 9 -14.048 11.832 1.612 68 HG3 GLU 9 2HG GLU 9 -15.477 12.091 0.623 69 H ASN 10 H ASN 10 -13.555 9.121 -0.122 70 HA ASN 10 HA ASN 10 -15.141 9.618 -2.587 71 HB2 ASN 10 1HB ASN 10 -13.326 10.931 -3.308 72 HB3 ASN 10 2HB ASN 10 -13.521 11.427 -1.646 73 HD21 ASN 10 1HD2 ASN 10 -12.091 8.719 -0.810 74 HD22 ASN 10 2HD2 ASN 10 -10.445 9.165 -0.949 75 H VAL 11 H VAL 11 -13.674 7.080 -0.971 76 HA VAL 11 HA VAL 11 -12.161 5.984 -3.263 77 HB VAL 11 HB VAL 11 -12.497 5.165 -0.342 78 HG11 VAL 11 1HG1 VAL 11 -12.461 3.101 -1.699 79 HG12 VAL 11 2HG1 VAL 11 -11.029 3.670 -2.574 80 HG13 VAL 11 3HG1 VAL 11 -10.940 3.312 -0.830 81 HG21 VAL 11 3HG2 VAL 11 -9.972 5.426 -0.406 82 HG22 VAL 11 1HG2 VAL 11 -10.152 6.178 -2.007 83 HG23 VAL 11 2HG2 VAL 11 -10.897 6.905 -0.576 84 H ASP 12 H ASP 12 -13.130 4.557 -4.563 85 HA ASP 12 HA ASP 12 -16.033 4.133 -4.324 86 HB2 ASP 12 1HB ASP 12 -15.064 4.854 -6.463 87 HB3 ASP 12 2HB ASP 12 -13.983 3.451 -6.449 88 H SER 13 H SER 13 -13.091 2.085 -4.860 89 HA SER 13 HA SER 13 -13.966 0.351 -2.704 90 HB2 SER 13 1HB SER 13 -13.169 -1.322 -5.002 91 HB3 SER 13 2HB SER 13 -14.415 -1.575 -3.799 92 HG SER 13 HG SER 13 -14.552 -0.212 -6.275 93 H ILE 14 H ILE 14 -12.096 -0.961 -1.877 94 HA ILE 14 HA ILE 14 -9.493 -0.364 -3.209 95 HB ILE 14 HB ILE 14 -10.040 -1.269 -0.358 96 HG12 ILE 14 1HG1 ILE 14 -8.930 1.308 -1.542 97 HG13 ILE 14 2HG1 ILE 14 -10.460 1.098 -0.707 98 HG21 ILE 14 1HG2 ILE 14 -7.320 -0.760 -1.642 99 HG22 ILE 14 2HG2 ILE 14 -7.633 -1.259 0.026 100 HG23 ILE 14 3HG2 ILE 14 -7.985 -2.367 -1.274 101 HD11 ILE 14 3HD1 ILE 14 -7.685 0.962 0.537 102 HD12 ILE 14 1HD1 ILE 14 -8.931 2.188 0.783 103 HD13 ILE 14 2HD1 ILE 14 -9.193 0.544 1.395 104 H CYS 15 H CYS 15 -8.338 -2.170 -3.883 105 HA CYS 15 HA CYS 15 -9.622 -4.840 -3.607 106 HB2 CYS 15 1HB CYS 15 -10.208 -3.927 -5.850 107 HB3 CYS 15 2HB CYS 15 -8.471 -3.739 -6.213 108 HG CYS 15 HG CYS 15 -9.702 -5.868 -7.347 109 H ILE 16 H ILE 16 -8.144 -6.333 -2.945 110 HA ILE 16 HA ILE 16 -5.259 -5.815 -3.388 111 HB ILE 16 HB ILE 16 -6.533 -6.929 -0.861 112 HG12 ILE 16 1HG1 ILE 16 -5.214 -4.279 -1.544 113 HG13 ILE 16 2HG1 ILE 16 -6.833 -4.543 -0.901 114 HG21 ILE 16 1HG2 ILE 16 -3.584 -6.475 -1.511 115 HG22 ILE 16 2HG2 ILE 16 -4.250 -7.099 0.007 116 HG23 ILE 16 3HG2 ILE 16 -4.387 -8.048 -1.463 117 HD11 ILE 16 3HD1 ILE 16 -5.762 -5.315 1.254 118 HD12 ILE 16 1HD1 ILE 16 -4.199 -4.790 0.557 119 HD13 ILE 16 2HD1 ILE 16 -5.490 -3.612 0.823 120 H ASP 17 H ASP 17 -4.773 -7.235 -4.904 121 HA ASP 17 HA ASP 17 -6.047 -9.909 -5.104 122 HB2 ASP 17 1HB ASP 17 -4.680 -8.055 -6.952 123 HB3 ASP 17 2HB ASP 17 -4.052 -9.680 -7.059 124 H PHE 18 H PHE 18 -5.144 -11.351 -3.697 125 HA PHE 18 HA PHE 18 -2.778 -10.744 -2.193 126 HB2 PHE 18 1HB PHE 18 -4.762 -13.040 -2.280 127 HB3 PHE 18 2HB PHE 18 -3.274 -13.241 -1.419 128 HD1 PHE 18 1HD PHE 18 -5.696 -10.351 -1.675 129 HD2 PHE 18 2HD PHE 18 -3.629 -13.129 0.895 130 HE1 PHE 18 1HE PHE 18 -6.573 -9.189 0.237 131 HE2 PHE 18 2HE PHE 18 -4.574 -11.984 2.873 132 HZ PHE 18 HZ PHE 18 -6.045 -9.997 2.589 133 H THR 19 H THR 19 -1.095 -12.529 -1.842 134 HA THR 19 HA THR 19 0.483 -12.891 -4.105 135 HB THR 19 HB THR 19 1.596 -14.581 -2.399 136 HG1 THR 19 1HG THR 19 0.783 -13.751 -0.204 137 HG21 THR 19 3HG2 THR 19 2.422 -12.302 -2.883 138 HG22 THR 19 1HG2 THR 19 2.580 -12.708 -1.169 139 HG23 THR 19 2HG2 THR 19 1.277 -11.632 -1.707 140 H ASN 20 H ASN 20 -2.092 -15.047 -2.792 141 HA ASN 20 HA ASN 20 -1.264 -17.266 -4.486 142 HB2 ASN 20 1HB ASN 20 -2.004 -17.574 -2.167 143 HB3 ASN 20 2HB ASN 20 -3.552 -16.739 -2.526 144 HD21 ASN 20 1HD2 ASN 20 -4.852 -18.604 -1.950 145 HD22 ASN 20 2HD2 ASN 20 -4.940 -19.840 -3.199 146 H SER 21 H SER 21 -4.064 -17.973 -5.129 147 HA SER 21 HA SER 21 -4.504 -16.197 -7.452 148 HB2 SER 21 1HB SER 21 -3.938 -18.574 -7.702 149 HB3 SER 21 2HB SER 21 -5.373 -19.041 -6.782 150 HG SER 21 HG SER 21 -6.558 -17.841 -8.443 151 H ILE 22 H ILE 22 -5.386 -15.181 -4.879 152 HA ILE 22 HA ILE 22 -8.306 -15.168 -5.159 153 HB ILE 22 HB ILE 22 -6.785 -15.321 -2.522 154 HG12 ILE 22 1HG1 ILE 22 -8.328 -17.401 -4.100 155 HG13 ILE 22 2HG1 ILE 22 -6.671 -17.475 -3.545 156 HG21 ILE 22 1HG2 ILE 22 -9.051 -15.579 -1.489 157 HG22 ILE 22 2HG2 ILE 22 -8.822 -14.034 -2.250 158 HG23 ILE 22 3HG2 ILE 22 -9.779 -15.288 -3.085 159 HD11 ILE 22 3HD1 ILE 22 -9.151 -17.812 -1.831 160 HD12 ILE 22 1HD1 ILE 22 -7.906 -19.000 -2.208 161 HD13 ILE 22 2HD1 ILE 22 -7.508 -17.617 -1.162 162 H GLN 23 H GLN 23 -9.169 -13.048 -4.491 163 HA GLN 23 HA GLN 23 -7.293 -10.989 -3.761 164 HB2 GLN 23 1HB GLN 23 -8.238 -9.694 -5.352 165 HB3 GLN 23 2HB GLN 23 -8.162 -11.189 -6.252 166 HG2 GLN 23 1HG GLN 23 -10.628 -11.491 -5.484 167 HG3 GLN 23 2HG GLN 23 -10.514 -9.799 -4.965 168 HE21 GLN 23 1HE2 GLN 23 -8.743 -9.127 -7.514 169 HE22 GLN 23 2HE2 GLN 23 -10.085 -8.807 -8.578 170 H LYS 24 H LYS 24 -8.522 -9.228 -2.640 171 HA LYS 24 HA LYS 24 -11.127 -9.973 -1.442 172 HB2 LYS 24 1HB LYS 24 -8.696 -10.026 -0.030 173 HB3 LYS 24 2HB LYS 24 -9.307 -8.419 0.321 174 HG2 LYS 24 1HG LYS 24 -10.641 -11.090 0.831 175 HG3 LYS 24 2HG LYS 24 -9.921 -10.023 2.015 176 HD2 LYS 24 1HD LYS 24 -12.432 -9.396 0.420 177 HD3 LYS 24 2HD LYS 24 -12.376 -10.036 2.062 178 HE2 LYS 24 1HE LYS 24 -11.198 -7.967 2.837 179 HE3 LYS 24 2HE LYS 24 -11.302 -7.307 1.204 180 HZ1 LYS 24 3HZ LYS 24 -13.616 -7.205 1.392 181 HZ2 LYS 24 1HZ LYS 24 -13.087 -6.642 2.814 182 HZ3 LYS 24 2HZ LYS 24 -13.681 -8.159 2.740 183 H ILE 25 H ILE 25 -12.532 -8.194 -1.516 184 HA ILE 25 HA ILE 25 -11.385 -5.589 -2.409 185 HB ILE 25 HB ILE 25 -14.140 -6.755 -2.954 186 HG12 ILE 25 1HG1 ILE 25 -13.110 -6.137 -5.398 187 HG13 ILE 25 2HG1 ILE 25 -11.608 -6.524 -4.582 188 HG21 ILE 25 1HG2 ILE 25 -14.232 -4.313 -2.574 189 HG22 ILE 25 2HG2 ILE 25 -12.943 -4.077 -3.785 190 HG23 ILE 25 3HG2 ILE 25 -14.516 -4.716 -4.258 191 HD11 ILE 25 3HD1 ILE 25 -12.511 -8.792 -4.062 192 HD12 ILE 25 1HD1 ILE 25 -14.067 -8.328 -4.793 193 HD13 ILE 25 2HD1 ILE 25 -12.610 -8.435 -5.796 194 H TYR 26 H TYR 26 -11.684 -3.964 -1.059 195 HA TYR 26 HA TYR 26 -13.294 -4.341 1.422 196 HB2 TYR 26 1HB TYR 26 -10.821 -2.611 1.081 197 HB3 TYR 26 2HB TYR 26 -11.770 -2.788 2.526 198 HD1 TYR 26 2HD TYR 26 -9.547 -4.486 0.119 199 HD2 TYR 26 1HD TYR 26 -11.202 -4.606 4.118 200 HE1 TYR 26 2HE TYR 26 -8.070 -6.381 0.658 201 HE2 TYR 26 1HE TYR 26 -9.711 -6.503 4.665 202 HH TYR 26 HH TYR 26 -7.124 -7.576 2.609 203 H ASP 27 H ASP 27 -15.109 -3.624 0.038 204 HA ASP 27 HA ASP 27 -14.986 -0.978 -1.231 205 HB2 ASP 27 1HB ASP 27 -17.233 -1.590 -2.034 206 HB3 ASP 27 2HB ASP 27 -16.042 -2.813 -2.425 207 H ASP 28 H ASP 28 -15.560 -2.083 1.910 208 HA ASP 28 HA ASP 28 -17.803 -0.266 2.486 209 HB2 ASP 28 1HB ASP 28 -16.676 -1.529 4.821 210 HB3 ASP 28 2HB ASP 28 -18.289 -1.589 4.167 211 H SER 29 H SER 29 -17.748 1.394 3.845 212 HA SER 29 HA SER 29 -15.756 3.115 4.296 213 HB2 SER 29 1HB SER 29 -18.398 2.721 5.207 214 HB3 SER 29 2HB SER 29 -17.478 2.830 6.691 215 HG SER 29 HG SER 29 -17.376 4.692 4.535 216 H GLU 30 H GLU 30 -16.644 0.682 6.777 217 HA GLU 30 HA GLU 30 -14.630 1.496 8.616 218 HB2 GLU 30 1HB GLU 30 -16.724 0.328 9.164 219 HB3 GLU 30 2HB GLU 30 -16.134 -1.141 8.366 220 HG2 GLU 30 1HG GLU 30 -14.413 -1.405 10.077 221 HG3 GLU 30 2HG GLU 30 -14.841 0.167 10.787 222 H SER 31 H SER 31 -14.593 -0.993 6.134 223 HA SER 31 HA SER 31 -12.133 -2.351 6.596 224 HB2 SER 31 1HB SER 31 -13.645 -1.860 4.028 225 HB3 SER 31 2HB SER 31 -12.604 -3.215 4.473 226 HG SER 31 HG SER 31 -15.033 -3.342 4.650 227 H ILE 32 H ILE 32 -13.038 0.388 4.434 228 HA ILE 32 HA ILE 32 -10.379 0.929 3.509 229 HB ILE 32 HB ILE 32 -12.909 2.623 3.629 230 HG12 ILE 32 1HG1 ILE 32 -11.593 1.395 1.184 231 HG13 ILE 32 2HG1 ILE 32 -12.763 0.498 2.122 232 HG21 ILE 32 1HG2 ILE 32 -11.082 4.197 3.549 233 HG22 ILE 32 2HG2 ILE 32 -10.236 3.259 2.311 234 HG23 ILE 32 3HG2 ILE 32 -11.747 4.111 1.932 235 HD11 ILE 32 3HD1 ILE 32 -14.478 2.237 1.729 236 HD12 ILE 32 1HD1 ILE 32 -13.335 3.146 0.731 237 HD13 ILE 32 2HD1 ILE 32 -13.855 1.532 0.218 238 H GLN 33 H GLN 33 -12.250 2.079 6.363 239 HA GLN 33 HA GLN 33 -10.479 4.101 7.139 240 HB2 GLN 33 1HB GLN 33 -12.946 3.000 7.983 241 HB3 GLN 33 2HB GLN 33 -11.895 2.845 9.371 242 HG2 GLN 33 1HG GLN 33 -11.872 5.489 7.886 243 HG3 GLN 33 2HG GLN 33 -13.330 5.060 8.712 244 HE21 GLN 33 1HE2 GLN 33 -10.057 6.168 9.072 245 HE22 GLN 33 2HE2 GLN 33 -10.076 6.334 10.793 246 H LYS 34 H LYS 34 -10.561 0.723 8.068 247 HA LYS 34 HA LYS 34 -8.314 0.735 9.836 248 HB2 LYS 34 1HB LYS 34 -9.985 -1.089 9.576 249 HB3 LYS 34 2HB LYS 34 -9.443 -1.360 7.941 250 HG2 LYS 34 1HG LYS 34 -7.097 -1.569 9.462 251 HG3 LYS 34 2HG LYS 34 -8.291 -2.275 10.521 252 HD2 LYS 34 1HD LYS 34 -7.942 -2.995 7.573 253 HD3 LYS 34 2HD LYS 34 -7.215 -3.897 8.909 254 HE2 LYS 34 1HE LYS 34 -9.269 -4.545 9.871 255 HE3 LYS 34 2HE LYS 34 -10.186 -3.348 8.965 256 HZ1 LYS 34 3HZ LYS 34 -10.621 -5.401 8.068 257 HZ2 LYS 34 1HZ LYS 34 -9.035 -5.851 7.915 258 HZ3 LYS 34 2HZ LYS 34 -9.642 -4.658 6.966 259 H ILE 35 H ILE 35 -8.391 -0.371 6.401 260 HA ILE 35 HA ILE 35 -5.698 -0.602 6.092 261 HB ILE 35 HB ILE 35 -7.887 0.133 4.081 262 HG12 ILE 35 1HG1 ILE 35 -6.410 -2.483 4.621 263 HG13 ILE 35 2HG1 ILE 35 -8.002 -2.088 5.245 264 HG21 ILE 35 1HG2 ILE 35 -5.074 -0.771 3.356 265 HG22 ILE 35 2HG2 ILE 35 -6.425 -0.504 2.227 266 HG23 ILE 35 3HG2 ILE 35 -5.742 0.864 3.076 267 HD11 ILE 35 3HD1 ILE 35 -7.297 -2.500 2.301 268 HD12 ILE 35 1HD1 ILE 35 -8.247 -3.535 3.351 269 HD13 ILE 35 2HD1 ILE 35 -8.875 -1.932 2.897 270 H LEU 36 H LEU 36 -7.522 2.471 5.434 271 HA LEU 36 HA LEU 36 -5.290 3.981 4.470 272 HB2 LEU 36 1HB LEU 36 -7.913 4.635 5.823 273 HB3 LEU 36 2HB LEU 36 -6.780 5.885 5.492 274 HG LEU 36 HG LEU 36 -8.763 4.904 3.762 275 HD11 LEU 36 1HD1 LEU 36 -8.042 7.166 3.788 276 HD12 LEU 36 2HD1 LEU 36 -7.798 6.553 2.153 277 HD13 LEU 36 3HD1 LEU 36 -6.395 6.701 3.248 278 HD21 LEU 36 3HD2 LEU 36 -7.420 3.022 2.970 279 HD22 LEU 36 1HD2 LEU 36 -6.124 4.144 2.475 280 HD23 LEU 36 2HD2 LEU 36 -7.717 4.214 1.708 281 H SER 37 H SER 37 -5.683 2.728 7.587 282 HA SER 37 HA SER 37 -3.839 4.635 8.863 283 HB2 SER 37 1HB SER 37 -6.005 3.379 9.878 284 HB3 SER 37 2HB SER 37 -4.791 2.153 10.260 285 HG SER 37 HG SER 37 -5.317 4.226 11.625 286 H GLU 38 H GLU 38 -3.969 0.925 8.412 287 HA GLU 38 HA GLU 38 -1.215 0.662 8.885 288 HB2 GLU 38 1HB GLU 38 -1.393 -1.503 7.600 289 HB3 GLU 38 2HB GLU 38 -2.434 -1.312 8.993 290 HG2 GLU 38 1HG GLU 38 -3.596 -0.743 6.332 291 HG3 GLU 38 2HG GLU 38 -3.162 -2.407 6.721 292 H ILE 39 H ILE 39 -2.735 1.810 6.028 293 HA ILE 39 HA ILE 39 -0.328 1.621 4.360 294 HB ILE 39 HB ILE 39 -3.081 2.890 4.073 295 HG12 ILE 39 1HG1 ILE 39 -3.104 0.462 3.927 296 HG13 ILE 39 2HG1 ILE 39 -3.448 1.157 2.369 297 HG21 ILE 39 1HG2 ILE 39 -0.917 2.852 1.983 298 HG22 ILE 39 2HG2 ILE 39 -2.655 3.134 1.694 299 HG23 ILE 39 3HG2 ILE 39 -1.739 4.256 2.709 300 HD11 ILE 39 3HD1 ILE 39 -0.805 -0.113 3.217 301 HD12 ILE 39 1HD1 ILE 39 -2.006 -0.731 2.082 302 HD13 ILE 39 2HD1 ILE 39 -1.062 0.705 1.667 303 H ALA 40 H ALA 40 -1.446 3.853 6.792 304 HA ALA 40 HA ALA 40 -0.004 6.132 5.587 305 HB1 ALA 40 1HB ALA 40 -1.778 5.947 8.042 306 HB2 ALA 40 2HB ALA 40 -1.026 7.427 7.427 307 HB3 ALA 40 3HB ALA 40 -2.238 6.571 6.441 308 H THR 41 H THR 41 0.399 3.724 7.990 309 HA THR 41 HA THR 41 1.876 5.118 9.899 310 HB THR 41 HB THR 41 0.767 2.990 10.254 311 HG1 THR 41 1HG THR 41 1.941 2.732 11.883 312 HG21 THR 41 3HG2 THR 41 1.589 1.900 8.169 313 HG22 THR 41 1HG2 THR 41 1.624 0.916 9.630 314 HG23 THR 41 2HG2 THR 41 3.134 1.629 8.999 315 H GLY 42 H GLY 42 3.043 3.674 6.860 316 HA2 GLY 42 1HA GLY 42 5.794 3.718 7.593 317 HA3 GLY 42 2HA GLY 42 5.090 3.512 5.972 318 H LYS 43 H LYS 43 7.480 4.863 6.608 319 HA LYS 43 HA LYS 43 6.853 7.636 5.800 320 HB2 LYS 43 1HB LYS 43 8.191 6.706 8.142 321 HB3 LYS 43 2HB LYS 43 9.471 7.287 7.063 322 HG2 LYS 43 1HG LYS 43 8.308 9.383 6.747 323 HG3 LYS 43 2HG LYS 43 6.953 8.817 7.741 324 HD2 LYS 43 1HD LYS 43 9.791 8.992 8.819 325 HD3 LYS 43 2HD LYS 43 8.703 10.381 8.880 326 HE2 LYS 43 1HE LYS 43 7.217 9.376 10.377 327 HE3 LYS 43 2HE LYS 43 7.726 7.742 9.969 328 HZ1 LYS 43 3HZ LYS 43 9.494 9.618 11.424 329 HZ2 LYS 43 1HZ LYS 43 9.731 8.030 11.141 330 HZ3 LYS 43 2HZ LYS 43 8.506 8.506 12.145 331 H ARG 44 H ARG 44 7.210 7.607 3.678 332 HA ARG 44 HA ARG 44 8.933 5.986 2.153 333 HB2 ARG 44 1HB ARG 44 8.665 7.820 0.402 334 HB3 ARG 44 2HB ARG 44 7.278 6.954 0.948 335 HG2 ARG 44 1HG ARG 44 6.537 9.129 0.960 336 HG3 ARG 44 2HG ARG 44 6.857 8.968 2.631 337 HD2 ARG 44 1HD ARG 44 8.861 10.208 2.468 338 HD3 ARG 44 2HD ARG 44 8.868 10.112 0.673 339 HE ARG 44 HE ARG 44 6.456 11.310 1.440 340 HH11 ARG 44 1HH1 ARG 44 9.895 12.058 1.331 341 HH12 ARG 44 2HH1 ARG 44 9.679 13.761 1.093 342 HH21 ARG 44 1HH2 ARG 44 6.078 13.492 1.390 343 HH22 ARG 44 2HH2 ARG 44 7.300 14.624 1.005 344 H THR 45 H THR 45 9.647 8.399 4.078 345 HA THR 45 HA THR 45 11.590 9.370 4.906 346 HB THR 45 HB THR 45 13.721 8.304 4.531 347 HG1 THR 45 1HG THR 45 12.559 7.197 2.248 348 HG21 THR 45 3HG2 THR 45 11.751 6.000 4.303 349 HG22 THR 45 1HG2 THR 45 11.833 7.002 5.770 350 HG23 THR 45 2HG2 THR 45 13.232 6.071 5.256 351 H GLU 46 H GLU 46 13.763 10.555 3.987 352 HA GLU 46 HA GLU 46 12.797 12.338 1.864 353 HB2 GLU 46 1HB GLU 46 15.196 12.358 3.703 354 HB3 GLU 46 2HB GLU 46 15.091 13.453 2.331 355 HG2 GLU 46 1HG GLU 46 12.572 13.536 3.793 356 HG3 GLU 46 2HG GLU 46 13.914 13.771 4.903 357 H LYS 47 H LYS 47 14.102 9.266 1.591 358 HA LYS 47 HA LYS 47 16.137 9.743 -0.378 359 HB2 LYS 47 1HB LYS 47 14.315 7.272 0.086 360 HB3 LYS 47 2HB LYS 47 15.627 7.414 -1.076 361 HG2 LYS 47 1HG LYS 47 17.190 7.879 0.824 362 HG3 LYS 47 2HG LYS 47 15.821 7.702 1.906 363 HD2 LYS 47 1HD LYS 47 15.392 5.404 0.901 364 HD3 LYS 47 2HD LYS 47 16.850 5.591 -0.049 365 HE2 LYS 47 1HE LYS 47 16.538 5.184 2.924 366 HE3 LYS 47 2HE LYS 47 17.363 4.209 1.712 367 HZ1 LYS 47 3HZ LYS 47 18.972 5.405 3.043 368 HZ2 LYS 47 1HZ LYS 47 18.227 6.842 2.771 369 HZ3 LYS 47 2HZ LYS 47 19.007 6.100 1.561 370 H GLN 48 H GLN 48 15.986 9.446 -2.498 371 HA GLN 48 HA GLN 48 13.451 10.267 -3.845 372 HB2 GLN 48 1HB GLN 48 16.154 9.654 -5.099 373 HB3 GLN 48 2HB GLN 48 14.719 10.239 -5.931 374 HG2 GLN 48 1HG GLN 48 14.816 12.324 -4.495 375 HG3 GLN 48 2HG GLN 48 16.355 11.750 -3.851 376 HE21 GLN 48 1HE2 GLN 48 18.174 11.667 -5.195 377 HE22 GLN 48 2HE2 GLN 48 18.240 12.282 -6.834 378 H SER 49 H SER 49 12.526 8.828 -5.440 379 HA SER 49 HA SER 49 13.137 5.950 -5.089 380 HB2 SER 49 1HB SER 49 10.294 6.927 -5.365 381 HB3 SER 49 2HB SER 49 10.947 5.503 -4.560 382 HG SER 49 HG SER 49 11.074 8.212 -3.690 383 H ILE 50 H ILE 50 13.678 5.169 -7.163 384 HA ILE 50 HA ILE 50 12.675 6.727 -9.509 385 HB ILE 50 HB ILE 50 14.884 6.665 -10.488 386 HG12 ILE 50 1HG1 ILE 50 15.922 5.635 -7.819 387 HG13 ILE 50 2HG1 ILE 50 15.791 4.647 -9.262 388 HG21 ILE 50 1HG2 ILE 50 14.086 8.600 -9.086 389 HG22 ILE 50 2HG2 ILE 50 15.005 7.942 -7.713 390 HG23 ILE 50 3HG2 ILE 50 15.839 8.463 -9.189 391 HD11 ILE 50 3HD1 ILE 50 18.063 5.336 -9.117 392 HD12 ILE 50 1HD1 ILE 50 17.341 6.258 -10.444 393 HD13 ILE 50 2HD1 ILE 50 17.624 7.033 -8.871 394 H GLN 51 H GLN 51 11.333 4.540 -8.726 395 HA GLN 51 HA GLN 51 11.811 2.603 -10.878 396 HB2 GLN 51 1HB GLN 51 11.188 0.801 -9.039 397 HB3 GLN 51 2HB GLN 51 12.856 1.290 -9.251 398 HG2 GLN 51 1HG GLN 51 12.722 2.808 -7.338 399 HG3 GLN 51 2HG GLN 51 10.983 2.537 -7.199 400 HE21 GLN 51 1HE2 GLN 51 10.210 0.473 -6.383 401 HE22 GLN 51 2HE2 GLN 51 11.251 -0.533 -5.445 402 H ASP 52 H ASP 52 9.945 1.310 -11.185 403 HA ASP 52 HA ASP 52 7.387 2.704 -10.440 404 HB2 ASP 52 1HB ASP 52 8.430 1.954 -13.003 405 HB3 ASP 52 2HB ASP 52 6.965 1.028 -12.711 406 H TYR 53 H TYR 53 9.117 -0.162 -9.762 407 HA TYR 53 HA TYR 53 6.710 -1.653 -8.969 408 HB2 TYR 53 1HB TYR 53 8.644 -2.440 -11.164 409 HB3 TYR 53 2HB TYR 53 8.123 -3.679 -10.046 410 HD1 TYR 53 1HD TYR 53 6.621 -1.035 -12.216 411 HD2 TYR 53 2HD TYR 53 6.237 -4.947 -10.490 412 HE1 TYR 53 1HE TYR 53 4.513 -1.293 -13.403 413 HE2 TYR 53 2HE TYR 53 4.188 -5.337 -11.802 414 HH TYR 53 HH TYR 53 2.412 -2.970 -13.343 415 HA PRO 54 HA PRO 54 9.520 -2.739 -5.716 416 HB2 PRO 54 1HB PRO 54 8.610 -5.143 -4.785 417 HB3 PRO 54 2HB PRO 54 7.665 -3.638 -4.612 418 HG2 PRO 54 1HG PRO 54 7.432 -5.722 -6.776 419 HG3 PRO 54 2HG PRO 54 6.126 -5.036 -5.743 420 HD2 PRO 54 1HD PRO 54 6.637 -4.098 -8.257 421 HD3 PRO 54 2HD PRO 54 6.182 -2.987 -6.939 422 H SER 55 H SER 55 11.049 -4.310 -4.954 423 HA SER 55 HA SER 55 12.599 -5.535 -7.109 424 HB2 SER 55 1HB SER 55 13.318 -3.941 -5.156 425 HB3 SER 55 2HB SER 55 13.284 -5.387 -4.146 426 HG SER 55 HG SER 55 14.920 -4.724 -6.365 427 H ALA 56 H ALA 56 10.163 -6.750 -5.042 428 HA ALA 56 HA ALA 56 11.528 -9.308 -4.393 429 HB1 ALA 56 1HB ALA 56 10.211 -8.304 -2.631 430 HB2 ALA 56 2HB ALA 56 8.764 -8.240 -3.675 431 HB3 ALA 56 3HB ALA 56 9.428 -9.798 -3.143 432 H GLU 57 H GLU 57 10.635 -11.369 -4.952 433 HA GLU 57 HA GLU 57 9.406 -11.626 -7.543 434 HB2 GLU 57 1HB GLU 57 10.923 -13.193 -5.737 435 HB3 GLU 57 2HB GLU 57 9.344 -13.968 -5.723 436 HG2 GLU 57 1HG GLU 57 9.442 -14.174 -8.197 437 HG3 GLU 57 2HG GLU 57 11.029 -13.364 -8.155 438 H GLU 58 H GLU 58 8.262 -11.601 -4.175 439 HA GLU 58 HA GLU 58 5.536 -12.483 -4.976 440 HB2 GLU 58 1HB GLU 58 7.257 -13.115 -2.576 441 HB3 GLU 58 2HB GLU 58 5.515 -13.375 -2.584 442 HG2 GLU 58 1HG GLU 58 5.614 -15.197 -3.972 443 HG3 GLU 58 2HG GLU 58 6.972 -14.577 -4.900 444 H TYR 59 H TYR 59 4.279 -10.756 -4.942 445 HA TYR 59 HA TYR 59 4.000 -9.166 -2.551 446 HB2 TYR 59 1HB TYR 59 3.980 -7.023 -3.850 447 HB3 TYR 59 2HB TYR 59 5.553 -7.750 -3.681 448 HD1 TYR 59 2HD TYR 59 2.799 -7.190 -6.128 449 HD2 TYR 59 1HD TYR 59 6.909 -8.381 -5.552 450 HE1 TYR 59 2HE TYR 59 3.182 -7.007 -8.554 451 HE2 TYR 59 1HE TYR 59 7.299 -8.196 -7.977 452 HH TYR 59 HH TYR 59 4.783 -7.634 -10.322 453 H GLY 60 H GLY 60 1.855 -7.901 -2.895 454 HA2 GLY 60 1HA GLY 60 0.015 -9.339 -4.793 455 HA3 GLY 60 2HA GLY 60 -0.490 -8.620 -3.268 456 H THR 61 H THR 61 -1.752 -7.950 -5.628 457 HA THR 61 HA THR 61 -0.686 -5.330 -6.478 458 HB THR 61 HB THR 61 -3.238 -6.601 -7.508 459 HG1 THR 61 1HG THR 61 -0.939 -7.360 -8.829 460 HG21 THR 61 3HG2 THR 61 -2.446 -5.521 -9.624 461 HG22 THR 61 1HG2 THR 61 -1.024 -4.917 -8.737 462 HG23 THR 61 2HG2 THR 61 -2.638 -4.367 -8.287 463 H ILE 62 H ILE 62 -1.523 -3.440 -5.523 464 HA ILE 62 HA ILE 62 -4.222 -3.689 -4.293 465 HB ILE 62 HB ILE 62 -2.004 -1.875 -3.349 466 HG12 ILE 62 1HG1 ILE 62 -2.474 -3.565 -1.271 467 HG13 ILE 62 2HG1 ILE 62 -2.831 -4.673 -2.575 468 HG21 ILE 62 1HG2 ILE 62 -4.898 -2.346 -2.572 469 HG22 ILE 62 2HG2 ILE 62 -3.744 -1.785 -1.376 470 HG23 ILE 62 3HG2 ILE 62 -4.033 -0.821 -2.826 471 HD11 ILE 62 3HD1 ILE 62 -0.248 -3.042 -2.408 472 HD12 ILE 62 1HD1 ILE 62 -0.435 -4.697 -1.762 473 HD13 ILE 62 2HD1 ILE 62 -0.585 -4.382 -3.496 474 H ASN 63 H ASN 63 -5.732 -2.262 -4.878 475 HA ASN 63 HA ASN 63 -4.883 0.236 -6.192 476 HB2 ASN 63 1HB ASN 63 -7.168 -1.590 -7.136 477 HB3 ASN 63 2HB ASN 63 -7.137 0.094 -7.478 478 HD21 ASN 63 1HD2 ASN 63 -5.580 -3.025 -8.169 479 HD22 ASN 63 2HD2 ASN 63 -4.657 -2.398 -9.517 480 H ILE 64 H ILE 64 -6.124 1.984 -5.659 481 HA ILE 64 HA ILE 64 -8.358 1.732 -3.740 482 HB ILE 64 HB ILE 64 -6.338 4.018 -3.909 483 HG12 ILE 64 1HG1 ILE 64 -6.747 1.983 -1.686 484 HG13 ILE 64 2HG1 ILE 64 -5.343 2.134 -2.751 485 HG21 ILE 64 1HG2 ILE 64 -7.648 5.117 -2.196 486 HG22 ILE 64 2HG2 ILE 64 -8.788 4.619 -3.444 487 HG23 ILE 64 3HG2 ILE 64 -8.648 3.671 -1.954 488 HD11 ILE 64 3HD1 ILE 64 -6.220 4.277 -0.760 489 HD12 ILE 64 1HD1 ILE 64 -4.939 3.115 -0.513 490 HD13 ILE 64 2HD1 ILE 64 -4.783 4.311 -1.816 491 H GLU 65 H GLU 65 -9.844 1.657 -5.441 492 HA GLU 65 HA GLU 65 -9.664 3.375 -7.788 493 HB2 GLU 65 1HB GLU 65 -10.943 1.185 -7.777 494 HB3 GLU 65 2HB GLU 65 -12.044 1.882 -6.585 495 HG2 GLU 65 1HG GLU 65 -13.083 2.149 -8.736 496 HG3 GLU 65 2HG GLU 65 -12.593 3.731 -8.202 497 H ASN 66 H ASN 66 -10.385 5.449 -7.834 498 HA ASN 66 HA ASN 66 -12.172 6.478 -5.772 499 HB2 ASN 66 1HB ASN 66 -10.712 8.250 -5.028 500 HB3 ASN 66 2HB ASN 66 -10.020 6.694 -4.656 501 HD21 ASN 66 1HD2 ASN 66 -7.943 6.099 -5.673 502 HD22 ASN 66 2HD2 ASN 66 -6.980 7.410 -6.356 503 H ASN 67 H ASN 67 -11.496 9.141 -6.576 504 HA ASN 67 HA ASN 67 -13.755 9.641 -7.849 505 HB2 ASN 67 1HB ASN 67 -11.255 11.397 -7.933 506 HB3 ASN 67 2HB ASN 67 -12.882 11.930 -8.176 507 HD21 ASN 67 1HD2 ASN 67 -10.459 11.039 -5.795 508 HD22 ASN 67 2HD2 ASN 67 -11.481 11.152 -4.385 509 H GLY 68 H GLY 68 -11.431 8.257 -9.638 510 HA2 GLY 68 1HA GLY 68 -11.978 8.267 -12.073 511 HA3 GLY 68 2HA GLY 68 -11.531 9.990 -12.060 512 H GLY 69 H GLY 69 -9.810 7.978 -9.828 513 HA2 GLY 69 1HA GLY 69 -7.889 7.014 -11.816 514 HA3 GLY 69 2HA GLY 69 -7.211 8.124 -10.615 515 H MET 70 H MET 70 -6.148 5.768 -10.857 516 HA MET 70 HA MET 70 -6.897 4.211 -8.453 517 HB2 MET 70 1HB MET 70 -6.092 3.321 -11.252 518 HB3 MET 70 2HB MET 70 -5.897 2.242 -9.871 519 HG2 MET 70 1HG MET 70 -8.101 1.894 -9.563 520 HG3 MET 70 2HG MET 70 -8.579 3.440 -10.215 521 HE1 MET 70 3HE MET 70 -7.197 -0.115 -11.010 522 HE2 MET 70 1HE MET 70 -7.217 -0.193 -12.790 523 HE3 MET 70 2HE MET 70 -6.037 0.840 -11.954 524 H THR 71 H THR 71 -5.365 4.580 -7.095 525 HA THR 71 HA THR 71 -2.557 5.149 -7.852 526 HB THR 71 HB THR 71 -3.888 4.993 -5.093 527 HG1 THR 71 1HG THR 71 -3.022 7.130 -6.706 528 HG21 THR 71 3HG2 THR 71 -1.711 6.247 -4.490 529 HG22 THR 71 1HG2 THR 71 -1.061 5.561 -6.002 530 HG23 THR 71 2HG2 THR 71 -1.633 4.490 -4.719 531 H THR 72 H THR 72 -2.172 3.198 -8.969 532 HA THR 72 HA THR 72 -2.403 0.623 -7.752 533 HB THR 72 HB THR 72 -0.387 1.546 -9.832 534 HG1 THR 72 1HG THR 72 -1.898 1.434 -11.294 535 HG21 THR 72 3HG2 THR 72 -1.677 -1.173 -9.273 536 HG22 THR 72 1HG2 THR 72 0.020 -0.749 -8.980 537 HG23 THR 72 2HG2 THR 72 -0.584 -0.814 -10.634 538 H MET 73 H MET 73 -0.967 -0.496 -6.443 539 HA MET 73 HA MET 73 1.757 0.371 -5.970 540 HB2 MET 73 1HB MET 73 1.384 0.662 -3.507 541 HB3 MET 73 2HB MET 73 0.784 1.928 -4.538 542 HG2 MET 73 1HG MET 73 -1.495 0.439 -4.343 543 HG3 MET 73 2HG MET 73 -0.737 0.054 -2.826 544 HE1 MET 73 3HE MET 73 0.068 2.292 -1.107 545 HE2 MET 73 1HE MET 73 0.776 3.125 -2.515 546 HE3 MET 73 2HE MET 73 -0.429 3.955 -1.510 547 H PHE 74 H PHE 74 2.743 -1.197 -4.275 548 HA PHE 74 HA PHE 74 1.525 -3.886 -4.296 549 HB2 PHE 74 1HB PHE 74 4.345 -3.302 -5.272 550 HB3 PHE 74 2HB PHE 74 3.509 -4.840 -5.265 551 HD1 PHE 74 2HD PHE 74 1.728 -5.307 -6.990 552 HD2 PHE 74 1HD PHE 74 4.066 -1.683 -7.056 553 HE1 PHE 74 2HE PHE 74 1.153 -4.967 -9.374 554 HE2 PHE 74 1HE PHE 74 3.435 -1.318 -9.425 555 HZ PHE 74 HZ PHE 74 1.976 -2.960 -10.585 556 H TYR 75 H TYR 75 2.449 -5.072 -2.343 557 HA TYR 75 HA TYR 75 4.487 -3.587 -0.764 558 HB2 TYR 75 1HB TYR 75 2.301 -5.085 0.619 559 HB3 TYR 75 2HB TYR 75 3.314 -3.857 1.291 560 HD1 TYR 75 2HD TYR 75 2.767 -1.626 -0.785 561 HD2 TYR 75 1HD TYR 75 0.196 -4.400 1.246 562 HE1 TYR 75 2HE TYR 75 0.847 -0.130 -1.216 563 HE2 TYR 75 1HE TYR 75 -1.715 -2.927 0.861 564 HH TYR 75 HH TYR 75 -2.456 -1.120 -0.327 565 H TYR 76 H TYR 76 5.932 -4.933 0.378 566 HA TYR 76 HA TYR 76 5.674 -7.839 0.210 567 HB2 TYR 76 1HB TYR 76 7.773 -8.195 -0.916 568 HB3 TYR 76 2HB TYR 76 6.682 -7.293 -1.924 569 HD1 TYR 76 1HD TYR 76 6.978 -4.752 -2.128 570 HD2 TYR 76 2HD TYR 76 9.934 -7.393 -0.510 571 HE1 TYR 76 1HE TYR 76 8.684 -2.920 -2.299 572 HE2 TYR 76 2HE TYR 76 11.697 -5.675 -0.892 573 HH TYR 76 HH TYR 76 12.117 -3.541 -1.257 574 H GLU 77 H GLU 77 7.910 -8.780 1.241 575 HA GLU 77 HA GLU 77 8.730 -7.169 3.614 576 HB2 GLU 77 1HB GLU 77 7.411 -9.259 4.118 577 HB3 GLU 77 2HB GLU 77 8.596 -10.195 3.225 578 HG2 GLU 77 1HG GLU 77 10.369 -9.537 4.837 579 HG3 GLU 77 2HG GLU 77 9.219 -8.530 5.698 580 H GLU 78 H GLU 78 10.978 -6.913 3.854 581 HA GLU 78 HA GLU 78 12.770 -8.428 2.073 582 HB2 GLU 78 1HB GLU 78 12.186 -6.280 0.997 583 HB3 GLU 78 2HB GLU 78 12.920 -5.416 2.303 584 HG2 GLU 78 1HG GLU 78 15.076 -5.970 1.729 585 HG3 GLU 78 2HG GLU 78 14.631 -7.486 0.960 586 H ASN 79 H ASN 79 13.990 -9.475 3.493 587 HA ASN 79 HA ASN 79 15.256 -10.014 5.229 588 HB2 ASN 79 1HB ASN 79 16.225 -7.460 4.232 589 HB3 ASN 79 2HB ASN 79 16.563 -7.577 5.940 590 HD21 ASN 79 1HD2 ASN 79 17.198 -9.045 2.743 591 HD22 ASN 79 2HD2 ASN 79 18.506 -10.015 3.320 592 H GLY 80 H GLY 80 12.492 -8.653 5.915 593 HA2 GLY 80 1HA GLY 80 11.451 -9.366 7.930 594 HA3 GLY 80 2HA GLY 80 12.925 -9.054 8.833 595 H LYS 81 H LYS 81 12.394 -6.511 6.626 596 HA LYS 81 HA LYS 81 10.485 -5.027 8.326 597 HB2 LYS 81 1HB LYS 81 12.988 -4.180 6.873 598 HB3 LYS 81 2HB LYS 81 11.565 -3.195 6.584 599 HG2 LYS 81 1HG LYS 81 12.901 -2.318 8.488 600 HG3 LYS 81 2HG LYS 81 11.279 -2.852 8.982 601 HD2 LYS 81 1HD LYS 81 12.163 -4.926 9.860 602 HD3 LYS 81 2HD LYS 81 13.787 -4.542 9.330 603 HE2 LYS 81 1HE LYS 81 12.225 -2.799 11.277 604 HE3 LYS 81 2HE LYS 81 13.054 -4.266 11.808 605 HZ1 LYS 81 3HZ LYS 81 14.318 -1.912 10.574 606 HZ2 LYS 81 1HZ LYS 81 15.104 -3.357 10.866 607 HZ3 LYS 81 2HZ LYS 81 14.451 -2.442 12.105 608 H TYR 82 H TYR 82 8.910 -3.780 6.918 609 HA TYR 82 HA TYR 82 8.493 -5.283 4.392 610 HB2 TYR 82 1HB TYR 82 6.408 -4.185 6.256 611 HB3 TYR 82 2HB TYR 82 6.226 -5.104 4.792 612 HD1 TYR 82 1HD TYR 82 7.630 -5.282 8.275 613 HD2 TYR 82 2HD TYR 82 6.014 -7.496 4.933 614 HE1 TYR 82 1HE TYR 82 7.731 -7.353 9.602 615 HE2 TYR 82 2HE TYR 82 6.047 -9.554 6.292 616 HH TYR 82 HH TYR 82 7.789 -9.802 9.224 617 H TYR 83 H TYR 83 7.429 -4.007 2.685 618 HA TYR 83 HA TYR 83 7.914 -1.096 2.951 619 HB2 TYR 83 1HB TYR 83 9.243 -2.916 0.917 620 HB3 TYR 83 2HB TYR 83 9.318 -1.158 0.916 621 HD1 TYR 83 2HD TYR 83 10.601 0.067 2.680 622 HD2 TYR 83 1HD TYR 83 10.515 -4.242 2.594 623 HE1 TYR 83 2HE TYR 83 12.535 -0.008 4.226 624 HE2 TYR 83 1HE TYR 83 12.424 -4.361 4.051 625 HH TYR 83 HH TYR 83 14.162 -3.094 5.098 626 H ILE 84 H ILE 84 6.956 0.176 1.392 627 HA ILE 84 HA ILE 84 4.780 -1.093 -0.196 628 HB ILE 84 HB ILE 84 4.739 1.390 1.545 629 HG12 ILE 84 1HG1 ILE 84 2.487 0.257 2.243 630 HG13 ILE 84 2HG1 ILE 84 3.188 -1.204 1.568 631 HG21 ILE 84 1HG2 ILE 84 2.398 1.781 0.630 632 HG22 ILE 84 2HG2 ILE 84 3.743 2.199 -0.427 633 HG23 ILE 84 3HG2 ILE 84 2.853 0.708 -0.706 634 HD11 ILE 84 3HD1 ILE 84 3.419 -0.983 3.991 635 HD12 ILE 84 1HD1 ILE 84 4.968 -1.187 3.195 636 HD13 ILE 84 2HD1 ILE 84 4.489 0.435 3.769 637 H GLU 85 H GLU 85 5.024 -0.820 -2.306 638 HA GLU 85 HA GLU 85 6.957 0.985 -3.418 639 HB2 GLU 85 1HB GLU 85 6.205 -1.363 -4.238 640 HB3 GLU 85 2HB GLU 85 4.738 -0.579 -4.827 641 HG2 GLU 85 1HG GLU 85 6.410 -0.839 -6.621 642 HG3 GLU 85 2HG GLU 85 5.997 0.842 -6.331 643 H CYS 86 H CYS 86 6.516 2.737 -4.915 644 HA CYS 86 HA CYS 86 3.995 3.848 -5.490 645 HB2 CYS 86 1HB CYS 86 5.274 4.546 -2.911 646 HB3 CYS 86 2HB CYS 86 5.006 5.981 -3.924 647 HG CYS 86 HG CYS 86 2.904 3.565 -3.191 648 HA PRO 87 HA PRO 87 6.826 6.265 -8.244 649 HB2 PRO 87 1HB PRO 87 5.859 8.823 -8.244 650 HB3 PRO 87 2HB PRO 87 4.924 7.487 -8.948 651 HG2 PRO 87 1HG PRO 87 4.752 8.529 -6.085 652 HG3 PRO 87 2HG PRO 87 3.423 8.430 -7.284 653 HD2 PRO 87 1HD PRO 87 3.733 6.442 -5.560 654 HD3 PRO 87 2HD PRO 87 3.504 6.047 -7.272 655 H TYR 88 H TYR 88 7.851 8.808 -7.926 656 HA TYR 88 HA TYR 88 10.058 8.679 -6.552 657 HB2 TYR 88 1HB TYR 88 8.465 11.242 -6.668 658 HB3 TYR 88 2HB TYR 88 10.202 11.089 -6.539 659 HD1 TYR 88 2HD TYR 88 11.580 10.069 -8.417 660 HD2 TYR 88 1HD TYR 88 7.460 11.313 -8.879 661 HE1 TYR 88 2HE TYR 88 11.921 10.287 -10.841 662 HE2 TYR 88 1HE TYR 88 7.843 11.622 -11.300 663 HH TYR 88 HH TYR 88 10.917 10.811 -12.916 664 H LYS 89 H LYS 89 7.216 8.665 -4.723 665 HA LYS 89 HA LYS 89 8.900 8.952 -2.384 666 HB2 LYS 89 1HB LYS 89 5.930 9.676 -2.373 667 HB3 LYS 89 2HB LYS 89 7.045 9.757 -1.024 668 HG2 LYS 89 1HG LYS 89 7.407 11.860 -1.517 669 HG3 LYS 89 2HG LYS 89 8.262 11.389 -2.925 670 HD2 LYS 89 1HD LYS 89 5.281 12.039 -2.732 671 HD3 LYS 89 2HD LYS 89 6.538 13.104 -3.391 672 HE2 LYS 89 1HE LYS 89 7.046 11.471 -5.151 673 HE3 LYS 89 2HE LYS 89 5.813 10.373 -4.502 674 HZ1 LYS 89 3HZ LYS 89 4.942 11.657 -6.390 675 HZ2 LYS 89 1HZ LYS 89 5.317 13.056 -5.667 676 HZ3 LYS 89 2HZ LYS 89 4.149 12.100 -5.001 677 H GLY 90 H GLY 90 8.998 6.563 -3.465 678 HA2 GLY 90 1HA GLY 90 6.982 4.904 -2.082 679 HA3 GLY 90 2HA GLY 90 7.724 4.573 -3.647 680 H ILE 91 H ILE 91 9.500 5.592 -0.740 681 HA ILE 91 HA ILE 91 10.431 2.770 -0.393 682 HB ILE 91 HB ILE 91 12.018 5.254 0.309 683 HG12 ILE 91 1HG1 ILE 91 11.864 3.752 -2.307 684 HG13 ILE 91 2HG1 ILE 91 11.791 5.470 -2.011 685 HG21 ILE 91 1HG2 ILE 91 12.472 2.964 1.388 686 HG22 ILE 91 2HG2 ILE 91 12.941 2.414 -0.217 687 HG23 ILE 91 3HG2 ILE 91 13.837 3.765 0.564 688 HD11 ILE 91 3HD1 ILE 91 14.198 5.505 -1.462 689 HD12 ILE 91 1HD1 ILE 91 14.300 3.763 -1.823 690 HD13 ILE 91 2HD1 ILE 91 13.867 4.903 -3.095 691 H TYR 92 H TYR 92 8.105 3.190 0.769 692 HA TYR 92 HA TYR 92 8.400 4.364 3.468 693 HB2 TYR 92 1HB TYR 92 6.106 2.627 2.537 694 HB3 TYR 92 2HB TYR 92 6.146 3.600 3.969 695 HD1 TYR 92 2HD TYR 92 5.789 3.672 0.290 696 HD2 TYR 92 1HD TYR 92 5.605 5.942 3.931 697 HE1 TYR 92 2HE TYR 92 4.794 5.518 -0.928 698 HE2 TYR 92 1HE TYR 92 4.779 7.900 2.676 699 HH TYR 92 HH TYR 92 4.072 7.858 -0.821 700 H GLU 93 H GLU 93 9.811 3.396 4.638 701 HA GLU 93 HA GLU 93 9.977 0.502 5.075 702 HB2 GLU 93 1HB GLU 93 11.895 2.065 5.389 703 HB3 GLU 93 2HB GLU 93 10.953 2.991 6.536 704 HG2 GLU 93 1HG GLU 93 10.956 0.728 7.940 705 HG3 GLU 93 2HG GLU 93 12.306 0.317 6.884 706 H ILE 94 H ILE 94 8.405 -0.534 6.151 707 HA ILE 94 HA ILE 94 7.429 0.743 8.647 708 HB ILE 94 HB ILE 94 5.417 -0.563 8.691 709 HG12 ILE 94 1HG1 ILE 94 6.224 -1.564 5.959 710 HG13 ILE 94 2HG1 ILE 94 6.076 -2.505 7.428 711 HG21 ILE 94 1HG2 ILE 94 5.614 1.048 6.120 712 HG22 ILE 94 2HG2 ILE 94 4.156 0.749 7.104 713 HG23 ILE 94 3HG2 ILE 94 5.466 1.686 7.787 714 HD11 ILE 94 3HD1 ILE 94 4.169 -2.769 5.829 715 HD12 ILE 94 1HD1 ILE 94 3.701 -2.317 7.470 716 HD13 ILE 94 2HD1 ILE 94 3.674 -1.118 6.163 717 H GLU 95 H GLU 95 7.102 -0.869 10.377 718 HA GLU 95 HA GLU 95 9.236 -2.883 10.195 719 HB2 GLU 95 1HB GLU 95 9.427 -2.610 12.604 720 HB3 GLU 95 2HB GLU 95 9.479 -1.050 11.770 721 HG2 GLU 95 1HG GLU 95 7.047 -0.721 12.359 722 HG3 GLU 95 2HG GLU 95 7.134 -2.214 13.304 723 H ASN 96 H ASN 96 6.117 -2.969 9.700 724 HA ASN 96 HA ASN 96 5.664 -5.543 11.106 725 HB2 ASN 96 1HB ASN 96 3.645 -3.287 10.850 726 HB3 ASN 96 2HB ASN 96 3.324 -4.857 11.568 727 HD21 ASN 96 1HD2 ASN 96 4.017 -1.732 12.390 728 HD22 ASN 96 2HD2 ASN 96 4.797 -2.019 13.933 729 H ASN 97 H ASN 97 4.096 -6.964 10.366 730 HA ASN 97 HA ASN 97 3.880 -7.289 7.510 731 HB2 ASN 97 1HB ASN 97 4.189 -9.201 9.035 732 HB3 ASN 97 2HB ASN 97 2.703 -8.793 9.904 733 HD21 ASN 97 1HD2 ASN 97 3.649 -9.363 6.392 734 HD22 ASN 97 2HD2 ASN 97 2.373 -10.528 6.177 735 H PHE 98 H PHE 98 2.491 -5.843 6.444 736 HA PHE 98 HA PHE 98 0.153 -4.663 7.409 737 HB2 PHE 98 1HB PHE 98 1.423 -3.885 5.492 738 HB3 PHE 98 2HB PHE 98 1.231 -5.425 4.669 739 HD1 PHE 98 2HD PHE 98 -0.447 -2.272 5.576 740 HD2 PHE 98 1HD PHE 98 -0.760 -5.999 3.427 741 HE1 PHE 98 2HE PHE 98 -2.422 -1.422 4.391 742 HE2 PHE 98 1HE PHE 98 -2.737 -5.162 2.246 743 HZ PHE 98 HZ PHE 98 -3.629 -2.871 2.748 744 H GLU 99 H GLU 99 0.757 -7.849 5.891 745 HA GLU 99 HA GLU 99 -1.926 -8.360 5.167 746 HB2 GLU 99 1HB GLU 99 0.560 -10.025 5.451 747 HB3 GLU 99 2HB GLU 99 -0.979 -10.774 4.987 748 HG2 GLU 99 1HG GLU 99 -1.172 -9.531 3.011 749 HG3 GLU 99 2HG GLU 99 -0.011 -8.316 3.530 750 H ASP 100 H ASP 100 -0.443 -8.624 8.303 751 HA ASP 100 HA ASP 100 -2.698 -10.206 9.379 752 HB2 ASP 100 1HB ASP 100 -0.506 -10.613 10.383 753 HB3 ASP 100 2HB ASP 100 -0.263 -8.881 10.658 754 H MET 101 H MET 101 -1.771 -6.852 8.956 755 HA MET 101 HA MET 101 -3.513 -5.862 11.078 756 HB2 MET 101 1HB MET 101 -2.196 -4.447 8.713 757 HB3 MET 101 2HB MET 101 -3.173 -3.651 9.959 758 HG2 MET 101 1HG MET 101 -1.672 -4.529 11.704 759 HG3 MET 101 2HG MET 101 -0.644 -5.268 10.487 760 HE1 MET 101 3HE MET 101 1.185 -2.166 12.273 761 HE2 MET 101 1HE MET 101 -0.172 -3.073 12.974 762 HE3 MET 101 2HE MET 101 1.143 -3.943 12.157 763 H ILE 102 H ILE 102 -3.824 -6.666 7.648 764 HA ILE 102 HA ILE 102 -6.355 -5.277 7.349 765 HB ILE 102 HB ILE 102 -6.457 -6.338 5.129 766 HG12 ILE 102 1HG1 ILE 102 -3.811 -7.618 5.906 767 HG13 ILE 102 2HG1 ILE 102 -5.319 -8.477 5.639 768 HG21 ILE 102 1HG2 ILE 102 -4.741 -4.950 4.199 769 HG22 ILE 102 2HG2 ILE 102 -5.268 -4.171 5.695 770 HG23 ILE 102 3HG2 ILE 102 -3.745 -5.055 5.670 771 HD11 ILE 102 3HD1 ILE 102 -3.667 -7.002 3.552 772 HD12 ILE 102 1HD1 ILE 102 -3.942 -8.743 3.690 773 HD13 ILE 102 2HD1 ILE 102 -5.283 -7.669 3.243
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