NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
473303 | 2nln | 7322 | cing | 1-original | 14 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA SER 1 HA SER 1 3.363 -1.769 -9.149 2 HG SER 1 HG SER 1 1.250 -4.930 -8.817 3 H1 SER 1 HT1 SER 1 3.635 -4.660 -9.699 4 H2 SER 1 HT2 SER 1 4.706 -3.459 -10.216 5 H3 SER 1 HT3 SER 1 3.116 -3.477 -10.792 6 HB2 SER 1 HB2 SER 1 1.563 -2.493 -7.600 7 HB3 SER 1 HB1 SER 1 1.202 -2.877 -9.283 8 H ILE 2 HN ILE 2 5.144 -4.498 -8.482 9 HA ILE 2 HA ILE 2 6.446 -3.379 -6.238 10 HB ILE 2 HB ILE 2 4.672 -5.734 -5.658 11 HG12 ILE 2 HG12 ILE 2 4.872 -2.997 -4.510 12 HG13 ILE 2 HG11 ILE 2 3.504 -3.717 -5.338 13 HG21 ILE 2 HG21 ILE 2 7.100 -4.737 -4.241 14 HG22 ILE 2 HG22 ILE 2 6.667 -6.386 -4.695 15 HG23 ILE 2 HG23 ILE 2 5.832 -5.585 -3.361 16 HD11 ILE 2 HD13 ILE 2 4.566 -4.776 -2.756 17 HD12 ILE 2 HD11 ILE 2 3.015 -5.105 -3.528 18 HD13 ILE 2 HD12 ILE 2 3.361 -3.516 -2.874 19 H THR 3 HN THR 3 5.659 -6.303 -7.990 20 HA THR 3 HA THR 3 7.921 -7.817 -7.421 21 HB THR 3 HB THR 3 7.417 -9.082 -9.480 22 HG1 THR 3 HG1 THR 3 5.567 -8.358 -10.705 23 HG21 THR 3 HG23 THR 3 4.841 -8.404 -8.078 24 HG22 THR 3 HG21 THR 3 6.131 -9.314 -7.288 25 HG23 THR 3 HG22 THR 3 5.357 -9.957 -8.738 26 H ASP 4 HN ASP 4 7.693 -4.963 -9.299 27 HA ASP 4 HA ASP 4 9.571 -5.237 -11.276 28 HB2 ASP 4 HB2 ASP 4 8.349 -3.126 -10.787 29 HB3 ASP 4 HB1 ASP 4 9.371 -2.884 -9.373 30 H ILE 5 HN ILE 5 10.163 -4.482 -7.859 31 HA ILE 5 HA ILE 5 12.710 -5.921 -7.993 32 HB ILE 5 HB ILE 5 12.588 -3.283 -6.548 33 HG12 ILE 5 HG12 ILE 5 13.783 -3.507 -9.302 34 HG13 ILE 5 HG11 ILE 5 12.087 -3.089 -9.094 35 HG21 ILE 5 HG21 ILE 5 14.373 -4.877 -6.005 36 HG22 ILE 5 HG22 ILE 5 15.004 -3.393 -6.720 37 HG23 ILE 5 HG23 ILE 5 14.889 -4.861 -7.692 38 HD11 ILE 5 HD13 ILE 5 13.720 -1.185 -9.357 39 HD12 ILE 5 HD11 ILE 5 14.259 -1.566 -7.721 40 HD13 ILE 5 HD12 ILE 5 12.580 -1.096 -8.013 41 H LEU 6 HN LEU 6 11.845 -7.501 -6.732 42 HA LEU 6 HA LEU 6 11.872 -7.129 -3.922 43 HG LEU 6 HG LEU 6 10.464 -6.575 -2.417 44 HB2 LEU 6 HB2 LEU 6 9.429 -6.501 -5.152 45 HB3 LEU 6 HB1 LEU 6 9.181 -8.032 -4.345 46 HD11 LEU 6 HD11 LEU 6 9.159 -4.723 -4.278 47 HD12 LEU 6 HD12 LEU 6 10.417 -4.431 -3.074 48 HD13 LEU 6 HD13 LEU 6 8.725 -4.508 -2.583 49 HD21 LEU 6 HD23 LEU 6 8.608 -7.931 -1.904 50 HD22 LEU 6 HD21 LEU 6 7.547 -7.024 -2.981 51 HD23 LEU 6 HD22 LEU 6 8.124 -6.287 -1.488 52 H SER 7 HN SER 7 11.196 -9.048 -2.685 53 HA SER 7 HA SER 7 11.941 -11.488 -4.065 54 HG SER 7 HG SER 7 13.724 -11.597 -1.646 55 HB2 SER 7 HB2 SER 7 11.093 -11.085 -1.185 56 HB3 SER 7 HB1 SER 7 11.854 -12.525 -1.854 57 H ALA 8 HN ALA 8 10.425 -12.644 -5.103 58 HA ALA 8 HA ALA 8 7.690 -11.936 -5.030 59 HB1 ALA 8 HB3 ALA 8 8.790 -12.922 -6.998 60 HB2 ALA 8 HB1 ALA 8 7.348 -13.820 -6.521 61 HB3 ALA 8 HB2 ALA 8 8.949 -14.450 -6.132 62 H GLU 9 HN GLU 9 9.451 -14.727 -3.604 63 HA GLU 9 HA GLU 9 7.137 -16.021 -2.647 64 HB2 GLU 9 HB2 GLU 9 10.007 -16.124 -1.733 65 HB3 GLU 9 HB1 GLU 9 8.755 -17.231 -1.175 66 HG2 GLU 9 HG2 GLU 9 9.620 -16.881 -4.024 67 HG3 GLU 9 HG1 GLU 9 10.180 -18.164 -2.953 68 H ASP 10 HN ASP 10 9.585 -14.154 -0.856 69 HA ASP 10 HA ASP 10 8.344 -13.951 1.528 70 HB2 ASP 10 HB2 ASP 10 9.967 -11.849 0.125 71 HB3 ASP 10 HB1 ASP 10 9.510 -11.752 1.818 72 H ILE 11 HN ILE 11 7.398 -12.363 -1.374 73 HA ILE 11 HA ILE 11 5.859 -10.293 -0.186 74 HB ILE 11 HB ILE 11 6.097 -11.540 -2.850 75 HG12 ILE 11 HG12 ILE 11 5.706 -8.655 -2.058 76 HG13 ILE 11 HG11 ILE 11 7.273 -9.466 -2.114 77 HG21 ILE 11 HG21 ILE 11 3.559 -10.131 -2.068 78 HG22 ILE 11 HG22 ILE 11 3.734 -11.730 -2.788 79 HG23 ILE 11 HG23 ILE 11 4.101 -10.291 -3.739 80 HD11 ILE 11 HD13 ILE 11 5.660 -8.369 -4.268 81 HD12 ILE 11 HD11 ILE 11 6.204 -10.014 -4.585 82 HD13 ILE 11 HD12 ILE 11 7.376 -8.753 -4.220 83 H ALA 12 HN ALA 12 4.991 -13.525 -1.387 84 HA ALA 12 HA ALA 12 2.283 -13.458 -0.684 85 HB1 ALA 12 HB3 ALA 12 3.782 -15.255 -1.971 86 HB2 ALA 12 HB1 ALA 12 2.219 -15.658 -1.256 87 HB3 ALA 12 HB2 ALA 12 3.706 -16.031 -0.388 88 H ALA 13 HN ALA 13 5.037 -14.795 1.172 89 HA ALA 13 HA ALA 13 3.478 -15.399 3.446 90 HB1 ALA 13 HB3 ALA 13 5.835 -16.206 2.945 91 HB2 ALA 13 HB1 ALA 13 5.526 -15.712 4.610 92 HB3 ALA 13 HB2 ALA 13 6.393 -14.632 3.517 93 H ALA 14 HN ALA 14 5.628 -12.713 2.770 94 HA ALA 14 HA ALA 14 5.259 -11.064 4.887 95 HB1 ALA 14 HB3 ALA 14 6.733 -10.322 3.193 96 HB2 ALA 14 HB1 ALA 14 5.451 -9.114 3.260 97 HB3 ALA 14 HB2 ALA 14 5.458 -10.319 1.969 98 H LEU 15 HN LEU 15 3.103 -11.306 2.087 99 HA LEU 15 HA LEU 15 1.220 -9.429 3.181 100 HG LEU 15 HG LEU 15 -0.143 -8.505 0.928 101 HB2 LEU 15 HB2 LEU 15 1.633 -9.983 0.695 102 HB3 LEU 15 HB1 LEU 15 0.635 -11.396 0.987 103 HD11 LEU 15 HD11 LEU 15 -1.710 -10.847 -0.067 104 HD12 LEU 15 HD12 LEU 15 -0.352 -10.204 -0.990 105 HD13 LEU 15 HD13 LEU 15 -1.733 -9.172 -0.618 106 HD21 LEU 15 HD23 LEU 15 -1.737 -10.643 2.326 107 HD22 LEU 15 HD21 LEU 15 -2.270 -8.995 1.991 108 HD23 LEU 15 HD22 LEU 15 -0.934 -9.280 3.104 109 H GLN 16 HN GLN 16 1.178 -12.948 2.549 110 HA GLN 16 HA GLN 16 -1.390 -13.410 3.584 111 HB2 GLN 16 HB2 GLN 16 0.921 -15.186 2.897 112 HB3 GLN 16 HB1 GLN 16 -0.655 -15.775 3.399 113 HG2 GLN 16 HG2 GLN 16 0.137 -15.338 0.836 114 HG3 GLN 16 HG1 GLN 16 -1.524 -15.485 1.400 115 HE21 GLN 16 HE21 GLN 16 0.083 -13.905 -0.714 116 HE22 GLN 16 HE22 GLN 16 -0.615 -12.330 -0.637 117 H GLU 17 HN GLU 17 1.354 -12.614 5.351 118 HA GLU 17 HA GLU 17 1.443 -14.725 7.220 119 HB2 GLU 17 HB2 GLU 17 3.270 -13.160 6.980 120 HB3 GLU 17 HB1 GLU 17 2.245 -11.851 7.548 121 HG2 GLU 17 HG2 GLU 17 3.821 -12.861 9.214 122 HG3 GLU 17 HG1 GLU 17 2.146 -12.727 9.722 123 H CYS 18 HN CYS 18 0.353 -11.399 7.992 124 HA CYS 18 HA CYS 18 -1.684 -12.577 9.713 125 HG CYS 18 HG CYS 18 -2.962 -9.972 11.337 126 HB2 CYS 18 HB2 CYS 18 0.191 -11.081 10.616 127 HB3 CYS 18 HB1 CYS 18 -0.659 -9.755 9.835 128 H GLN 19 HN GLN 19 -1.601 -11.494 6.681 129 HA GLN 19 HA GLN 19 -3.053 -9.192 6.407 130 HB2 GLN 19 HB2 GLN 19 -2.146 -10.274 4.492 131 HB3 GLN 19 HB1 GLN 19 -3.151 -11.684 4.738 132 HG2 GLN 19 HG2 GLN 19 -5.127 -10.131 4.339 133 HG3 GLN 19 HG1 GLN 19 -3.937 -8.961 3.768 134 HE21 GLN 19 HE21 GLN 19 -4.403 -8.910 1.634 135 HE22 GLN 19 HE22 GLN 19 -4.301 -10.281 0.583 136 H ASP 20 HN ASP 20 -5.047 -8.584 6.234 137 HA ASP 20 HA ASP 20 -7.426 -9.920 6.238 138 HB2 ASP 20 HB2 ASP 20 -6.228 -9.771 8.961 139 HB3 ASP 20 HB1 ASP 20 -7.936 -9.370 8.827 140 HA PRO 21 HA PRO 21 -8.737 -5.713 6.017 141 HB2 PRO 21 HB2 PRO 21 -11.247 -5.776 6.902 142 HB3 PRO 21 HB1 PRO 21 -10.794 -6.535 5.385 143 HG2 PRO 21 HG2 PRO 21 -11.193 -7.759 8.088 144 HG3 PRO 21 HG1 PRO 21 -11.789 -8.318 6.512 145 HD2 PRO 21 HD2 PRO 21 -9.592 -9.360 7.667 146 HD3 PRO 21 HD1 PRO 21 -9.753 -9.187 5.911 147 H ASP 22 HN ASP 22 -7.064 -5.485 7.934 148 HA ASP 22 HA ASP 22 -7.658 -3.523 9.634 149 HB2 ASP 22 HB2 ASP 22 -9.479 -4.569 10.695 150 HB3 ASP 22 HB1 ASP 22 -8.603 -6.075 10.870 151 H THR 23 HN THR 23 -5.637 -6.141 8.884 152 HA THR 23 HA THR 23 -3.901 -5.648 11.184 153 HB THR 23 HB THR 23 -4.343 -7.962 10.782 154 HG1 THR 23 HG1 THR 23 -1.712 -7.538 9.803 155 HG21 THR 23 HG23 THR 23 -4.255 -7.234 8.067 156 HG22 THR 23 HG21 THR 23 -4.590 -8.819 8.744 157 HG23 THR 23 HG22 THR 23 -2.941 -8.380 8.313 158 H PHE 24 HN PHE 24 -3.765 -5.469 7.647 159 HA PHE 24 HA PHE 24 -2.230 -3.608 6.856 160 HD1 PHE 24 HD1 PHE 24 -0.700 -1.928 6.784 161 HD2 PHE 24 HD2 PHE 24 0.182 -3.925 10.440 162 HE1 PHE 24 HE1 PHE 24 -0.342 0.242 7.880 163 HE2 PHE 24 HE2 PHE 24 0.542 -1.757 11.540 164 HZ PHE 24 HZ PHE 24 0.281 0.331 10.260 165 HB2 PHE 24 HB2 PHE 24 -0.375 -5.189 8.595 166 HB3 PHE 24 HB1 PHE 24 0.266 -4.522 7.106 167 H GLU 25 HN GLU 25 -3.441 -4.887 5.211 168 HA GLU 25 HA GLU 25 -2.260 -7.207 4.136 169 HB2 GLU 25 HB2 GLU 25 -4.101 -5.322 2.693 170 HB3 GLU 25 HB1 GLU 25 -3.871 -7.040 2.407 171 HG2 GLU 25 HG2 GLU 25 -4.757 -7.477 4.681 172 HG3 GLU 25 HG1 GLU 25 -5.131 -5.763 4.799 173 HA PRO 26 HA PRO 26 -0.291 -4.366 0.884 174 HB2 PRO 26 HB2 PRO 26 -0.236 -1.678 1.336 175 HB3 PRO 26 HB1 PRO 26 -1.510 -2.505 0.450 176 HG2 PRO 26 HG2 PRO 26 -1.591 -1.292 3.080 177 HG3 PRO 26 HG1 PRO 26 -2.920 -1.791 2.036 178 HD2 PRO 26 HD2 PRO 26 -1.845 -3.143 4.340 179 HD3 PRO 26 HD1 PRO 26 -3.231 -3.606 3.335 180 H GLN 27 HN GLN 27 0.137 -2.566 3.929 181 HA GLN 27 HA GLN 27 2.817 -1.940 3.629 182 HB2 GLN 27 HB2 GLN 27 1.252 -2.437 6.159 183 HB3 GLN 27 HB1 GLN 27 2.831 -1.669 6.105 184 HG2 GLN 27 HG2 GLN 27 0.413 -0.614 4.666 185 HG3 GLN 27 HG1 GLN 27 0.897 -0.105 6.284 186 HE21 GLN 27 HE21 GLN 27 2.813 1.050 6.548 187 HE22 GLN 27 HE22 GLN 27 3.557 1.892 5.234 188 H LYS 28 HN LYS 28 1.403 -4.878 4.994 189 HA LYS 28 HA LYS 28 3.834 -5.908 6.032 190 HB2 LYS 28 HB2 LYS 28 1.169 -7.115 5.330 191 HB3 LYS 28 HB1 LYS 28 2.493 -8.058 5.934 192 HG2 LYS 28 HG2 LYS 28 1.901 -5.724 7.539 193 HG3 LYS 28 HG1 LYS 28 0.613 -6.927 7.484 194 HD2 LYS 28 HD2 LYS 28 2.318 -8.651 8.085 195 HD3 LYS 28 HD1 LYS 28 3.482 -7.344 8.310 196 HE2 LYS 28 HE2 LYS 28 1.987 -6.355 10.000 197 HE3 LYS 28 HE1 LYS 28 0.901 -7.731 9.819 198 HZ1 LYS 28 HZ3 LYS 28 2.272 -8.137 11.693 199 HZ2 LYS 28 HZ1 LYS 28 3.685 -7.759 10.842 200 HZ3 LYS 28 HZ2 LYS 28 2.820 -9.163 10.464 201 H PHE 29 HN PHE 29 1.991 -6.324 3.084 202 HA PHE 29 HA PHE 29 3.444 -8.252 1.752 203 HD1 PHE 29 HD1 PHE 29 4.321 -6.243 -1.016 204 HD2 PHE 29 HD2 PHE 29 0.711 -8.476 -0.800 205 HE1 PHE 29 HE1 PHE 29 4.650 -7.024 -3.324 206 HE2 PHE 29 HE2 PHE 29 1.041 -9.258 -3.100 207 HZ PHE 29 HZ PHE 29 3.017 -8.527 -4.369 208 HB2 PHE 29 HB2 PHE 29 1.308 -7.236 0.988 209 HB3 PHE 29 HB1 PHE 29 2.155 -5.748 0.624 210 H PHE 30 HN PHE 30 3.865 -4.757 1.768 211 HA PHE 30 HA PHE 30 6.167 -4.726 0.101 212 HD1 PHE 30 HD1 PHE 30 3.966 -4.377 -0.744 213 HD2 PHE 30 HD2 PHE 30 3.833 -0.894 1.700 214 HE1 PHE 30 HE1 PHE 30 1.675 -3.922 -1.502 215 HE2 PHE 30 HE2 PHE 30 1.543 -0.434 0.932 216 HZ PHE 30 HZ PHE 30 0.458 -1.955 -0.673 217 HB2 PHE 30 HB2 PHE 30 5.513 -2.538 2.016 218 HB3 PHE 30 HB1 PHE 30 6.137 -2.418 0.376 219 H GLN 31 HN GLN 31 5.784 -3.930 3.547 220 HA GLN 31 HA GLN 31 8.449 -3.502 4.119 221 HB2 GLN 31 HB2 GLN 31 6.384 -2.962 5.500 222 HB3 GLN 31 HB1 GLN 31 6.493 -4.608 6.108 223 HG2 GLN 31 HG2 GLN 31 7.670 -3.566 7.728 224 HG3 GLN 31 HG1 GLN 31 8.989 -3.853 6.595 225 HE21 GLN 31 HE21 GLN 31 8.010 -1.791 4.732 226 HE22 GLN 31 HE22 GLN 31 8.412 -0.279 5.454 227 H THR 32 HN THR 32 6.708 -6.376 5.214 228 HA THR 32 HA THR 32 8.884 -7.716 6.219 229 HB THR 32 HB THR 32 6.442 -8.892 4.903 230 HG1 THR 32 HG1 THR 32 5.889 -7.730 6.712 231 HG21 THR 32 HG23 THR 32 8.278 -10.543 5.005 232 HG22 THR 32 HG21 THR 32 6.945 -10.958 6.083 233 HG23 THR 32 HG22 THR 32 8.419 -10.247 6.738 234 H SER 33 HN SER 33 7.617 -8.034 2.892 235 HA SER 33 HA SER 33 9.831 -9.733 2.143 236 HG SER 33 HG SER 33 9.505 -9.406 -0.664 237 HB2 SER 33 HB2 SER 33 7.601 -10.188 1.283 238 HB3 SER 33 HB1 SER 33 7.586 -8.640 0.455 239 H GLY 34 HN GLY 34 8.635 -6.610 0.929 240 HA2 GLY 34 HA2 GLY 34 11.204 -6.339 -0.454 241 HA3 GLY 34 HA1 GLY 34 9.761 -5.448 -0.855 242 H LEU 35 HN LEU 35 9.082 -3.957 1.121 243 HA LEU 35 HA LEU 35 10.769 -1.801 1.014 244 HG LEU 35 HG LEU 35 9.275 0.230 1.839 245 HB2 LEU 35 HB2 LEU 35 8.383 -2.582 2.452 246 HB3 LEU 35 HB1 LEU 35 9.409 -1.548 3.430 247 HD11 LEU 35 HD11 LEU 35 7.945 -1.777 0.034 248 HD12 LEU 35 HD12 LEU 35 9.493 -0.970 -0.217 249 HD13 LEU 35 HD13 LEU 35 7.995 -0.042 -0.276 250 HD21 LEU 35 HD23 LEU 35 6.499 -0.894 1.881 251 HD22 LEU 35 HD21 LEU 35 7.008 0.790 1.962 252 HD23 LEU 35 HD22 LEU 35 7.277 -0.281 3.338 253 H SER 36 HN SER 36 10.633 -4.292 3.524 254 HA SER 36 HA SER 36 12.110 -3.445 5.537 255 HG SER 36 HG SER 36 14.066 -6.360 5.463 256 HB2 SER 36 HB2 SER 36 11.423 -5.730 5.471 257 HB3 SER 36 HB1 SER 36 12.490 -6.074 4.110 258 H LYS 37 HN LYS 37 13.656 -4.251 2.407 259 HA LYS 37 HA LYS 37 15.992 -2.739 3.321 260 HB2 LYS 37 HB2 LYS 37 16.442 -5.335 1.913 261 HB3 LYS 37 HB1 LYS 37 17.535 -4.427 2.945 262 HG2 LYS 37 HG2 LYS 37 16.233 -5.035 4.897 263 HG3 LYS 37 HG1 LYS 37 15.104 -5.916 3.870 264 HD2 LYS 37 HD2 LYS 37 18.008 -6.523 4.311 265 HD3 LYS 37 HD1 LYS 37 16.628 -7.467 4.869 266 HE2 LYS 37 HE2 LYS 37 17.103 -8.675 3.009 267 HE3 LYS 37 HE1 LYS 37 16.088 -7.446 2.257 268 HZ1 LYS 37 HZ3 LYS 37 18.048 -7.674 0.962 269 HZ2 LYS 37 HZ1 LYS 37 19.052 -7.531 2.315 270 HZ3 LYS 37 HZ2 LYS 37 18.168 -6.197 1.774 271 H MET 38 HN MET 38 14.215 -1.729 1.491 272 HA MET 38 HA MET 38 15.699 -1.990 -1.033 273 HB2 MET 38 HB2 MET 38 12.781 -1.344 -0.659 274 HB3 MET 38 HB1 MET 38 13.632 -1.504 -2.179 275 HG2 MET 38 HG2 MET 38 13.728 -3.782 -0.316 276 HG3 MET 38 HG1 MET 38 12.216 -3.469 -1.165 277 HE1 MET 38 HE3 MET 38 14.415 -6.171 -1.454 278 HE2 MET 38 HE1 MET 38 13.813 -6.502 -3.078 279 HE3 MET 38 HE2 MET 38 12.696 -6.004 -1.805 280 H SER 39 HN SER 39 16.057 -0.165 -2.289 281 HA SER 39 HA SER 39 16.440 2.264 -0.870 282 HG SER 39 HG SER 39 18.678 1.114 -3.419 283 HB2 SER 39 HB2 SER 39 16.661 1.673 -3.832 284 HB3 SER 39 HB1 SER 39 17.239 3.138 -3.041 285 H ALA 40 HN ALA 40 15.704 4.387 -2.031 286 HA ALA 40 HA ALA 40 12.889 4.529 -1.718 287 HB1 ALA 40 HB3 ALA 40 14.554 6.655 -3.024 288 HB2 ALA 40 HB1 ALA 40 14.565 6.373 -1.282 289 HB3 ALA 40 HB2 ALA 40 13.064 6.832 -2.090 290 H SER 41 HN SER 41 14.948 4.625 -4.624 291 HA SER 41 HA SER 41 13.132 5.353 -6.525 292 HG SER 41 HG SER 41 16.605 4.991 -7.074 293 HB2 SER 41 HB2 SER 41 15.350 3.314 -6.750 294 HB3 SER 41 HB1 SER 41 14.506 4.025 -8.126 295 H GLN 42 HN GLN 42 13.870 1.955 -5.718 296 HA GLN 42 HA GLN 42 11.948 0.796 -7.347 297 HB2 GLN 42 HB2 GLN 42 12.108 -1.179 -5.938 298 HB3 GLN 42 HB1 GLN 42 13.695 -0.475 -6.219 299 HG2 GLN 42 HG2 GLN 42 13.812 -0.926 -3.998 300 HG3 GLN 42 HG1 GLN 42 13.247 0.742 -3.989 301 HE21 GLN 42 HE21 GLN 42 12.186 -2.600 -3.743 302 HE22 GLN 42 HE22 GLN 42 10.786 -2.281 -2.784 303 H VAL 43 HN VAL 43 11.596 2.400 -4.361 304 HA VAL 43 HA VAL 43 9.110 1.369 -3.504 305 HB VAL 43 HB VAL 43 9.854 4.260 -3.127 306 HG11 VAL 43 HG11 VAL 43 8.423 2.374 -1.281 307 HG12 VAL 43 HG12 VAL 43 7.602 3.403 -2.453 308 HG13 VAL 43 HG13 VAL 43 8.548 4.128 -1.152 309 HG21 VAL 43 HG23 VAL 43 11.060 3.593 -1.099 310 HG22 VAL 43 HG21 VAL 43 11.813 2.956 -2.550 311 HG23 VAL 43 HG22 VAL 43 10.841 1.901 -1.540 312 H LYS 44 HN LYS 44 9.991 3.706 -5.911 313 HA LYS 44 HA LYS 44 7.537 4.931 -6.396 314 HB2 LYS 44 HB2 LYS 44 9.834 4.224 -8.216 315 HB3 LYS 44 HB1 LYS 44 8.402 5.037 -8.829 316 HG2 LYS 44 HG2 LYS 44 8.859 6.988 -7.703 317 HG3 LYS 44 HG1 LYS 44 9.839 6.177 -6.482 318 HD2 LYS 44 HD2 LYS 44 11.126 7.583 -8.117 319 HD3 LYS 44 HD1 LYS 44 11.652 5.903 -8.001 320 HE2 LYS 44 HE2 LYS 44 10.401 5.359 -10.019 321 HE3 LYS 44 HE1 LYS 44 9.823 7.023 -10.126 322 HZ1 LYS 44 HZ3 LYS 44 11.703 6.597 -11.607 323 HZ2 LYS 44 HZ1 LYS 44 12.672 6.193 -10.281 324 HZ3 LYS 44 HZ2 LYS 44 12.084 7.769 -10.448 325 H ASP 45 HN ASP 45 8.889 1.949 -7.736 326 HA ASP 45 HA ASP 45 6.597 1.283 -9.275 327 HB2 ASP 45 HB2 ASP 45 9.201 0.250 -8.927 328 HB3 ASP 45 HB1 ASP 45 8.101 -1.051 -8.481 329 H ILE 46 HN ILE 46 7.768 0.332 -6.049 330 HA ILE 46 HA ILE 46 5.787 -1.509 -5.434 331 HB ILE 46 HB ILE 46 7.592 0.228 -3.834 332 HG12 ILE 46 HG12 ILE 46 8.027 -2.252 -3.043 333 HG13 ILE 46 HG11 ILE 46 7.249 -2.623 -4.555 334 HG21 ILE 46 HG21 ILE 46 5.240 -1.276 -2.753 335 HG22 ILE 46 HG22 ILE 46 5.836 0.332 -2.335 336 HG23 ILE 46 HG23 ILE 46 6.716 -1.101 -1.802 337 HD11 ILE 46 HD13 ILE 46 9.752 -2.493 -4.610 338 HD12 ILE 46 HD11 ILE 46 9.572 -0.758 -4.362 339 HD13 ILE 46 HD12 ILE 46 8.896 -1.514 -5.801 340 H PHE 47 HN PHE 47 5.971 1.919 -4.536 341 HA PHE 47 HA PHE 47 3.682 2.571 -3.415 342 HD1 PHE 47 HD1 PHE 47 2.632 5.328 -3.435 343 HD2 PHE 47 HD2 PHE 47 4.271 4.863 -7.332 344 HE1 PHE 47 HE1 PHE 47 1.034 6.969 -4.310 345 HE2 PHE 47 HE2 PHE 47 2.670 6.510 -8.211 346 HZ PHE 47 HZ PHE 47 1.044 7.568 -6.694 347 HB2 PHE 47 HB2 PHE 47 4.990 4.386 -3.920 348 HB3 PHE 47 HB1 PHE 47 5.310 3.854 -5.547 349 H ARG 48 HN ARG 48 3.980 1.726 -6.772 350 HA ARG 48 HA ARG 48 1.454 2.440 -7.698 351 HE ARG 48 HE ARG 48 4.480 4.946 -9.591 352 HB2 ARG 48 HB2 ARG 48 3.141 0.118 -8.622 353 HB3 ARG 48 HB1 ARG 48 1.837 0.879 -9.526 354 HG2 ARG 48 HG2 ARG 48 4.488 2.063 -8.769 355 HG3 ARG 48 HG1 ARG 48 3.873 1.727 -10.389 356 HD2 ARG 48 HD2 ARG 48 2.075 3.402 -9.976 357 HD3 ARG 48 HD1 ARG 48 2.853 3.797 -8.440 358 HH11 ARG 48 HH11 ARG 48 2.575 3.068 -11.825 359 HH12 ARG 48 HH12 ARG 48 3.248 3.821 -13.231 360 HH21 ARG 48 HH21 ARG 48 5.373 5.942 -11.438 361 HH22 ARG 48 HH22 ARG 48 4.839 5.455 -13.012 362 H PHE 49 HN PHE 49 2.313 -0.115 -5.563 363 HA PHE 49 HA PHE 49 0.396 -2.033 -6.100 364 HD1 PHE 49 HD2 PHE 49 1.562 -4.472 -4.882 365 HD2 PHE 49 HD1 PHE 49 -0.784 -2.062 -2.267 366 HE1 PHE 49 HE2 PHE 49 0.375 -6.478 -4.098 367 HE2 PHE 49 HE1 PHE 49 -1.968 -4.065 -1.480 368 HZ PHE 49 HZ PHE 49 -1.391 -6.277 -2.395 369 HB2 PHE 49 HB2 PHE 49 2.223 -2.204 -4.366 370 HB3 PHE 49 HB1 PHE 49 1.232 -1.187 -3.317 371 H ILE 50 HN ILE 50 0.061 0.558 -3.633 372 HA ILE 50 HA ILE 50 -2.724 0.199 -3.355 373 HB ILE 50 HB ILE 50 -2.711 2.379 -2.192 374 HG12 ILE 50 HG12 ILE 50 0.207 2.482 -3.002 375 HG13 ILE 50 HG11 ILE 50 -1.057 3.559 -3.592 376 HG21 ILE 50 HG21 ILE 50 -0.663 0.308 -1.554 377 HG22 ILE 50 HG22 ILE 50 -2.225 0.621 -0.795 378 HG23 ILE 50 HG23 ILE 50 -0.873 1.720 -0.519 379 HD11 ILE 50 HD13 ILE 50 -0.615 3.370 -0.659 380 HD12 ILE 50 HD11 ILE 50 -1.158 4.733 -1.635 381 HD13 ILE 50 HD12 ILE 50 0.547 4.273 -1.629 382 H ASP 51 HN ASP 51 -3.285 3.255 -3.722 383 HA ASP 51 HA ASP 51 -4.345 2.953 -6.350 384 HB2 ASP 51 HB2 ASP 51 -4.353 5.190 -4.340 385 HB3 ASP 51 HB1 ASP 51 -4.974 5.429 -5.971 386 H ASN 52 HN ASN 52 -3.929 4.369 -8.138 387 HA ASN 52 HA ASN 52 -1.131 4.555 -8.690 388 HB2 ASN 52 HB2 ASN 52 -2.915 3.898 -10.337 389 HB3 ASN 52 HB1 ASN 52 -3.378 5.594 -10.403 390 HD21 ASN 52 HD21 ASN 52 -2.338 3.852 -12.494 391 HD22 ASN 52 HD22 ASN 52 -0.907 4.617 -13.087 392 H ASP 53 HN ASP 53 -3.687 6.958 -8.271 393 HA ASP 53 HA ASP 53 -2.139 8.925 -7.122 394 HB2 ASP 53 HB2 ASP 53 -1.895 10.514 -9.074 395 HB3 ASP 53 HB1 ASP 53 -0.802 9.134 -9.095 396 H GLN 54 HN GLN 54 -4.559 8.442 -9.618 397 HA GLN 54 HA GLN 54 -6.698 9.071 -9.858 398 HB2 GLN 54 HB2 GLN 54 -6.740 9.864 -6.973 399 HB3 GLN 54 HB1 GLN 54 -8.014 9.159 -7.954 400 HG2 GLN 54 HG2 GLN 54 -6.890 7.046 -8.017 401 HG3 GLN 54 HG1 GLN 54 -5.495 7.716 -7.180 402 HE21 GLN 54 HE21 GLN 54 -5.836 8.495 -5.004 403 HE22 GLN 54 HE22 GLN 54 -6.955 7.667 -3.979 404 H SER 55 HN SER 55 -5.165 11.448 -7.673 405 HA SER 55 HA SER 55 -5.808 13.547 -9.539 406 HG SER 55 HG SER 55 -7.192 15.684 -7.106 407 HB2 SER 55 HB2 SER 55 -7.870 13.379 -8.179 408 HB3 SER 55 HB1 SER 55 -6.913 13.647 -6.721 409 H GLY 56 HN GLY 56 -3.392 12.359 -8.430 410 HA2 GLY 56 HA2 GLY 56 -1.369 13.699 -8.235 411 HA3 GLY 56 HA1 GLY 56 -2.282 14.813 -7.223 412 H TYR 57 HN TYR 57 -3.504 12.312 -5.923 413 HA TYR 57 HA TYR 57 -1.353 11.065 -4.520 414 HD1 TYR 57 HD1 TYR 57 -4.280 14.041 -3.287 415 HD2 TYR 57 HD2 TYR 57 -0.090 14.323 -3.828 416 HE1 TYR 57 HE1 TYR 57 -4.533 16.421 -3.905 417 HE2 TYR 57 HE2 TYR 57 -0.306 16.700 -4.431 418 HH TYR 57 HH TYR 57 -2.034 18.219 -5.323 419 HB2 TYR 57 HB2 TYR 57 -2.854 12.373 -2.435 420 HB3 TYR 57 HB1 TYR 57 -1.126 12.405 -2.712 421 H LEU 58 HN LEU 58 -2.182 9.710 -2.737 422 HA LEU 58 HA LEU 58 -4.857 8.746 -3.403 423 HG LEU 58 HG LEU 58 -2.645 5.893 -4.011 424 HB2 LEU 58 HB2 LEU 58 -2.659 7.349 -1.877 425 HB3 LEU 58 HB1 LEU 58 -4.152 6.636 -2.448 426 HD11 LEU 58 HD11 LEU 58 -3.446 8.478 -5.286 427 HD12 LEU 58 HD12 LEU 58 -4.514 7.091 -5.108 428 HD13 LEU 58 HD13 LEU 58 -3.064 6.957 -6.091 429 HD21 LEU 58 HD23 LEU 58 -1.202 8.451 -3.720 430 HD22 LEU 58 HD21 LEU 58 -0.961 7.421 -5.125 431 HD23 LEU 58 HD22 LEU 58 -0.632 6.796 -3.508 432 H ASP 59 HN ASP 59 -6.379 8.335 -1.656 433 HA ASP 59 HA ASP 59 -5.576 9.431 0.933 434 HB2 ASP 59 HB2 ASP 59 -6.496 11.297 -0.439 435 HB3 ASP 59 HB1 ASP 59 -8.028 10.429 -0.510 436 H GLY 60 HN GLY 60 -6.976 9.016 2.618 437 HA2 GLY 60 HA2 GLY 60 -7.524 6.389 3.050 438 HA3 GLY 60 HA1 GLY 60 -8.331 7.691 3.909 439 H ASP 61 HN ASP 61 -9.632 8.658 1.463 440 HA ASP 61 HA ASP 61 -12.005 7.067 1.675 441 HB2 ASP 61 HB2 ASP 61 -11.406 9.151 -0.425 442 HB3 ASP 61 HB1 ASP 61 -12.988 8.646 0.175 443 H GLU 62 HN GLU 62 -9.680 7.785 -0.810 444 HA GLU 62 HA GLU 62 -10.788 6.027 -2.757 445 HB2 GLU 62 HB2 GLU 62 -8.309 7.681 -2.593 446 HB3 GLU 62 HB1 GLU 62 -8.673 6.658 -3.964 447 HG2 GLU 62 HG2 GLU 62 -10.303 8.961 -2.955 448 HG3 GLU 62 HG1 GLU 62 -9.341 8.920 -4.430 449 H LEU 63 HN LEU 63 -8.220 5.776 -0.407 450 HA LEU 63 HA LEU 63 -6.545 3.905 -1.419 451 HG LEU 63 HG LEU 63 -6.522 6.064 0.919 452 HB2 LEU 63 HB2 LEU 63 -7.662 4.055 1.374 453 HB3 LEU 63 HB1 LEU 63 -6.276 3.095 0.922 454 HD11 LEU 63 HD11 LEU 63 -4.151 5.097 2.117 455 HD12 LEU 63 HD12 LEU 63 -5.536 4.233 2.791 456 HD13 LEU 63 HD13 LEU 63 -5.481 5.994 2.845 457 HD21 LEU 63 HD23 LEU 63 -4.641 4.354 -0.596 458 HD22 LEU 63 HD21 LEU 63 -4.020 5.832 0.142 459 HD23 LEU 63 HD22 LEU 63 -5.341 5.922 -1.033 460 H LYS 64 HN LYS 64 -9.780 3.188 -0.042 461 HA LYS 64 HA LYS 64 -9.719 0.476 -0.148 462 HB2 LYS 64 HB2 LYS 64 -12.052 2.229 -0.905 463 HB3 LYS 64 HB1 LYS 64 -12.139 0.585 -0.332 464 HG2 LYS 64 HG2 LYS 64 -11.327 1.248 1.835 465 HG3 LYS 64 HG1 LYS 64 -11.133 2.908 1.268 466 HD2 LYS 64 HD2 LYS 64 -13.785 1.525 1.105 467 HD3 LYS 64 HD1 LYS 64 -13.255 2.280 2.609 468 HE2 LYS 64 HE2 LYS 64 -13.367 3.708 -0.040 469 HE3 LYS 64 HE1 LYS 64 -14.680 3.724 1.136 470 HZ1 LYS 64 HZ3 LYS 64 -11.921 4.734 1.578 471 HZ2 LYS 64 HZ1 LYS 64 -13.146 4.705 2.747 472 HZ3 LYS 64 HZ2 LYS 64 -13.311 5.677 1.373 473 H TYR 65 HN TYR 65 -10.026 2.691 -2.828 474 HA TYR 65 HA TYR 65 -11.047 0.758 -4.670 475 HD1 TYR 65 HD1 TYR 65 -12.454 1.898 -3.594 476 HD2 TYR 65 HD2 TYR 65 -11.378 5.209 -6.033 477 HE1 TYR 65 HE1 TYR 65 -14.435 3.121 -2.793 478 HE2 TYR 65 HE2 TYR 65 -13.361 6.436 -5.253 479 HH TYR 65 HH TYR 65 -15.589 5.915 -4.287 480 HB2 TYR 65 HB2 TYR 65 -9.702 3.391 -5.277 481 HB3 TYR 65 HB1 TYR 65 -10.698 2.444 -6.375 482 H PHE 66 HN PHE 66 -7.909 1.270 -3.448 483 HA PHE 66 HA PHE 66 -6.208 0.994 -5.533 484 HD1 PHE 66 HD2 PHE 66 -7.934 -0.701 -2.566 485 HD2 PHE 66 HD1 PHE 66 -3.736 -1.301 -2.488 486 HE1 PHE 66 HE2 PHE 66 -8.233 -2.629 -1.075 487 HE2 PHE 66 HE1 PHE 66 -4.046 -3.200 -0.966 488 HZ PHE 66 HZ PHE 66 -6.277 -3.870 -0.261 489 HB2 PHE 66 HB2 PHE 66 -4.631 0.220 -3.977 490 HB3 PHE 66 HB1 PHE 66 -5.717 1.186 -3.023 491 H LEU 67 HN LEU 67 -8.221 -1.518 -4.192 492 HA LEU 67 HA LEU 67 -6.999 -3.609 -5.720 493 HG LEU 67 HG LEU 67 -6.654 -3.941 -3.089 494 HB2 LEU 67 HB2 LEU 67 -9.033 -3.388 -3.563 495 HB3 LEU 67 HB1 LEU 67 -9.109 -4.802 -4.597 496 HD11 LEU 67 HD11 LEU 67 -8.762 -5.969 -2.386 497 HD12 LEU 67 HD12 LEU 67 -8.297 -4.532 -1.467 498 HD13 LEU 67 HD13 LEU 67 -7.173 -5.887 -1.622 499 HD21 LEU 67 HD23 LEU 67 -7.284 -6.553 -4.428 500 HD22 LEU 67 HD21 LEU 67 -5.748 -6.044 -3.719 501 HD23 LEU 67 HD22 LEU 67 -6.360 -5.242 -5.172 502 H GLN 68 HN GLN 68 -9.685 -1.488 -5.750 503 HA GLN 68 HA GLN 68 -11.180 -2.888 -7.752 504 HB2 GLN 68 HB2 GLN 68 -11.501 -0.407 -6.147 505 HB3 GLN 68 HB1 GLN 68 -12.360 -0.510 -7.669 506 HG2 GLN 68 HG2 GLN 68 -13.303 -2.695 -6.881 507 HG3 GLN 68 HG1 GLN 68 -12.595 -2.342 -5.306 508 HE21 GLN 68 HE21 GLN 68 -14.603 -2.291 -4.311 509 HE22 GLN 68 HE22 GLN 68 -15.708 -0.980 -4.529 510 H LYS 69 HN LYS 69 -8.337 -1.284 -7.890 511 HA LYS 69 HA LYS 69 -8.772 0.475 -10.104 512 HB2 LYS 69 HB2 LYS 69 -6.267 -0.751 -8.913 513 HB3 LYS 69 HB1 LYS 69 -6.275 0.491 -10.158 514 HG2 LYS 69 HG2 LYS 69 -7.385 0.792 -7.384 515 HG3 LYS 69 HG1 LYS 69 -5.822 1.374 -7.925 516 HD2 LYS 69 HD2 LYS 69 -6.786 2.972 -9.345 517 HD3 LYS 69 HD1 LYS 69 -8.354 2.172 -9.289 518 HE2 LYS 69 HE2 LYS 69 -8.704 2.835 -7.038 519 HE3 LYS 69 HE1 LYS 69 -7.061 3.461 -6.910 520 HZ1 LYS 69 HZ3 LYS 69 -7.633 5.127 -8.593 521 HZ2 LYS 69 HZ1 LYS 69 -8.621 5.257 -7.224 522 HZ3 LYS 69 HZ2 LYS 69 -9.220 4.546 -8.637 523 H PHE 70 HN PHE 70 -7.033 -2.512 -9.505 524 HA PHE 70 HA PHE 70 -7.121 -3.255 -12.310 525 HD1 PHE 70 HD1 PHE 70 -6.021 -4.496 -8.266 526 HD2 PHE 70 HD2 PHE 70 -5.261 -6.655 -11.867 527 HE1 PHE 70 HE1 PHE 70 -5.928 -6.593 -6.993 528 HE2 PHE 70 HE2 PHE 70 -5.169 -8.752 -10.588 529 HZ PHE 70 HZ PHE 70 -5.503 -8.724 -8.151 530 HB2 PHE 70 HB2 PHE 70 -5.176 -4.313 -11.886 531 HB3 PHE 70 HB1 PHE 70 -5.172 -3.389 -10.403 532 H GLN 71 HN GLN 71 -8.180 -4.472 -9.161 533 HA GLN 71 HA GLN 71 -9.393 -6.821 -10.377 534 HB2 GLN 71 HB2 GLN 71 -8.218 -6.812 -8.120 535 HB3 GLN 71 HB1 GLN 71 -9.630 -5.972 -7.499 536 HG2 GLN 71 HG2 GLN 71 -10.876 -8.007 -8.647 537 HG3 GLN 71 HG1 GLN 71 -9.320 -8.784 -8.349 538 HE21 GLN 71 HE21 GLN 71 -12.033 -7.171 -6.884 539 HE22 GLN 71 HE22 GLN 71 -11.802 -7.784 -5.286 540 H SER 72 HN SER 72 -10.303 -3.654 -10.006 541 HA SER 72 HA SER 72 -12.320 -2.588 -9.442 542 HG SER 72 HG SER 72 -11.639 -4.600 -12.224 543 HB2 SER 72 HB2 SER 72 -13.790 -2.906 -11.484 544 HB3 SER 72 HB1 SER 72 -12.129 -2.394 -11.778 545 H ASP 73 HN ASP 73 -12.379 -4.884 -7.877 546 HA ASP 73 HA ASP 73 -15.214 -5.176 -7.533 547 HB2 ASP 73 HB2 ASP 73 -13.489 -7.530 -8.296 548 HB3 ASP 73 HB1 ASP 73 -15.052 -7.700 -7.509 549 H ALA 74 HN ALA 74 -12.604 -4.343 -6.122 550 HA ALA 74 HA ALA 74 -11.958 -6.084 -4.070 551 HB1 ALA 74 HB3 ALA 74 -10.668 -4.400 -3.319 552 HB2 ALA 74 HB1 ALA 74 -11.977 -3.221 -3.396 553 HB3 ALA 74 HB2 ALA 74 -11.095 -3.649 -4.861 554 H ARG 75 HN ARG 75 -12.341 -5.503 -1.711 555 HA ARG 75 HA ARG 75 -15.212 -5.487 -1.271 556 HE ARG 75 HE ARG 75 -9.958 -4.496 0.275 557 HB2 ARG 75 HB2 ARG 75 -14.364 -5.833 1.202 558 HB3 ARG 75 HB1 ARG 75 -14.380 -7.162 0.057 559 HG2 ARG 75 HG2 ARG 75 -12.340 -7.251 1.251 560 HG3 ARG 75 HG1 ARG 75 -11.959 -6.720 -0.379 561 HD2 ARG 75 HD2 ARG 75 -12.188 -4.329 0.676 562 HD3 ARG 75 HD1 ARG 75 -11.909 -5.190 2.186 563 HH11 ARG 75 HH11 ARG 75 -10.851 -7.081 2.440 564 HH12 ARG 75 HH12 ARG 75 -9.253 -7.743 2.506 565 HH21 ARG 75 HH21 ARG 75 -7.863 -5.360 0.362 566 HH22 ARG 75 HH22 ARG 75 -7.557 -6.764 1.324 567 H GLU 76 HN GLU 76 -12.639 -3.330 -1.270 568 HA GLU 76 HA GLU 76 -12.691 -1.075 -1.092 569 HB2 GLU 76 HB2 GLU 76 -15.204 -1.306 0.565 570 HB3 GLU 76 HB1 GLU 76 -14.526 0.146 -0.151 571 HG2 GLU 76 HG2 GLU 76 -15.019 -0.593 -2.347 572 HG3 GLU 76 HG1 GLU 76 -15.444 -2.202 -1.769 573 H LEU 77 HN LEU 77 -11.193 -2.660 0.328 574 HA LEU 77 HA LEU 77 -10.159 -3.121 2.316 575 HG LEU 77 HG LEU 77 -8.993 -1.581 0.170 576 HB2 LEU 77 HB2 LEU 77 -10.051 -0.185 1.802 577 HB3 LEU 77 HB1 LEU 77 -9.084 -0.910 3.056 578 HD11 LEU 77 HD11 LEU 77 -8.008 0.568 0.761 579 HD12 LEU 77 HD12 LEU 77 -6.817 -0.621 0.287 580 HD13 LEU 77 HD13 LEU 77 -7.017 -0.236 1.980 581 HD21 LEU 77 HD23 LEU 77 -7.879 -3.442 0.684 582 HD22 LEU 77 HD21 LEU 77 -8.393 -3.212 2.341 583 HD23 LEU 77 HD22 LEU 77 -6.866 -2.569 1.824 584 H THR 78 HN THR 78 -13.024 -2.782 2.875 585 HA THR 78 HA THR 78 -14.487 -2.161 4.558 586 HB THR 78 HB THR 78 -14.016 -3.336 6.571 587 HG1 THR 78 HG1 THR 78 -11.885 -3.916 7.143 588 HG21 THR 78 HG23 THR 78 -13.294 -5.498 5.794 589 HG22 THR 78 HG21 THR 78 -12.466 -4.772 4.416 590 HG23 THR 78 HG22 THR 78 -14.229 -4.730 4.511 591 H GLU 79 HN GLU 79 -14.224 -1.421 7.139 592 HA GLU 79 HA GLU 79 -13.452 1.309 6.970 593 HB2 GLU 79 HB2 GLU 79 -14.036 -0.374 9.416 594 HB3 GLU 79 HB1 GLU 79 -13.965 1.383 9.375 595 HG2 GLU 79 HG2 GLU 79 -15.875 1.407 7.830 596 HG3 GLU 79 HG1 GLU 79 -15.960 -0.351 7.932 597 H SER 80 HN SER 80 -12.105 -1.559 8.466 598 HA SER 80 HA SER 80 -9.917 -0.292 9.729 599 HG SER 80 HG SER 80 -8.365 -1.925 10.479 600 HB2 SER 80 HB2 SER 80 -11.112 -2.448 10.349 601 HB3 SER 80 HB1 SER 80 -10.047 -3.215 9.179 602 H GLU 81 HN GLU 81 -9.897 -2.366 6.690 603 HA GLU 81 HA GLU 81 -7.160 -2.588 6.589 604 HB2 GLU 81 HB2 GLU 81 -9.242 -3.369 4.955 605 HB3 GLU 81 HB1 GLU 81 -8.345 -2.248 3.967 606 HG2 GLU 81 HG2 GLU 81 -7.279 -4.726 5.249 607 HG3 GLU 81 HG1 GLU 81 -7.508 -4.425 3.521 608 H THR 82 HN THR 82 -9.114 0.084 5.195 609 HA THR 82 HA THR 82 -7.015 1.343 3.883 610 HB THR 82 HB THR 82 -8.252 3.449 4.158 611 HG1 THR 82 HG1 THR 82 -9.092 3.049 6.270 612 HG21 THR 82 HG23 THR 82 -9.933 1.061 3.416 613 HG22 THR 82 HG21 THR 82 -8.867 1.974 2.346 614 HG23 THR 82 HG22 THR 82 -10.314 2.735 3.012 615 H LYS 83 HN LYS 83 -7.625 1.008 7.267 616 HA LYS 83 HA LYS 83 -6.264 3.245 8.271 617 HB2 LYS 83 HB2 LYS 83 -7.578 1.709 9.698 618 HB3 LYS 83 HB1 LYS 83 -6.373 0.452 9.445 619 HG2 LYS 83 HG2 LYS 83 -4.692 1.943 10.495 620 HG3 LYS 83 HG1 LYS 83 -5.988 3.069 10.876 621 HD2 LYS 83 HD2 LYS 83 -5.703 0.228 11.845 622 HD3 LYS 83 HD1 LYS 83 -5.499 1.696 12.803 623 HE2 LYS 83 HE2 LYS 83 -7.838 2.262 12.453 624 HE3 LYS 83 HE1 LYS 83 -8.036 0.827 11.451 625 HZ1 LYS 83 HZ3 LYS 83 -7.327 0.833 14.334 626 HZ2 LYS 83 HZ1 LYS 83 -7.520 -0.546 13.372 627 HZ3 LYS 83 HZ2 LYS 83 -8.846 0.453 13.696 628 H SER 84 HN SER 84 -5.171 0.078 7.204 629 HA SER 84 HA SER 84 -2.497 0.169 7.860 630 HG SER 84 HG SER 84 -4.314 -2.660 6.801 631 HB2 SER 84 HB2 SER 84 -3.969 -1.030 5.506 632 HB3 SER 84 HB1 SER 84 -2.301 -1.389 5.891 633 H LEU 85 HN LEU 85 -4.057 1.020 4.803 634 HA LEU 85 HA LEU 85 -1.856 2.169 3.550 635 HG LEU 85 HG LEU 85 -4.207 0.304 2.604 636 HB2 LEU 85 HB2 LEU 85 -4.826 2.500 3.244 637 HB3 LEU 85 HB1 LEU 85 -3.686 3.224 2.141 638 HD11 LEU 85 HD11 LEU 85 -4.427 2.119 0.215 639 HD12 LEU 85 HD12 LEU 85 -5.723 1.269 1.056 640 HD13 LEU 85 HD13 LEU 85 -4.534 0.361 0.126 641 HD21 LEU 85 HD23 LEU 85 -1.813 0.548 2.506 642 HD22 LEU 85 HD21 LEU 85 -1.941 1.566 1.075 643 HD23 LEU 85 HD22 LEU 85 -2.393 -0.136 0.990 644 H MET 86 HN MET 86 -4.491 3.642 5.360 645 HA MET 86 HA MET 86 -3.810 6.322 5.148 646 HB2 MET 86 HB2 MET 86 -4.985 4.872 7.531 647 HB3 MET 86 HB1 MET 86 -4.989 6.618 7.317 648 HG2 MET 86 HG2 MET 86 -6.088 5.426 4.987 649 HG3 MET 86 HG1 MET 86 -6.874 4.725 6.397 650 HE1 MET 86 HE3 MET 86 -5.607 8.699 6.370 651 HE2 MET 86 HE1 MET 86 -6.728 9.050 5.055 652 HE3 MET 86 HE2 MET 86 -5.502 7.792 4.860 653 H ASP 87 HN ASP 87 -2.816 3.956 7.565 654 HA ASP 87 HA ASP 87 -0.982 5.647 8.947 655 HB2 ASP 87 HB2 ASP 87 -1.311 2.654 8.918 656 HB3 ASP 87 HB1 ASP 87 -0.311 3.545 10.062 657 H ALA 88 HN ALA 88 -0.781 4.400 5.911 658 HA ALA 88 HA ALA 88 1.761 3.149 5.883 659 HB1 ALA 88 HB3 ALA 88 1.392 2.787 3.666 660 HB2 ALA 88 HB1 ALA 88 0.546 4.323 3.446 661 HB3 ALA 88 HB2 ALA 88 -0.254 2.986 4.266 662 H ALA 89 HN ALA 89 0.764 6.487 5.711 663 HA ALA 89 HA ALA 89 3.505 7.301 5.716 664 HB1 ALA 89 HB3 ALA 89 3.336 6.861 3.353 665 HB2 ALA 89 HB1 ALA 89 3.465 8.598 3.624 666 HB3 ALA 89 HB2 ALA 89 1.902 7.881 3.226 667 H ASP 90 HN ASP 90 0.868 9.115 4.240 668 HA ASP 90 HA ASP 90 1.263 11.190 6.249 669 HB2 ASP 90 HB2 ASP 90 0.736 11.279 3.506 670 HB3 ASP 90 HB1 ASP 90 -0.749 11.829 4.276 671 H ASN 91 HN ASN 91 0.337 10.035 7.951 672 HA ASN 91 HA ASN 91 -2.576 9.679 7.823 673 HB2 ASN 91 HB2 ASN 91 -1.823 8.388 10.122 674 HB3 ASN 91 HB1 ASN 91 -2.090 7.612 8.571 675 HD21 ASN 91 HD21 ASN 91 -0.294 7.040 7.290 676 HD22 ASN 91 HD22 ASN 91 1.286 6.910 7.974 677 H ASP 92 HN ASP 92 0.052 10.929 9.805 678 HA ASP 92 HA ASP 92 -1.588 11.868 11.899 679 HB2 ASP 92 HB2 ASP 92 0.762 11.377 12.242 680 HB3 ASP 92 HB1 ASP 92 1.217 12.663 11.129 681 H GLY 93 HN GLY 93 -1.023 13.296 8.776 682 HA2 GLY 93 HA2 GLY 93 -2.650 15.526 9.593 683 HA3 GLY 93 HA1 GLY 93 -0.984 15.961 9.311 684 H ASP 94 HN ASP 94 -2.995 13.688 7.523 685 HA ASP 94 HA ASP 94 -3.631 15.424 5.415 686 HB2 ASP 94 HB2 ASP 94 -1.065 15.195 5.221 687 HB3 ASP 94 HB1 ASP 94 -1.413 13.602 4.564 688 H GLY 95 HN GLY 95 -3.190 12.153 6.545 689 HA2 GLY 95 HA2 GLY 95 -4.292 10.208 6.077 690 HA3 GLY 95 HA1 GLY 95 -5.616 11.241 5.569 691 H LYS 96 HN LYS 96 -2.729 11.701 3.784 692 HA LYS 96 HA LYS 96 -3.867 10.069 1.614 693 HB2 LYS 96 HB2 LYS 96 -3.683 11.822 0.224 694 HB3 LYS 96 HB1 LYS 96 -3.318 12.802 1.630 695 HG2 LYS 96 HG2 LYS 96 -1.328 11.493 -0.216 696 HG3 LYS 96 HG1 LYS 96 -1.718 13.206 -0.134 697 HD2 LYS 96 HD2 LYS 96 -1.022 12.611 2.459 698 HD3 LYS 96 HD1 LYS 96 0.095 11.624 1.506 699 HE2 LYS 96 HE2 LYS 96 -0.333 14.603 1.312 700 HE3 LYS 96 HE1 LYS 96 1.100 13.767 1.901 701 HZ1 LYS 96 HZ3 LYS 96 0.068 13.682 -0.880 702 HZ2 LYS 96 HZ1 LYS 96 1.434 12.858 -0.316 703 HZ3 LYS 96 HZ2 LYS 96 1.420 14.549 -0.351 704 H ILE 97 HN ILE 97 -2.455 8.906 0.267 705 HA ILE 97 HA ILE 97 0.264 8.531 1.336 706 HB ILE 97 HB ILE 97 -1.382 6.380 0.027 707 HG12 ILE 97 HG12 ILE 97 -2.427 6.964 2.160 708 HG13 ILE 97 HG11 ILE 97 -1.618 5.408 2.274 709 HG21 ILE 97 HG21 ILE 97 0.411 4.965 1.194 710 HG22 ILE 97 HG22 ILE 97 1.303 6.480 1.362 711 HG23 ILE 97 HG23 ILE 97 0.879 5.878 -0.240 712 HD11 ILE 97 HD13 ILE 97 0.205 6.372 3.483 713 HD12 ILE 97 HD11 ILE 97 -1.307 6.837 4.261 714 HD13 ILE 97 HD12 ILE 97 -0.445 7.992 3.246 715 H GLY 98 HN GLY 98 1.266 9.781 -0.251 716 HA2 GLY 98 HA2 GLY 98 0.876 9.003 -3.037 717 HA3 GLY 98 HA1 GLY 98 1.679 10.467 -2.475 718 H ALA 99 HN ALA 99 2.970 9.004 -4.368 719 HA ALA 99 HA ALA 99 4.587 6.896 -3.522 720 HB1 ALA 99 HB3 ALA 99 5.942 7.306 -5.395 721 HB2 ALA 99 HB1 ALA 99 5.599 9.037 -5.373 722 HB3 ALA 99 HB2 ALA 99 4.346 7.898 -5.863 723 H ASP 100 HN ASP 100 5.303 10.375 -3.451 724 HA ASP 100 HA ASP 100 7.769 10.272 -2.176 725 HB2 ASP 100 HB2 ASP 100 6.762 12.311 -3.198 726 HB3 ASP 100 HB1 ASP 100 5.668 12.423 -1.825 727 H GLU 101 HN GLU 101 4.554 10.646 -0.730 728 HA GLU 101 HA GLU 101 5.366 10.679 1.979 729 HB2 GLU 101 HB2 GLU 101 2.872 10.302 0.458 730 HB3 GLU 101 HB1 GLU 101 2.870 9.545 2.037 731 HG2 GLU 101 HG2 GLU 101 2.016 12.001 1.648 732 HG3 GLU 101 HG1 GLU 101 2.829 11.532 3.131 733 H PHE 102 HN PHE 102 4.227 8.047 -0.109 734 HA PHE 102 HA PHE 102 4.498 5.951 1.672 735 HD1 PHE 102 HD1 PHE 102 6.774 4.121 -0.334 736 HD2 PHE 102 HD2 PHE 102 2.547 3.655 -0.249 737 HE1 PHE 102 HE1 PHE 102 7.055 1.705 -0.079 738 HE2 PHE 102 HE2 PHE 102 2.820 1.221 -0.010 739 HZ PHE 102 HZ PHE 102 5.079 0.240 0.076 740 HB2 PHE 102 HB2 PHE 102 3.416 5.745 -0.531 741 HB3 PHE 102 HB1 PHE 102 4.979 5.874 -1.326 742 H GLN 103 HN GLN 103 6.929 7.346 -0.544 743 HA GLN 103 HA GLN 103 9.039 5.601 0.083 744 HB2 GLN 103 HB2 GLN 103 9.273 8.535 -0.620 745 HB3 GLN 103 HB1 GLN 103 10.554 7.339 -0.732 746 HG2 GLN 103 HG2 GLN 103 8.499 6.304 -2.275 747 HG3 GLN 103 HG1 GLN 103 8.490 8.032 -2.588 748 HE21 GLN 103 HE21 GLN 103 9.240 5.802 -4.320 749 HE22 GLN 103 HE22 GLN 103 10.856 6.138 -4.832 750 H GLU 104 HN GLU 104 7.767 8.389 1.735 751 HA GLU 104 HA GLU 104 9.963 8.873 3.445 752 HB2 GLU 104 HB2 GLU 104 8.762 10.627 4.131 753 HB3 GLU 104 HB1 GLU 104 7.611 10.157 2.898 754 HG2 GLU 104 HG2 GLU 104 6.146 9.244 4.429 755 HG3 GLU 104 HG1 GLU 104 7.387 9.065 5.668 756 H MET 105 HN MET 105 7.126 6.821 3.749 757 HA MET 105 HA MET 105 7.476 6.048 6.415 758 HB2 MET 105 HB2 MET 105 5.565 5.543 4.693 759 HB3 MET 105 HB1 MET 105 6.463 4.072 4.419 760 HG2 MET 105 HG2 MET 105 4.706 3.763 6.037 761 HG3 MET 105 HG1 MET 105 6.286 3.563 6.744 762 HE1 MET 105 HE3 MET 105 4.141 5.076 9.677 763 HE2 MET 105 HE1 MET 105 5.186 3.738 9.198 764 HE3 MET 105 HE2 MET 105 3.611 3.944 8.433 765 H VAL 106 HN VAL 106 8.505 4.294 3.473 766 HA VAL 106 HA VAL 106 9.956 2.293 4.770 767 HB VAL 106 HB VAL 106 9.407 2.050 2.435 768 HG11 VAL 106 HG11 VAL 106 11.056 4.525 2.090 769 HG12 VAL 106 HG12 VAL 106 9.378 4.235 1.621 770 HG13 VAL 106 HG13 VAL 106 10.688 3.438 0.753 771 HG21 VAL 106 HG23 VAL 106 12.040 1.674 3.468 772 HG22 VAL 106 HG21 VAL 106 12.168 2.133 1.772 773 HG23 VAL 106 HG22 VAL 106 11.209 0.728 2.234 774 H HIS 107 HN HIS 107 10.811 5.543 3.828 775 HA HIS 107 HA HIS 107 13.618 5.237 4.379 776 HD1 HIS 107 HD1 HIS 107 13.179 9.349 5.408 777 HD2 HIS 107 HD2 HIS 107 15.683 7.213 2.870 778 HE1 HIS 107 HE1 HIS 107 15.417 10.482 5.563 779 HE2 HIS 107 HE2 HIS 107 16.890 9.231 3.947 780 HB2 HIS 107 HB2 HIS 107 12.871 6.842 2.701 781 HB3 HIS 107 HB1 HIS 107 11.937 7.708 3.913 782 H SER 108 HN SER 108 10.787 6.084 6.171 783 HA SER 108 HA SER 108 11.833 7.648 8.205 784 HG SER 108 HG SER 108 9.371 6.158 10.349 785 HB2 SER 108 HB2 SER 108 9.444 7.265 7.993 786 HB3 SER 108 HB1 SER 108 9.654 5.554 8.360 Start of MODEL 2 1 HA SER 1 HA SER 1 2.267 -3.378 -9.558 2 HG SER 1 HG SER 1 0.349 -4.556 -7.039 3 H1 SER 1 HT1 SER 1 2.691 -6.251 -10.135 4 H2 SER 1 HT2 SER 1 3.693 -4.981 -10.628 5 H3 SER 1 HT3 SER 1 2.116 -5.097 -11.232 6 HB2 SER 1 HB2 SER 1 0.148 -4.571 -9.798 7 HB3 SER 1 HB1 SER 1 0.709 -5.830 -8.697 8 H ILE 2 HN ILE 2 4.243 -3.071 -8.557 9 HA ILE 2 HA ILE 2 5.446 -2.836 -6.626 10 HB ILE 2 HB ILE 2 3.209 -4.137 -5.623 11 HG12 ILE 2 HG12 ILE 2 5.608 -2.964 -4.272 12 HG13 ILE 2 HG11 ILE 2 4.151 -2.133 -4.737 13 HG21 ILE 2 HG21 ILE 2 5.416 -5.458 -4.140 14 HG22 ILE 2 HG22 ILE 2 4.857 -6.220 -5.628 15 HG23 ILE 2 HG23 ILE 2 3.725 -5.925 -4.312 16 HD11 ILE 2 HD13 ILE 2 4.595 -4.045 -2.496 17 HD12 ILE 2 HD11 ILE 2 2.977 -3.724 -3.123 18 HD13 ILE 2 HD12 ILE 2 3.948 -2.408 -2.472 19 H THR 3 HN THR 3 4.984 -6.025 -7.991 20 HA THR 3 HA THR 3 7.342 -7.206 -7.074 21 HB THR 3 HB THR 3 7.041 -8.839 -8.883 22 HG1 THR 3 HG1 THR 3 6.293 -7.636 -10.584 23 HG21 THR 3 HG23 THR 3 4.340 -8.169 -7.737 24 HG22 THR 3 HG21 THR 3 5.652 -8.806 -6.744 25 HG23 THR 3 HG22 THR 3 5.021 -9.758 -8.088 26 H ASP 4 HN ASP 4 7.088 -4.593 -9.206 27 HA ASP 4 HA ASP 4 8.895 -5.024 -11.214 28 HB2 ASP 4 HB2 ASP 4 7.659 -2.874 -10.717 29 HB3 ASP 4 HB1 ASP 4 8.887 -2.526 -9.504 30 H ILE 5 HN ILE 5 9.694 -3.862 -7.946 31 HA ILE 5 HA ILE 5 12.182 -5.410 -8.039 32 HB ILE 5 HB ILE 5 12.230 -2.651 -6.869 33 HG12 ILE 5 HG12 ILE 5 13.178 -3.169 -9.676 34 HG13 ILE 5 HG11 ILE 5 11.525 -2.651 -9.364 35 HG21 ILE 5 HG21 ILE 5 14.021 -4.151 -6.276 36 HG22 ILE 5 HG22 ILE 5 14.642 -2.872 -7.320 37 HG23 ILE 5 HG23 ILE 5 14.347 -4.482 -7.977 38 HD11 ILE 5 HD13 ILE 5 13.058 -0.804 -9.934 39 HD12 ILE 5 HD11 ILE 5 13.966 -1.149 -8.463 40 HD13 ILE 5 HD12 ILE 5 12.284 -0.622 -8.358 41 H LEU 6 HN LEU 6 11.448 -6.790 -6.577 42 HA LEU 6 HA LEU 6 11.473 -6.052 -3.804 43 HG LEU 6 HG LEU 6 9.613 -6.307 -2.137 44 HB2 LEU 6 HB2 LEU 6 9.079 -5.624 -5.002 45 HB3 LEU 6 HB1 LEU 6 8.858 -7.253 -4.401 46 HD11 LEU 6 HD11 LEU 6 10.283 -4.185 -2.135 47 HD12 LEU 6 HD12 LEU 6 8.608 -3.736 -2.453 48 HD13 LEU 6 HD13 LEU 6 9.724 -3.950 -3.783 49 HD21 LEU 6 HD23 LEU 6 7.230 -6.805 -3.150 50 HD22 LEU 6 HD21 LEU 6 7.056 -5.062 -2.975 51 HD23 LEU 6 HD22 LEU 6 7.424 -6.055 -1.565 52 H SER 7 HN SER 7 10.917 -7.907 -2.335 53 HA SER 7 HA SER 7 12.157 -10.300 -3.368 54 HG SER 7 HG SER 7 13.680 -9.616 -1.493 55 HB2 SER 7 HB2 SER 7 10.983 -9.826 -0.624 56 HB3 SER 7 HB1 SER 7 12.042 -11.140 -1.121 57 H ALA 8 HN ALA 8 10.077 -10.163 -4.823 58 HA ALA 8 HA ALA 8 7.657 -10.966 -4.385 59 HB1 ALA 8 HB3 ALA 8 8.728 -10.889 -6.623 60 HB2 ALA 8 HB1 ALA 8 7.588 -12.221 -6.423 61 HB3 ALA 8 HB2 ALA 8 9.325 -12.527 -6.341 62 H GLU 9 HN GLU 9 10.377 -13.060 -3.606 63 HA GLU 9 HA GLU 9 8.912 -15.455 -3.267 64 HB2 GLU 9 HB2 GLU 9 11.453 -14.495 -1.945 65 HB3 GLU 9 HB1 GLU 9 10.842 -16.143 -1.842 66 HG2 GLU 9 HG2 GLU 9 11.553 -14.732 -4.387 67 HG3 GLU 9 HG1 GLU 9 12.637 -15.817 -3.516 68 H ASP 10 HN ASP 10 9.873 -12.897 -1.036 69 HA ASP 10 HA ASP 10 8.469 -13.906 1.233 70 HB2 ASP 10 HB2 ASP 10 10.051 -11.439 0.614 71 HB3 ASP 10 HB1 ASP 10 9.081 -11.530 2.080 72 H ILE 11 HN ILE 11 7.519 -12.375 -1.521 73 HA ILE 11 HA ILE 11 5.696 -10.434 -0.454 74 HB ILE 11 HB ILE 11 6.322 -11.495 -3.172 75 HG12 ILE 11 HG12 ILE 11 7.578 -9.627 -2.126 76 HG13 ILE 11 HG11 ILE 11 6.774 -9.159 -3.621 77 HG21 ILE 11 HG21 ILE 11 3.814 -10.012 -2.461 78 HG22 ILE 11 HG22 ILE 11 3.985 -11.472 -3.431 79 HG23 ILE 11 HG23 ILE 11 4.523 -9.920 -4.070 80 HD11 ILE 11 HD13 ILE 11 5.177 -8.734 -1.225 81 HD12 ILE 11 HD11 ILE 11 5.482 -7.677 -2.601 82 HD13 ILE 11 HD12 ILE 11 6.664 -7.796 -1.304 83 H ALA 12 HN ALA 12 5.510 -13.718 -1.806 84 HA ALA 12 HA ALA 12 2.723 -13.972 -1.706 85 HB1 ALA 12 HB3 ALA 12 4.738 -15.590 -2.534 86 HB2 ALA 12 HB1 ALA 12 3.074 -16.129 -2.288 87 HB3 ALA 12 HB2 ALA 12 4.273 -16.363 -1.018 88 H ALA 13 HN ALA 13 5.256 -14.915 0.655 89 HA ALA 13 HA ALA 13 3.374 -15.655 2.640 90 HB1 ALA 13 HB3 ALA 13 5.858 -16.232 2.544 91 HB2 ALA 13 HB1 ALA 13 5.205 -15.802 4.127 92 HB3 ALA 13 HB2 ALA 13 6.141 -14.622 3.210 93 H ALA 14 HN ALA 14 5.412 -12.776 2.377 94 HA ALA 14 HA ALA 14 4.390 -11.229 4.350 95 HB1 ALA 14 HB3 ALA 14 6.215 -10.421 3.007 96 HB2 ALA 14 HB1 ALA 14 4.925 -9.221 2.981 97 HB3 ALA 14 HB2 ALA 14 5.174 -10.278 1.592 98 H LEU 15 HN LEU 15 2.940 -11.749 1.166 99 HA LEU 15 HA LEU 15 0.736 -9.972 1.661 100 HG LEU 15 HG LEU 15 -0.209 -9.392 -0.925 101 HB2 LEU 15 HB2 LEU 15 1.700 -10.690 -0.624 102 HB3 LEU 15 HB1 LEU 15 0.786 -12.168 -0.397 103 HD11 LEU 15 HD11 LEU 15 -0.867 -12.102 -2.044 104 HD12 LEU 15 HD12 LEU 15 0.110 -10.849 -2.807 105 HD13 LEU 15 HD13 LEU 15 -1.613 -10.584 -2.539 106 HD21 LEU 15 HD23 LEU 15 -1.751 -11.568 0.460 107 HD22 LEU 15 HD21 LEU 15 -2.510 -10.229 -0.397 108 HD23 LEU 15 HD22 LEU 15 -1.485 -9.915 1.002 109 H GLN 16 HN GLN 16 1.044 -13.511 1.322 110 HA GLN 16 HA GLN 16 -1.632 -14.068 2.031 111 HB2 GLN 16 HB2 GLN 16 0.832 -15.756 1.718 112 HB3 GLN 16 HB1 GLN 16 -0.783 -16.407 2.031 113 HG2 GLN 16 HG2 GLN 16 0.268 -15.019 -0.377 114 HG3 GLN 16 HG1 GLN 16 -0.534 -16.570 -0.240 115 HE21 GLN 16 HE21 GLN 16 -0.947 -13.155 -0.428 116 HE22 GLN 16 HE22 GLN 16 -2.646 -13.163 -0.729 117 H GLU 17 HN GLU 17 0.909 -13.129 4.002 118 HA GLU 17 HA GLU 17 0.765 -15.113 6.013 119 HB2 GLU 17 HB2 GLU 17 2.732 -13.886 6.030 120 HB3 GLU 17 HB1 GLU 17 1.905 -12.353 5.836 121 HG2 GLU 17 HG2 GLU 17 1.203 -12.397 8.133 122 HG3 GLU 17 HG1 GLU 17 1.851 -14.019 8.333 123 H CYS 18 HN CYS 18 -0.114 -11.696 6.545 124 HA CYS 18 HA CYS 18 -2.224 -12.616 8.304 125 HG CYS 18 HG CYS 18 -0.443 -10.520 11.132 126 HB2 CYS 18 HB2 CYS 18 -0.364 -10.337 8.265 127 HB3 CYS 18 HB1 CYS 18 -1.966 -10.043 8.930 128 H GLN 19 HN GLN 19 -2.224 -11.796 5.165 129 HA GLN 19 HA GLN 19 -3.567 -9.438 4.807 130 HB2 GLN 19 HB2 GLN 19 -2.858 -11.064 3.014 131 HB3 GLN 19 HB1 GLN 19 -4.331 -11.954 3.345 132 HG2 GLN 19 HG2 GLN 19 -5.652 -9.986 2.758 133 HG3 GLN 19 HG1 GLN 19 -4.167 -9.103 2.410 134 HE21 GLN 19 HE21 GLN 19 -4.704 -8.752 0.271 135 HE22 GLN 19 HE22 GLN 19 -4.711 -10.016 -0.908 136 H ASP 20 HN ASP 20 -5.567 -8.682 4.817 137 HA ASP 20 HA ASP 20 -7.983 -9.938 5.151 138 HB2 ASP 20 HB2 ASP 20 -6.478 -9.744 7.688 139 HB3 ASP 20 HB1 ASP 20 -8.154 -9.213 7.760 140 HA PRO 21 HA PRO 21 -9.239 -5.694 5.102 141 HB2 PRO 21 HB2 PRO 21 -11.762 -5.823 5.791 142 HB3 PRO 21 HB1 PRO 21 -11.206 -6.724 4.390 143 HG2 PRO 21 HG2 PRO 21 -11.735 -7.667 7.184 144 HG3 PRO 21 HG1 PRO 21 -12.215 -8.412 5.646 145 HD2 PRO 21 HD2 PRO 21 -10.002 -9.150 7.094 146 HD3 PRO 21 HD1 PRO 21 -10.188 -9.377 5.349 147 H ASP 22 HN ASP 22 -7.687 -5.873 7.386 148 HA ASP 22 HA ASP 22 -8.517 -3.790 8.970 149 HB2 ASP 22 HB2 ASP 22 -10.406 -4.934 9.765 150 HB3 ASP 22 HB1 ASP 22 -9.498 -6.410 10.012 151 H THR 23 HN THR 23 -6.422 -6.521 8.586 152 HA THR 23 HA THR 23 -4.944 -5.805 11.000 153 HB THR 23 HB THR 23 -5.358 -8.164 10.698 154 HG1 THR 23 HG1 THR 23 -3.459 -7.841 11.752 155 HG21 THR 23 HG23 THR 23 -3.488 -8.469 8.457 156 HG22 THR 23 HG21 THR 23 -5.040 -7.741 8.047 157 HG23 THR 23 HG22 THR 23 -4.988 -9.322 8.818 158 H PHE 24 HN PHE 24 -4.393 -5.824 7.480 159 HA PHE 24 HA PHE 24 -2.712 -3.923 6.989 160 HD1 PHE 24 HD1 PHE 24 -1.321 -2.426 7.124 161 HD2 PHE 24 HD2 PHE 24 -0.381 -4.658 10.617 162 HE1 PHE 24 HE1 PHE 24 -0.897 -0.335 8.340 163 HE2 PHE 24 HE2 PHE 24 0.052 -2.568 11.841 164 HZ PHE 24 HZ PHE 24 -0.207 -0.401 10.701 165 HB2 PHE 24 HB2 PHE 24 -1.191 -5.762 8.756 166 HB3 PHE 24 HB1 PHE 24 -0.322 -5.129 7.363 167 H GLU 25 HN GLU 25 -3.830 -4.915 5.051 168 HA GLU 25 HA GLU 25 -2.614 -7.157 3.816 169 HB2 GLU 25 HB2 GLU 25 -4.890 -6.683 3.313 170 HB3 GLU 25 HB1 GLU 25 -4.504 -5.039 2.825 171 HG2 GLU 25 HG2 GLU 25 -3.284 -5.877 0.927 172 HG3 GLU 25 HG1 GLU 25 -3.664 -7.533 1.383 173 HA PRO 26 HA PRO 26 -0.315 -4.045 1.108 174 HB2 PRO 26 HB2 PRO 26 -0.542 -1.396 1.566 175 HB3 PRO 26 HB1 PRO 26 -1.679 -2.330 0.600 176 HG2 PRO 26 HG2 PRO 26 -2.050 -1.135 3.196 177 HG3 PRO 26 HG1 PRO 26 -3.250 -1.791 2.086 178 HD2 PRO 26 HD2 PRO 26 -2.075 -3.014 4.450 179 HD3 PRO 26 HD1 PRO 26 -3.457 -3.553 3.476 180 H GLN 27 HN GLN 27 -0.282 -2.086 4.093 181 HA GLN 27 HA GLN 27 2.304 -1.241 4.034 182 HB2 GLN 27 HB2 GLN 27 0.219 -0.885 5.653 183 HB3 GLN 27 HB1 GLN 27 1.152 -1.996 6.648 184 HG2 GLN 27 HG2 GLN 27 3.100 -0.427 6.245 185 HG3 GLN 27 HG1 GLN 27 1.899 0.722 5.674 186 HE21 GLN 27 HE21 GLN 27 0.287 1.441 7.126 187 HE22 GLN 27 HE22 GLN 27 0.550 1.405 8.830 188 H LYS 28 HN LYS 28 1.087 -4.186 5.561 189 HA LYS 28 HA LYS 28 3.641 -4.911 6.669 190 HB2 LYS 28 HB2 LYS 28 1.573 -5.712 7.703 191 HB3 LYS 28 HB1 LYS 28 1.156 -6.571 6.226 192 HG2 LYS 28 HG2 LYS 28 2.775 -8.181 6.540 193 HG3 LYS 28 HG1 LYS 28 3.725 -7.152 7.612 194 HD2 LYS 28 HD2 LYS 28 1.015 -8.284 8.302 195 HD3 LYS 28 HD1 LYS 28 2.547 -9.023 8.771 196 HE2 LYS 28 HE2 LYS 28 3.142 -6.927 9.950 197 HE3 LYS 28 HE1 LYS 28 1.548 -6.288 9.555 198 HZ1 LYS 28 HZ3 LYS 28 1.600 -7.198 11.785 199 HZ2 LYS 28 HZ1 LYS 28 2.084 -8.707 11.190 200 HZ3 LYS 28 HZ2 LYS 28 0.552 -8.099 10.809 201 H PHE 29 HN PHE 29 1.741 -5.750 3.890 202 HA PHE 29 HA PHE 29 3.193 -7.832 2.807 203 HD1 PHE 29 HD1 PHE 29 3.561 -5.306 -0.133 204 HD2 PHE 29 HD2 PHE 29 1.139 -8.758 0.205 205 HE1 PHE 29 HE1 PHE 29 4.148 -5.926 -2.437 206 HE2 PHE 29 HE2 PHE 29 1.708 -9.405 -2.101 207 HZ PHE 29 HZ PHE 29 3.220 -7.982 -3.429 208 HB2 PHE 29 HB2 PHE 29 1.098 -7.225 1.868 209 HB3 PHE 29 HB1 PHE 29 1.625 -5.579 1.566 210 H PHE 30 HN PHE 30 3.682 -4.358 2.448 211 HA PHE 30 HA PHE 30 5.847 -4.472 0.619 212 HD1 PHE 30 HD1 PHE 30 4.215 -3.603 -0.611 213 HD2 PHE 30 HD2 PHE 30 3.533 -0.874 2.570 214 HE1 PHE 30 HE1 PHE 30 2.023 -3.036 -1.577 215 HE2 PHE 30 HE2 PHE 30 1.339 -0.294 1.616 216 HZ PHE 30 HZ PHE 30 0.579 -1.378 -0.462 217 HB2 PHE 30 HB2 PHE 30 5.381 -2.272 2.623 218 HB3 PHE 30 HB1 PHE 30 6.106 -2.151 1.023 219 H GLN 31 HN GLN 31 5.699 -3.784 4.042 220 HA GLN 31 HA GLN 31 8.387 -3.595 4.552 221 HB2 GLN 31 HB2 GLN 31 6.280 -3.141 6.031 222 HB3 GLN 31 HB1 GLN 31 6.586 -4.776 6.606 223 HG2 GLN 31 HG2 GLN 31 7.588 -2.958 7.996 224 HG3 GLN 31 HG1 GLN 31 8.734 -4.173 7.426 225 HE21 GLN 31 HE21 GLN 31 10.137 -3.647 5.724 226 HE22 GLN 31 HE22 GLN 31 10.516 -2.013 5.316 227 H THR 32 HN THR 32 6.416 -6.452 5.381 228 HA THR 32 HA THR 32 8.390 -8.081 6.270 229 HB THR 32 HB THR 32 6.063 -8.917 4.537 230 HG1 THR 32 HG1 THR 32 4.983 -9.128 6.486 231 HG21 THR 32 HG23 THR 32 6.298 -11.107 5.599 232 HG22 THR 32 HG21 THR 32 7.719 -10.539 6.475 233 HG23 THR 32 HG22 THR 32 7.765 -10.680 4.718 234 H SER 33 HN SER 33 7.300 -8.049 2.859 235 HA SER 33 HA SER 33 9.600 -9.644 2.136 236 HG SER 33 HG SER 33 9.094 -9.288 -0.844 237 HB2 SER 33 HB2 SER 33 7.399 -10.161 1.236 238 HB3 SER 33 HB1 SER 33 7.375 -8.627 0.391 239 H GLY 34 HN GLY 34 8.362 -6.404 1.144 240 HA2 GLY 34 HA2 GLY 34 10.865 -6.149 -0.333 241 HA3 GLY 34 HA1 GLY 34 9.437 -5.193 -0.591 242 H LEU 35 HN LEU 35 8.916 -3.807 1.515 243 HA LEU 35 HA LEU 35 10.701 -1.732 1.351 244 HG LEU 35 HG LEU 35 7.785 -1.196 1.139 245 HB2 LEU 35 HB2 LEU 35 8.383 -2.470 3.016 246 HB3 LEU 35 HB1 LEU 35 9.415 -1.211 3.662 247 HD11 LEU 35 HD11 LEU 35 7.968 0.683 3.483 248 HD12 LEU 35 HD12 LEU 35 6.674 -0.474 3.169 249 HD13 LEU 35 HD13 LEU 35 6.922 0.891 2.079 250 HD21 LEU 35 HD23 LEU 35 10.167 0.468 1.802 251 HD22 LEU 35 HD21 LEU 35 8.862 1.118 0.817 252 HD23 LEU 35 HD22 LEU 35 9.743 -0.312 0.284 253 H SER 36 HN SER 36 10.585 -4.303 3.750 254 HA SER 36 HA SER 36 12.059 -3.707 5.774 255 HG SER 36 HG SER 36 13.511 -6.886 3.857 256 HB2 SER 36 HB2 SER 36 13.260 -5.869 5.681 257 HB3 SER 36 HB1 SER 36 11.548 -6.015 5.282 258 H LYS 37 HN LYS 37 13.818 -4.156 2.655 259 HA LYS 37 HA LYS 37 15.834 -2.305 3.674 260 HB2 LYS 37 HB2 LYS 37 16.760 -4.892 2.501 261 HB3 LYS 37 HB1 LYS 37 17.645 -3.749 3.496 262 HG2 LYS 37 HG2 LYS 37 16.508 -4.428 5.454 263 HG3 LYS 37 HG1 LYS 37 15.346 -5.366 4.519 264 HD2 LYS 37 HD2 LYS 37 18.282 -5.934 4.526 265 HD3 LYS 37 HD1 LYS 37 17.152 -6.685 5.653 266 HE2 LYS 37 HE2 LYS 37 15.904 -7.636 3.799 267 HE3 LYS 37 HE1 LYS 37 16.972 -6.835 2.646 268 HZ1 LYS 37 HZ3 LYS 37 18.800 -8.165 3.417 269 HZ2 LYS 37 HZ1 LYS 37 17.522 -9.189 2.992 270 HZ3 LYS 37 HZ2 LYS 37 17.847 -8.872 4.622 271 H MET 38 HN MET 38 14.247 -1.478 1.684 272 HA MET 38 HA MET 38 15.823 -1.902 -0.753 273 HB2 MET 38 HB2 MET 38 12.954 -1.045 -0.517 274 HB3 MET 38 HB1 MET 38 13.825 -1.488 -1.968 275 HG2 MET 38 HG2 MET 38 13.602 -3.411 0.270 276 HG3 MET 38 HG1 MET 38 12.263 -3.198 -0.843 277 HE1 MET 38 HE3 MET 38 13.531 -6.492 -2.342 278 HE2 MET 38 HE1 MET 38 12.118 -5.488 -2.017 279 HE3 MET 38 HE2 MET 38 13.142 -6.025 -0.687 280 H SER 39 HN SER 39 16.008 -0.173 -2.245 281 HA SER 39 HA SER 39 16.654 2.329 -1.057 282 HG SER 39 HG SER 39 18.260 0.536 -3.635 283 HB2 SER 39 HB2 SER 39 16.490 1.589 -3.987 284 HB3 SER 39 HB1 SER 39 17.302 3.001 -3.315 285 H ALA 40 HN ALA 40 15.862 4.407 -2.066 286 HA ALA 40 HA ALA 40 13.060 4.638 -1.602 287 HB1 ALA 40 HB3 ALA 40 14.757 6.743 -2.908 288 HB2 ALA 40 HB1 ALA 40 14.827 6.402 -1.178 289 HB3 ALA 40 HB2 ALA 40 13.315 6.949 -1.908 290 H SER 41 HN SER 41 15.020 4.736 -4.577 291 HA SER 41 HA SER 41 13.224 5.585 -6.412 292 HG SER 41 HG SER 41 16.079 5.670 -6.370 293 HB2 SER 41 HB2 SER 41 15.412 3.539 -6.597 294 HB3 SER 41 HB1 SER 41 14.467 4.010 -8.007 295 H GLN 42 HN GLN 42 13.729 2.117 -5.698 296 HA GLN 42 HA GLN 42 11.663 1.249 -7.374 297 HB2 GLN 42 HB2 GLN 42 11.766 -0.876 -6.301 298 HB3 GLN 42 HB1 GLN 42 13.392 -0.239 -6.489 299 HG2 GLN 42 HG2 GLN 42 13.529 0.330 -4.233 300 HG3 GLN 42 HG1 GLN 42 11.818 0.017 -3.964 301 HE21 GLN 42 HE21 GLN 42 11.154 -2.008 -3.466 302 HE22 GLN 42 HE22 GLN 42 12.192 -3.383 -3.393 303 H VAL 43 HN VAL 43 11.589 2.571 -4.244 304 HA VAL 43 HA VAL 43 9.139 1.584 -3.301 305 HB VAL 43 HB VAL 43 9.954 4.433 -2.833 306 HG11 VAL 43 HG11 VAL 43 8.615 2.454 -1.009 307 HG12 VAL 43 HG12 VAL 43 7.748 3.593 -2.040 308 HG13 VAL 43 HG13 VAL 43 8.805 4.191 -0.759 309 HG21 VAL 43 HG23 VAL 43 11.258 3.588 -0.897 310 HG22 VAL 43 HG21 VAL 43 11.940 3.151 -2.452 311 HG23 VAL 43 HG22 VAL 43 11.051 1.955 -1.522 312 H LYS 44 HN LYS 44 9.933 4.058 -5.610 313 HA LYS 44 HA LYS 44 7.461 5.295 -5.960 314 HB2 LYS 44 HB2 LYS 44 9.647 4.643 -7.947 315 HB3 LYS 44 HB1 LYS 44 8.245 5.610 -8.352 316 HG2 LYS 44 HG2 LYS 44 8.943 7.406 -7.146 317 HG3 LYS 44 HG1 LYS 44 9.847 6.408 -6.025 318 HD2 LYS 44 HD2 LYS 44 11.271 7.805 -7.521 319 HD3 LYS 44 HD1 LYS 44 11.609 6.075 -7.592 320 HE2 LYS 44 HE2 LYS 44 11.585 6.856 -9.829 321 HE3 LYS 44 HE1 LYS 44 10.086 5.965 -9.570 322 HZ1 LYS 44 HZ3 LYS 44 9.716 8.039 -10.770 323 HZ2 LYS 44 HZ1 LYS 44 10.352 8.919 -9.473 324 HZ3 LYS 44 HZ2 LYS 44 8.918 8.045 -9.278 325 H ASP 45 HN ASP 45 8.829 2.384 -7.410 326 HA ASP 45 HA ASP 45 6.581 1.725 -8.981 327 HB2 ASP 45 HB2 ASP 45 9.171 0.600 -8.366 328 HB3 ASP 45 HB1 ASP 45 7.939 -0.652 -8.337 329 H ILE 46 HN ILE 46 7.737 0.703 -5.798 330 HA ILE 46 HA ILE 46 5.805 -1.157 -5.165 331 HB ILE 46 HB ILE 46 7.528 0.660 -3.571 332 HG12 ILE 46 HG12 ILE 46 8.565 -1.348 -2.871 333 HG13 ILE 46 HG11 ILE 46 7.215 -2.323 -3.418 334 HG21 ILE 46 HG21 ILE 46 5.219 -0.865 -2.448 335 HG22 ILE 46 HG22 ILE 46 5.727 0.795 -2.135 336 HG23 ILE 46 HG23 ILE 46 6.667 -0.549 -1.490 337 HD11 ILE 46 HD13 ILE 46 7.803 -1.580 -5.761 338 HD12 ILE 46 HD11 ILE 46 8.951 -2.655 -4.970 339 HD13 ILE 46 HD12 ILE 46 9.291 -0.932 -5.075 340 H PHE 47 HN PHE 47 5.792 2.326 -4.465 341 HA PHE 47 HA PHE 47 3.440 2.833 -3.307 342 HD1 PHE 47 HD1 PHE 47 2.100 5.384 -3.406 343 HD2 PHE 47 HD2 PHE 47 4.042 5.267 -7.189 344 HE1 PHE 47 HE1 PHE 47 0.415 6.919 -4.327 345 HE2 PHE 47 HE2 PHE 47 2.357 6.800 -8.111 346 HZ PHE 47 HZ PHE 47 0.537 7.631 -6.676 347 HB2 PHE 47 HB2 PHE 47 4.637 4.726 -3.806 348 HB3 PHE 47 HB1 PHE 47 5.015 4.206 -5.423 349 H ARG 48 HN ARG 48 3.884 1.890 -6.610 350 HA ARG 48 HA ARG 48 1.310 2.441 -7.593 351 HE ARG 48 HE ARG 48 2.600 4.613 -11.234 352 HB2 ARG 48 HB2 ARG 48 3.249 0.332 -8.537 353 HB3 ARG 48 HB1 ARG 48 1.855 0.919 -9.431 354 HG2 ARG 48 HG2 ARG 48 4.330 2.449 -8.689 355 HG3 ARG 48 HG1 ARG 48 3.770 2.011 -10.305 356 HD2 ARG 48 HD2 ARG 48 1.644 3.376 -9.584 357 HD3 ARG 48 HD1 ARG 48 2.765 4.123 -8.443 358 HH11 ARG 48 HH11 ARG 48 4.903 4.306 -8.639 359 HH12 ARG 48 HH12 ARG 48 6.061 5.367 -9.370 360 HH21 ARG 48 HH21 ARG 48 4.119 6.001 -12.208 361 HH22 ARG 48 HH22 ARG 48 5.616 6.330 -11.399 362 H PHE 49 HN PHE 49 2.459 -0.213 -5.635 363 HA PHE 49 HA PHE 49 0.612 -2.177 -6.242 364 HD1 PHE 49 HD1 PHE 49 -0.237 -1.798 -2.229 365 HD2 PHE 49 HD2 PHE 49 1.321 -4.828 -4.775 366 HE1 PHE 49 HE1 PHE 49 -1.625 -3.468 -1.078 367 HE2 PHE 49 HE2 PHE 49 -0.064 -6.508 -3.627 368 HZ PHE 49 HZ PHE 49 -1.539 -5.828 -1.776 369 HB2 PHE 49 HB2 PHE 49 2.334 -2.692 -4.694 370 HB3 PHE 49 HB1 PHE 49 1.822 -1.452 -3.567 371 H ILE 50 HN ILE 50 0.225 0.322 -3.691 372 HA ILE 50 HA ILE 50 -2.538 -0.202 -3.356 373 HB ILE 50 HB ILE 50 -2.609 2.075 -2.278 374 HG12 ILE 50 HG12 ILE 50 0.365 2.067 -2.837 375 HG13 ILE 50 HG11 ILE 50 -0.807 3.123 -3.622 376 HG21 ILE 50 HG21 ILE 50 -0.854 -0.141 -1.450 377 HG22 ILE 50 HG22 ILE 50 -2.304 0.525 -0.694 378 HG23 ILE 50 HG23 ILE 50 -0.761 1.363 -0.532 379 HD11 ILE 50 HD13 ILE 50 -0.610 3.106 -0.649 380 HD12 ILE 50 HD11 ILE 50 -1.120 4.397 -1.736 381 HD13 ILE 50 HD12 ILE 50 0.590 3.984 -1.596 382 H ASP 51 HN ASP 51 -2.979 2.969 -3.828 383 HA ASP 51 HA ASP 51 -4.136 2.548 -6.392 384 HB2 ASP 51 HB2 ASP 51 -4.094 4.718 -4.381 385 HB3 ASP 51 HB1 ASP 51 -4.306 5.232 -6.060 386 H ASN 52 HN ASN 52 -3.590 3.587 -8.338 387 HA ASN 52 HA ASN 52 -0.711 4.109 -8.583 388 HB2 ASN 52 HB2 ASN 52 -1.543 2.352 -10.037 389 HB3 ASN 52 HB1 ASN 52 -2.778 3.423 -10.676 390 HD21 ASN 52 HD21 ASN 52 -2.301 4.758 -12.280 391 HD22 ASN 52 HD22 ASN 52 -0.761 4.871 -13.055 392 H ASP 53 HN ASP 53 -3.818 5.447 -9.475 393 HA ASP 53 HA ASP 53 -2.856 8.124 -9.274 394 HB2 ASP 53 HB2 ASP 53 -1.999 7.615 -11.519 395 HB3 ASP 53 HB1 ASP 53 -3.596 7.072 -12.020 396 H GLN 54 HN GLN 54 -4.609 9.532 -8.961 397 HA GLN 54 HA GLN 54 -7.245 8.610 -9.617 398 HB2 GLN 54 HB2 GLN 54 -6.728 9.410 -6.781 399 HB3 GLN 54 HB1 GLN 54 -8.059 8.484 -7.450 400 HG2 GLN 54 HG2 GLN 54 -6.362 6.674 -7.951 401 HG3 GLN 54 HG1 GLN 54 -5.255 7.579 -6.929 402 HE21 GLN 54 HE21 GLN 54 -5.748 7.804 -4.731 403 HE22 GLN 54 HE22 GLN 54 -6.714 6.637 -3.919 404 H SER 55 HN SER 55 -5.657 11.048 -7.506 405 HA SER 55 HA SER 55 -6.640 13.160 -9.255 406 HG SER 55 HG SER 55 -6.690 13.203 -5.574 407 HB2 SER 55 HB2 SER 55 -7.566 14.391 -7.247 408 HB3 SER 55 HB1 SER 55 -8.491 12.974 -7.748 409 H GLY 56 HN GLY 56 -4.003 12.347 -8.911 410 HA2 GLY 56 HA2 GLY 56 -2.048 13.688 -8.823 411 HA3 GLY 56 HA1 GLY 56 -2.890 14.785 -7.733 412 H TYR 57 HN TYR 57 -3.802 12.397 -6.179 413 HA TYR 57 HA TYR 57 -1.444 11.249 -4.982 414 HD1 TYR 57 HD1 TYR 57 -4.515 13.938 -3.654 415 HD2 TYR 57 HD2 TYR 57 -0.432 14.763 -4.406 416 HE1 TYR 57 HE1 TYR 57 -5.116 16.250 -4.290 417 HE2 TYR 57 HE2 TYR 57 -0.994 17.080 -5.029 418 HH TYR 57 HH TYR 57 -4.062 18.447 -4.430 419 HB2 TYR 57 HB2 TYR 57 -2.787 12.526 -2.793 420 HB3 TYR 57 HB1 TYR 57 -1.123 12.733 -3.298 421 H LEU 58 HN LEU 58 -2.113 9.904 -3.067 422 HA LEU 58 HA LEU 58 -4.813 8.878 -3.568 423 HG LEU 58 HG LEU 58 -1.606 7.955 -4.021 424 HB2 LEU 58 HB2 LEU 58 -2.783 7.438 -1.903 425 HB3 LEU 58 HB1 LEU 58 -4.113 6.777 -2.833 426 HD11 LEU 58 HD11 LEU 58 -2.379 5.168 -3.312 427 HD12 LEU 58 HD12 LEU 58 -0.819 5.985 -3.137 428 HD13 LEU 58 HD13 LEU 58 -1.371 5.464 -4.726 429 HD21 LEU 58 HD23 LEU 58 -2.614 6.552 -6.014 430 HD22 LEU 58 HD21 LEU 58 -3.066 8.231 -5.728 431 HD23 LEU 58 HD22 LEU 58 -4.119 6.933 -5.188 432 H ASP 59 HN ASP 59 -6.226 8.442 -1.765 433 HA ASP 59 HA ASP 59 -5.391 9.610 0.777 434 HB2 ASP 59 HB2 ASP 59 -6.364 11.446 -0.608 435 HB3 ASP 59 HB1 ASP 59 -7.885 10.556 -0.643 436 H GLY 60 HN GLY 60 -6.870 9.247 2.494 437 HA2 GLY 60 HA2 GLY 60 -7.439 6.609 2.931 438 HA3 GLY 60 HA1 GLY 60 -8.235 7.921 3.784 439 H ASP 61 HN ASP 61 -9.426 8.881 1.215 440 HA ASP 61 HA ASP 61 -11.876 7.395 1.428 441 HB2 ASP 61 HB2 ASP 61 -11.231 9.308 -0.792 442 HB3 ASP 61 HB1 ASP 61 -12.792 8.989 -0.033 443 H GLU 62 HN GLU 62 -9.467 7.965 -1.032 444 HA GLU 62 HA GLU 62 -10.601 6.170 -2.937 445 HB2 GLU 62 HB2 GLU 62 -7.949 7.577 -2.892 446 HB3 GLU 62 HB1 GLU 62 -8.681 6.801 -4.295 447 HG2 GLU 62 HG2 GLU 62 -9.879 9.107 -2.794 448 HG3 GLU 62 HG1 GLU 62 -8.917 9.264 -4.262 449 H LEU 63 HN LEU 63 -8.117 5.980 -0.514 450 HA LEU 63 HA LEU 63 -6.397 4.058 -1.254 451 HG LEU 63 HG LEU 63 -6.377 6.197 1.068 452 HB2 LEU 63 HB2 LEU 63 -7.840 4.395 1.367 453 HB3 LEU 63 HB1 LEU 63 -6.566 3.219 1.170 454 HD11 LEU 63 HD11 LEU 63 -4.285 5.001 2.508 455 HD12 LEU 63 HD12 LEU 63 -5.796 4.248 3.017 456 HD13 LEU 63 HD13 LEU 63 -5.607 5.995 3.107 457 HD21 LEU 63 HD23 LEU 63 -4.471 4.210 -0.089 458 HD22 LEU 63 HD21 LEU 63 -3.927 5.787 0.490 459 HD23 LEU 63 HD22 LEU 63 -5.114 5.689 -0.817 460 H LYS 64 HN LYS 64 -9.745 3.339 -0.180 461 HA LYS 64 HA LYS 64 -9.594 0.602 -0.194 462 HB2 LYS 64 HB2 LYS 64 -11.943 2.300 -1.009 463 HB3 LYS 64 HB1 LYS 64 -12.007 0.647 -0.444 464 HG2 LYS 64 HG2 LYS 64 -11.305 1.275 1.738 465 HG3 LYS 64 HG1 LYS 64 -10.968 2.922 1.198 466 HD2 LYS 64 HD2 LYS 64 -13.710 1.876 0.779 467 HD3 LYS 64 HD1 LYS 64 -13.234 2.264 2.432 468 HE2 LYS 64 HE2 LYS 64 -12.921 4.167 0.121 469 HE3 LYS 64 HE1 LYS 64 -14.354 4.120 1.147 470 HZ1 LYS 64 HZ3 LYS 64 -12.899 4.548 3.066 471 HZ2 LYS 64 HZ1 LYS 64 -12.861 5.803 1.931 472 HZ3 LYS 64 HZ2 LYS 64 -11.578 4.706 2.021 473 H TYR 65 HN TYR 65 -9.741 2.733 -2.942 474 HA TYR 65 HA TYR 65 -10.738 0.758 -4.754 475 HD1 TYR 65 HD1 TYR 65 -12.193 2.059 -3.881 476 HD2 TYR 65 HD2 TYR 65 -10.530 5.247 -6.153 477 HE1 TYR 65 HE1 TYR 65 -14.013 3.544 -3.128 478 HE2 TYR 65 HE2 TYR 65 -12.353 6.728 -5.425 479 HH TYR 65 HH TYR 65 -14.464 5.930 -2.883 480 HB2 TYR 65 HB2 TYR 65 -9.197 3.228 -5.520 481 HB3 TYR 65 HB1 TYR 65 -10.319 2.315 -6.514 482 H PHE 66 HN PHE 66 -7.654 1.226 -3.373 483 HA PHE 66 HA PHE 66 -5.919 0.542 -5.410 484 HD1 PHE 66 HD2 PHE 66 -3.875 -1.780 -4.585 485 HD2 PHE 66 HD1 PHE 66 -5.702 -0.824 -0.872 486 HE1 PHE 66 HE2 PHE 66 -3.105 -3.925 -3.657 487 HE2 PHE 66 HE1 PHE 66 -4.958 -2.971 0.064 488 HZ PHE 66 HZ PHE 66 -3.647 -4.524 -1.331 489 HB2 PHE 66 HB2 PHE 66 -4.482 0.708 -3.685 490 HB3 PHE 66 HB1 PHE 66 -5.819 0.703 -2.561 491 H LEU 67 HN LEU 67 -7.644 -1.652 -3.241 492 HA LEU 67 HA LEU 67 -6.775 -4.058 -4.451 493 HG LEU 67 HG LEU 67 -6.989 -3.975 -1.541 494 HB2 LEU 67 HB2 LEU 67 -9.022 -3.284 -2.652 495 HB3 LEU 67 HB1 LEU 67 -9.149 -4.823 -3.488 496 HD11 LEU 67 HD11 LEU 67 -9.170 -6.046 -1.435 497 HD12 LEU 67 HD12 LEU 67 -8.988 -4.619 -0.417 498 HD13 LEU 67 HD13 LEU 67 -7.839 -5.949 -0.283 499 HD21 LEU 67 HD23 LEU 67 -7.201 -6.417 -3.287 500 HD22 LEU 67 HD21 LEU 67 -6.172 -6.329 -1.856 501 HD23 LEU 67 HD22 LEU 67 -5.888 -5.242 -3.215 502 H GLN 68 HN GLN 68 -9.353 -1.827 -5.040 503 HA GLN 68 HA GLN 68 -10.814 -3.379 -6.877 504 HB2 GLN 68 HB2 GLN 68 -10.692 -0.433 -6.275 505 HB3 GLN 68 HB1 GLN 68 -11.752 -1.078 -7.504 506 HG2 GLN 68 HG2 GLN 68 -12.555 -2.665 -5.618 507 HG3 GLN 68 HG1 GLN 68 -11.840 -1.451 -4.555 508 HE21 GLN 68 HE21 GLN 68 -14.633 -2.243 -4.902 509 HE22 GLN 68 HE22 GLN 68 -15.486 -0.800 -5.322 510 H LYS 69 HN LYS 69 -8.230 -0.914 -7.297 511 HA LYS 69 HA LYS 69 -8.148 -0.772 -9.989 512 HB2 LYS 69 HB2 LYS 69 -5.762 -0.943 -8.136 513 HB3 LYS 69 HB1 LYS 69 -5.757 -0.258 -9.755 514 HG2 LYS 69 HG2 LYS 69 -6.933 0.818 -7.243 515 HG3 LYS 69 HG1 LYS 69 -5.931 1.621 -8.445 516 HD2 LYS 69 HD2 LYS 69 -7.791 1.583 -10.028 517 HD3 LYS 69 HD1 LYS 69 -8.778 0.749 -8.832 518 HE2 LYS 69 HE2 LYS 69 -9.418 2.974 -8.802 519 HE3 LYS 69 HE1 LYS 69 -8.473 2.720 -7.338 520 HZ1 LYS 69 HZ3 LYS 69 -6.556 3.702 -8.500 521 HZ2 LYS 69 HZ1 LYS 69 -7.843 4.792 -8.363 522 HZ3 LYS 69 HZ2 LYS 69 -7.536 4.026 -9.840 523 H PHE 70 HN PHE 70 -6.115 -2.938 -8.045 524 HA PHE 70 HA PHE 70 -5.220 -4.455 -10.263 525 HD1 PHE 70 HD2 PHE 70 -3.792 -7.342 -9.274 526 HD2 PHE 70 HD1 PHE 70 -5.719 -5.632 -5.886 527 HE1 PHE 70 HE2 PHE 70 -3.997 -9.579 -8.264 528 HE2 PHE 70 HE1 PHE 70 -5.927 -7.861 -4.870 529 HZ PHE 70 HZ PHE 70 -5.067 -9.841 -6.061 530 HB2 PHE 70 HB2 PHE 70 -3.651 -4.906 -8.737 531 HB3 PHE 70 HB1 PHE 70 -4.649 -4.239 -7.459 532 H GLN 71 HN GLN 71 -7.674 -5.065 -7.761 533 HA GLN 71 HA GLN 71 -8.330 -7.628 -8.936 534 HB2 GLN 71 HB2 GLN 71 -8.461 -7.266 -6.482 535 HB3 GLN 71 HB1 GLN 71 -9.784 -6.140 -6.749 536 HG2 GLN 71 HG2 GLN 71 -11.139 -7.906 -7.702 537 HG3 GLN 71 HG1 GLN 71 -9.808 -9.046 -7.523 538 HE21 GLN 71 HE21 GLN 71 -10.660 -6.603 -5.152 539 HE22 GLN 71 HE22 GLN 71 -11.195 -7.701 -3.940 540 H SER 72 HN SER 72 -10.471 -4.978 -8.043 541 HA SER 72 HA SER 72 -11.833 -3.713 -9.511 542 HG SER 72 HG SER 72 -10.683 -3.819 -11.643 543 HB2 SER 72 HB2 SER 72 -12.091 -6.227 -11.151 544 HB3 SER 72 HB1 SER 72 -12.852 -4.682 -11.506 545 H ASP 73 HN ASP 73 -12.061 -5.670 -7.223 546 HA ASP 73 HA ASP 73 -14.905 -5.576 -6.964 547 HB2 ASP 73 HB2 ASP 73 -14.657 -7.652 -8.267 548 HB3 ASP 73 HB1 ASP 73 -13.554 -8.285 -7.049 549 H ALA 74 HN ALA 74 -12.472 -4.595 -5.581 550 HA ALA 74 HA ALA 74 -11.908 -6.031 -3.251 551 HB1 ALA 74 HB3 ALA 74 -10.796 -4.135 -2.537 552 HB2 ALA 74 HB1 ALA 74 -11.960 -3.044 -3.286 553 HB3 ALA 74 HB2 ALA 74 -10.796 -3.907 -4.288 554 H ARG 75 HN ARG 75 -12.690 -5.785 -1.122 555 HA ARG 75 HA ARG 75 -15.498 -5.326 -0.924 556 HE ARG 75 HE ARG 75 -10.598 -5.731 2.148 557 HB2 ARG 75 HB2 ARG 75 -15.186 -5.805 1.470 558 HB3 ARG 75 HB1 ARG 75 -14.420 -7.020 0.458 559 HG2 ARG 75 HG2 ARG 75 -12.615 -4.855 1.152 560 HG3 ARG 75 HG1 ARG 75 -13.266 -5.683 2.569 561 HD2 ARG 75 HD2 ARG 75 -12.501 -7.807 1.741 562 HD3 ARG 75 HD1 ARG 75 -11.996 -7.079 0.217 563 HH11 ARG 75 HH11 ARG 75 -10.949 -9.062 1.197 564 HH12 ARG 75 HH12 ARG 75 -9.346 -9.505 1.681 565 HH21 ARG 75 HH21 ARG 75 -8.484 -6.302 2.791 566 HH22 ARG 75 HH22 ARG 75 -7.944 -7.935 2.587 567 H GLU 76 HN GLU 76 -12.893 -3.257 -1.004 568 HA GLU 76 HA GLU 76 -12.930 -0.962 -0.978 569 HB2 GLU 76 HB2 GLU 76 -15.279 -1.088 0.918 570 HB3 GLU 76 HB1 GLU 76 -14.633 0.324 0.107 571 HG2 GLU 76 HG2 GLU 76 -15.312 -0.505 -2.032 572 HG3 GLU 76 HG1 GLU 76 -15.825 -2.029 -1.318 573 H LEU 77 HN LEU 77 -11.437 -2.692 0.413 574 HA LEU 77 HA LEU 77 -10.293 -3.169 2.386 575 HG LEU 77 HG LEU 77 -9.082 -2.035 0.101 576 HB2 LEU 77 HB2 LEU 77 -9.889 -0.270 1.730 577 HB3 LEU 77 HB1 LEU 77 -8.938 -1.086 2.951 578 HD11 LEU 77 HD11 LEU 77 -6.620 -0.752 0.929 579 HD12 LEU 77 HD12 LEU 77 -7.997 0.348 0.944 580 HD13 LEU 77 HD13 LEU 77 -7.583 -0.522 -0.531 581 HD21 LEU 77 HD23 LEU 77 -6.675 -2.590 1.589 582 HD22 LEU 77 HD21 LEU 77 -7.770 -3.704 0.772 583 HD23 LEU 77 HD22 LEU 77 -8.094 -3.209 2.433 584 H THR 78 HN THR 78 -13.047 -2.589 3.009 585 HA THR 78 HA THR 78 -14.466 -1.746 4.613 586 HB THR 78 HB THR 78 -14.045 -2.723 6.759 587 HG1 THR 78 HG1 THR 78 -11.996 -3.418 7.362 588 HG21 THR 78 HG23 THR 78 -13.651 -5.003 6.157 589 HG22 THR 78 HG21 THR 78 -12.756 -4.521 4.716 590 HG23 THR 78 HG22 THR 78 -14.494 -4.236 4.810 591 H GLU 79 HN GLU 79 -14.402 -0.750 6.998 592 HA GLU 79 HA GLU 79 -13.410 1.871 6.741 593 HB2 GLU 79 HB2 GLU 79 -15.419 1.153 8.071 594 HB3 GLU 79 HB1 GLU 79 -14.317 0.447 9.248 595 HG2 GLU 79 HG2 GLU 79 -13.318 2.654 9.588 596 HG3 GLU 79 HG1 GLU 79 -14.499 3.333 8.474 597 H SER 80 HN SER 80 -12.471 -0.955 8.595 598 HA SER 80 HA SER 80 -10.307 0.227 9.982 599 HG SER 80 HG SER 80 -9.915 -2.282 11.893 600 HB2 SER 80 HB2 SER 80 -11.598 -1.750 10.747 601 HB3 SER 80 HB1 SER 80 -10.798 -2.704 9.501 602 H GLU 81 HN GLU 81 -10.291 -2.001 7.128 603 HA GLU 81 HA GLU 81 -7.558 -2.381 7.081 604 HB2 GLU 81 HB2 GLU 81 -9.634 -3.258 5.546 605 HB3 GLU 81 HB1 GLU 81 -8.770 -2.220 4.431 606 HG2 GLU 81 HG2 GLU 81 -7.584 -4.507 5.952 607 HG3 GLU 81 HG1 GLU 81 -7.986 -4.489 4.236 608 H THR 82 HN THR 82 -9.367 0.308 5.553 609 HA THR 82 HA THR 82 -7.184 1.301 4.089 610 HB THR 82 HB THR 82 -8.286 3.457 4.081 611 HG1 THR 82 HG1 THR 82 -10.366 3.559 5.268 612 HG21 THR 82 HG23 THR 82 -10.122 1.100 3.724 613 HG22 THR 82 HG21 THR 82 -9.122 1.885 2.499 614 HG23 THR 82 HG22 THR 82 -10.511 2.733 3.183 615 H LYS 83 HN LYS 83 -7.846 1.237 7.469 616 HA LYS 83 HA LYS 83 -6.368 3.425 8.376 617 HB2 LYS 83 HB2 LYS 83 -7.819 1.930 9.788 618 HB3 LYS 83 HB1 LYS 83 -6.553 0.712 9.709 619 HG2 LYS 83 HG2 LYS 83 -5.013 2.214 10.843 620 HG3 LYS 83 HG1 LYS 83 -6.256 3.466 10.892 621 HD2 LYS 83 HD2 LYS 83 -6.205 2.394 13.031 622 HD3 LYS 83 HD1 LYS 83 -7.681 1.890 12.207 623 HE2 LYS 83 HE2 LYS 83 -6.629 -0.010 13.289 624 HE3 LYS 83 HE1 LYS 83 -6.585 -0.198 11.537 625 HZ1 LYS 83 HZ3 LYS 83 -4.475 -0.797 12.564 626 HZ2 LYS 83 HZ1 LYS 83 -4.331 0.756 13.220 627 HZ3 LYS 83 HZ2 LYS 83 -4.290 0.539 11.543 628 H SER 84 HN SER 84 -5.422 0.151 7.475 629 HA SER 84 HA SER 84 -2.756 0.170 8.170 630 HG SER 84 HG SER 84 -4.555 -2.604 7.427 631 HB2 SER 84 HB2 SER 84 -4.313 -1.143 5.952 632 HB3 SER 84 HB1 SER 84 -2.598 -1.400 6.144 633 H LEU 85 HN LEU 85 -4.261 1.028 5.079 634 HA LEU 85 HA LEU 85 -1.998 2.008 3.788 635 HG LEU 85 HG LEU 85 -4.357 0.298 2.975 636 HB2 LEU 85 HB2 LEU 85 -4.935 2.616 3.515 637 HB3 LEU 85 HB1 LEU 85 -3.730 3.175 2.382 638 HD11 LEU 85 HD11 LEU 85 -5.095 0.389 0.543 639 HD12 LEU 85 HD12 LEU 85 -5.110 2.139 0.742 640 HD13 LEU 85 HD13 LEU 85 -6.157 1.134 1.737 641 HD21 LEU 85 HD23 LEU 85 -2.017 0.631 2.413 642 HD22 LEU 85 HD21 LEU 85 -2.480 1.547 0.979 643 HD23 LEU 85 HD22 LEU 85 -2.871 -0.166 1.095 644 H MET 86 HN MET 86 -4.573 3.776 5.497 645 HA MET 86 HA MET 86 -3.572 6.344 5.292 646 HB2 MET 86 HB2 MET 86 -5.084 5.067 7.580 647 HB3 MET 86 HB1 MET 86 -4.802 6.797 7.435 648 HG2 MET 86 HG2 MET 86 -5.968 5.659 5.037 649 HG3 MET 86 HG1 MET 86 -6.966 5.401 6.466 650 HE1 MET 86 HE3 MET 86 -4.578 8.631 6.027 651 HE2 MET 86 HE1 MET 86 -5.598 9.496 4.877 652 HE3 MET 86 HE2 MET 86 -4.922 7.923 4.449 653 H ASP 87 HN ASP 87 -2.979 3.947 7.837 654 HA ASP 87 HA ASP 87 -1.059 5.538 9.241 655 HB2 ASP 87 HB2 ASP 87 -1.826 2.629 9.407 656 HB3 ASP 87 HB1 ASP 87 -0.632 3.375 10.465 657 H ALA 88 HN ALA 88 -0.895 3.991 6.333 658 HA ALA 88 HA ALA 88 1.629 2.673 6.480 659 HB1 ALA 88 HB3 ALA 88 1.184 1.979 4.389 660 HB2 ALA 88 HB1 ALA 88 0.584 3.560 3.881 661 HB3 ALA 88 HB2 ALA 88 -0.435 2.499 4.841 662 H ALA 89 HN ALA 89 0.605 5.932 5.941 663 HA ALA 89 HA ALA 89 3.336 6.804 5.828 664 HB1 ALA 89 HB3 ALA 89 2.930 6.103 3.477 665 HB2 ALA 89 HB1 ALA 89 3.318 7.814 3.640 666 HB3 ALA 89 HB2 ALA 89 1.643 7.314 3.348 667 H ASP 90 HN ASP 90 0.436 8.179 4.440 668 HA ASP 90 HA ASP 90 0.682 10.713 5.446 669 HB2 ASP 90 HB2 ASP 90 -1.414 11.038 4.416 670 HB3 ASP 90 HB1 ASP 90 -0.529 9.891 3.477 671 H ASN 91 HN ASN 91 0.977 9.452 7.783 672 HA ASN 91 HA ASN 91 -1.502 10.051 9.229 673 HB2 ASN 91 HB2 ASN 91 -0.230 8.441 10.962 674 HB3 ASN 91 HB1 ASN 91 -1.317 7.827 9.736 675 HD21 ASN 91 HD21 ASN 91 -0.400 6.989 7.838 676 HD22 ASN 91 HD22 ASN 91 1.174 6.310 7.878 677 H ASP 92 HN ASP 92 1.954 10.413 9.085 678 HA ASP 92 HA ASP 92 2.353 11.678 11.525 679 HB2 ASP 92 HB2 ASP 92 4.157 10.766 10.098 680 HB3 ASP 92 HB1 ASP 92 3.915 12.100 8.973 681 H GLY 93 HN GLY 93 0.892 12.978 8.622 682 HA2 GLY 93 HA2 GLY 93 -0.174 15.147 9.835 683 HA3 GLY 93 HA1 GLY 93 1.435 15.694 9.418 684 H ASP 94 HN ASP 94 -1.267 13.963 7.799 685 HA ASP 94 HA ASP 94 -1.738 16.031 5.972 686 HB2 ASP 94 HB2 ASP 94 0.377 15.499 4.980 687 HB3 ASP 94 HB1 ASP 94 0.008 13.780 4.960 688 H GLY 95 HN GLY 95 -1.579 12.660 5.060 689 HA2 GLY 95 HA2 GLY 95 -3.553 11.188 5.684 690 HA3 GLY 95 HA1 GLY 95 -4.534 12.552 5.170 691 H LYS 96 HN LYS 96 -1.996 12.524 3.082 692 HA LYS 96 HA LYS 96 -3.482 10.842 1.179 693 HB2 LYS 96 HB2 LYS 96 -3.408 12.671 -0.106 694 HB3 LYS 96 HB1 LYS 96 -2.303 13.458 0.990 695 HG2 LYS 96 HG2 LYS 96 -1.452 11.564 -1.187 696 HG3 LYS 96 HG1 LYS 96 -1.513 13.315 -1.348 697 HD2 LYS 96 HD2 LYS 96 -0.051 12.960 0.954 698 HD3 LYS 96 HD1 LYS 96 0.489 11.629 -0.077 699 HE2 LYS 96 HE2 LYS 96 1.902 13.542 -0.454 700 HE3 LYS 96 HE1 LYS 96 0.913 13.264 -1.886 701 HZ1 LYS 96 HZ3 LYS 96 0.969 15.596 -1.376 702 HZ2 LYS 96 HZ1 LYS 96 0.442 15.315 0.208 703 HZ3 LYS 96 HZ2 LYS 96 -0.594 15.015 -1.094 704 H ILE 97 HN ILE 97 -2.507 9.187 0.102 705 HA ILE 97 HA ILE 97 0.211 8.496 0.953 706 HB ILE 97 HB ILE 97 -1.799 6.700 -0.405 707 HG12 ILE 97 HG12 ILE 97 -2.655 7.252 1.785 708 HG13 ILE 97 HG11 ILE 97 -2.010 5.612 1.807 709 HG21 ILE 97 HG21 ILE 97 -0.183 4.961 0.634 710 HG22 ILE 97 HG22 ILE 97 0.951 6.314 0.701 711 HG23 ILE 97 HG23 ILE 97 0.282 5.797 -0.846 712 HD11 ILE 97 HD13 ILE 97 -0.002 6.374 2.880 713 HD12 ILE 97 HD11 ILE 97 -1.418 6.875 3.805 714 HD13 ILE 97 HD12 ILE 97 -0.565 8.045 2.790 715 H GLY 98 HN GLY 98 1.303 9.805 -0.620 716 HA2 GLY 98 HA2 GLY 98 0.995 8.858 -3.360 717 HA3 GLY 98 HA1 GLY 98 1.730 10.379 -2.862 718 H ALA 99 HN ALA 99 3.127 8.950 -4.588 719 HA ALA 99 HA ALA 99 4.797 6.891 -3.611 720 HB1 ALA 99 HB3 ALA 99 5.000 7.207 -5.903 721 HB2 ALA 99 HB1 ALA 99 6.493 7.936 -5.310 722 HB3 ALA 99 HB2 ALA 99 5.125 8.959 -5.754 723 H ASP 100 HN ASP 100 5.102 10.386 -3.488 724 HA ASP 100 HA ASP 100 7.556 10.571 -2.155 725 HB2 ASP 100 HB2 ASP 100 5.210 12.470 -1.915 726 HB3 ASP 100 HB1 ASP 100 6.895 12.844 -1.570 727 H GLU 101 HN GLU 101 4.252 10.686 -0.799 728 HA GLU 101 HA GLU 101 4.968 10.765 1.901 729 HB2 GLU 101 HB2 GLU 101 2.588 10.702 0.470 730 HB3 GLU 101 HB1 GLU 101 2.547 9.232 1.423 731 HG2 GLU 101 HG2 GLU 101 2.474 12.063 2.297 732 HG3 GLU 101 HG1 GLU 101 1.549 10.684 2.837 733 H PHE 102 HN PHE 102 4.034 8.017 -0.135 734 HA PHE 102 HA PHE 102 4.418 5.971 1.657 735 HD1 PHE 102 HD1 PHE 102 6.839 4.164 -0.095 736 HD2 PHE 102 HD2 PHE 102 2.628 3.609 -0.367 737 HE1 PHE 102 HE1 PHE 102 7.145 1.768 0.251 738 HE2 PHE 102 HE2 PHE 102 2.928 1.189 -0.031 739 HZ PHE 102 HZ PHE 102 5.190 0.264 0.282 740 HB2 PHE 102 HB2 PHE 102 3.470 5.711 -0.628 741 HB3 PHE 102 HB1 PHE 102 5.092 5.852 -1.305 742 H GLN 103 HN GLN 103 6.835 7.492 -0.478 743 HA GLN 103 HA GLN 103 9.034 5.893 0.177 744 HB2 GLN 103 HB2 GLN 103 8.915 8.818 -0.562 745 HB3 GLN 103 HB1 GLN 103 10.415 7.912 -0.415 746 HG2 GLN 103 HG2 GLN 103 8.437 6.645 -2.134 747 HG3 GLN 103 HG1 GLN 103 8.949 8.238 -2.674 748 HE21 GLN 103 HE21 GLN 103 10.062 7.489 -4.438 749 HE22 GLN 103 HE22 GLN 103 11.541 6.604 -4.312 750 H GLU 104 HN GLU 104 7.489 8.473 1.971 751 HA GLU 104 HA GLU 104 9.602 9.075 3.737 752 HB2 GLU 104 HB2 GLU 104 6.627 9.239 4.235 753 HB3 GLU 104 HB1 GLU 104 7.864 9.977 5.239 754 HG2 GLU 104 HG2 GLU 104 7.225 10.649 2.380 755 HG3 GLU 104 HG1 GLU 104 6.906 11.637 3.804 756 H MET 105 HN MET 105 7.010 6.673 3.966 757 HA MET 105 HA MET 105 7.499 5.814 6.576 758 HB2 MET 105 HB2 MET 105 5.593 5.237 4.893 759 HB3 MET 105 HB1 MET 105 6.629 3.883 4.467 760 HG2 MET 105 HG2 MET 105 5.710 4.489 7.262 761 HG3 MET 105 HG1 MET 105 4.903 3.366 6.176 762 HE1 MET 105 HE3 MET 105 6.636 1.035 8.812 763 HE2 MET 105 HE1 MET 105 5.191 1.167 7.811 764 HE3 MET 105 HE2 MET 105 5.617 2.470 8.918 765 H VAL 106 HN VAL 106 8.641 4.301 3.542 766 HA VAL 106 HA VAL 106 10.223 2.345 4.709 767 HB VAL 106 HB VAL 106 9.756 2.296 2.336 768 HG11 VAL 106 HG11 VAL 106 11.108 4.929 2.397 769 HG12 VAL 106 HG12 VAL 106 9.662 4.406 1.528 770 HG13 VAL 106 HG13 VAL 106 11.261 3.941 0.950 771 HG21 VAL 106 HG23 VAL 106 12.666 2.465 3.081 772 HG22 VAL 106 HG21 VAL 106 12.149 2.031 1.454 773 HG23 VAL 106 HG22 VAL 106 11.681 1.022 2.823 774 H HIS 107 HN HIS 107 10.801 5.730 4.220 775 HA HIS 107 HA HIS 107 13.616 5.597 4.818 776 HD1 HIS 107 HD1 HIS 107 12.669 9.789 5.985 777 HD2 HIS 107 HD2 HIS 107 15.638 7.617 4.052 778 HE1 HIS 107 HE1 HIS 107 14.818 10.995 6.486 779 HE2 HIS 107 HE2 HIS 107 16.594 9.696 5.260 780 HB2 HIS 107 HB2 HIS 107 12.779 7.343 3.332 781 HB3 HIS 107 HB1 HIS 107 11.730 7.953 4.605 782 H SER 108 HN SER 108 11.054 7.486 6.404 783 HA SER 108 HA SER 108 10.848 8.179 8.571 784 HG SER 108 HG SER 108 10.379 7.279 10.646 785 HB2 SER 108 HB2 SER 108 9.798 5.972 8.618 786 HB3 SER 108 HB1 SER 108 11.350 5.228 8.999 Start of MODEL 3 1 HA SER 1 HA SER 1 1.455 -8.512 -7.152 2 HG SER 1 HG SER 1 0.216 -6.920 -9.219 3 H1 SER 1 HT1 SER 1 -0.028 -8.413 -5.256 4 H2 SER 1 HT2 SER 1 0.814 -7.082 -4.642 5 H3 SER 1 HT3 SER 1 1.582 -8.584 -4.766 6 HB2 SER 1 HB2 SER 1 -0.632 -7.212 -7.310 7 HB3 SER 1 HB1 SER 1 0.214 -5.787 -6.714 8 H ILE 2 HN ILE 2 2.402 -6.113 -8.353 9 HA ILE 2 HA ILE 2 4.166 -4.704 -8.458 10 HB ILE 2 HB ILE 2 4.923 -5.554 -5.673 11 HG12 ILE 2 HG12 ILE 2 4.071 -3.012 -5.449 12 HG13 ILE 2 HG11 ILE 2 2.981 -3.601 -6.702 13 HG21 ILE 2 HG21 ILE 2 5.806 -3.163 -7.262 14 HG22 ILE 2 HG22 ILE 2 6.756 -4.636 -7.062 15 HG23 ILE 2 HG23 ILE 2 6.363 -3.642 -5.660 16 HD11 ILE 2 HD13 ILE 2 3.366 -5.331 -4.354 17 HD12 ILE 2 HD11 ILE 2 1.914 -4.997 -5.295 18 HD13 ILE 2 HD12 ILE 2 2.501 -3.834 -4.123 19 H THR 3 HN THR 3 6.306 -6.458 -6.476 20 HA THR 3 HA THR 3 7.806 -8.106 -6.726 21 HB THR 3 HB THR 3 7.483 -9.949 -8.179 22 HG1 THR 3 HG1 THR 3 6.222 -9.895 -9.965 23 HG21 THR 3 HG23 THR 3 4.700 -9.074 -7.447 24 HG22 THR 3 HG21 THR 3 5.891 -9.574 -6.243 25 HG23 THR 3 HG22 THR 3 5.359 -10.710 -7.487 26 H ASP 4 HN ASP 4 7.538 -5.491 -8.612 27 HA ASP 4 HA ASP 4 9.192 -5.997 -10.807 28 HB2 ASP 4 HB2 ASP 4 9.783 -3.542 -10.643 29 HB3 ASP 4 HB1 ASP 4 8.057 -3.885 -10.702 30 H ILE 5 HN ILE 5 10.011 -4.832 -7.544 31 HA ILE 5 HA ILE 5 12.592 -6.210 -7.776 32 HB ILE 5 HB ILE 5 12.344 -3.469 -6.528 33 HG12 ILE 5 HG12 ILE 5 13.666 -3.947 -9.182 34 HG13 ILE 5 HG11 ILE 5 11.935 -3.641 -9.103 35 HG21 ILE 5 HG21 ILE 5 14.184 -4.773 -5.689 36 HG22 ILE 5 HG22 ILE 5 14.814 -3.507 -6.743 37 HG23 ILE 5 HG23 ILE 5 14.703 -5.166 -7.328 38 HD11 ILE 5 HD13 ILE 5 13.375 -1.650 -9.559 39 HD12 ILE 5 HD11 ILE 5 13.977 -1.799 -7.908 40 HD13 ILE 5 HD12 ILE 5 12.262 -1.490 -8.200 41 H LEU 6 HN LEU 6 11.886 -7.770 -6.463 42 HA LEU 6 HA LEU 6 12.001 -7.393 -3.653 43 HG LEU 6 HG LEU 6 10.620 -5.806 -2.933 44 HB2 LEU 6 HB2 LEU 6 9.318 -7.441 -4.922 45 HB3 LEU 6 HB1 LEU 6 9.520 -8.340 -3.433 46 HD11 LEU 6 HD11 LEU 6 8.601 -5.650 -4.977 47 HD12 LEU 6 HD12 LEU 6 9.564 -4.366 -4.252 48 HD13 LEU 6 HD13 LEU 6 8.051 -4.858 -3.502 49 HD21 LEU 6 HD23 LEU 6 9.490 -7.166 -1.297 50 HD22 LEU 6 HD21 LEU 6 7.975 -7.048 -2.190 51 HD23 LEU 6 HD22 LEU 6 8.661 -5.615 -1.426 52 H SER 7 HN SER 7 11.527 -9.374 -2.405 53 HA SER 7 HA SER 7 12.164 -11.763 -3.926 54 HG SER 7 HG SER 7 13.910 -11.095 -0.932 55 HB2 SER 7 HB2 SER 7 11.808 -11.247 -0.962 56 HB3 SER 7 HB1 SER 7 12.167 -12.837 -1.634 57 H ALA 8 HN ALA 8 10.569 -13.057 -4.703 58 HA ALA 8 HA ALA 8 7.859 -12.318 -4.497 59 HB1 ALA 8 HB3 ALA 8 8.747 -13.549 -6.403 60 HB2 ALA 8 HB1 ALA 8 7.395 -14.414 -5.671 61 HB3 ALA 8 HB2 ALA 8 9.049 -14.953 -5.377 62 H GLU 9 HN GLU 9 9.607 -15.067 -2.955 63 HA GLU 9 HA GLU 9 7.354 -16.103 -1.637 64 HB2 GLU 9 HB2 GLU 9 10.287 -16.280 -0.955 65 HB3 GLU 9 HB1 GLU 9 9.035 -17.230 -0.164 66 HG2 GLU 9 HG2 GLU 9 9.659 -17.272 -3.095 67 HG3 GLU 9 HG1 GLU 9 10.232 -18.459 -1.924 68 H ASP 10 HN ASP 10 10.020 -14.148 -0.288 69 HA ASP 10 HA ASP 10 8.985 -13.601 2.152 70 HB2 ASP 10 HB2 ASP 10 10.520 -11.758 0.337 71 HB3 ASP 10 HB1 ASP 10 10.197 -11.392 2.026 72 H ILE 11 HN ILE 11 8.040 -12.201 -0.873 73 HA ILE 11 HA ILE 11 6.411 -10.143 0.192 74 HB ILE 11 HB ILE 11 6.941 -11.372 -2.407 75 HG12 ILE 11 HG12 ILE 11 6.144 -8.561 -1.620 76 HG13 ILE 11 HG11 ILE 11 7.790 -9.188 -1.729 77 HG21 ILE 11 HG21 ILE 11 4.135 -10.621 -1.800 78 HG22 ILE 11 HG22 ILE 11 4.769 -11.901 -2.831 79 HG23 ILE 11 HG23 ILE 11 4.800 -10.229 -3.385 80 HD11 ILE 11 HD13 ILE 11 7.837 -9.072 -3.965 81 HD12 ILE 11 HD11 ILE 11 6.573 -7.868 -3.714 82 HD13 ILE 11 HD12 ILE 11 6.147 -9.530 -4.122 83 H ALA 12 HN ALA 12 5.716 -13.427 -0.940 84 HA ALA 12 HA ALA 12 2.967 -13.452 -0.383 85 HB1 ALA 12 HB3 ALA 12 4.607 -15.230 -1.523 86 HB2 ALA 12 HB1 ALA 12 3.023 -15.669 -0.881 87 HB3 ALA 12 HB2 ALA 12 4.472 -15.953 0.080 88 H ALA 13 HN ALA 13 5.681 -14.604 1.635 89 HA ALA 13 HA ALA 13 4.060 -15.176 3.858 90 HB1 ALA 13 HB3 ALA 13 6.485 -15.861 3.515 91 HB2 ALA 13 HB1 ALA 13 6.064 -15.303 5.137 92 HB3 ALA 13 HB2 ALA 13 6.918 -14.228 4.028 93 H ALA 14 HN ALA 14 6.104 -12.407 3.184 94 HA ALA 14 HA ALA 14 5.495 -10.710 5.210 95 HB1 ALA 14 HB3 ALA 14 7.075 -9.959 3.636 96 HB2 ALA 14 HB1 ALA 14 5.741 -8.811 3.528 97 HB3 ALA 14 HB2 ALA 14 5.925 -10.066 2.300 98 H LEU 15 HN LEU 15 3.572 -11.059 2.237 99 HA LEU 15 HA LEU 15 1.565 -9.203 3.081 100 HG LEU 15 HG LEU 15 0.498 -8.433 0.593 101 HB2 LEU 15 HB2 LEU 15 2.265 -9.928 0.690 102 HB3 LEU 15 HB1 LEU 15 1.219 -11.303 0.975 103 HD11 LEU 15 HD11 LEU 15 -0.735 -10.984 -0.408 104 HD12 LEU 15 HD12 LEU 15 0.472 -10.032 -1.273 105 HD13 LEU 15 HD13 LEU 15 -1.116 -9.343 -0.932 106 HD21 LEU 15 HD23 LEU 15 -1.423 -10.380 1.827 107 HD22 LEU 15 HD21 LEU 15 -1.629 -8.653 1.548 108 HD23 LEU 15 HD22 LEU 15 -0.501 -9.212 2.776 109 H GLN 16 HN GLN 16 1.681 -12.711 2.602 110 HA GLN 16 HA GLN 16 -0.953 -13.181 3.482 111 HB2 GLN 16 HB2 GLN 16 1.311 -15.091 2.990 112 HB3 GLN 16 HB1 GLN 16 -0.414 -15.479 3.036 113 HG2 GLN 16 HG2 GLN 16 0.870 -13.593 1.104 114 HG3 GLN 16 HG1 GLN 16 0.489 -15.268 0.741 115 HE21 GLN 16 HE21 GLN 16 -0.685 -12.091 1.299 116 HE22 GLN 16 HE22 GLN 16 -2.291 -12.339 0.736 117 H GLU 17 HN GLU 17 1.710 -12.404 5.316 118 HA GLU 17 HA GLU 17 1.796 -14.500 7.205 119 HB2 GLU 17 HB2 GLU 17 3.587 -12.878 7.046 120 HB3 GLU 17 HB1 GLU 17 2.499 -11.600 7.558 121 HG2 GLU 17 HG2 GLU 17 4.060 -12.587 9.276 122 HG3 GLU 17 HG1 GLU 17 2.373 -12.422 9.735 123 H CYS 18 HN CYS 18 0.573 -11.213 7.874 124 HA CYS 18 HA CYS 18 -1.413 -12.410 9.645 125 HG CYS 18 HG CYS 18 -2.882 -9.737 10.994 126 HB2 CYS 18 HB2 CYS 18 0.339 -10.807 10.545 127 HB3 CYS 18 HB1 CYS 18 -0.471 -9.548 9.619 128 H GLN 19 HN GLN 19 -1.390 -11.519 6.565 129 HA GLN 19 HA GLN 19 -2.917 -9.297 6.165 130 HB2 GLN 19 HB2 GLN 19 -2.135 -10.171 4.211 131 HB3 GLN 19 HB1 GLN 19 -2.565 -11.806 4.653 132 HG2 GLN 19 HG2 GLN 19 -4.752 -11.570 3.922 133 HG3 GLN 19 HG1 GLN 19 -4.703 -9.813 4.044 134 HE21 GLN 19 HE21 GLN 19 -3.901 -8.619 2.368 135 HE22 GLN 19 HE22 GLN 19 -3.520 -9.279 0.819 136 H ASP 20 HN ASP 20 -4.911 -8.731 6.028 137 HA ASP 20 HA ASP 20 -7.272 -10.116 6.109 138 HB2 ASP 20 HB2 ASP 20 -6.043 -9.758 8.801 139 HB3 ASP 20 HB1 ASP 20 -7.766 -9.419 8.660 140 HA PRO 21 HA PRO 21 -8.662 -5.949 5.598 141 HB2 PRO 21 HB2 PRO 21 -11.158 -5.993 6.545 142 HB3 PRO 21 HB1 PRO 21 -10.722 -6.825 5.062 143 HG2 PRO 21 HG2 PRO 21 -11.050 -7.912 7.835 144 HG3 PRO 21 HG1 PRO 21 -11.659 -8.565 6.300 145 HD2 PRO 21 HD2 PRO 21 -9.432 -9.508 7.468 146 HD3 PRO 21 HD1 PRO 21 -9.614 -9.420 5.708 147 H ASP 22 HN ASP 22 -6.951 -5.726 7.558 148 HA ASP 22 HA ASP 22 -7.565 -3.619 9.129 149 HB2 ASP 22 HB2 ASP 22 -9.352 -4.559 10.265 150 HB3 ASP 22 HB1 ASP 22 -8.585 -6.127 10.349 151 H THR 23 HN THR 23 -5.453 -6.138 8.420 152 HA THR 23 HA THR 23 -3.753 -5.585 10.740 153 HB THR 23 HB THR 23 -4.177 -7.919 10.401 154 HG1 THR 23 HG1 THR 23 -1.536 -7.299 9.516 155 HG21 THR 23 HG23 THR 23 -4.047 -7.244 7.666 156 HG22 THR 23 HG21 THR 23 -4.417 -8.808 8.380 157 HG23 THR 23 HG22 THR 23 -2.754 -8.402 7.967 158 H PHE 24 HN PHE 24 -3.700 -5.419 7.217 159 HA PHE 24 HA PHE 24 -2.150 -3.551 6.423 160 HD1 PHE 24 HD1 PHE 24 -0.939 -1.901 6.609 161 HD2 PHE 24 HD2 PHE 24 0.709 -4.212 9.771 162 HE1 PHE 24 HE1 PHE 24 -0.508 0.158 7.879 163 HE2 PHE 24 HE2 PHE 24 1.148 -2.157 11.049 164 HZ PHE 24 HZ PHE 24 0.538 0.033 10.104 165 HB2 PHE 24 HB2 PHE 24 -0.279 -5.293 7.991 166 HB3 PHE 24 HB1 PHE 24 0.324 -4.519 6.534 167 H GLU 25 HN GLU 25 -3.423 -4.676 4.725 168 HA GLU 25 HA GLU 25 -2.446 -7.031 3.554 169 HB2 GLU 25 HB2 GLU 25 -3.992 -4.923 2.067 170 HB3 GLU 25 HB1 GLU 25 -3.955 -6.650 1.778 171 HG2 GLU 25 HG2 GLU 25 -5.120 -5.343 4.201 172 HG3 GLU 25 HG1 GLU 25 -6.040 -5.896 2.809 173 HA PRO 26 HA PRO 26 -0.006 -4.375 0.527 174 HB2 PRO 26 HB2 PRO 26 -0.103 -1.674 0.666 175 HB3 PRO 26 HB1 PRO 26 -1.313 -2.650 -0.159 176 HG2 PRO 26 HG2 PRO 26 -1.551 -1.139 2.301 177 HG3 PRO 26 HG1 PRO 26 -2.817 -1.831 1.284 178 HD2 PRO 26 HD2 PRO 26 -1.676 -2.871 3.752 179 HD3 PRO 26 HD1 PRO 26 -3.095 -3.433 2.852 180 H GLN 27 HN GLN 27 0.115 -2.244 3.404 181 HA GLN 27 HA GLN 27 2.722 -1.430 3.220 182 HB2 GLN 27 HB2 GLN 27 0.646 -0.950 4.850 183 HB3 GLN 27 HB1 GLN 27 1.652 -1.922 5.913 184 HG2 GLN 27 HG2 GLN 27 3.531 -0.337 5.232 185 HG3 GLN 27 HG1 GLN 27 2.241 0.717 4.663 186 HE21 GLN 27 HE21 GLN 27 0.711 1.494 6.167 187 HE22 GLN 27 HE22 GLN 27 1.086 1.589 7.848 188 H LYS 28 HN LYS 28 1.526 -4.434 4.638 189 HA LYS 28 HA LYS 28 3.980 -5.034 5.997 190 HB2 LYS 28 HB2 LYS 28 1.355 -6.307 5.611 191 HB3 LYS 28 HB1 LYS 28 2.710 -7.367 5.861 192 HG2 LYS 28 HG2 LYS 28 2.400 -5.093 7.686 193 HG3 LYS 28 HG1 LYS 28 1.308 -6.462 7.876 194 HD2 LYS 28 HD2 LYS 28 3.106 -7.947 8.279 195 HD3 LYS 28 HD1 LYS 28 4.299 -6.768 7.732 196 HE2 LYS 28 HE2 LYS 28 3.814 -5.360 9.654 197 HE3 LYS 28 HE1 LYS 28 2.568 -6.489 10.187 198 HZ1 LYS 28 HZ3 LYS 28 4.731 -6.721 11.352 199 HZ2 LYS 28 HZ1 LYS 28 5.431 -7.214 9.892 200 HZ3 LYS 28 HZ2 LYS 28 4.208 -8.143 10.601 201 H PHE 29 HN PHE 29 2.389 -5.917 3.042 202 HA PHE 29 HA PHE 29 4.012 -7.933 2.088 203 HD1 PHE 29 HD1 PHE 29 4.787 -5.649 -0.766 204 HD2 PHE 29 HD2 PHE 29 1.883 -8.743 -0.792 205 HE1 PHE 29 HE1 PHE 29 5.526 -6.311 -3.008 206 HE2 PHE 29 HE2 PHE 29 2.621 -9.423 -3.028 207 HZ PHE 29 HZ PHE 29 4.454 -8.216 -4.133 208 HB2 PHE 29 HB2 PHE 29 1.961 -7.339 0.998 209 HB3 PHE 29 HB1 PHE 29 2.510 -5.704 0.706 210 H PHE 30 HN PHE 30 4.328 -4.439 1.788 211 HA PHE 30 HA PHE 30 6.612 -4.461 0.111 212 HD1 PHE 30 HD1 PHE 30 4.692 -3.883 -1.162 213 HD2 PHE 30 HD2 PHE 30 3.967 -0.936 1.816 214 HE1 PHE 30 HE1 PHE 30 2.432 -3.507 -2.078 215 HE2 PHE 30 HE2 PHE 30 1.713 -0.560 0.911 216 HZ PHE 30 HZ PHE 30 0.944 -1.849 -1.039 217 HB2 PHE 30 HB2 PHE 30 5.888 -2.186 1.912 218 HB3 PHE 30 HB1 PHE 30 6.547 -2.145 0.284 219 H GLN 31 HN GLN 31 6.245 -3.500 3.507 220 HA GLN 31 HA GLN 31 8.903 -3.103 4.043 221 HB2 GLN 31 HB2 GLN 31 6.663 -3.817 5.889 222 HB3 GLN 31 HB1 GLN 31 8.215 -3.184 6.384 223 HG2 GLN 31 HG2 GLN 31 6.107 -1.803 4.794 224 HG3 GLN 31 HG1 GLN 31 6.750 -1.347 6.371 225 HE21 GLN 31 HE21 GLN 31 9.521 -1.871 5.542 226 HE22 GLN 31 HE22 GLN 31 9.962 -0.588 4.476 227 H THR 32 HN THR 32 7.064 -5.827 5.360 228 HA THR 32 HA THR 32 9.131 -7.134 6.537 229 HB THR 32 HB THR 32 6.776 -8.357 5.107 230 HG1 THR 32 HG1 THR 32 7.272 -7.444 7.732 231 HG21 THR 32 HG23 THR 32 7.169 -10.342 6.524 232 HG22 THR 32 HG21 THR 32 8.677 -9.621 7.087 233 HG23 THR 32 HG22 THR 32 8.490 -10.065 5.390 234 H SER 33 HN SER 33 8.099 -7.610 3.160 235 HA SER 33 HA SER 33 10.371 -9.330 2.657 236 HG SER 33 HG SER 33 8.994 -10.125 -0.501 237 HB2 SER 33 HB2 SER 33 8.217 -9.899 1.674 238 HB3 SER 33 HB1 SER 33 8.221 -8.401 0.753 239 H GLY 34 HN GLY 34 9.194 -6.300 1.189 240 HA2 GLY 34 HA2 GLY 34 11.873 -6.070 0.001 241 HA3 GLY 34 HA1 GLY 34 10.461 -5.262 -0.614 242 H LEU 35 HN LEU 35 9.587 -3.565 1.175 243 HA LEU 35 HA LEU 35 11.346 -1.474 0.913 244 HG LEU 35 HG LEU 35 8.382 -1.852 0.355 245 HB2 LEU 35 HB2 LEU 35 8.957 -1.934 2.657 246 HB3 LEU 35 HB1 LEU 35 9.774 -0.384 2.568 247 HD11 LEU 35 HD11 LEU 35 7.786 0.850 1.532 248 HD12 LEU 35 HD12 LEU 35 7.002 -0.638 2.055 249 HD13 LEU 35 HD13 LEU 35 6.806 -0.078 0.397 250 HD21 LEU 35 HD23 LEU 35 9.008 0.739 -0.471 251 HD22 LEU 35 HD21 LEU 35 9.647 -0.780 -1.096 252 HD23 LEU 35 HD22 LEU 35 10.491 0.063 0.197 253 H SER 36 HN SER 36 10.846 -3.588 3.719 254 HA SER 36 HA SER 36 12.139 -2.431 5.714 255 HG SER 36 HG SER 36 11.970 -6.240 4.666 256 HB2 SER 36 HB2 SER 36 13.148 -4.670 6.312 257 HB3 SER 36 HB1 SER 36 11.416 -4.683 5.983 258 H LYS 37 HN LYS 37 13.791 -3.349 2.738 259 HA LYS 37 HA LYS 37 16.176 -2.018 3.805 260 HB2 LYS 37 HB2 LYS 37 16.265 -4.666 2.363 261 HB3 LYS 37 HB1 LYS 37 17.648 -3.750 2.940 262 HG2 LYS 37 HG2 LYS 37 16.905 -4.036 5.236 263 HG3 LYS 37 HG1 LYS 37 15.499 -4.932 4.665 264 HD2 LYS 37 HD2 LYS 37 16.955 -6.642 3.717 265 HD3 LYS 37 HD1 LYS 37 18.373 -5.739 4.252 266 HE2 LYS 37 HE2 LYS 37 17.532 -5.963 6.594 267 HE3 LYS 37 HE1 LYS 37 16.267 -7.025 5.978 268 HZ1 LYS 37 HZ3 LYS 37 18.009 -8.503 5.131 269 HZ2 LYS 37 HZ1 LYS 37 18.102 -8.317 6.811 270 HZ3 LYS 37 HZ2 LYS 37 19.193 -7.501 5.808 271 H MET 38 HN MET 38 14.282 -2.889 0.964 272 HA MET 38 HA MET 38 16.036 -2.217 -1.057 273 HB2 MET 38 HB2 MET 38 13.075 -1.678 -1.016 274 HB3 MET 38 HB1 MET 38 14.108 -1.783 -2.431 275 HG2 MET 38 HG2 MET 38 13.600 -4.006 -0.502 276 HG3 MET 38 HG1 MET 38 12.798 -3.818 -2.051 277 HE1 MET 38 HE3 MET 38 14.850 -6.440 -0.886 278 HE2 MET 38 HE1 MET 38 15.132 -6.900 -2.566 279 HE3 MET 38 HE2 MET 38 13.534 -6.351 -2.056 280 H SER 39 HN SER 39 16.068 -0.410 -2.486 281 HA SER 39 HA SER 39 16.470 2.056 -1.122 282 HG SER 39 HG SER 39 17.227 3.225 -4.549 283 HB2 SER 39 HB2 SER 39 17.991 1.596 -2.868 284 HB3 SER 39 HB1 SER 39 16.694 1.200 -4.000 285 H ALA 40 HN ALA 40 15.689 4.095 -2.261 286 HA ALA 40 HA ALA 40 12.881 4.284 -1.920 287 HB1 ALA 40 HB3 ALA 40 14.565 6.321 -3.346 288 HB2 ALA 40 HB1 ALA 40 14.609 6.114 -1.595 289 HB3 ALA 40 HB2 ALA 40 13.102 6.571 -2.389 290 H SER 41 HN SER 41 14.929 4.278 -4.826 291 HA SER 41 HA SER 41 13.173 4.989 -6.778 292 HG SER 41 HG SER 41 15.378 1.864 -7.494 293 HB2 SER 41 HB2 SER 41 14.513 3.579 -8.318 294 HB3 SER 41 HB1 SER 41 15.512 4.556 -7.242 295 H GLN 42 HN GLN 42 13.616 1.606 -5.647 296 HA GLN 42 HA GLN 42 11.600 0.653 -7.383 297 HB2 GLN 42 HB2 GLN 42 11.722 -1.435 -6.304 298 HB3 GLN 42 HB1 GLN 42 13.350 -0.778 -6.379 299 HG2 GLN 42 HG2 GLN 42 13.458 -0.410 -4.161 300 HG3 GLN 42 HG1 GLN 42 11.716 -0.315 -3.952 301 HE21 GLN 42 HE21 GLN 42 10.545 -2.137 -3.593 302 HE22 GLN 42 HE22 GLN 42 11.246 -3.699 -3.360 303 H VAL 43 HN VAL 43 11.532 2.062 -4.266 304 HA VAL 43 HA VAL 43 9.023 1.151 -3.382 305 HB VAL 43 HB VAL 43 10.259 3.831 -2.825 306 HG11 VAL 43 HG11 VAL 43 8.447 2.541 -0.906 307 HG12 VAL 43 HG12 VAL 43 7.720 3.253 -2.342 308 HG13 VAL 43 HG13 VAL 43 8.689 4.246 -1.260 309 HG21 VAL 43 HG23 VAL 43 11.066 1.235 -2.049 310 HG22 VAL 43 HG21 VAL 43 10.418 2.051 -0.627 311 HG23 VAL 43 HG22 VAL 43 11.733 2.784 -1.537 312 H LYS 44 HN LYS 44 9.966 3.797 -5.510 313 HA LYS 44 HA LYS 44 7.538 5.091 -5.888 314 HB2 LYS 44 HB2 LYS 44 10.013 4.777 -7.394 315 HB3 LYS 44 HB1 LYS 44 8.616 4.926 -8.440 316 HG2 LYS 44 HG2 LYS 44 8.310 7.084 -7.944 317 HG3 LYS 44 HG1 LYS 44 8.794 6.896 -6.264 318 HD2 LYS 44 HD2 LYS 44 10.703 6.776 -8.568 319 HD3 LYS 44 HD1 LYS 44 10.348 8.270 -7.702 320 HE2 LYS 44 HE2 LYS 44 11.137 5.849 -6.193 321 HE3 LYS 44 HE1 LYS 44 12.387 6.732 -7.069 322 HZ1 LYS 44 HZ3 LYS 44 10.544 8.032 -5.142 323 HZ2 LYS 44 HZ1 LYS 44 11.945 8.684 -5.831 324 HZ3 LYS 44 HZ2 LYS 44 12.061 7.428 -4.702 325 H ASP 45 HN ASP 45 8.851 2.242 -7.489 326 HA ASP 45 HA ASP 45 6.643 1.681 -9.144 327 HB2 ASP 45 HB2 ASP 45 9.148 0.434 -8.411 328 HB3 ASP 45 HB1 ASP 45 7.864 -0.759 -8.470 329 H ILE 46 HN ILE 46 7.634 0.380 -5.990 330 HA ILE 46 HA ILE 46 5.550 -1.322 -5.462 331 HB ILE 46 HB ILE 46 7.379 0.315 -3.798 332 HG12 ILE 46 HG12 ILE 46 8.223 -1.784 -3.110 333 HG13 ILE 46 HG11 ILE 46 6.799 -2.632 -3.681 334 HG21 ILE 46 HG21 ILE 46 4.891 -0.938 -2.747 335 HG22 ILE 46 HG22 ILE 46 5.641 0.609 -2.349 336 HG23 ILE 46 HG23 ILE 46 6.352 -0.891 -1.757 337 HD11 ILE 46 HD13 ILE 46 7.487 -1.888 -6.013 338 HD12 ILE 46 HD11 ILE 46 8.485 -3.110 -5.231 339 HD13 ILE 46 HD12 ILE 46 9.029 -1.437 -5.287 340 H PHE 47 HN PHE 47 5.738 2.111 -4.512 341 HA PHE 47 HA PHE 47 3.344 2.694 -3.487 342 HD1 PHE 47 HD1 PHE 47 2.314 5.568 -3.443 343 HD2 PHE 47 HD2 PHE 47 4.164 5.063 -7.240 344 HE1 PHE 47 HE1 PHE 47 0.732 7.176 -4.431 345 HE2 PHE 47 HE2 PHE 47 2.594 6.677 -8.229 346 HZ PHE 47 HZ PHE 47 0.874 7.737 -6.822 347 HB2 PHE 47 HB2 PHE 47 4.646 4.574 -3.749 348 HB3 PHE 47 HB1 PHE 47 5.156 4.134 -5.359 349 H ARG 48 HN ARG 48 3.987 2.191 -6.871 350 HA ARG 48 HA ARG 48 1.579 2.969 -8.002 351 HE ARG 48 HE ARG 48 2.010 3.352 -10.980 352 HB2 ARG 48 HB2 ARG 48 3.265 0.649 -8.933 353 HB3 ARG 48 HB1 ARG 48 2.133 1.584 -9.898 354 HG2 ARG 48 HG2 ARG 48 4.700 2.567 -8.681 355 HG3 ARG 48 HG1 ARG 48 4.371 2.296 -10.393 356 HD2 ARG 48 HD2 ARG 48 2.926 4.292 -8.644 357 HD3 ARG 48 HD1 ARG 48 4.255 4.682 -9.740 358 HH11 ARG 48 HH11 ARG 48 3.464 6.405 -10.125 359 HH12 ARG 48 HH12 ARG 48 2.597 7.300 -11.328 360 HH21 ARG 48 HH21 ARG 48 0.865 4.527 -12.566 361 HH22 ARG 48 HH22 ARG 48 1.122 6.234 -12.716 362 H PHE 49 HN PHE 49 2.257 0.148 -6.078 363 HA PHE 49 HA PHE 49 0.217 -1.555 -6.898 364 HD1 PHE 49 HD2 PHE 49 0.195 -3.927 -6.246 365 HD2 PHE 49 HD1 PHE 49 -0.311 -1.960 -2.505 366 HE1 PHE 49 HE2 PHE 49 -1.312 -5.727 -5.505 367 HE2 PHE 49 HE1 PHE 49 -1.816 -3.753 -1.762 368 HZ PHE 49 HZ PHE 49 -2.319 -5.640 -3.261 369 HB2 PHE 49 HB2 PHE 49 1.898 -2.201 -5.213 370 HB3 PHE 49 HB1 PHE 49 1.181 -1.087 -4.059 371 H ILE 50 HN ILE 50 0.075 0.775 -4.205 372 HA ILE 50 HA ILE 50 -2.803 0.762 -4.252 373 HB ILE 50 HB ILE 50 -2.557 2.554 -2.500 374 HG12 ILE 50 HG12 ILE 50 0.365 1.781 -2.587 375 HG13 ILE 50 HG11 ILE 50 -0.273 3.282 -3.251 376 HG21 ILE 50 HG21 ILE 50 -1.815 -0.255 -2.350 377 HG22 ILE 50 HG22 ILE 50 -2.934 0.691 -1.367 378 HG23 ILE 50 HG23 ILE 50 -1.210 0.712 -1.005 379 HD11 ILE 50 HD13 ILE 50 -0.348 2.420 -0.370 380 HD12 ILE 50 HD11 ILE 50 -1.079 3.892 -1.007 381 HD13 ILE 50 HD12 ILE 50 0.670 3.678 -1.073 382 H ASP 51 HN ASP 51 -4.106 2.228 -5.032 383 HA ASP 51 HA ASP 51 -4.657 3.637 -6.822 384 HB2 ASP 51 HB2 ASP 51 -3.985 5.243 -4.368 385 HB3 ASP 51 HB1 ASP 51 -4.909 5.886 -5.729 386 H ASN 52 HN ASN 52 -4.064 4.684 -8.548 387 HA ASN 52 HA ASN 52 -1.253 5.314 -8.931 388 HB2 ASN 52 HB2 ASN 52 -1.836 5.492 -11.315 389 HB3 ASN 52 HB1 ASN 52 -2.365 3.963 -10.618 390 HD21 ASN 52 HD21 ASN 52 -3.315 5.417 -12.978 391 HD22 ASN 52 HD22 ASN 52 -5.007 5.662 -12.732 392 H ASP 53 HN ASP 53 -2.424 7.212 -7.245 393 HA ASP 53 HA ASP 53 -2.529 9.475 -6.950 394 HB2 ASP 53 HB2 ASP 53 -0.430 9.385 -8.332 395 HB3 ASP 53 HB1 ASP 53 -1.422 9.677 -9.757 396 H GLN 54 HN GLN 54 -4.818 8.316 -7.610 397 HA GLN 54 HA GLN 54 -6.288 9.082 -9.735 398 HB2 GLN 54 HB2 GLN 54 -7.915 9.451 -7.377 399 HB3 GLN 54 HB1 GLN 54 -8.081 8.296 -8.680 400 HG2 GLN 54 HG2 GLN 54 -7.825 7.008 -6.761 401 HG3 GLN 54 HG1 GLN 54 -6.240 6.975 -7.535 402 HE21 GLN 54 HE21 GLN 54 -6.934 6.510 -4.774 403 HE22 GLN 54 HE22 GLN 54 -6.069 7.667 -3.835 404 H SER 55 HN SER 55 -5.380 11.209 -7.081 405 HA SER 55 HA SER 55 -6.360 13.431 -8.697 406 HG SER 55 HG SER 55 -8.237 15.008 -7.487 407 HB2 SER 55 HB2 SER 55 -8.220 12.883 -7.177 408 HB3 SER 55 HB1 SER 55 -7.141 13.074 -5.795 409 H GLY 56 HN GLY 56 -3.702 12.511 -8.099 410 HA2 GLY 56 HA2 GLY 56 -1.796 13.966 -7.915 411 HA3 GLY 56 HA1 GLY 56 -2.734 14.989 -6.826 412 H TYR 57 HN TYR 57 -3.718 12.637 -5.396 413 HA TYR 57 HA TYR 57 -1.443 11.376 -4.166 414 HD1 TYR 57 HD1 TYR 57 -4.481 14.141 -2.811 415 HD2 TYR 57 HD2 TYR 57 -0.330 14.733 -3.380 416 HE1 TYR 57 HE1 TYR 57 -4.909 16.517 -3.340 417 HE2 TYR 57 HE2 TYR 57 -0.720 17.109 -3.896 418 HH TYR 57 HH TYR 57 -2.539 18.545 -4.695 419 HB2 TYR 57 HB2 TYR 57 -2.913 12.566 -1.996 420 HB3 TYR 57 HB1 TYR 57 -1.205 12.710 -2.352 421 H LEU 58 HN LEU 58 -2.224 9.939 -2.376 422 HA LEU 58 HA LEU 58 -4.883 8.943 -3.102 423 HG LEU 58 HG LEU 58 -1.651 8.062 -3.454 424 HB2 LEU 58 HB2 LEU 58 -2.877 7.466 -1.427 425 HB3 LEU 58 HB1 LEU 58 -4.185 6.812 -2.400 426 HD11 LEU 58 HD11 LEU 58 -2.294 5.396 -2.627 427 HD12 LEU 58 HD12 LEU 58 -0.760 6.048 -3.212 428 HD13 LEU 58 HD13 LEU 58 -1.955 5.432 -4.355 429 HD21 LEU 58 HD23 LEU 58 -2.962 6.685 -5.481 430 HD22 LEU 58 HD21 LEU 58 -2.755 8.423 -5.328 431 HD23 LEU 58 HD22 LEU 58 -4.204 7.650 -4.694 432 H ASP 59 HN ASP 59 -6.415 8.467 -1.422 433 HA ASP 59 HA ASP 59 -5.711 9.418 1.244 434 HB2 ASP 59 HB2 ASP 59 -6.518 11.402 0.009 435 HB3 ASP 59 HB1 ASP 59 -8.042 10.568 -0.294 436 H GLY 60 HN GLY 60 -7.378 8.996 2.841 437 HA2 GLY 60 HA2 GLY 60 -8.007 6.359 3.053 438 HA3 GLY 60 HA1 GLY 60 -8.916 7.619 3.871 439 H ASP 61 HN ASP 61 -9.851 8.710 1.251 440 HA ASP 61 HA ASP 61 -12.227 7.068 1.138 441 HB2 ASP 61 HB2 ASP 61 -12.095 9.650 0.927 442 HB3 ASP 61 HB1 ASP 61 -11.615 9.332 -0.740 443 H GLU 62 HN GLU 62 -9.605 8.009 -1.001 444 HA GLU 62 HA GLU 62 -10.539 6.381 -3.172 445 HB2 GLU 62 HB2 GLU 62 -7.902 7.791 -2.887 446 HB3 GLU 62 HB1 GLU 62 -8.672 7.239 -4.375 447 HG2 GLU 62 HG2 GLU 62 -9.892 9.290 -2.576 448 HG3 GLU 62 HG1 GLU 62 -8.807 9.705 -3.900 449 H LEU 63 HN LEU 63 -8.223 6.084 -0.581 450 HA LEU 63 HA LEU 63 -6.432 4.231 -1.465 451 HG LEU 63 HG LEU 63 -6.324 6.248 0.978 452 HB2 LEU 63 HB2 LEU 63 -7.796 4.453 1.219 453 HB3 LEU 63 HB1 LEU 63 -6.541 3.273 0.911 454 HD11 LEU 63 HD11 LEU 63 -5.554 4.026 2.664 455 HD12 LEU 63 HD12 LEU 63 -5.796 5.712 3.069 456 HD13 LEU 63 HD13 LEU 63 -4.257 5.183 2.385 457 HD21 LEU 63 HD23 LEU 63 -4.417 4.289 -0.244 458 HD22 LEU 63 HD21 LEU 63 -3.930 5.895 0.304 459 HD23 LEU 63 HD22 LEU 63 -5.135 5.728 -0.978 460 H LYS 64 HN LYS 64 -9.693 3.482 -0.201 461 HA LYS 64 HA LYS 64 -9.571 0.751 -0.484 462 HB2 LYS 64 HB2 LYS 64 -12.152 1.041 -0.824 463 HB3 LYS 64 HB1 LYS 64 -11.412 1.403 0.717 464 HG2 LYS 64 HG2 LYS 64 -11.448 3.784 0.182 465 HG3 LYS 64 HG1 LYS 64 -12.161 3.421 -1.393 466 HD2 LYS 64 HD2 LYS 64 -13.678 2.150 0.667 467 HD3 LYS 64 HD1 LYS 64 -13.469 3.852 1.071 468 HE2 LYS 64 HE2 LYS 64 -14.309 2.988 -1.662 469 HE3 LYS 64 HE1 LYS 64 -15.489 3.155 -0.365 470 HZ1 LYS 64 HZ3 LYS 64 -13.671 5.303 -1.320 471 HZ2 LYS 64 HZ1 LYS 64 -14.828 5.458 -0.095 472 HZ3 LYS 64 HZ2 LYS 64 -15.316 5.177 -1.690 473 H TYR 65 HN TYR 65 -9.606 3.058 -2.980 474 HA TYR 65 HA TYR 65 -10.926 1.439 -4.931 475 HD1 TYR 65 HD1 TYR 65 -12.068 2.816 -3.760 476 HD2 TYR 65 HD2 TYR 65 -10.490 5.869 -6.258 477 HE1 TYR 65 HE1 TYR 65 -13.854 4.334 -3.018 478 HE2 TYR 65 HE2 TYR 65 -12.276 7.396 -5.532 479 HH TYR 65 HH TYR 65 -14.553 7.249 -4.586 480 HB2 TYR 65 HB2 TYR 65 -9.110 3.806 -5.377 481 HB3 TYR 65 HB1 TYR 65 -10.198 3.090 -6.553 482 H PHE 66 HN PHE 66 -7.756 1.505 -3.634 483 HA PHE 66 HA PHE 66 -6.059 0.879 -5.669 484 HD1 PHE 66 HD2 PHE 66 -4.388 -1.710 -5.240 485 HD2 PHE 66 HD1 PHE 66 -5.842 -1.076 -1.303 486 HE1 PHE 66 HE2 PHE 66 -3.673 -3.979 -4.612 487 HE2 PHE 66 HE1 PHE 66 -5.130 -3.327 -0.655 488 HZ PHE 66 HZ PHE 66 -4.040 -4.794 -2.314 489 HB2 PHE 66 HB2 PHE 66 -4.712 0.727 -3.876 490 HB3 PHE 66 HB1 PHE 66 -6.098 0.589 -2.820 491 H LEU 67 HN LEU 67 -8.088 -1.414 -3.946 492 HA LEU 67 HA LEU 67 -7.353 -3.640 -5.561 493 HG LEU 67 HG LEU 67 -7.272 -4.091 -2.774 494 HB2 LEU 67 HB2 LEU 67 -9.388 -3.103 -3.469 495 HB3 LEU 67 HB1 LEU 67 -9.699 -4.454 -4.545 496 HD11 LEU 67 HD11 LEU 67 -9.658 -5.919 -2.626 497 HD12 LEU 67 HD12 LEU 67 -9.160 -4.693 -1.458 498 HD13 LEU 67 HD13 LEU 67 -8.185 -6.148 -1.683 499 HD21 LEU 67 HD23 LEU 67 -7.990 -6.365 -4.620 500 HD22 LEU 67 HD21 LEU 67 -6.607 -6.309 -3.524 501 HD23 LEU 67 HD22 LEU 67 -6.700 -5.189 -4.886 502 H GLN 68 HN GLN 68 -9.800 -1.223 -5.643 503 HA GLN 68 HA GLN 68 -11.412 -2.462 -7.640 504 HB2 GLN 68 HB2 GLN 68 -11.475 0.004 -6.032 505 HB3 GLN 68 HB1 GLN 68 -12.258 0.089 -7.592 506 HG2 GLN 68 HG2 GLN 68 -13.538 -1.977 -6.936 507 HG3 GLN 68 HG1 GLN 68 -12.880 -1.758 -5.317 508 HE21 GLN 68 HE21 GLN 68 -14.875 -1.412 -4.388 509 HE22 GLN 68 HE22 GLN 68 -15.786 0.034 -4.645 510 H LYS 69 HN LYS 69 -8.402 -1.098 -7.848 511 HA LYS 69 HA LYS 69 -8.799 0.580 -10.151 512 HB2 LYS 69 HB2 LYS 69 -6.313 -0.626 -8.924 513 HB3 LYS 69 HB1 LYS 69 -6.328 0.588 -10.193 514 HG2 LYS 69 HG2 LYS 69 -7.167 0.877 -7.330 515 HG3 LYS 69 HG1 LYS 69 -5.875 1.695 -8.169 516 HD2 LYS 69 HD2 LYS 69 -8.831 2.078 -8.543 517 HD3 LYS 69 HD1 LYS 69 -7.666 3.252 -7.928 518 HE2 LYS 69 HE2 LYS 69 -6.564 3.285 -10.120 519 HE3 LYS 69 HE1 LYS 69 -7.749 2.127 -10.724 520 HZ1 LYS 69 HZ3 LYS 69 -8.327 4.875 -9.755 521 HZ2 LYS 69 HZ1 LYS 69 -9.492 3.762 -10.274 522 HZ3 LYS 69 HZ2 LYS 69 -8.347 4.362 -11.367 523 H PHE 70 HN PHE 70 -7.095 -2.404 -9.414 524 HA PHE 70 HA PHE 70 -6.982 -3.178 -12.183 525 HD1 PHE 70 HD1 PHE 70 -6.317 -4.710 -8.037 526 HD2 PHE 70 HD2 PHE 70 -3.836 -2.637 -10.823 527 HE1 PHE 70 HE1 PHE 70 -5.037 -3.738 -6.181 528 HE2 PHE 70 HE2 PHE 70 -2.560 -1.666 -8.960 529 HZ PHE 70 HZ PHE 70 -3.159 -2.219 -6.640 530 HB2 PHE 70 HB2 PHE 70 -6.232 -5.327 -10.429 531 HB3 PHE 70 HB1 PHE 70 -5.249 -4.407 -11.553 532 H GLN 71 HN GLN 71 -8.856 -4.064 -9.343 533 HA GLN 71 HA GLN 71 -10.022 -6.341 -10.721 534 HB2 GLN 71 HB2 GLN 71 -9.669 -6.570 -8.342 535 HB3 GLN 71 HB1 GLN 71 -10.626 -5.134 -8.027 536 HG2 GLN 71 HG2 GLN 71 -12.618 -6.248 -8.855 537 HG3 GLN 71 HG1 GLN 71 -11.668 -7.683 -9.232 538 HE21 GLN 71 HE21 GLN 71 -11.258 -5.707 -6.355 539 HE22 GLN 71 HE22 GLN 71 -11.800 -6.899 -5.237 540 H SER 72 HN SER 72 -11.737 -3.888 -8.900 541 HA SER 72 HA SER 72 -13.140 -2.186 -9.819 542 HG SER 72 HG SER 72 -12.205 -2.027 -11.916 543 HB2 SER 72 HB2 SER 72 -13.906 -4.248 -11.875 544 HB3 SER 72 HB1 SER 72 -14.598 -2.638 -11.738 545 H ASP 73 HN ASP 73 -13.214 -4.458 -7.901 546 HA ASP 73 HA ASP 73 -15.978 -4.244 -7.200 547 HB2 ASP 73 HB2 ASP 73 -16.071 -6.093 -8.834 548 HB3 ASP 73 HB1 ASP 73 -14.892 -6.986 -7.880 549 H ALA 74 HN ALA 74 -13.250 -3.706 -6.084 550 HA ALA 74 HA ALA 74 -12.560 -5.537 -4.092 551 HB1 ALA 74 HB3 ALA 74 -11.163 -3.904 -3.273 552 HB2 ALA 74 HB1 ALA 74 -12.300 -2.605 -3.618 553 HB3 ALA 74 HB2 ALA 74 -11.386 -3.340 -4.932 554 H ARG 75 HN ARG 75 -12.995 -5.503 -1.831 555 HA ARG 75 HA ARG 75 -15.707 -4.996 -1.183 556 HE ARG 75 HE ARG 75 -10.404 -5.697 0.962 557 HB2 ARG 75 HB2 ARG 75 -15.041 -5.610 1.120 558 HB3 ARG 75 HB1 ARG 75 -14.487 -6.779 -0.069 559 HG2 ARG 75 HG2 ARG 75 -12.491 -4.753 0.357 560 HG3 ARG 75 HG1 ARG 75 -12.971 -5.493 1.887 561 HD2 ARG 75 HD2 ARG 75 -12.403 -7.658 1.128 562 HD3 ARG 75 HD1 ARG 75 -12.269 -7.117 -0.545 563 HH11 ARG 75 HH11 ARG 75 -11.033 -8.978 -0.022 564 HH12 ARG 75 HH12 ARG 75 -9.364 -9.440 -0.007 565 HH21 ARG 75 HH21 ARG 75 -8.200 -6.295 0.982 566 HH22 ARG 75 HH22 ARG 75 -7.754 -7.914 0.561 567 H GLU 76 HN GLU 76 -13.016 -2.988 -1.397 568 HA GLU 76 HA GLU 76 -12.936 -0.705 -1.212 569 HB2 GLU 76 HB2 GLU 76 -15.219 -0.847 0.760 570 HB3 GLU 76 HB1 GLU 76 -14.557 0.580 -0.012 571 HG2 GLU 76 HG2 GLU 76 -15.366 -0.095 -2.146 572 HG3 GLU 76 HG1 GLU 76 -15.862 -1.660 -1.512 573 H LEU 77 HN LEU 77 -11.383 -2.458 -0.050 574 HA LEU 77 HA LEU 77 -10.136 -3.089 1.798 575 HG LEU 77 HG LEU 77 -9.114 -1.509 -0.438 576 HB2 LEU 77 HB2 LEU 77 -9.867 -0.118 1.474 577 HB3 LEU 77 HB1 LEU 77 -8.817 -1.043 2.526 578 HD11 LEU 77 HD11 LEU 77 -6.578 -0.535 0.671 579 HD12 LEU 77 HD12 LEU 77 -7.918 0.606 0.698 580 HD13 LEU 77 HD13 LEU 77 -7.412 -0.106 -0.826 581 HD21 LEU 77 HD23 LEU 77 -6.717 -2.550 0.655 582 HD22 LEU 77 HD21 LEU 77 -8.050 -3.421 -0.102 583 HD23 LEU 77 HD22 LEU 77 -8.063 -3.128 1.636 584 H THR 78 HN THR 78 -12.860 -2.740 2.552 585 HA THR 78 HA THR 78 -14.283 -2.246 4.285 586 HB THR 78 HB THR 78 -13.656 -3.318 6.343 587 HG1 THR 78 HG1 THR 78 -11.602 -3.582 6.946 588 HG21 THR 78 HG23 THR 78 -13.101 -5.504 5.559 589 HG22 THR 78 HG21 THR 78 -12.313 -4.848 4.126 590 HG23 THR 78 HG22 THR 78 -14.063 -4.727 4.300 591 H GLU 79 HN GLU 79 -14.248 -1.390 6.728 592 HA GLU 79 HA GLU 79 -13.458 1.323 6.597 593 HB2 GLU 79 HB2 GLU 79 -14.102 -0.269 9.088 594 HB3 GLU 79 HB1 GLU 79 -14.208 1.474 8.891 595 HG2 GLU 79 HG2 GLU 79 -16.048 1.228 7.350 596 HG3 GLU 79 HG1 GLU 79 -15.902 -0.528 7.414 597 H SER 80 HN SER 80 -12.229 -1.525 8.225 598 HA SER 80 HA SER 80 -10.055 -0.257 9.526 599 HG SER 80 HG SER 80 -8.449 -2.134 10.148 600 HB2 SER 80 HB2 SER 80 -11.260 -2.352 10.237 601 HB3 SER 80 HB1 SER 80 -10.305 -3.203 9.025 602 H GLU 81 HN GLU 81 -10.055 -2.425 6.586 603 HA GLU 81 HA GLU 81 -7.332 -2.673 6.419 604 HB2 GLU 81 HB2 GLU 81 -9.358 -3.614 4.930 605 HB3 GLU 81 HB1 GLU 81 -8.758 -2.377 3.850 606 HG2 GLU 81 HG2 GLU 81 -7.176 -4.652 4.962 607 HG3 GLU 81 HG1 GLU 81 -7.736 -4.458 3.298 608 H THR 82 HN THR 82 -9.260 0.007 4.956 609 HA THR 82 HA THR 82 -7.129 1.153 3.595 610 HB THR 82 HB THR 82 -8.299 3.285 3.731 611 HG1 THR 82 HG1 THR 82 -9.055 2.896 5.967 612 HG21 THR 82 HG23 THR 82 -10.055 0.890 3.223 613 HG22 THR 82 HG21 THR 82 -9.067 1.761 2.050 614 HG23 THR 82 HG22 THR 82 -10.481 2.538 2.764 615 H LYS 83 HN LYS 83 -7.699 0.925 6.978 616 HA LYS 83 HA LYS 83 -6.248 3.176 7.880 617 HB2 LYS 83 HB2 LYS 83 -7.702 1.715 9.322 618 HB3 LYS 83 HB1 LYS 83 -6.465 0.469 9.230 619 HG2 LYS 83 HG2 LYS 83 -4.880 1.914 10.348 620 HG3 LYS 83 HG1 LYS 83 -6.059 3.225 10.369 621 HD2 LYS 83 HD2 LYS 83 -7.551 1.809 11.745 622 HD3 LYS 83 HD1 LYS 83 -6.293 0.571 11.785 623 HE2 LYS 83 HE2 LYS 83 -6.275 1.927 13.817 624 HE3 LYS 83 HE1 LYS 83 -4.784 2.124 12.898 625 HZ1 LYS 83 HZ3 LYS 83 -5.588 4.211 12.048 626 HZ2 LYS 83 HZ1 LYS 83 -5.670 4.236 13.737 627 HZ3 LYS 83 HZ2 LYS 83 -7.077 4.010 12.826 628 H SER 84 HN SER 84 -5.333 -0.076 6.844 629 HA SER 84 HA SER 84 -2.667 -0.119 7.572 630 HG SER 84 HG SER 84 -4.839 -2.416 6.896 631 HB2 SER 84 HB2 SER 84 -4.172 -1.283 5.222 632 HB3 SER 84 HB1 SER 84 -2.515 -1.678 5.594 633 H LEU 85 HN LEU 85 -4.147 0.802 4.490 634 HA LEU 85 HA LEU 85 -1.911 1.886 3.267 635 HG LEU 85 HG LEU 85 -4.262 0.213 2.154 636 HB2 LEU 85 HB2 LEU 85 -4.873 2.321 3.069 637 HB3 LEU 85 HB1 LEU 85 -3.787 3.183 2.013 638 HD11 LEU 85 HD11 LEU 85 -4.686 2.254 -0.020 639 HD12 LEU 85 HD12 LEU 85 -5.935 1.430 0.914 640 HD13 LEU 85 HD13 LEU 85 -4.918 0.515 -0.198 641 HD21 LEU 85 HD23 LEU 85 -1.852 0.698 1.838 642 HD22 LEU 85 HD21 LEU 85 -2.265 1.641 0.409 643 HD23 LEU 85 HD22 LEU 85 -2.599 -0.092 0.455 644 H MET 86 HN MET 86 -4.385 3.298 5.292 645 HA MET 86 HA MET 86 -3.668 5.955 5.285 646 HB2 MET 86 HB2 MET 86 -5.626 4.669 6.450 647 HB3 MET 86 HB1 MET 86 -4.521 4.591 7.820 648 HG2 MET 86 HG2 MET 86 -4.882 6.706 8.343 649 HG3 MET 86 HG1 MET 86 -4.627 7.198 6.676 650 HE1 MET 86 HE3 MET 86 -7.543 8.025 5.159 651 HE2 MET 86 HE1 MET 86 -7.446 6.284 4.888 652 HE3 MET 86 HE2 MET 86 -5.967 7.242 4.995 653 H ASP 87 HN ASP 87 -2.585 3.374 7.438 654 HA ASP 87 HA ASP 87 -0.674 4.903 8.881 655 HB2 ASP 87 HB2 ASP 87 -0.993 1.930 8.531 656 HB3 ASP 87 HB1 ASP 87 0.063 2.693 9.719 657 H ALA 88 HN ALA 88 -0.573 4.023 5.712 658 HA ALA 88 HA ALA 88 1.985 2.823 5.466 659 HB1 ALA 88 HB3 ALA 88 1.571 2.746 3.219 660 HB2 ALA 88 HB1 ALA 88 0.649 4.252 3.228 661 HB3 ALA 88 HB2 ALA 88 -0.060 2.780 3.889 662 H ALA 89 HN ALA 89 0.868 6.182 5.486 663 HA ALA 89 HA ALA 89 3.616 7.050 5.630 664 HB1 ALA 89 HB3 ALA 89 3.425 6.841 3.244 665 HB2 ALA 89 HB1 ALA 89 3.470 8.552 3.668 666 HB3 ALA 89 HB2 ALA 89 1.935 7.792 3.230 667 H ASP 90 HN ASP 90 0.860 8.876 4.387 668 HA ASP 90 HA ASP 90 1.219 10.804 6.561 669 HB2 ASP 90 HB2 ASP 90 0.831 11.239 3.904 670 HB3 ASP 90 HB1 ASP 90 -0.820 11.344 4.498 671 H ASN 91 HN ASN 91 0.362 9.318 8.100 672 HA ASN 91 HA ASN 91 -2.483 8.660 7.857 673 HB2 ASN 91 HB2 ASN 91 -1.569 7.563 10.261 674 HB3 ASN 91 HB1 ASN 91 -1.862 6.712 8.756 675 HD21 ASN 91 HD21 ASN 91 -0.075 6.415 7.311 676 HD22 ASN 91 HD22 ASN 91 1.536 6.356 7.929 677 H ASP 92 HN ASP 92 -0.292 10.009 10.307 678 HA ASP 92 HA ASP 92 -2.406 10.788 12.029 679 HB2 ASP 92 HB2 ASP 92 -0.160 10.267 12.845 680 HB3 ASP 92 HB1 ASP 92 0.478 11.676 12.003 681 H GLY 93 HN GLY 93 -1.420 12.299 9.126 682 HA2 GLY 93 HA2 GLY 93 -2.582 14.796 10.177 683 HA3 GLY 93 HA1 GLY 93 -1.176 14.809 9.133 684 H ASP 94 HN ASP 94 -1.438 14.191 6.919 685 HA ASP 94 HA ASP 94 -3.859 15.269 5.830 686 HB2 ASP 94 HB2 ASP 94 -1.464 14.060 4.448 687 HB3 ASP 94 HB1 ASP 94 -2.767 14.934 3.651 688 H GLY 95 HN GLY 95 -3.104 12.163 6.837 689 HA2 GLY 95 HA2 GLY 95 -4.001 10.083 6.384 690 HA3 GLY 95 HA1 GLY 95 -5.448 10.995 5.994 691 H LYS 96 HN LYS 96 -2.638 11.600 4.076 692 HA LYS 96 HA LYS 96 -3.872 10.078 1.896 693 HB2 LYS 96 HB2 LYS 96 -3.701 11.898 0.582 694 HB3 LYS 96 HB1 LYS 96 -3.266 12.793 2.021 695 HG2 LYS 96 HG2 LYS 96 -1.356 11.528 0.068 696 HG3 LYS 96 HG1 LYS 96 -1.728 13.241 0.205 697 HD2 LYS 96 HD2 LYS 96 -0.995 12.577 2.767 698 HD3 LYS 96 HD1 LYS 96 0.088 11.593 1.777 699 HE2 LYS 96 HE2 LYS 96 1.135 13.717 2.219 700 HE3 LYS 96 HE1 LYS 96 0.712 13.624 0.510 701 HZ1 LYS 96 HZ3 LYS 96 0.139 15.776 1.373 702 HZ2 LYS 96 HZ1 LYS 96 -0.778 15.092 2.618 703 HZ3 LYS 96 HZ2 LYS 96 -1.287 14.943 1.014 704 H ILE 97 HN ILE 97 -2.479 8.997 0.381 705 HA ILE 97 HA ILE 97 0.233 8.460 1.396 706 HB ILE 97 HB ILE 97 -1.557 6.387 0.162 707 HG12 ILE 97 HG12 ILE 97 -2.428 7.117 2.358 708 HG13 ILE 97 HG11 ILE 97 -1.840 5.464 2.367 709 HG21 ILE 97 HG21 ILE 97 0.203 4.883 1.232 710 HG22 ILE 97 HG22 ILE 97 1.173 6.348 1.401 711 HG23 ILE 97 HG23 ILE 97 0.680 5.796 -0.200 712 HD11 ILE 97 HD13 ILE 97 0.312 6.376 3.318 713 HD12 ILE 97 HD11 ILE 97 -1.102 6.411 4.372 714 HD13 ILE 97 HD12 ILE 97 -0.568 7.883 3.567 715 H GLY 98 HN GLY 98 1.317 9.616 -0.188 716 HA2 GLY 98 HA2 GLY 98 0.865 8.816 -2.973 717 HA3 GLY 98 HA1 GLY 98 1.625 10.315 -2.454 718 H ALA 99 HN ALA 99 2.918 8.854 -4.322 719 HA ALA 99 HA ALA 99 4.641 6.830 -3.455 720 HB1 ALA 99 HB3 ALA 99 6.004 7.322 -5.354 721 HB2 ALA 99 HB1 ALA 99 5.373 8.968 -5.451 722 HB3 ALA 99 HB2 ALA 99 4.322 7.599 -5.810 723 H ASP 100 HN ASP 100 5.137 10.346 -3.445 724 HA ASP 100 HA ASP 100 7.670 10.380 -2.270 725 HB2 ASP 100 HB2 ASP 100 5.442 12.417 -2.058 726 HB3 ASP 100 HB1 ASP 100 7.110 12.708 -1.574 727 H GLU 101 HN GLU 101 4.491 10.716 -0.711 728 HA GLU 101 HA GLU 101 5.368 10.831 1.945 729 HB2 GLU 101 HB2 GLU 101 2.863 10.472 0.504 730 HB3 GLU 101 HB1 GLU 101 2.891 9.547 1.993 731 HG2 GLU 101 HG2 GLU 101 1.985 11.996 1.901 732 HG3 GLU 101 HG1 GLU 101 2.855 11.402 3.302 733 H PHE 102 HN PHE 102 4.168 8.116 0.032 734 HA PHE 102 HA PHE 102 4.503 6.055 1.835 735 HD1 PHE 102 HD1 PHE 102 6.686 4.197 -0.286 736 HD2 PHE 102 HD2 PHE 102 2.460 3.803 -0.006 737 HE1 PHE 102 HE1 PHE 102 6.929 1.786 -0.082 738 HE2 PHE 102 HE2 PHE 102 2.700 1.360 0.188 739 HZ PHE 102 HZ PHE 102 4.944 0.348 0.147 740 HB2 PHE 102 HB2 PHE 102 3.360 5.873 -0.352 741 HB3 PHE 102 HB1 PHE 102 4.918 5.972 -1.168 742 H GLN 103 HN GLN 103 6.812 7.401 -0.489 743 HA GLN 103 HA GLN 103 8.966 5.694 -0.025 744 HB2 GLN 103 HB2 GLN 103 8.836 8.590 -0.851 745 HB3 GLN 103 HB1 GLN 103 10.356 7.708 -0.747 746 HG2 GLN 103 HG2 GLN 103 8.161 6.481 -2.293 747 HG3 GLN 103 HG1 GLN 103 8.958 7.897 -2.965 748 HE21 GLN 103 HE21 GLN 103 9.620 6.417 -4.640 749 HE22 GLN 103 HE22 GLN 103 11.000 5.431 -4.377 750 H GLU 104 HN GLU 104 7.761 8.376 1.862 751 HA GLU 104 HA GLU 104 10.083 8.809 3.429 752 HB2 GLU 104 HB2 GLU 104 7.177 9.275 4.126 753 HB3 GLU 104 HB1 GLU 104 8.541 9.867 5.061 754 HG2 GLU 104 HG2 GLU 104 7.952 10.598 2.205 755 HG3 GLU 104 HG1 GLU 104 7.566 11.585 3.611 756 H MET 105 HN MET 105 7.405 6.564 3.669 757 HA MET 105 HA MET 105 7.871 5.632 6.268 758 HB2 MET 105 HB2 MET 105 5.989 5.170 4.372 759 HB3 MET 105 HB1 MET 105 6.862 3.644 4.358 760 HG2 MET 105 HG2 MET 105 5.607 4.959 6.756 761 HG3 MET 105 HG1 MET 105 4.984 3.559 5.888 762 HE1 MET 105 HE3 MET 105 7.795 0.900 6.619 763 HE2 MET 105 HE1 MET 105 7.843 2.062 5.294 764 HE3 MET 105 HE2 MET 105 6.329 1.258 5.707 765 H VAL 106 HN VAL 106 8.904 4.151 3.151 766 HA VAL 106 HA VAL 106 10.378 2.087 4.315 767 HB VAL 106 HB VAL 106 9.777 1.987 1.974 768 HG11 VAL 106 HG11 VAL 106 11.322 4.525 1.823 769 HG12 VAL 106 HG12 VAL 106 9.755 4.105 1.124 770 HG13 VAL 106 HG13 VAL 106 11.240 3.476 0.410 771 HG21 VAL 106 HG23 VAL 106 12.413 1.517 2.969 772 HG22 VAL 106 HG21 VAL 106 12.528 2.039 1.289 773 HG23 VAL 106 HG22 VAL 106 11.544 0.634 1.711 774 H HIS 107 HN HIS 107 11.149 5.417 3.681 775 HA HIS 107 HA HIS 107 13.977 5.103 4.136 776 HD1 HIS 107 HD1 HIS 107 15.239 8.454 4.943 777 HD2 HIS 107 HD2 HIS 107 14.763 6.661 1.226 778 HE1 HIS 107 HE1 HIS 107 17.400 8.857 3.720 779 HE2 HIS 107 HE2 HIS 107 17.118 7.691 1.504 780 HB2 HIS 107 HB2 HIS 107 12.509 6.990 2.846 781 HB3 HIS 107 HB1 HIS 107 12.795 7.799 4.383 782 H SER 108 HN SER 108 11.167 5.698 6.057 783 HA SER 108 HA SER 108 12.395 6.957 8.269 784 HG SER 108 HG SER 108 10.339 5.381 10.245 785 HB2 SER 108 HB2 SER 108 9.986 7.021 7.988 786 HB3 SER 108 HB1 SER 108 9.891 5.265 8.116 Start of MODEL 4 1 HA SER 1 HA SER 1 2.268 -8.403 -6.891 2 HG SER 1 HG SER 1 0.677 -9.941 -8.990 3 H1 SER 1 HT1 SER 1 0.496 -6.062 -7.253 4 H2 SER 1 HT2 SER 1 1.150 -6.622 -5.798 5 H3 SER 1 HT3 SER 1 0.009 -7.557 -6.625 6 HB2 SER 1 HB2 SER 1 0.945 -7.312 -9.387 7 HB3 SER 1 HB1 SER 1 2.193 -8.557 -9.375 8 H ILE 2 HN ILE 2 4.088 -7.394 -6.215 9 HA ILE 2 HA ILE 2 5.142 -5.278 -7.964 10 HB ILE 2 HB ILE 2 5.849 -5.541 -5.094 11 HG12 ILE 2 HG12 ILE 2 4.456 -3.441 -4.800 12 HG13 ILE 2 HG11 ILE 2 3.754 -3.777 -6.376 13 HG21 ILE 2 HG21 ILE 2 6.112 -3.058 -6.693 14 HG22 ILE 2 HG22 ILE 2 7.206 -4.392 -7.034 15 HG23 ILE 2 HG23 ILE 2 7.150 -3.692 -5.413 16 HD11 ILE 2 HD13 ILE 2 3.582 -6.132 -4.838 17 HD12 ILE 2 HD11 ILE 2 2.281 -5.094 -5.419 18 HD13 ILE 2 HD12 ILE 2 3.038 -4.788 -3.870 19 H THR 3 HN THR 3 5.588 -7.858 -8.469 20 HA THR 3 HA THR 3 7.877 -8.988 -7.320 21 HB THR 3 HB THR 3 7.945 -10.452 -9.328 22 HG1 THR 3 HG1 THR 3 6.919 -8.603 -10.634 23 HG21 THR 3 HG23 THR 3 5.096 -10.258 -8.433 24 HG22 THR 3 HG21 THR 3 6.360 -10.665 -7.271 25 HG23 THR 3 HG22 THR 3 6.095 -11.690 -8.683 26 H ASP 4 HN ASP 4 7.739 -6.196 -9.228 27 HA ASP 4 HA ASP 4 9.827 -6.417 -10.992 28 HB2 ASP 4 HB2 ASP 4 8.453 -4.411 -10.830 29 HB3 ASP 4 HB1 ASP 4 9.106 -4.059 -9.234 30 H ILE 5 HN ILE 5 10.291 -4.874 -7.782 31 HA ILE 5 HA ILE 5 12.859 -6.327 -7.620 32 HB ILE 5 HB ILE 5 12.354 -3.566 -6.505 33 HG12 ILE 5 HG12 ILE 5 13.910 -4.224 -9.008 34 HG13 ILE 5 HG11 ILE 5 12.228 -3.701 -9.030 35 HG21 ILE 5 HG21 ILE 5 14.122 -4.878 -5.416 36 HG22 ILE 5 HG22 ILE 5 14.763 -3.469 -6.261 37 HG23 ILE 5 HG23 ILE 5 14.922 -5.073 -6.976 38 HD11 ILE 5 HD13 ILE 5 13.969 -1.930 -9.450 39 HD12 ILE 5 HD11 ILE 5 14.405 -2.085 -7.748 40 HD13 ILE 5 HD12 ILE 5 12.778 -1.573 -8.199 41 H LEU 6 HN LEU 6 12.096 -7.897 -6.338 42 HA LEU 6 HA LEU 6 12.035 -7.468 -3.553 43 HG LEU 6 HG LEU 6 10.644 -5.846 -3.011 44 HB2 LEU 6 HB2 LEU 6 9.421 -7.515 -4.935 45 HB3 LEU 6 HB1 LEU 6 9.542 -8.461 -3.466 46 HD11 LEU 6 HD11 LEU 6 7.915 -5.959 -4.265 47 HD12 LEU 6 HD12 LEU 6 9.285 -4.943 -4.713 48 HD13 LEU 6 HD13 LEU 6 8.425 -4.646 -3.205 49 HD21 LEU 6 HD23 LEU 6 8.237 -7.306 -1.933 50 HD22 LEU 6 HD21 LEU 6 8.915 -5.829 -1.250 51 HD23 LEU 6 HD22 LEU 6 9.866 -7.314 -1.258 52 H SER 7 HN SER 7 11.561 -9.427 -2.300 53 HA SER 7 HA SER 7 12.420 -11.801 -3.721 54 HG SER 7 HG SER 7 13.874 -10.979 -0.652 55 HB2 SER 7 HB2 SER 7 11.799 -11.256 -0.812 56 HB3 SER 7 HB1 SER 7 12.252 -12.850 -1.409 57 H ALA 8 HN ALA 8 11.030 -13.263 -4.554 58 HA ALA 8 HA ALA 8 8.285 -12.727 -4.716 59 HB1 ALA 8 HB3 ALA 8 9.567 -14.047 -6.365 60 HB2 ALA 8 HB1 ALA 8 8.089 -14.850 -5.836 61 HB3 ALA 8 HB2 ALA 8 9.650 -15.370 -5.202 62 H GLU 9 HN GLU 9 9.978 -15.208 -2.786 63 HA GLU 9 HA GLU 9 7.624 -16.291 -1.664 64 HB2 GLU 9 HB2 GLU 9 10.475 -16.342 -0.682 65 HB3 GLU 9 HB1 GLU 9 9.175 -17.319 -0.007 66 HG2 GLU 9 HG2 GLU 9 10.107 -17.407 -2.854 67 HG3 GLU 9 HG1 GLU 9 10.616 -18.534 -1.598 68 H ASP 10 HN ASP 10 10.094 -14.177 -0.228 69 HA ASP 10 HA ASP 10 8.847 -13.575 2.102 70 HB2 ASP 10 HB2 ASP 10 10.435 -11.676 0.396 71 HB3 ASP 10 HB1 ASP 10 10.087 -11.442 2.103 72 H ILE 11 HN ILE 11 8.144 -12.230 -1.052 73 HA ILE 11 HA ILE 11 6.459 -10.155 -0.133 74 HB ILE 11 HB ILE 11 7.040 -11.484 -2.689 75 HG12 ILE 11 HG12 ILE 11 6.460 -8.627 -1.886 76 HG13 ILE 11 HG11 ILE 11 8.050 -9.367 -2.042 77 HG21 ILE 11 HG21 ILE 11 4.313 -10.338 -2.212 78 HG22 ILE 11 HG22 ILE 11 4.755 -11.847 -3.007 79 HG23 ILE 11 HG23 ILE 11 5.057 -10.306 -3.811 80 HD11 ILE 11 HD13 ILE 11 7.533 -7.954 -3.949 81 HD12 ILE 11 HD11 ILE 11 6.093 -8.910 -4.282 82 HD13 ILE 11 HD12 ILE 11 7.679 -9.638 -4.438 83 H ALA 12 HN ALA 12 5.773 -13.451 -1.215 84 HA ALA 12 HA ALA 12 3.010 -13.473 -0.785 85 HB1 ALA 12 HB3 ALA 12 4.689 -15.298 -1.747 86 HB2 ALA 12 HB1 ALA 12 3.092 -15.726 -1.127 87 HB3 ALA 12 HB2 ALA 12 4.516 -15.930 -0.109 88 H ALA 13 HN ALA 13 5.589 -14.489 1.462 89 HA ALA 13 HA ALA 13 3.817 -14.988 3.619 90 HB1 ALA 13 HB3 ALA 13 6.240 -15.738 3.432 91 HB2 ALA 13 HB1 ALA 13 5.741 -15.111 5.005 92 HB3 ALA 13 HB2 ALA 13 6.681 -14.096 3.910 93 H ALA 14 HN ALA 14 5.865 -12.281 2.818 94 HA ALA 14 HA ALA 14 5.282 -10.464 4.753 95 HB1 ALA 14 HB3 ALA 14 6.858 -9.893 3.059 96 HB2 ALA 14 HB1 ALA 14 5.578 -8.684 3.000 97 HB3 ALA 14 HB2 ALA 14 5.626 -9.973 1.798 98 H LEU 15 HN LEU 15 3.408 -10.962 1.779 99 HA LEU 15 HA LEU 15 1.341 -9.135 2.548 100 HG LEU 15 HG LEU 15 0.132 -8.462 0.180 101 HB2 LEU 15 HB2 LEU 15 2.055 -9.808 0.183 102 HB3 LEU 15 HB1 LEU 15 1.146 -11.276 0.442 103 HD11 LEU 15 HD11 LEU 15 -0.527 -11.069 -1.173 104 HD12 LEU 15 HD12 LEU 15 0.317 -9.689 -1.870 105 HD13 LEU 15 HD13 LEU 15 -1.389 -9.555 -1.446 106 HD21 LEU 15 HD23 LEU 15 -1.035 -9.191 2.108 107 HD22 LEU 15 HD21 LEU 15 -1.301 -10.794 1.426 108 HD23 LEU 15 HD22 LEU 15 -2.134 -9.397 0.745 109 H GLN 16 HN GLN 16 1.546 -12.693 2.249 110 HA GLN 16 HA GLN 16 -1.062 -13.252 3.162 111 HB2 GLN 16 HB2 GLN 16 1.428 -14.905 2.833 112 HB3 GLN 16 HB1 GLN 16 -0.113 -15.571 3.333 113 HG2 GLN 16 HG2 GLN 16 0.718 -15.564 0.826 114 HG3 GLN 16 HG1 GLN 16 -0.985 -15.481 1.268 115 HE21 GLN 16 HE21 GLN 16 -2.017 -13.420 1.178 116 HE22 GLN 16 HE22 GLN 16 -1.429 -12.201 0.106 117 H GLU 17 HN GLU 17 1.475 -12.061 5.007 118 HA GLU 17 HA GLU 17 1.663 -13.981 7.062 119 HB2 GLU 17 HB2 GLU 17 3.371 -12.336 6.821 120 HB3 GLU 17 HB1 GLU 17 2.217 -11.058 7.028 121 HG2 GLU 17 HG2 GLU 17 1.911 -11.618 9.333 122 HG3 GLU 17 HG1 GLU 17 2.928 -13.048 9.154 123 H CYS 18 HN CYS 18 0.363 -10.712 7.569 124 HA CYS 18 HA CYS 18 -1.574 -11.811 9.420 125 HG CYS 18 HG CYS 18 -1.815 -11.153 11.617 126 HB2 CYS 18 HB2 CYS 18 0.329 -9.758 9.482 127 HB3 CYS 18 HB1 CYS 18 -1.246 -8.956 9.469 128 H GLN 19 HN GLN 19 -1.655 -11.140 6.282 129 HA GLN 19 HA GLN 19 -3.294 -9.001 5.772 130 HB2 GLN 19 HB2 GLN 19 -2.331 -10.267 3.986 131 HB3 GLN 19 HB1 GLN 19 -3.232 -11.695 4.450 132 HG2 GLN 19 HG2 GLN 19 -5.312 -10.587 3.832 133 HG3 GLN 19 HG1 GLN 19 -4.404 -9.150 3.379 134 HE21 GLN 19 HE21 GLN 19 -4.911 -9.117 1.242 135 HE22 GLN 19 HE22 GLN 19 -4.427 -10.342 0.123 136 H ASP 20 HN ASP 20 -5.378 -8.603 5.639 137 HA ASP 20 HA ASP 20 -7.586 -10.197 5.963 138 HB2 ASP 20 HB2 ASP 20 -6.181 -9.756 8.474 139 HB3 ASP 20 HB1 ASP 20 -7.827 -9.139 8.540 140 HA PRO 21 HA PRO 21 -9.468 -6.203 5.499 141 HB2 PRO 21 HB2 PRO 21 -11.861 -6.430 6.594 142 HB3 PRO 21 HB1 PRO 21 -11.420 -7.426 5.217 143 HG2 PRO 21 HG2 PRO 21 -11.489 -8.107 8.131 144 HG3 PRO 21 HG1 PRO 21 -12.057 -9.061 6.747 145 HD2 PRO 21 HD2 PRO 21 -9.643 -9.437 7.974 146 HD3 PRO 21 HD1 PRO 21 -9.977 -9.843 6.287 147 H ASP 22 HN ASP 22 -7.666 -6.076 7.621 148 HA ASP 22 HA ASP 22 -8.319 -3.753 8.951 149 HB2 ASP 22 HB2 ASP 22 -8.888 -4.486 11.221 150 HB3 ASP 22 HB1 ASP 22 -10.092 -5.030 10.064 151 H THR 23 HN THR 23 -6.073 -6.088 8.284 152 HA THR 23 HA THR 23 -4.414 -5.568 10.622 153 HB THR 23 HB THR 23 -2.885 -7.238 9.480 154 HG1 THR 23 HG1 THR 23 -3.540 -8.151 7.671 155 HG21 THR 23 HG23 THR 23 -3.823 -8.538 11.036 156 HG22 THR 23 HG21 THR 23 -5.047 -8.988 9.847 157 HG23 THR 23 HG22 THR 23 -5.334 -7.632 10.941 158 H PHE 24 HN PHE 24 -4.239 -5.376 7.131 159 HA PHE 24 HA PHE 24 -3.129 -3.681 5.930 160 HD1 PHE 24 HD2 PHE 24 -1.177 -5.534 8.834 161 HD2 PHE 24 HD1 PHE 24 0.754 -2.070 7.321 162 HE1 PHE 24 HE2 PHE 24 0.888 -6.216 9.963 163 HE2 PHE 24 HE1 PHE 24 2.846 -2.743 8.456 164 HZ PHE 24 HZ PHE 24 2.910 -4.820 9.781 165 HB2 PHE 24 HB2 PHE 24 -1.263 -2.522 6.611 166 HB3 PHE 24 HB1 PHE 24 -2.179 -2.691 8.077 167 H GLU 25 HN GLU 25 -3.079 -5.061 4.392 168 HA GLU 25 HA GLU 25 -1.112 -7.135 4.246 169 HB2 GLU 25 HB2 GLU 25 -2.305 -7.164 1.785 170 HB3 GLU 25 HB1 GLU 25 -2.736 -8.169 3.158 171 HG2 GLU 25 HG2 GLU 25 -3.902 -5.492 2.750 172 HG3 GLU 25 HG1 GLU 25 -4.557 -6.878 1.911 173 HA PRO 26 HA PRO 26 0.301 -4.483 0.474 174 HB2 PRO 26 HB2 PRO 26 0.086 -1.772 0.826 175 HB3 PRO 26 HB1 PRO 26 -1.043 -2.754 -0.094 176 HG2 PRO 26 HG2 PRO 26 -1.306 -1.628 2.605 177 HG3 PRO 26 HG1 PRO 26 -2.548 -1.957 1.394 178 HD2 PRO 26 HD2 PRO 26 -2.082 -3.499 3.620 179 HD3 PRO 26 HD1 PRO 26 -2.881 -4.059 2.145 180 H GLN 27 HN GLN 27 0.561 -2.319 3.319 181 HA GLN 27 HA GLN 27 3.224 -1.703 2.916 182 HB2 GLN 27 HB2 GLN 27 2.282 -0.227 4.350 183 HB3 GLN 27 HB1 GLN 27 1.216 -1.430 5.052 184 HG2 GLN 27 HG2 GLN 27 2.660 -1.962 6.684 185 HG3 GLN 27 HG1 GLN 27 4.078 -1.616 5.702 186 HE21 GLN 27 HE21 GLN 27 1.550 -0.234 7.666 187 HE22 GLN 27 HE22 GLN 27 2.320 1.286 7.943 188 H LYS 28 HN LYS 28 1.761 -4.521 4.363 189 HA LYS 28 HA LYS 28 4.069 -5.450 5.733 190 HB2 LYS 28 HB2 LYS 28 1.451 -6.612 4.881 191 HB3 LYS 28 HB1 LYS 28 2.734 -7.655 5.411 192 HG2 LYS 28 HG2 LYS 28 2.008 -5.381 7.099 193 HG3 LYS 28 HG1 LYS 28 0.951 -6.784 7.087 194 HD2 LYS 28 HD2 LYS 28 2.493 -7.043 8.897 195 HD3 LYS 28 HD1 LYS 28 2.939 -8.190 7.635 196 HE2 LYS 28 HE2 LYS 28 4.749 -6.807 6.925 197 HE3 LYS 28 HE1 LYS 28 4.225 -5.488 7.971 198 HZ1 LYS 28 HZ3 LYS 28 6.081 -6.663 8.944 199 HZ2 LYS 28 HZ1 LYS 28 5.240 -8.131 8.871 200 HZ3 LYS 28 HZ2 LYS 28 4.700 -6.896 9.891 201 H PHE 29 HN PHE 29 2.531 -6.080 2.663 202 HA PHE 29 HA PHE 29 4.111 -8.054 1.574 203 HD1 PHE 29 HD1 PHE 29 5.133 -6.087 -1.230 204 HD2 PHE 29 HD2 PHE 29 1.622 -8.478 -1.152 205 HE1 PHE 29 HE1 PHE 29 5.649 -6.918 -3.487 206 HE2 PHE 29 HE2 PHE 29 2.132 -9.325 -3.399 207 HZ PHE 29 HZ PHE 29 4.147 -8.542 -4.572 208 HB2 PHE 29 HB2 PHE 29 2.033 -7.139 0.595 209 HB3 PHE 29 HB1 PHE 29 2.861 -5.637 0.238 210 H PHE 30 HN PHE 30 4.484 -4.571 1.434 211 HA PHE 30 HA PHE 30 6.907 -4.559 -0.046 212 HD1 PHE 30 HD1 PHE 30 4.904 -4.176 -1.229 213 HD2 PHE 30 HD2 PHE 30 4.276 -0.847 1.344 214 HE1 PHE 30 HE1 PHE 30 2.690 -3.811 -2.235 215 HE2 PHE 30 HE2 PHE 30 2.063 -0.477 0.338 216 HZ PHE 30 HZ PHE 30 1.268 -1.961 -1.456 217 HB2 PHE 30 HB2 PHE 30 6.061 -2.309 1.729 218 HB3 PHE 30 HB1 PHE 30 6.821 -2.240 0.144 219 H GLN 31 HN GLN 31 6.238 -3.662 3.329 220 HA GLN 31 HA GLN 31 8.835 -3.180 4.113 221 HB2 GLN 31 HB2 GLN 31 6.647 -2.666 5.315 222 HB3 GLN 31 HB1 GLN 31 6.756 -4.295 5.968 223 HG2 GLN 31 HG2 GLN 31 7.774 -3.184 7.649 224 HG3 GLN 31 HG1 GLN 31 9.182 -3.461 6.627 225 HE21 GLN 31 HE21 GLN 31 8.245 -1.458 4.650 226 HE22 GLN 31 HE22 GLN 31 8.585 0.075 5.363 227 H THR 32 HN THR 32 7.054 -6.081 5.080 228 HA THR 32 HA THR 32 9.133 -7.383 6.316 229 HB THR 32 HB THR 32 7.003 -8.742 4.671 230 HG1 THR 32 HG1 THR 32 5.678 -8.421 6.336 231 HG21 THR 32 HG23 THR 32 8.818 -10.236 5.355 232 HG22 THR 32 HG21 THR 32 7.327 -10.607 6.223 233 HG23 THR 32 HG22 THR 32 8.618 -9.714 7.028 234 H SER 33 HN SER 33 8.217 -7.727 2.885 235 HA SER 33 HA SER 33 10.524 -9.390 2.373 236 HG SER 33 HG SER 33 9.340 -10.370 -0.623 237 HB2 SER 33 HB2 SER 33 8.438 -9.936 1.279 238 HB3 SER 33 HB1 SER 33 8.402 -8.371 0.489 239 H GLY 34 HN GLY 34 9.370 -6.329 0.967 240 HA2 GLY 34 HA2 GLY 34 12.090 -5.990 -0.080 241 HA3 GLY 34 HA1 GLY 34 10.684 -5.179 -0.715 242 H LEU 35 HN LEU 35 9.684 -3.644 1.162 243 HA LEU 35 HA LEU 35 11.196 -1.394 1.106 244 HG LEU 35 HG LEU 35 9.705 0.551 1.977 245 HB2 LEU 35 HB2 LEU 35 8.810 -2.294 2.401 246 HB3 LEU 35 HB1 LEU 35 9.736 -1.294 3.507 247 HD11 LEU 35 HD11 LEU 35 8.273 0.254 -0.146 248 HD12 LEU 35 HD12 LEU 35 8.596 -1.467 0.067 249 HD13 LEU 35 HD13 LEU 35 9.932 -0.339 -0.151 250 HD21 LEU 35 HD23 LEU 35 6.924 -0.588 1.977 251 HD22 LEU 35 HD21 LEU 35 7.410 1.106 2.043 252 HD23 LEU 35 HD22 LEU 35 7.698 0.050 3.426 253 H SER 36 HN SER 36 11.151 -3.774 3.735 254 HA SER 36 HA SER 36 12.543 -2.728 5.720 255 HG SER 36 HG SER 36 14.296 -5.593 4.159 256 HB2 SER 36 HB2 SER 36 13.630 -4.898 6.120 257 HB3 SER 36 HB1 SER 36 11.947 -5.097 5.632 258 H LYS 37 HN LYS 37 14.004 -3.341 2.570 259 HA LYS 37 HA LYS 37 16.361 -1.862 3.486 260 HB2 LYS 37 HB2 LYS 37 17.850 -3.408 2.300 261 HB3 LYS 37 HB1 LYS 37 17.010 -4.152 3.651 262 HG2 LYS 37 HG2 LYS 37 15.474 -5.215 2.159 263 HG3 LYS 37 HG1 LYS 37 16.192 -4.397 0.771 264 HD2 LYS 37 HD2 LYS 37 17.438 -6.257 0.595 265 HD3 LYS 37 HD1 LYS 37 18.367 -5.532 1.909 266 HE2 LYS 37 HE2 LYS 37 16.092 -7.484 2.242 267 HE3 LYS 37 HE1 LYS 37 17.805 -7.881 2.362 268 HZ1 LYS 37 HZ3 LYS 37 16.852 -7.563 4.541 269 HZ2 LYS 37 HZ1 LYS 37 16.322 -6.010 4.129 270 HZ3 LYS 37 HZ2 LYS 37 17.978 -6.339 4.231 271 H MET 38 HN MET 38 14.252 -2.712 0.838 272 HA MET 38 HA MET 38 15.593 -1.931 -1.388 273 HB2 MET 38 HB2 MET 38 12.715 -1.376 -0.695 274 HB3 MET 38 HB1 MET 38 13.407 -1.261 -2.301 275 HG2 MET 38 HG2 MET 38 13.357 -3.742 -0.642 276 HG3 MET 38 HG1 MET 38 12.204 -3.367 -1.913 277 HE1 MET 38 HE3 MET 38 14.636 -5.924 -1.478 278 HE2 MET 38 HE1 MET 38 14.589 -6.294 -3.202 279 HE3 MET 38 HE2 MET 38 13.094 -5.941 -2.333 280 H SER 39 HN SER 39 15.964 -0.120 -2.535 281 HA SER 39 HA SER 39 16.412 2.300 -1.112 282 HG SER 39 HG SER 39 16.545 3.499 -4.524 283 HB2 SER 39 HB2 SER 39 17.955 1.938 -2.821 284 HB3 SER 39 HB1 SER 39 16.711 1.481 -3.985 285 H ALA 40 HN ALA 40 15.681 4.434 -2.034 286 HA ALA 40 HA ALA 40 12.889 4.661 -1.737 287 HB1 ALA 40 HB3 ALA 40 14.714 6.718 -2.957 288 HB2 ALA 40 HB1 ALA 40 14.509 6.460 -1.222 289 HB3 ALA 40 HB2 ALA 40 13.138 6.991 -2.203 290 H SER 41 HN SER 41 14.921 4.728 -4.649 291 HA SER 41 HA SER 41 13.058 5.528 -6.518 292 HG SER 41 HG SER 41 15.998 5.705 -6.282 293 HB2 SER 41 HB2 SER 41 15.375 3.613 -6.797 294 HB3 SER 41 HB1 SER 41 14.461 4.246 -8.165 295 H GLN 42 HN GLN 42 13.924 2.125 -5.840 296 HA GLN 42 HA GLN 42 12.021 0.981 -7.501 297 HB2 GLN 42 HB2 GLN 42 12.380 -1.068 -6.375 298 HB3 GLN 42 HB1 GLN 42 13.909 -0.200 -6.330 299 HG2 GLN 42 HG2 GLN 42 13.769 -0.968 -4.191 300 HG3 GLN 42 HG1 GLN 42 13.049 0.634 -4.044 301 HE21 GLN 42 HE21 GLN 42 12.409 -2.792 -4.161 302 HE22 GLN 42 HE22 GLN 42 10.820 -2.719 -3.486 303 H VAL 43 HN VAL 43 11.643 2.464 -4.441 304 HA VAL 43 HA VAL 43 9.264 1.314 -3.539 305 HB VAL 43 HB VAL 43 9.900 4.240 -3.263 306 HG11 VAL 43 HG11 VAL 43 8.237 2.350 -1.619 307 HG12 VAL 43 HG12 VAL 43 7.649 3.682 -2.612 308 HG13 VAL 43 HG13 VAL 43 8.610 4.013 -1.170 309 HG21 VAL 43 HG23 VAL 43 10.833 3.398 -1.008 310 HG22 VAL 43 HG21 VAL 43 11.825 3.251 -2.453 311 HG23 VAL 43 HG22 VAL 43 10.969 1.846 -1.833 312 H LYS 44 HN LYS 44 9.739 4.067 -5.735 313 HA LYS 44 HA LYS 44 7.147 4.777 -6.242 314 HB2 LYS 44 HB2 LYS 44 9.568 4.633 -8.001 315 HB3 LYS 44 HB1 LYS 44 8.018 5.040 -8.710 316 HG2 LYS 44 HG2 LYS 44 7.981 7.090 -7.814 317 HG3 LYS 44 HG1 LYS 44 8.726 6.546 -6.324 318 HD2 LYS 44 HD2 LYS 44 10.110 8.132 -7.702 319 HD3 LYS 44 HD1 LYS 44 10.901 6.617 -7.259 320 HE2 LYS 44 HE2 LYS 44 11.371 7.052 -9.564 321 HE3 LYS 44 HE1 LYS 44 10.240 5.703 -9.463 322 HZ1 LYS 44 HZ3 LYS 44 9.630 7.290 -11.198 323 HZ2 LYS 44 HZ1 LYS 44 9.484 8.517 -10.042 324 HZ3 LYS 44 HZ2 LYS 44 8.436 7.189 -10.006 325 H ASP 45 HN ASP 45 8.919 2.008 -7.455 326 HA ASP 45 HA ASP 45 6.860 1.041 -9.173 327 HB2 ASP 45 HB2 ASP 45 9.548 0.309 -8.457 328 HB3 ASP 45 HB1 ASP 45 8.511 -1.106 -8.354 329 H ILE 46 HN ILE 46 7.943 0.317 -5.882 330 HA ILE 46 HA ILE 46 6.179 -1.770 -5.305 331 HB ILE 46 HB ILE 46 7.789 0.146 -3.719 332 HG12 ILE 46 HG12 ILE 46 8.935 -1.808 -3.017 333 HG13 ILE 46 HG11 ILE 46 7.654 -2.849 -3.610 334 HG21 ILE 46 HG21 ILE 46 5.517 -1.430 -2.628 335 HG22 ILE 46 HG22 ILE 46 6.100 0.176 -2.186 336 HG23 ILE 46 HG23 ILE 46 6.986 -1.256 -1.666 337 HD11 ILE 46 HD13 ILE 46 8.229 -2.059 -5.917 338 HD12 ILE 46 HD11 ILE 46 9.465 -3.026 -5.114 339 HD13 ILE 46 HD12 ILE 46 9.640 -1.278 -5.211 340 H PHE 47 HN PHE 47 5.959 1.635 -4.309 341 HA PHE 47 HA PHE 47 3.520 1.785 -3.232 342 HD1 PHE 47 HD2 PHE 47 3.254 3.411 -1.798 343 HD2 PHE 47 HD1 PHE 47 2.999 5.543 -5.457 344 HE1 PHE 47 HE2 PHE 47 1.564 4.872 -0.816 345 HE2 PHE 47 HE1 PHE 47 1.287 7.013 -4.486 346 HZ PHE 47 HZ PHE 47 0.567 6.679 -2.156 347 HB2 PHE 47 HB2 PHE 47 5.179 3.624 -3.689 348 HB3 PHE 47 HB1 PHE 47 4.449 3.782 -5.280 349 H ARG 48 HN ARG 48 4.154 1.265 -6.611 350 HA ARG 48 HA ARG 48 1.765 2.082 -7.731 351 HE ARG 48 HE ARG 48 5.394 3.612 -9.959 352 HB2 ARG 48 HB2 ARG 48 3.413 -0.305 -8.549 353 HB3 ARG 48 HB1 ARG 48 2.195 0.494 -9.538 354 HG2 ARG 48 HG2 ARG 48 4.847 1.536 -8.646 355 HG3 ARG 48 HG1 ARG 48 4.253 1.322 -10.288 356 HD2 ARG 48 HD2 ARG 48 2.610 3.112 -9.916 357 HD3 ARG 48 HD1 ARG 48 3.219 3.341 -8.271 358 HH11 ARG 48 HH11 ARG 48 2.330 5.191 -9.470 359 HH12 ARG 48 HH12 ARG 48 2.897 6.740 -10.002 360 HH21 ARG 48 HH21 ARG 48 6.152 5.645 -10.662 361 HH22 ARG 48 HH22 ARG 48 5.070 6.997 -10.680 362 H PHE 49 HN PHE 49 2.400 -0.772 -5.777 363 HA PHE 49 HA PHE 49 0.220 -2.335 -6.463 364 HD1 PHE 49 HD2 PHE 49 0.390 -4.839 -5.749 365 HD2 PHE 49 HD1 PHE 49 -0.388 -2.619 -2.202 366 HE1 PHE 49 HE2 PHE 49 -1.156 -6.596 -4.992 367 HE2 PHE 49 HE1 PHE 49 -1.934 -4.371 -1.441 368 HZ PHE 49 HZ PHE 49 -2.321 -6.362 -2.836 369 HB2 PHE 49 HB2 PHE 49 1.964 -3.035 -4.853 370 HB3 PHE 49 HB1 PHE 49 1.305 -1.912 -3.668 371 H ILE 50 HN ILE 50 0.275 0.020 -3.743 372 HA ILE 50 HA ILE 50 -2.603 0.181 -3.786 373 HB ILE 50 HB ILE 50 -2.248 2.091 -2.162 374 HG12 ILE 50 HG12 ILE 50 0.591 1.044 -2.111 375 HG13 ILE 50 HG11 ILE 50 0.105 2.572 -2.842 376 HG21 ILE 50 HG21 ILE 50 -1.583 -0.756 -1.708 377 HG22 ILE 50 HG22 ILE 50 -2.915 0.226 -1.094 378 HG23 ILE 50 HG23 ILE 50 -1.308 0.380 -0.387 379 HD11 ILE 50 HD13 ILE 50 -0.018 1.808 0.063 380 HD12 ILE 50 HD11 ILE 50 -0.766 3.261 -0.598 381 HD13 ILE 50 HD12 ILE 50 0.984 3.054 -0.683 382 H ASP 51 HN ASP 51 -3.772 1.540 -4.861 383 HA ASP 51 HA ASP 51 -4.049 2.825 -6.833 384 HB2 ASP 51 HB2 ASP 51 -3.943 4.591 -4.386 385 HB3 ASP 51 HB1 ASP 51 -4.633 5.084 -5.933 386 H ASN 52 HN ASN 52 -3.078 3.721 -8.462 387 HA ASN 52 HA ASN 52 -0.302 4.572 -8.150 388 HB2 ASN 52 HB2 ASN 52 0.049 4.082 -10.391 389 HB3 ASN 52 HB1 ASN 52 -1.155 2.890 -9.931 390 HD21 ASN 52 HD21 ASN 52 -3.484 3.660 -10.316 391 HD22 ASN 52 HD22 ASN 52 -3.773 4.460 -11.815 392 H ASP 53 HN ASP 53 -3.344 5.730 -9.405 393 HA ASP 53 HA ASP 53 -2.641 8.447 -8.808 394 HB2 ASP 53 HB2 ASP 53 -3.084 7.587 -11.678 395 HB3 ASP 53 HB1 ASP 53 -3.087 9.260 -11.128 396 H GLN 54 HN GLN 54 -4.507 9.752 -8.664 397 HA GLN 54 HA GLN 54 -7.025 8.734 -9.552 398 HB2 GLN 54 HB2 GLN 54 -6.448 9.053 -6.601 399 HB3 GLN 54 HB1 GLN 54 -7.999 8.648 -7.313 400 HG2 GLN 54 HG2 GLN 54 -6.955 6.583 -8.247 401 HG3 GLN 54 HG1 GLN 54 -5.500 6.976 -7.336 402 HE21 GLN 54 HE21 GLN 54 -5.477 6.687 -5.121 403 HE22 GLN 54 HE22 GLN 54 -6.718 5.842 -4.271 404 H SER 55 HN SER 55 -5.812 11.041 -7.048 405 HA SER 55 HA SER 55 -6.764 13.240 -8.718 406 HG SER 55 HG SER 55 -8.435 14.887 -6.104 407 HB2 SER 55 HB2 SER 55 -8.625 12.557 -7.163 408 HB3 SER 55 HB1 SER 55 -7.572 12.985 -5.813 409 H GLY 56 HN GLY 56 -4.116 12.536 -8.254 410 HA2 GLY 56 HA2 GLY 56 -2.249 13.959 -7.920 411 HA3 GLY 56 HA1 GLY 56 -3.205 14.899 -6.781 412 H TYR 57 HN TYR 57 -4.130 12.472 -5.437 413 HA TYR 57 HA TYR 57 -1.798 11.189 -4.311 414 HD1 TYR 57 HD1 TYR 57 -4.776 13.978 -2.803 415 HD2 TYR 57 HD2 TYR 57 -0.614 14.404 -3.440 416 HE1 TYR 57 HE1 TYR 57 -5.110 16.383 -3.251 417 HE2 TYR 57 HE2 TYR 57 -0.909 16.808 -3.883 418 HH TYR 57 HH TYR 57 -2.710 18.333 -4.628 419 HB2 TYR 57 HB2 TYR 57 -3.268 12.300 -2.079 420 HB3 TYR 57 HB1 TYR 57 -1.554 12.401 -2.425 421 H LEU 58 HN LEU 58 -2.440 9.614 -2.603 422 HA LEU 58 HA LEU 58 -5.112 8.534 -3.223 423 HG LEU 58 HG LEU 58 -1.776 8.047 -3.646 424 HB2 LEU 58 HB2 LEU 58 -3.037 6.979 -1.750 425 HB3 LEU 58 HB1 LEU 58 -4.215 6.423 -2.921 426 HD11 LEU 58 HD11 LEU 58 -2.163 5.069 -3.850 427 HD12 LEU 58 HD12 LEU 58 -1.111 5.891 -2.701 428 HD13 LEU 58 HD13 LEU 58 -0.775 5.985 -4.429 429 HD21 LEU 58 HD23 LEU 58 -3.244 6.334 -5.558 430 HD22 LEU 58 HD21 LEU 58 -2.356 7.828 -5.826 431 HD23 LEU 58 HD22 LEU 58 -3.962 7.876 -5.097 432 H ASP 59 HN ASP 59 -6.523 9.464 -1.663 433 HA ASP 59 HA ASP 59 -5.555 9.608 1.066 434 HB2 ASP 59 HB2 ASP 59 -7.588 11.026 1.396 435 HB3 ASP 59 HB1 ASP 59 -6.462 11.662 0.200 436 H GLY 60 HN GLY 60 -7.245 9.203 2.774 437 HA2 GLY 60 HA2 GLY 60 -7.759 6.544 2.976 438 HA3 GLY 60 HA1 GLY 60 -8.697 7.757 3.827 439 H ASP 61 HN ASP 61 -9.673 8.857 1.234 440 HA ASP 61 HA ASP 61 -12.010 7.160 1.053 441 HB2 ASP 61 HB2 ASP 61 -11.939 9.761 0.940 442 HB3 ASP 61 HB1 ASP 61 -11.466 9.508 -0.739 443 H GLU 62 HN GLU 62 -9.346 8.215 -0.966 444 HA GLU 62 HA GLU 62 -10.130 6.741 -3.268 445 HB2 GLU 62 HB2 GLU 62 -7.404 7.856 -2.638 446 HB3 GLU 62 HB1 GLU 62 -8.074 7.501 -4.224 447 HG2 GLU 62 HG2 GLU 62 -9.227 9.543 -2.369 448 HG3 GLU 62 HG1 GLU 62 -8.015 9.919 -3.593 449 H LEU 63 HN LEU 63 -7.981 6.203 -0.566 450 HA LEU 63 HA LEU 63 -6.422 4.132 -1.388 451 HG LEU 63 HG LEU 63 -6.262 6.323 0.871 452 HB2 LEU 63 HB2 LEU 63 -7.763 4.518 1.295 453 HB3 LEU 63 HB1 LEU 63 -6.512 3.334 1.007 454 HD11 LEU 63 HD11 LEU 63 -4.241 4.907 2.345 455 HD12 LEU 63 HD12 LEU 63 -5.857 4.541 2.963 456 HD13 LEU 63 HD13 LEU 63 -5.302 6.214 2.855 457 HD21 LEU 63 HD23 LEU 63 -4.350 4.240 -0.122 458 HD22 LEU 63 HD21 LEU 63 -3.892 5.911 0.221 459 HD23 LEU 63 HD22 LEU 63 -5.093 5.563 -1.031 460 H LYS 64 HN LYS 64 -9.803 3.744 -0.165 461 HA LYS 64 HA LYS 64 -9.968 1.028 -0.378 462 HB2 LYS 64 HB2 LYS 64 -12.142 2.997 -1.073 463 HB3 LYS 64 HB1 LYS 64 -12.366 1.331 -0.589 464 HG2 LYS 64 HG2 LYS 64 -11.678 1.773 1.617 465 HG3 LYS 64 HG1 LYS 64 -11.073 3.370 1.173 466 HD2 LYS 64 HD2 LYS 64 -13.963 2.633 0.840 467 HD3 LYS 64 HD1 LYS 64 -13.336 3.241 2.375 468 HE2 LYS 64 HE2 LYS 64 -12.524 5.253 1.217 469 HE3 LYS 64 HE1 LYS 64 -13.198 4.644 -0.293 470 HZ1 LYS 64 HZ3 LYS 64 -15.399 4.702 0.721 471 HZ2 LYS 64 HZ1 LYS 64 -14.682 6.235 0.737 472 HZ3 LYS 64 HZ2 LYS 64 -14.742 5.314 2.154 473 H TYR 65 HN TYR 65 -9.811 3.329 -2.942 474 HA TYR 65 HA TYR 65 -11.079 1.666 -4.878 475 HD1 TYR 65 HD1 TYR 65 -12.241 3.098 -3.748 476 HD2 TYR 65 HD2 TYR 65 -10.414 6.155 -6.073 477 HE1 TYR 65 HE1 TYR 65 -13.859 4.735 -2.864 478 HE2 TYR 65 HE2 TYR 65 -12.029 7.790 -5.209 479 HH TYR 65 HH TYR 65 -14.260 7.830 -4.217 480 HB2 TYR 65 HB2 TYR 65 -9.223 3.964 -5.459 481 HB3 TYR 65 HB1 TYR 65 -10.446 3.286 -6.521 482 H PHE 66 HN PHE 66 -7.964 1.656 -3.505 483 HA PHE 66 HA PHE 66 -6.213 0.964 -5.483 484 HD1 PHE 66 HD2 PHE 66 -4.586 -1.567 -5.076 485 HD2 PHE 66 HD1 PHE 66 -6.112 -1.056 -1.148 486 HE1 PHE 66 HE2 PHE 66 -3.847 -3.845 -4.492 487 HE2 PHE 66 HE1 PHE 66 -5.396 -3.310 -0.548 488 HZ PHE 66 HZ PHE 66 -4.251 -4.723 -2.223 489 HB2 PHE 66 HB2 PHE 66 -4.991 0.842 -3.583 490 HB3 PHE 66 HB1 PHE 66 -6.421 0.600 -2.624 491 H LEU 67 HN LEU 67 -8.345 -1.248 -3.779 492 HA LEU 67 HA LEU 67 -7.693 -3.528 -5.363 493 HG LEU 67 HG LEU 67 -7.695 -3.810 -2.531 494 HB2 LEU 67 HB2 LEU 67 -9.770 -2.838 -3.344 495 HB3 LEU 67 HB1 LEU 67 -10.062 -4.236 -4.366 496 HD11 LEU 67 HD11 LEU 67 -10.097 -5.608 -2.370 497 HD12 LEU 67 HD12 LEU 67 -9.617 -4.328 -1.256 498 HD13 LEU 67 HD13 LEU 67 -8.655 -5.800 -1.372 499 HD21 LEU 67 HD23 LEU 67 -8.354 -6.042 -4.436 500 HD22 LEU 67 HD21 LEU 67 -7.172 -6.181 -3.132 501 HD23 LEU 67 HD22 LEU 67 -6.926 -5.007 -4.424 502 H GLN 68 HN GLN 68 -9.920 -0.919 -5.572 503 HA GLN 68 HA GLN 68 -11.660 -2.052 -7.525 504 HB2 GLN 68 HB2 GLN 68 -11.295 0.726 -6.445 505 HB3 GLN 68 HB1 GLN 68 -12.520 0.300 -7.605 506 HG2 GLN 68 HG2 GLN 68 -13.375 -1.387 -5.958 507 HG3 GLN 68 HG1 GLN 68 -12.260 -0.683 -4.786 508 HE21 GLN 68 HE21 GLN 68 -15.183 -0.804 -4.769 509 HE22 GLN 68 HE22 GLN 68 -15.724 0.832 -4.644 510 H LYS 69 HN LYS 69 -8.521 -0.719 -7.725 511 HA LYS 69 HA LYS 69 -8.929 0.652 -10.233 512 HB2 LYS 69 HB2 LYS 69 -6.341 -0.115 -8.889 513 HB3 LYS 69 HB1 LYS 69 -6.568 1.103 -10.138 514 HG2 LYS 69 HG2 LYS 69 -7.344 1.196 -7.260 515 HG3 LYS 69 HG1 LYS 69 -6.285 2.264 -8.138 516 HD2 LYS 69 HD2 LYS 69 -9.268 2.051 -8.403 517 HD3 LYS 69 HD1 LYS 69 -8.354 3.409 -7.749 518 HE2 LYS 69 HE2 LYS 69 -8.236 2.427 -10.598 519 HE3 LYS 69 HE1 LYS 69 -9.133 3.837 -10.039 520 HZ1 LYS 69 HZ3 LYS 69 -7.046 4.838 -9.341 521 HZ2 LYS 69 HZ1 LYS 69 -7.007 4.463 -10.990 522 HZ3 LYS 69 HZ2 LYS 69 -6.188 3.485 -9.880 523 H PHE 70 HN PHE 70 -7.100 -2.068 -8.975 524 HA PHE 70 HA PHE 70 -6.543 -3.189 -11.534 525 HD1 PHE 70 HD2 PHE 70 -5.509 -6.337 -11.173 526 HD2 PHE 70 HD1 PHE 70 -6.506 -4.960 -7.273 527 HE1 PHE 70 HE2 PHE 70 -5.831 -8.664 -10.439 528 HE2 PHE 70 HE1 PHE 70 -6.830 -7.281 -6.528 529 HZ PHE 70 HZ PHE 70 -6.493 -9.139 -8.112 530 HB2 PHE 70 HB2 PHE 70 -4.883 -4.025 -10.298 531 HB3 PHE 70 HB1 PHE 70 -5.651 -3.461 -8.833 532 H GLN 71 HN GLN 71 -8.822 -3.943 -8.923 533 HA GLN 71 HA GLN 71 -9.803 -6.256 -10.390 534 HB2 GLN 71 HB2 GLN 71 -9.632 -6.348 -7.919 535 HB3 GLN 71 HB1 GLN 71 -10.852 -5.094 -7.810 536 HG2 GLN 71 HG2 GLN 71 -12.446 -6.574 -8.962 537 HG3 GLN 71 HG1 GLN 71 -11.221 -7.838 -8.978 538 HE21 GLN 71 HE21 GLN 71 -11.908 -5.578 -6.348 539 HE22 GLN 71 HE22 GLN 71 -12.423 -6.773 -5.222 540 H SER 72 HN SER 72 -11.659 -3.728 -8.783 541 HA SER 72 HA SER 72 -12.984 -2.075 -9.860 542 HG SER 72 HG SER 72 -14.259 -1.858 -12.819 543 HB2 SER 72 HB2 SER 72 -12.498 -2.808 -12.167 544 HB3 SER 72 HB1 SER 72 -13.575 -4.178 -11.932 545 H ASP 73 HN ASP 73 -13.237 -4.239 -7.886 546 HA ASP 73 HA ASP 73 -16.059 -4.071 -7.465 547 HB2 ASP 73 HB2 ASP 73 -15.843 -6.001 -9.069 548 HB3 ASP 73 HB1 ASP 73 -14.914 -6.843 -7.834 549 H ALA 74 HN ALA 74 -13.476 -3.435 -6.129 550 HA ALA 74 HA ALA 74 -12.916 -5.193 -4.028 551 HB1 ALA 74 HB3 ALA 74 -11.583 -3.513 -3.184 552 HB2 ALA 74 HB1 ALA 74 -12.688 -2.237 -3.691 553 HB3 ALA 74 HB2 ALA 74 -11.682 -3.052 -4.886 554 H ARG 75 HN ARG 75 -13.551 -5.175 -1.855 555 HA ARG 75 HA ARG 75 -16.283 -4.566 -1.372 556 HE ARG 75 HE ARG 75 -11.135 -5.811 0.715 557 HB2 ARG 75 HB2 ARG 75 -15.748 -5.251 0.971 558 HB3 ARG 75 HB1 ARG 75 -15.278 -6.436 -0.240 559 HG2 ARG 75 HG2 ARG 75 -13.078 -4.698 0.168 560 HG3 ARG 75 HG1 ARG 75 -13.680 -5.199 1.749 561 HD2 ARG 75 HD2 ARG 75 -13.338 -7.463 1.296 562 HD3 ARG 75 HD1 ARG 75 -13.247 -7.195 -0.445 563 HH11 ARG 75 HH11 ARG 75 -12.204 -9.110 0.387 564 HH12 ARG 75 HH12 ARG 75 -10.601 -9.767 0.407 565 HH21 ARG 75 HH21 ARG 75 -9.022 -6.665 0.740 566 HH22 ARG 75 HH22 ARG 75 -8.792 -8.376 0.607 567 H GLU 76 HN GLU 76 -13.521 -2.670 -1.366 568 HA GLU 76 HA GLU 76 -13.418 -0.379 -1.129 569 HB2 GLU 76 HB2 GLU 76 -15.648 -0.537 0.893 570 HB3 GLU 76 HB1 GLU 76 -14.973 0.900 0.141 571 HG2 GLU 76 HG2 GLU 76 -15.696 -0.269 -2.068 572 HG3 GLU 76 HG1 GLU 76 -16.785 -1.152 -1.006 573 H LEU 77 HN LEU 77 -11.923 -2.274 -0.045 574 HA LEU 77 HA LEU 77 -10.663 -2.991 1.749 575 HG LEU 77 HG LEU 77 -9.564 -1.535 -0.459 576 HB2 LEU 77 HB2 LEU 77 -10.235 -0.046 1.435 577 HB3 LEU 77 HB1 LEU 77 -9.236 -1.017 2.494 578 HD11 LEU 77 HD11 LEU 77 -7.010 -0.571 0.608 579 HD12 LEU 77 HD12 LEU 77 -8.320 0.601 0.593 580 HD13 LEU 77 HD13 LEU 77 -7.830 -0.183 -0.905 581 HD21 LEU 77 HD23 LEU 77 -7.240 -2.525 1.055 582 HD22 LEU 77 HD21 LEU 77 -8.175 -3.299 -0.223 583 HD23 LEU 77 HD22 LEU 77 -8.781 -3.292 1.436 584 H THR 78 HN THR 78 -13.344 -2.501 2.635 585 HA THR 78 HA THR 78 -14.615 -1.943 4.469 586 HB THR 78 HB THR 78 -13.922 -3.130 6.454 587 HG1 THR 78 HG1 THR 78 -11.703 -4.111 6.311 588 HG21 THR 78 HG23 THR 78 -14.143 -5.177 5.538 589 HG22 THR 78 HG21 THR 78 -12.729 -4.975 4.502 590 HG23 THR 78 HG22 THR 78 -14.283 -4.295 4.017 591 H GLU 79 HN GLU 79 -14.275 -1.286 6.975 592 HA GLU 79 HA GLU 79 -13.388 1.420 6.908 593 HB2 GLU 79 HB2 GLU 79 -14.144 -0.285 9.290 594 HB3 GLU 79 HB1 GLU 79 -14.011 1.469 9.274 595 HG2 GLU 79 HG2 GLU 79 -15.857 1.609 7.696 596 HG3 GLU 79 HG1 GLU 79 -15.979 -0.150 7.673 597 H SER 80 HN SER 80 -12.212 -1.546 8.398 598 HA SER 80 HA SER 80 -9.965 -0.325 9.689 599 HG SER 80 HG SER 80 -9.860 -2.523 11.815 600 HB2 SER 80 HB2 SER 80 -11.379 -2.365 10.376 601 HB3 SER 80 HB1 SER 80 -10.285 -3.261 9.333 602 H GLU 81 HN GLU 81 -10.391 -1.863 6.561 603 HA GLU 81 HA GLU 81 -7.696 -2.838 6.412 604 HB2 GLU 81 HB2 GLU 81 -9.941 -3.369 4.942 605 HB3 GLU 81 HB1 GLU 81 -9.005 -2.368 3.844 606 HG2 GLU 81 HG2 GLU 81 -8.064 -4.885 5.174 607 HG3 GLU 81 HG1 GLU 81 -8.514 -4.705 3.480 608 H THR 82 HN THR 82 -9.356 0.010 4.982 609 HA THR 82 HA THR 82 -7.103 1.063 3.690 610 HB THR 82 HB THR 82 -8.167 3.205 3.739 611 HG1 THR 82 HG1 THR 82 -9.112 3.591 5.628 612 HG21 THR 82 HG23 THR 82 -9.958 0.852 3.265 613 HG22 THR 82 HG21 THR 82 -9.117 1.869 2.092 614 HG23 THR 82 HG22 THR 82 -10.510 2.500 2.975 615 H LYS 83 HN LYS 83 -7.867 0.765 7.040 616 HA LYS 83 HA LYS 83 -6.555 2.933 8.211 617 HB2 LYS 83 HB2 LYS 83 -7.934 1.044 9.297 618 HB3 LYS 83 HB1 LYS 83 -6.422 0.145 9.313 619 HG2 LYS 83 HG2 LYS 83 -6.763 1.203 11.424 620 HG3 LYS 83 HG1 LYS 83 -5.395 1.952 10.623 621 HD2 LYS 83 HD2 LYS 83 -6.793 3.641 11.664 622 HD3 LYS 83 HD1 LYS 83 -6.849 3.800 9.906 623 HE2 LYS 83 HE2 LYS 83 -8.979 2.728 9.809 624 HE3 LYS 83 HE1 LYS 83 -8.886 2.290 11.513 625 HZ1 LYS 83 HZ3 LYS 83 -10.337 4.184 11.183 626 HZ2 LYS 83 HZ1 LYS 83 -9.088 5.051 10.437 627 HZ3 LYS 83 HZ2 LYS 83 -8.977 4.647 12.076 628 H SER 84 HN SER 84 -5.460 -0.099 6.899 629 HA SER 84 HA SER 84 -2.792 -0.097 7.611 630 HG SER 84 HG SER 84 -4.074 -2.104 7.664 631 HB2 SER 84 HB2 SER 84 -4.083 -1.053 5.048 632 HB3 SER 84 HB1 SER 84 -2.617 -1.660 5.774 633 H LEU 85 HN LEU 85 -4.305 0.931 4.569 634 HA LEU 85 HA LEU 85 -2.089 2.123 3.427 635 HG LEU 85 HG LEU 85 -4.597 0.380 2.724 636 HB2 LEU 85 HB2 LEU 85 -5.009 2.800 3.052 637 HB3 LEU 85 HB1 LEU 85 -3.719 3.139 1.925 638 HD11 LEU 85 HD11 LEU 85 -5.329 0.333 0.289 639 HD12 LEU 85 HD12 LEU 85 -5.232 2.090 0.354 640 HD13 LEU 85 HD13 LEU 85 -6.340 1.232 1.421 641 HD21 LEU 85 HD23 LEU 85 -2.289 0.351 2.140 642 HD22 LEU 85 HD21 LEU 85 -2.574 1.381 0.736 643 HD23 LEU 85 HD22 LEU 85 -3.197 -0.267 0.759 644 H MET 86 HN MET 86 -4.532 3.365 5.603 645 HA MET 86 HA MET 86 -3.936 6.107 5.519 646 HB2 MET 86 HB2 MET 86 -4.775 4.509 7.945 647 HB3 MET 86 HB1 MET 86 -4.921 6.246 7.760 648 HG2 MET 86 HG2 MET 86 -6.634 4.076 6.725 649 HG3 MET 86 HG1 MET 86 -7.040 5.646 7.351 650 HE1 MET 86 HE3 MET 86 -6.633 7.714 6.344 651 HE2 MET 86 HE1 MET 86 -6.929 8.039 4.637 652 HE3 MET 86 HE2 MET 86 -5.325 7.624 5.185 653 H ASP 87 HN ASP 87 -2.780 3.518 7.626 654 HA ASP 87 HA ASP 87 -0.833 5.079 9.030 655 HB2 ASP 87 HB2 ASP 87 -1.369 2.126 8.832 656 HB3 ASP 87 HB1 ASP 87 -0.131 2.818 9.880 657 H ALA 88 HN ALA 88 -0.811 4.039 5.913 658 HA ALA 88 HA ALA 88 1.740 2.786 5.735 659 HB1 ALA 88 HB3 ALA 88 1.345 2.650 3.443 660 HB2 ALA 88 HB1 ALA 88 0.232 4.021 3.467 661 HB3 ALA 88 HB2 ALA 88 -0.236 2.492 4.210 662 H ALA 89 HN ALA 89 0.654 6.153 5.523 663 HA ALA 89 HA ALA 89 3.439 6.956 5.490 664 HB1 ALA 89 HB3 ALA 89 2.985 6.670 3.117 665 HB2 ALA 89 HB1 ALA 89 3.255 8.367 3.506 666 HB3 ALA 89 HB2 ALA 89 1.616 7.776 3.222 667 H ASP 90 HN ASP 90 0.702 8.923 4.401 668 HA ASP 90 HA ASP 90 1.302 10.831 6.518 669 HB2 ASP 90 HB2 ASP 90 0.518 11.165 3.894 670 HB3 ASP 90 HB1 ASP 90 -0.974 11.459 4.783 671 H ASN 91 HN ASN 91 0.594 9.296 8.137 672 HA ASN 91 HA ASN 91 -2.302 8.866 8.277 673 HB2 ASN 91 HB2 ASN 91 -1.286 7.540 10.456 674 HB3 ASN 91 HB1 ASN 91 -1.648 6.814 8.902 675 HD21 ASN 91 HD21 ASN 91 0.063 6.437 7.428 676 HD22 ASN 91 HD22 ASN 91 1.700 6.355 7.979 677 H ASP 92 HN ASP 92 0.322 9.832 10.473 678 HA ASP 92 HA ASP 92 -1.490 10.760 12.463 679 HB2 ASP 92 HB2 ASP 92 1.493 11.104 12.163 680 HB3 ASP 92 HB1 ASP 92 0.569 11.542 13.592 681 H GLY 93 HN GLY 93 -0.529 12.236 9.553 682 HA2 GLY 93 HA2 GLY 93 -1.006 14.869 10.793 683 HA3 GLY 93 HA1 GLY 93 0.104 14.626 9.460 684 H ASP 94 HN ASP 94 -0.742 14.223 7.362 685 HA ASP 94 HA ASP 94 -3.113 15.735 6.849 686 HB2 ASP 94 HB2 ASP 94 -1.140 15.785 5.358 687 HB3 ASP 94 HB1 ASP 94 -1.459 14.112 4.915 688 H GLY 95 HN GLY 95 -2.275 12.326 6.105 689 HA2 GLY 95 HA2 GLY 95 -3.937 10.623 6.678 690 HA3 GLY 95 HA1 GLY 95 -5.171 11.769 6.193 691 H LYS 96 HN LYS 96 -2.683 12.057 4.003 692 HA LYS 96 HA LYS 96 -4.076 10.257 2.150 693 HB2 LYS 96 HB2 LYS 96 -3.841 11.794 0.510 694 HB3 LYS 96 HB1 LYS 96 -3.640 12.902 1.852 695 HG2 LYS 96 HG2 LYS 96 -1.513 11.722 0.086 696 HG3 LYS 96 HG1 LYS 96 -1.956 13.415 0.280 697 HD2 LYS 96 HD2 LYS 96 -1.297 12.726 2.831 698 HD3 LYS 96 HD1 LYS 96 -0.178 11.735 1.889 699 HE2 LYS 96 HE2 LYS 96 -0.537 14.726 1.719 700 HE3 LYS 96 HE1 LYS 96 0.846 13.867 2.393 701 HZ1 LYS 96 HZ3 LYS 96 -0.020 13.811 -0.448 702 HZ2 LYS 96 HZ1 LYS 96 1.294 12.957 0.192 703 HZ3 LYS 96 HZ2 LYS 96 1.316 14.648 0.167 704 H ILE 97 HN ILE 97 -2.742 9.227 0.444 705 HA ILE 97 HA ILE 97 -0.047 8.519 1.383 706 HB ILE 97 HB ILE 97 -2.052 6.613 0.176 707 HG12 ILE 97 HG12 ILE 97 -2.685 7.134 2.465 708 HG13 ILE 97 HG11 ILE 97 -2.031 5.504 2.344 709 HG21 ILE 97 HG21 ILE 97 -0.260 4.954 1.041 710 HG22 ILE 97 HG22 ILE 97 0.816 6.358 0.987 711 HG23 ILE 97 HG23 ILE 97 -0.007 5.812 -0.478 712 HD11 ILE 97 HD13 ILE 97 0.113 6.315 3.213 713 HD12 ILE 97 HD11 ILE 97 -1.218 6.573 4.341 714 HD13 ILE 97 HD12 ILE 97 -0.597 7.917 3.393 715 H GLY 98 HN GLY 98 1.062 9.678 -0.224 716 HA2 GLY 98 HA2 GLY 98 0.616 8.791 -2.980 717 HA3 GLY 98 HA1 GLY 98 1.305 10.347 -2.521 718 H ALA 99 HN ALA 99 2.695 8.823 -4.304 719 HA ALA 99 HA ALA 99 4.474 6.921 -3.303 720 HB1 ALA 99 HB3 ALA 99 5.819 7.313 -5.209 721 HB2 ALA 99 HB1 ALA 99 5.250 8.976 -5.362 722 HB3 ALA 99 HB2 ALA 99 4.160 7.636 -5.710 723 H ASP 100 HN ASP 100 4.860 10.435 -3.456 724 HA ASP 100 HA ASP 100 7.371 10.638 -2.277 725 HB2 ASP 100 HB2 ASP 100 6.116 12.518 -3.349 726 HB3 ASP 100 HB1 ASP 100 5.091 12.596 -1.920 727 H GLU 101 HN GLU 101 4.180 10.769 -0.732 728 HA GLU 101 HA GLU 101 5.078 10.987 1.919 729 HB2 GLU 101 HB2 GLU 101 2.570 10.593 0.514 730 HB3 GLU 101 HB1 GLU 101 2.626 9.625 1.974 731 HG2 GLU 101 HG2 GLU 101 1.689 12.065 1.951 732 HG3 GLU 101 HG1 GLU 101 2.558 11.432 3.338 733 H PHE 102 HN PHE 102 4.044 8.163 0.021 734 HA PHE 102 HA PHE 102 4.494 6.226 1.976 735 HD1 PHE 102 HD1 PHE 102 6.717 4.438 -0.372 736 HD2 PHE 102 HD2 PHE 102 2.682 3.664 0.726 737 HE1 PHE 102 HE1 PHE 102 7.274 2.087 0.016 738 HE2 PHE 102 HE2 PHE 102 3.234 1.295 1.104 739 HZ PHE 102 HZ PHE 102 5.540 0.502 0.748 740 HB2 PHE 102 HB2 PHE 102 3.269 5.756 -0.059 741 HB3 PHE 102 HB1 PHE 102 4.731 5.955 -1.028 742 H GLN 103 HN GLN 103 6.658 7.495 -0.553 743 HA GLN 103 HA GLN 103 8.889 5.942 -0.096 744 HB2 GLN 103 HB2 GLN 103 8.673 8.843 -0.878 745 HB3 GLN 103 HB1 GLN 103 10.210 7.991 -0.815 746 HG2 GLN 103 HG2 GLN 103 8.064 6.703 -2.357 747 HG3 GLN 103 HG1 GLN 103 8.704 8.213 -2.991 748 HE21 GLN 103 HE21 GLN 103 9.623 7.218 -4.757 749 HE22 GLN 103 HE22 GLN 103 11.038 6.233 -4.636 750 H GLU 104 HN GLU 104 7.633 8.602 1.794 751 HA GLU 104 HA GLU 104 9.971 9.083 3.336 752 HB2 GLU 104 HB2 GLU 104 7.057 9.559 3.984 753 HB3 GLU 104 HB1 GLU 104 8.388 10.104 4.992 754 HG2 GLU 104 HG2 GLU 104 7.935 10.921 2.133 755 HG3 GLU 104 HG1 GLU 104 7.496 11.875 3.548 756 H MET 105 HN MET 105 7.417 6.742 3.486 757 HA MET 105 HA MET 105 7.771 5.842 6.120 758 HB2 MET 105 HB2 MET 105 5.960 5.322 4.248 759 HB3 MET 105 HB1 MET 105 6.968 3.899 4.023 760 HG2 MET 105 HG2 MET 105 5.806 4.748 6.661 761 HG3 MET 105 HG1 MET 105 5.059 3.577 5.579 762 HE1 MET 105 HE3 MET 105 6.125 3.216 8.785 763 HE2 MET 105 HE1 MET 105 6.530 1.506 8.645 764 HE3 MET 105 HE2 MET 105 5.060 2.129 7.895 765 H VAL 106 HN VAL 106 9.047 4.410 3.065 766 HA VAL 106 HA VAL 106 10.579 2.447 4.311 767 HB VAL 106 HB VAL 106 10.027 2.412 1.923 768 HG11 VAL 106 HG11 VAL 106 11.564 4.918 1.938 769 HG12 VAL 106 HG12 VAL 106 10.196 4.419 0.948 770 HG13 VAL 106 HG13 VAL 106 11.821 3.850 0.563 771 HG21 VAL 106 HG23 VAL 106 12.466 1.689 3.117 772 HG22 VAL 106 HG21 VAL 106 12.870 2.358 1.537 773 HG23 VAL 106 HG22 VAL 106 11.742 1.005 1.659 774 H HIS 107 HN HIS 107 11.165 5.815 3.743 775 HA HIS 107 HA HIS 107 13.996 5.665 4.268 776 HD1 HIS 107 HD1 HIS 107 15.170 8.097 2.017 777 HD2 HIS 107 HD2 HIS 107 14.387 9.096 5.974 778 HE1 HIS 107 HE1 HIS 107 17.125 9.496 2.757 779 HE2 HIS 107 HE2 HIS 107 16.587 10.160 5.128 780 HB2 HIS 107 HB2 HIS 107 12.910 7.356 2.739 781 HB3 HIS 107 HB1 HIS 107 12.260 8.135 4.179 782 H SER 108 HN SER 108 11.082 6.629 6.015 783 HA SER 108 HA SER 108 12.173 7.818 8.247 784 HG SER 108 HG SER 108 9.939 4.995 8.697 785 HB2 SER 108 HB2 SER 108 10.154 7.104 9.456 786 HB3 SER 108 HB1 SER 108 9.761 7.693 7.842 Start of MODEL 5 1 HA SER 1 HA SER 1 3.233 -3.457 -10.212 2 HG SER 1 HG SER 1 1.067 -4.091 -9.354 3 H1 SER 1 HT1 SER 1 4.606 -5.791 -11.412 4 H2 SER 1 HT2 SER 1 5.280 -4.260 -11.164 5 H3 SER 1 HT3 SER 1 4.005 -4.455 -12.259 6 HB2 SER 1 HB2 SER 1 1.689 -4.881 -11.472 7 HB3 SER 1 HB1 SER 1 2.294 -6.308 -10.632 8 H ILE 2 HN ILE 2 5.353 -3.533 -8.980 9 HA ILE 2 HA ILE 2 6.117 -3.642 -6.814 10 HB ILE 2 HB ILE 2 4.151 -5.868 -6.384 11 HG12 ILE 2 HG12 ILE 2 4.151 -3.015 -5.556 12 HG13 ILE 2 HG11 ILE 2 3.026 -3.773 -6.664 13 HG21 ILE 2 HG21 ILE 2 6.125 -4.590 -4.555 14 HG22 ILE 2 HG22 ILE 2 5.916 -6.301 -4.941 15 HG23 ILE 2 HG23 ILE 2 4.706 -5.459 -3.969 16 HD11 ILE 2 HD13 ILE 2 3.075 -5.138 -4.138 17 HD12 ILE 2 HD11 ILE 2 1.726 -4.405 -5.001 18 HD13 ILE 2 HD12 ILE 2 2.735 -3.425 -3.948 19 H THR 3 HN THR 3 5.455 -6.798 -8.261 20 HA THR 3 HA THR 3 7.611 -8.169 -7.190 21 HB THR 3 HB THR 3 7.396 -9.730 -9.092 22 HG1 THR 3 HG1 THR 3 6.826 -7.914 -10.594 23 HG21 THR 3 HG23 THR 3 4.652 -8.894 -8.182 24 HG22 THR 3 HG21 THR 3 5.810 -9.668 -7.098 25 HG23 THR 3 HG22 THR 3 5.243 -10.518 -8.537 26 H ASP 4 HN ASP 4 7.625 -5.653 -9.525 27 HA ASP 4 HA ASP 4 9.790 -6.175 -11.122 28 HB2 ASP 4 HB2 ASP 4 8.352 -4.043 -11.013 29 HB3 ASP 4 HB1 ASP 4 9.471 -3.492 -9.771 30 H ILE 5 HN ILE 5 10.187 -4.213 -8.143 31 HA ILE 5 HA ILE 5 12.669 -5.714 -7.639 32 HB ILE 5 HB ILE 5 12.207 -2.978 -6.542 33 HG12 ILE 5 HG12 ILE 5 13.698 -2.467 -8.727 34 HG13 ILE 5 HG11 ILE 5 12.660 -3.719 -9.365 35 HG21 ILE 5 HG21 ILE 5 14.093 -4.302 -5.732 36 HG22 ILE 5 HG22 ILE 5 14.643 -2.884 -6.624 37 HG23 ILE 5 HG23 ILE 5 14.683 -4.474 -7.385 38 HD11 ILE 5 HD13 ILE 5 10.702 -2.417 -8.681 39 HD12 ILE 5 HD11 ILE 5 11.727 -1.544 -9.820 40 HD13 ILE 5 HD12 ILE 5 11.770 -1.138 -8.104 41 H LEU 6 HN LEU 6 11.886 -7.193 -6.264 42 HA LEU 6 HA LEU 6 11.524 -6.491 -3.548 43 HG LEU 6 HG LEU 6 9.709 -6.673 -2.045 44 HB2 LEU 6 HB2 LEU 6 9.188 -6.199 -4.949 45 HB3 LEU 6 HB1 LEU 6 9.026 -7.808 -4.272 46 HD11 LEU 6 HD11 LEU 6 9.041 -4.351 -1.856 47 HD12 LEU 6 HD12 LEU 6 8.724 -4.307 -3.587 48 HD13 LEU 6 HD13 LEU 6 10.367 -4.548 -3.001 49 HD21 LEU 6 HD23 LEU 6 7.577 -7.589 -2.140 50 HD22 LEU 6 HD21 LEU 6 7.054 -6.469 -3.393 51 HD23 LEU 6 HD22 LEU 6 7.286 -5.896 -1.745 52 H SER 7 HN SER 7 10.904 -8.350 -2.140 53 HA SER 7 HA SER 7 12.239 -10.731 -3.092 54 HG SER 7 HG SER 7 13.676 -10.338 -0.630 55 HB2 SER 7 HB2 SER 7 10.931 -10.201 -0.418 56 HB3 SER 7 HB1 SER 7 11.965 -11.561 -0.836 57 H ALA 8 HN ALA 8 10.255 -10.594 -4.661 58 HA ALA 8 HA ALA 8 7.806 -11.385 -4.383 59 HB1 ALA 8 HB3 ALA 8 9.011 -11.342 -6.548 60 HB2 ALA 8 HB1 ALA 8 7.866 -12.676 -6.400 61 HB3 ALA 8 HB2 ALA 8 9.595 -12.972 -6.205 62 H GLU 9 HN GLU 9 10.447 -13.479 -3.392 63 HA GLU 9 HA GLU 9 8.889 -15.826 -3.098 64 HB2 GLU 9 HB2 GLU 9 11.409 -14.937 -1.689 65 HB3 GLU 9 HB1 GLU 9 10.734 -16.561 -1.591 66 HG2 GLU 9 HG2 GLU 9 11.617 -15.207 -4.113 67 HG3 GLU 9 HG1 GLU 9 12.599 -16.347 -3.193 68 H ASP 10 HN ASP 10 9.835 -13.245 -0.874 69 HA ASP 10 HA ASP 10 8.323 -14.227 1.335 70 HB2 ASP 10 HB2 ASP 10 10.063 -11.839 0.818 71 HB3 ASP 10 HB1 ASP 10 9.038 -11.899 2.248 72 H ILE 11 HN ILE 11 7.443 -12.707 -1.461 73 HA ILE 11 HA ILE 11 5.763 -10.639 -0.394 74 HB ILE 11 HB ILE 11 6.338 -11.742 -3.072 75 HG12 ILE 11 HG12 ILE 11 5.852 -8.950 -1.992 76 HG13 ILE 11 HG11 ILE 11 7.419 -9.715 -2.262 77 HG21 ILE 11 HG21 ILE 11 3.658 -10.536 -2.446 78 HG22 ILE 11 HG22 ILE 11 4.020 -12.007 -3.348 79 HG23 ILE 11 HG23 ILE 11 4.377 -10.431 -4.053 80 HD11 ILE 11 HD13 ILE 11 5.455 -8.685 -4.261 81 HD12 ILE 11 HD11 ILE 11 6.652 -9.893 -4.718 82 HD13 ILE 11 HD12 ILE 11 7.169 -8.331 -4.093 83 H ALA 12 HN ALA 12 5.289 -13.968 -1.549 84 HA ALA 12 HA ALA 12 2.508 -14.063 -1.241 85 HB1 ALA 12 HB3 ALA 12 4.353 -15.848 -2.077 86 HB2 ALA 12 HB1 ALA 12 2.703 -16.290 -1.627 87 HB3 ALA 12 HB2 ALA 12 4.011 -16.467 -0.459 88 H ALA 13 HN ALA 13 5.133 -14.951 1.029 89 HA ALA 13 HA ALA 13 3.376 -15.421 3.194 90 HB1 ALA 13 HB3 ALA 13 5.824 -16.088 3.009 91 HB2 ALA 13 HB1 ALA 13 5.302 -15.461 4.574 92 HB3 ALA 13 HB2 ALA 13 6.205 -14.427 3.467 93 H ALA 14 HN ALA 14 5.441 -12.673 2.507 94 HA ALA 14 HA ALA 14 4.674 -10.869 4.372 95 HB1 ALA 14 HB3 ALA 14 6.361 -10.286 2.770 96 HB2 ALA 14 HB1 ALA 14 5.091 -9.064 2.691 97 HB3 ALA 14 HB2 ALA 14 5.191 -10.316 1.450 98 H LEU 15 HN LEU 15 2.962 -11.528 1.342 99 HA LEU 15 HA LEU 15 0.856 -9.668 1.880 100 HG LEU 15 HG LEU 15 -0.733 -9.426 -0.009 101 HB2 LEU 15 HB2 LEU 15 1.614 -10.401 -0.402 102 HB3 LEU 15 HB1 LEU 15 0.891 -11.963 -0.079 103 HD11 LEU 15 HD11 LEU 15 -1.333 -10.731 -2.378 104 HD12 LEU 15 HD12 LEU 15 0.428 -10.773 -2.307 105 HD13 LEU 15 HD13 LEU 15 -0.424 -9.230 -2.216 106 HD21 LEU 15 HD23 LEU 15 -1.827 -11.289 1.018 107 HD22 LEU 15 HD21 LEU 15 -1.385 -12.346 -0.322 108 HD23 LEU 15 HD22 LEU 15 -2.550 -11.047 -0.569 109 H GLN 16 HN GLN 16 0.967 -13.231 1.697 110 HA GLN 16 HA GLN 16 -1.655 -13.652 2.642 111 HB2 GLN 16 HB2 GLN 16 0.704 -15.517 2.317 112 HB3 GLN 16 HB1 GLN 16 -1.002 -15.987 2.417 113 HG2 GLN 16 HG2 GLN 16 -0.068 -14.105 0.300 114 HG3 GLN 16 HG1 GLN 16 0.186 -15.838 0.116 115 HE21 GLN 16 HE21 GLN 16 -2.317 -13.465 0.880 116 HE22 GLN 16 HE22 GLN 16 -3.591 -14.289 0.079 117 H GLU 17 HN GLU 17 1.029 -12.741 4.441 118 HA GLU 17 HA GLU 17 1.065 -14.718 6.442 119 HB2 GLU 17 HB2 GLU 17 2.912 -13.245 6.279 120 HB3 GLU 17 HB1 GLU 17 1.886 -11.855 6.460 121 HG2 GLU 17 HG2 GLU 17 1.473 -12.413 8.765 122 HG3 GLU 17 HG1 GLU 17 2.415 -13.894 8.598 123 H CYS 18 HN CYS 18 0.031 -11.387 7.022 124 HA CYS 18 HA CYS 18 -1.919 -12.369 8.943 125 HG CYS 18 HG CYS 18 0.240 -11.131 11.491 126 HB2 CYS 18 HB2 CYS 18 0.163 -10.473 9.020 127 HB3 CYS 18 HB1 CYS 18 -1.355 -9.572 9.146 128 H GLN 19 HN GLN 19 -2.081 -11.573 5.842 129 HA GLN 19 HA GLN 19 -3.434 -9.210 5.492 130 HB2 GLN 19 HB2 GLN 19 -2.761 -10.623 3.630 131 HB3 GLN 19 HB1 GLN 19 -3.968 -11.806 4.074 132 HG2 GLN 19 HG2 GLN 19 -5.662 -10.645 3.169 133 HG3 GLN 19 HG1 GLN 19 -4.981 -9.090 3.628 134 HE21 GLN 19 HE21 GLN 19 -2.479 -9.313 2.346 135 HE22 GLN 19 HE22 GLN 19 -2.748 -9.281 0.643 136 H ASP 20 HN ASP 20 -5.417 -8.486 5.514 137 HA ASP 20 HA ASP 20 -7.823 -9.772 5.916 138 HB2 ASP 20 HB2 ASP 20 -6.262 -9.550 8.368 139 HB3 ASP 20 HB1 ASP 20 -7.817 -8.735 8.502 140 HA PRO 21 HA PRO 21 -9.124 -5.564 5.548 141 HB2 PRO 21 HB2 PRO 21 -11.571 -5.554 6.503 142 HB3 PRO 21 HB1 PRO 21 -11.166 -6.613 5.160 143 HG2 PRO 21 HG2 PRO 21 -11.429 -7.240 8.076 144 HG3 PRO 21 HG1 PRO 21 -12.055 -8.139 6.679 145 HD2 PRO 21 HD2 PRO 21 -9.723 -8.752 7.991 146 HD3 PRO 21 HD1 PRO 21 -10.069 -9.165 6.305 147 H ASP 22 HN ASP 22 -7.399 -5.688 7.763 148 HA ASP 22 HA ASP 22 -7.962 -3.330 9.130 149 HB2 ASP 22 HB2 ASP 22 -8.666 -4.045 11.330 150 HB3 ASP 22 HB1 ASP 22 -9.809 -4.634 10.139 151 H THR 23 HN THR 23 -5.858 -5.934 8.617 152 HA THR 23 HA THR 23 -4.260 -5.248 10.963 153 HB THR 23 HB THR 23 -4.799 -7.604 10.588 154 HG1 THR 23 HG1 THR 23 -2.822 -8.216 11.256 155 HG21 THR 23 HG23 THR 23 -3.958 -7.004 7.933 156 HG22 THR 23 HG21 THR 23 -4.666 -8.487 8.558 157 HG23 THR 23 HG22 THR 23 -2.917 -8.268 8.585 158 H PHE 24 HN PHE 24 -4.073 -5.124 7.464 159 HA PHE 24 HA PHE 24 -2.480 -3.321 6.670 160 HD1 PHE 24 HD1 PHE 24 -1.311 -1.592 6.981 161 HD2 PHE 24 HD2 PHE 24 0.188 -3.930 10.205 162 HE1 PHE 24 HE1 PHE 24 -1.006 0.449 8.317 163 HE2 PHE 24 HE2 PHE 24 0.499 -1.891 11.542 164 HZ PHE 24 HZ PHE 24 -0.100 0.302 10.599 165 HB2 PHE 24 HB2 PHE 24 -0.637 -5.006 8.346 166 HB3 PHE 24 HB1 PHE 24 -0.008 -4.186 6.931 167 H GLU 25 HN GLU 25 -3.641 -4.503 4.926 168 HA GLU 25 HA GLU 25 -2.493 -6.876 3.866 169 HB2 GLU 25 HB2 GLU 25 -4.245 -4.893 2.432 170 HB3 GLU 25 HB1 GLU 25 -3.980 -6.573 2.006 171 HG2 GLU 25 HG2 GLU 25 -5.008 -7.220 4.158 172 HG3 GLU 25 HG1 GLU 25 -5.399 -5.525 4.421 173 HA PRO 26 HA PRO 26 -0.512 -3.966 0.652 174 HB2 PRO 26 HB2 PRO 26 -0.310 -1.318 1.248 175 HB3 PRO 26 HB1 PRO 26 -1.639 -2.037 0.349 176 HG2 PRO 26 HG2 PRO 26 -1.579 -1.030 3.076 177 HG3 PRO 26 HG1 PRO 26 -2.954 -1.290 2.010 178 HD2 PRO 26 HD2 PRO 26 -2.107 -2.915 4.173 179 HD3 PRO 26 HD1 PRO 26 -3.420 -3.234 3.026 180 H GLN 27 HN GLN 27 0.187 -2.158 3.651 181 HA GLN 27 HA GLN 27 2.919 -1.868 3.182 182 HB2 GLN 27 HB2 GLN 27 1.400 -1.937 5.781 183 HB3 GLN 27 HB1 GLN 27 3.084 -1.450 5.643 184 HG2 GLN 27 HG2 GLN 27 2.386 0.355 4.106 185 HG3 GLN 27 HG1 GLN 27 0.706 -0.101 4.401 186 HE21 GLN 27 HE21 GLN 27 -0.242 0.395 6.338 187 HE22 GLN 27 HE22 GLN 27 0.484 1.441 7.505 188 H LYS 28 HN LYS 28 1.198 -4.458 4.862 189 HA LYS 28 HA LYS 28 3.464 -5.692 5.986 190 HB2 LYS 28 HB2 LYS 28 1.036 -6.178 6.516 191 HB3 LYS 28 HB1 LYS 28 0.989 -7.130 5.040 192 HG2 LYS 28 HG2 LYS 28 2.271 -8.800 5.902 193 HG3 LYS 28 HG1 LYS 28 3.127 -7.721 7.001 194 HD2 LYS 28 HD2 LYS 28 0.250 -8.553 7.325 195 HD3 LYS 28 HD1 LYS 28 1.615 -9.310 8.147 196 HE2 LYS 28 HE2 LYS 28 2.181 -7.104 9.132 197 HE3 LYS 28 HE1 LYS 28 0.721 -6.441 8.400 198 HZ1 LYS 28 HZ3 LYS 28 0.472 -7.101 10.760 199 HZ2 LYS 28 HZ1 LYS 28 0.722 -8.713 10.307 200 HZ3 LYS 28 HZ2 LYS 28 -0.621 -7.869 9.722 201 H PHE 29 HN PHE 29 1.776 -6.180 2.940 202 HA PHE 29 HA PHE 29 3.220 -8.227 1.809 203 HD1 PHE 29 HD1 PHE 29 4.451 -6.255 -0.926 204 HD2 PHE 29 HD2 PHE 29 0.841 -8.487 -0.976 205 HE1 PHE 29 HE1 PHE 29 5.033 -7.135 -3.138 206 HE2 PHE 29 HE2 PHE 29 1.410 -9.366 -3.204 207 HZ PHE 29 HZ PHE 29 3.509 -8.685 -4.288 208 HB2 PHE 29 HB2 PHE 29 1.237 -7.173 0.793 209 HB3 PHE 29 HB1 PHE 29 2.160 -5.712 0.489 210 H PHE 30 HN PHE 30 3.839 -4.781 1.661 211 HA PHE 30 HA PHE 30 6.238 -4.934 0.148 212 HD1 PHE 30 HD1 PHE 30 4.335 -4.350 -1.111 213 HD2 PHE 30 HD2 PHE 30 3.897 -1.074 1.586 214 HE1 PHE 30 HE1 PHE 30 2.178 -3.738 -2.164 215 HE2 PHE 30 HE2 PHE 30 1.754 -0.483 0.540 216 HZ PHE 30 HZ PHE 30 0.895 -1.819 -1.337 217 HB2 PHE 30 HB2 PHE 30 5.554 -2.647 1.951 218 HB3 PHE 30 HB1 PHE 30 6.357 -2.614 0.386 219 H GLN 31 HN GLN 31 5.643 -4.088 3.531 220 HA GLN 31 HA GLN 31 8.241 -3.751 4.364 221 HB2 GLN 31 HB2 GLN 31 6.094 -3.244 5.605 222 HB3 GLN 31 HB1 GLN 31 6.085 -4.935 6.085 223 HG2 GLN 31 HG2 GLN 31 7.131 -4.081 7.890 224 HG3 GLN 31 HG1 GLN 31 8.545 -4.323 6.866 225 HE21 GLN 31 HE21 GLN 31 7.791 -2.079 5.101 226 HE22 GLN 31 HE22 GLN 31 8.181 -0.649 5.980 227 H THR 32 HN THR 32 6.359 -6.643 5.125 228 HA THR 32 HA THR 32 8.372 -8.116 6.245 229 HB THR 32 HB THR 32 6.101 -9.144 4.551 230 HG1 THR 32 HG1 THR 32 4.969 -9.130 6.406 231 HG21 THR 32 HG23 THR 32 6.409 -11.272 5.717 232 HG22 THR 32 HG21 THR 32 7.819 -10.617 6.550 233 HG23 THR 32 HG22 THR 32 7.855 -10.845 4.802 234 H SER 33 HN SER 33 7.460 -8.243 2.774 235 HA SER 33 HA SER 33 9.752 -9.900 2.209 236 HG SER 33 HG SER 33 9.093 -8.891 -0.932 237 HB2 SER 33 HB2 SER 33 8.608 -10.551 0.408 238 HB3 SER 33 HB1 SER 33 7.254 -9.637 1.067 239 H GLY 34 HN GLY 34 8.666 -6.718 1.031 240 HA2 GLY 34 HA2 GLY 34 11.362 -6.395 -0.068 241 HA3 GLY 34 HA1 GLY 34 9.965 -5.500 -0.590 242 H LEU 35 HN LEU 35 9.078 -4.078 1.453 243 HA LEU 35 HA LEU 35 10.629 -1.854 1.417 244 HG LEU 35 HG LEU 35 9.264 0.093 2.708 245 HB2 LEU 35 HB2 LEU 35 8.288 -2.756 2.725 246 HB3 LEU 35 HB1 LEU 35 9.287 -1.959 3.926 247 HD11 LEU 35 HD11 LEU 35 7.947 0.209 0.540 248 HD12 LEU 35 HD12 LEU 35 8.059 -1.550 0.498 249 HD13 LEU 35 HD13 LEU 35 9.525 -0.571 0.463 250 HD21 LEU 35 HD23 LEU 35 6.481 -1.046 2.543 251 HD22 LEU 35 HD21 LEU 35 6.939 0.645 2.748 252 HD23 LEU 35 HD22 LEU 35 7.245 -0.516 4.041 253 H SER 36 HN SER 36 10.669 -4.328 3.965 254 HA SER 36 HA SER 36 12.200 -3.451 5.890 255 HG SER 36 HG SER 36 14.401 -5.404 6.000 256 HB2 SER 36 HB2 SER 36 11.606 -5.803 5.707 257 HB3 SER 36 HB1 SER 36 12.802 -6.028 4.432 258 H LYS 37 HN LYS 37 13.548 -3.911 2.646 259 HA LYS 37 HA LYS 37 15.872 -2.366 3.541 260 HB2 LYS 37 HB2 LYS 37 16.110 -4.944 1.994 261 HB3 LYS 37 HB1 LYS 37 17.436 -3.879 2.430 262 HG2 LYS 37 HG2 LYS 37 17.068 -4.310 4.774 263 HG3 LYS 37 HG1 LYS 37 15.662 -5.299 4.387 264 HD2 LYS 37 HD2 LYS 37 17.091 -6.867 3.176 265 HD3 LYS 37 HD1 LYS 37 18.500 -5.872 3.545 266 HE2 LYS 37 HE2 LYS 37 16.735 -7.284 5.543 267 HE3 LYS 37 HE1 LYS 37 18.361 -7.771 5.064 268 HZ1 LYS 37 HZ3 LYS 37 17.650 -5.233 6.435 269 HZ2 LYS 37 HZ1 LYS 37 19.210 -5.701 5.977 270 HZ3 LYS 37 HZ2 LYS 37 18.378 -6.575 7.160 271 H MET 38 HN MET 38 13.653 -3.091 0.995 272 HA MET 38 HA MET 38 14.980 -2.417 -1.290 273 HB2 MET 38 HB2 MET 38 12.150 -1.736 -0.520 274 HB3 MET 38 HB1 MET 38 12.799 -1.631 -2.148 275 HG2 MET 38 HG2 MET 38 12.771 -4.139 -0.527 276 HG3 MET 38 HG1 MET 38 11.511 -3.701 -1.671 277 HE1 MET 38 HE3 MET 38 14.273 -6.177 -1.470 278 HE2 MET 38 HE1 MET 38 13.855 -6.662 -3.113 279 HE3 MET 38 HE2 MET 38 12.581 -6.347 -1.935 280 H SER 39 HN SER 39 15.504 -0.678 -2.402 281 HA SER 39 HA SER 39 16.093 1.745 -1.051 282 HG SER 39 HG SER 39 16.713 2.894 -4.519 283 HB2 SER 39 HB2 SER 39 17.566 1.212 -2.802 284 HB3 SER 39 HB1 SER 39 16.250 0.911 -3.939 285 H ALA 40 HN ALA 40 15.478 3.907 -2.123 286 HA ALA 40 HA ALA 40 12.684 4.266 -1.763 287 HB1 ALA 40 HB3 ALA 40 14.594 6.230 -3.010 288 HB2 ALA 40 HB1 ALA 40 14.379 6.005 -1.273 289 HB3 ALA 40 HB2 ALA 40 13.030 6.578 -2.262 290 H SER 41 HN SER 41 14.707 4.288 -4.693 291 HA SER 41 HA SER 41 12.942 5.142 -6.573 292 HG SER 41 HG SER 41 16.326 4.582 -7.133 293 HB2 SER 41 HB2 SER 41 15.029 2.971 -6.762 294 HB3 SER 41 HB1 SER 41 14.167 3.601 -8.164 295 H GLN 42 HN GLN 42 13.407 1.705 -5.756 296 HA GLN 42 HA GLN 42 11.354 0.723 -7.352 297 HB2 GLN 42 HB2 GLN 42 11.442 -1.291 -6.060 298 HB3 GLN 42 HB1 GLN 42 13.073 -0.663 -6.236 299 HG2 GLN 42 HG2 GLN 42 13.047 -1.248 -4.034 300 HG3 GLN 42 HG1 GLN 42 12.607 0.457 -3.972 301 HE21 GLN 42 HE21 GLN 42 11.359 -2.811 -3.826 302 HE22 GLN 42 HE22 GLN 42 9.914 -2.423 -2.965 303 H VAL 43 HN VAL 43 11.221 2.341 -4.338 304 HA VAL 43 HA VAL 43 8.702 1.478 -3.409 305 HB VAL 43 HB VAL 43 9.664 4.309 -3.073 306 HG11 VAL 43 HG11 VAL 43 8.155 2.571 -1.151 307 HG12 VAL 43 HG12 VAL 43 7.357 3.575 -2.359 308 HG13 VAL 43 HG13 VAL 43 8.360 4.321 -1.116 309 HG21 VAL 43 HG23 VAL 43 10.834 3.555 -1.047 310 HG22 VAL 43 HG21 VAL 43 11.526 2.869 -2.507 311 HG23 VAL 43 HG22 VAL 43 10.492 1.882 -1.486 312 H LYS 44 HN LYS 44 9.673 3.912 -5.719 313 HA LYS 44 HA LYS 44 7.276 5.211 -6.195 314 HB2 LYS 44 HB2 LYS 44 9.514 4.438 -8.068 315 HB3 LYS 44 HB1 LYS 44 8.142 5.400 -8.597 316 HG2 LYS 44 HG2 LYS 44 8.812 7.245 -7.436 317 HG3 LYS 44 HG1 LYS 44 9.632 6.303 -6.192 318 HD2 LYS 44 HD2 LYS 44 11.155 7.597 -7.702 319 HD3 LYS 44 HD1 LYS 44 11.479 5.865 -7.637 320 HE2 LYS 44 HE2 LYS 44 10.243 5.560 -9.730 321 HE3 LYS 44 HE1 LYS 44 9.930 7.295 -9.795 322 HZ1 LYS 44 HZ3 LYS 44 12.320 7.675 -9.929 323 HZ2 LYS 44 HZ1 LYS 44 11.789 6.697 -11.203 324 HZ3 LYS 44 HZ2 LYS 44 12.605 6.008 -9.893 325 H ASP 45 HN ASP 45 8.502 2.188 -7.567 326 HA ASP 45 HA ASP 45 6.245 1.645 -9.177 327 HB2 ASP 45 HB2 ASP 45 8.376 0.538 -9.592 328 HB3 ASP 45 HB1 ASP 45 8.300 -0.225 -8.013 329 H ILE 46 HN ILE 46 7.242 0.524 -5.953 330 HA ILE 46 HA ILE 46 5.139 -1.112 -5.294 331 HB ILE 46 HB ILE 46 6.972 0.651 -3.756 332 HG12 ILE 46 HG12 ILE 46 7.746 -1.410 -2.850 333 HG13 ILE 46 HG11 ILE 46 6.339 -2.272 -3.443 334 HG21 ILE 46 HG21 ILE 46 4.492 -0.560 -2.597 335 HG22 ILE 46 HG22 ILE 46 5.146 1.064 -2.389 336 HG23 ILE 46 HG23 ILE 46 5.940 -0.309 -1.620 337 HD11 ILE 46 HD13 ILE 46 7.148 -1.697 -5.768 338 HD12 ILE 46 HD11 ILE 46 8.114 -2.860 -4.858 339 HD13 ILE 46 HD12 ILE 46 8.654 -1.189 -5.004 340 H PHE 47 HN PHE 47 5.384 2.353 -4.585 341 HA PHE 47 HA PHE 47 3.006 3.066 -3.618 342 HD1 PHE 47 HD1 PHE 47 2.076 5.845 -3.656 343 HD2 PHE 47 HD2 PHE 47 3.940 5.350 -7.449 344 HE1 PHE 47 HE1 PHE 47 0.566 7.527 -4.621 345 HE2 PHE 47 HE2 PHE 47 2.433 7.037 -8.416 346 HZ PHE 47 HZ PHE 47 0.741 8.128 -6.999 347 HB2 PHE 47 HB2 PHE 47 4.434 4.835 -3.994 348 HB3 PHE 47 HB1 PHE 47 4.846 4.306 -5.604 349 H ARG 48 HN ARG 48 3.641 2.291 -6.960 350 HA ARG 48 HA ARG 48 1.219 3.053 -8.107 351 HE ARG 48 HE ARG 48 1.138 4.191 -10.460 352 HB2 ARG 48 HB2 ARG 48 2.924 0.727 -8.980 353 HB3 ARG 48 HB1 ARG 48 1.790 1.639 -9.968 354 HG2 ARG 48 HG2 ARG 48 4.359 2.630 -8.777 355 HG3 ARG 48 HG1 ARG 48 4.008 2.359 -10.484 356 HD2 ARG 48 HD2 ARG 48 2.618 4.373 -8.706 357 HD3 ARG 48 HD1 ARG 48 3.904 4.745 -9.860 358 HH11 ARG 48 HH11 ARG 48 4.397 4.294 -11.687 359 HH12 ARG 48 HH12 ARG 48 3.908 4.479 -13.338 360 HH21 ARG 48 HH21 ARG 48 0.486 4.424 -12.640 361 HH22 ARG 48 HH22 ARG 48 1.688 4.554 -13.878 362 H PHE 49 HN PHE 49 2.003 0.196 -6.229 363 HA PHE 49 HA PHE 49 -0.026 -1.500 -7.041 364 HD1 PHE 49 HD2 PHE 49 -0.177 -4.049 -6.172 365 HD2 PHE 49 HD1 PHE 49 -0.500 -1.638 -2.678 366 HE1 PHE 49 HE2 PHE 49 -1.809 -5.631 -5.232 367 HE2 PHE 49 HE1 PHE 49 -2.128 -3.216 -1.735 368 HZ PHE 49 HZ PHE 49 -2.787 -5.216 -3.010 369 HB2 PHE 49 HB2 PHE 49 1.587 -2.328 -5.487 370 HB3 PHE 49 HB1 PHE 49 1.142 -1.145 -4.267 371 H ILE 50 HN ILE 50 -0.230 0.788 -4.275 372 HA ILE 50 HA ILE 50 -2.983 0.400 -4.031 373 HB ILE 50 HB ILE 50 -2.990 2.450 -2.605 374 HG12 ILE 50 HG12 ILE 50 -0.027 2.462 -3.250 375 HG13 ILE 50 HG11 ILE 50 -1.185 3.725 -3.666 376 HG21 ILE 50 HG21 ILE 50 -2.498 0.116 -1.842 377 HG22 ILE 50 HG22 ILE 50 -1.891 1.409 -0.814 378 HG23 ILE 50 HG23 ILE 50 -0.788 0.547 -1.883 379 HD11 ILE 50 HD13 ILE 50 -0.624 2.906 -0.828 380 HD12 ILE 50 HD11 ILE 50 -1.459 4.347 -1.398 381 HD13 ILE 50 HD12 ILE 50 0.283 4.181 -1.644 382 H ASP 51 HN ASP 51 -3.229 3.646 -4.021 383 HA ASP 51 HA ASP 51 -4.609 3.572 -6.537 384 HB2 ASP 51 HB2 ASP 51 -4.369 5.552 -4.295 385 HB3 ASP 51 HB1 ASP 51 -5.075 6.040 -5.844 386 H ASN 52 HN ASN 52 -4.242 5.205 -8.262 387 HA ASN 52 HA ASN 52 -1.367 5.824 -8.422 388 HB2 ASN 52 HB2 ASN 52 -1.903 3.925 -9.788 389 HB3 ASN 52 HB1 ASN 52 -3.171 4.823 -10.608 390 HD21 ASN 52 HD21 ASN 52 -0.071 6.226 -9.774 391 HD22 ASN 52 HD22 ASN 52 0.508 6.370 -11.393 392 H ASP 53 HN ASP 53 -4.539 7.025 -9.694 393 HA ASP 53 HA ASP 53 -3.076 9.523 -10.272 394 HB2 ASP 53 HB2 ASP 53 -5.259 8.354 -11.976 395 HB3 ASP 53 HB1 ASP 53 -4.333 9.814 -12.319 396 H GLN 54 HN GLN 54 -4.208 9.753 -7.964 397 HA GLN 54 HA GLN 54 -6.860 10.852 -8.396 398 HB2 GLN 54 HB2 GLN 54 -5.812 10.761 -5.688 399 HB3 GLN 54 HB1 GLN 54 -7.413 10.387 -6.279 400 HG2 GLN 54 HG2 GLN 54 -6.384 8.301 -7.305 401 HG3 GLN 54 HG1 GLN 54 -4.977 8.650 -6.304 402 HE21 GLN 54 HE21 GLN 54 -6.420 9.709 -4.095 403 HE22 GLN 54 HE22 GLN 54 -7.112 8.365 -3.299 404 H SER 55 HN SER 55 -4.239 12.146 -9.058 405 HA SER 55 HA SER 55 -3.895 14.398 -9.492 406 HG SER 55 HG SER 55 -6.960 15.738 -8.910 407 HB2 SER 55 HB2 SER 55 -5.471 15.086 -7.007 408 HB3 SER 55 HB1 SER 55 -4.960 16.174 -8.296 409 H GLY 56 HN GLY 56 -2.027 12.896 -8.538 410 HA2 GLY 56 HA2 GLY 56 0.090 13.221 -7.662 411 HA3 GLY 56 HA1 GLY 56 -0.452 14.765 -7.027 412 H TYR 57 HN TYR 57 -2.574 12.370 -6.006 413 HA TYR 57 HA TYR 57 -1.021 11.381 -3.856 414 HD1 TYR 57 HD2 TYR 57 -4.780 12.484 -3.207 415 HD2 TYR 57 HD1 TYR 57 -1.935 15.625 -3.422 416 HE1 TYR 57 HE2 TYR 57 -6.589 14.073 -3.711 417 HE2 TYR 57 HE1 TYR 57 -3.730 17.232 -3.934 418 HH TYR 57 HH TYR 57 -5.988 17.246 -4.824 419 HB2 TYR 57 HB2 TYR 57 -2.332 12.516 -2.031 420 HB3 TYR 57 HB1 TYR 57 -1.196 13.545 -2.895 421 H LEU 58 HN LEU 58 -2.308 10.273 -2.178 422 HA LEU 58 HA LEU 58 -4.766 9.175 -3.328 423 HG LEU 58 HG LEU 58 -1.695 8.100 -3.608 424 HB2 LEU 58 HB2 LEU 58 -2.850 7.739 -1.508 425 HB3 LEU 58 HB1 LEU 58 -4.223 7.049 -2.358 426 HD11 LEU 58 HD11 LEU 58 -2.424 5.544 -2.602 427 HD12 LEU 58 HD12 LEU 58 -0.924 6.032 -3.396 428 HD13 LEU 58 HD13 LEU 58 -2.288 5.447 -4.356 429 HD21 LEU 58 HD23 LEU 58 -2.957 6.917 -5.624 430 HD22 LEU 58 HD21 LEU 58 -3.089 8.635 -5.271 431 HD23 LEU 58 HD22 LEU 58 -4.342 7.528 -4.726 432 H ASP 59 HN ASP 59 -6.442 8.491 -1.644 433 HA ASP 59 HA ASP 59 -5.946 9.653 0.986 434 HB2 ASP 59 HB2 ASP 59 -6.843 11.427 -0.510 435 HB3 ASP 59 HB1 ASP 59 -8.325 10.489 -0.657 436 H GLY 60 HN GLY 60 -7.422 9.152 2.549 437 HA2 GLY 60 HA2 GLY 60 -7.946 6.495 2.887 438 HA3 GLY 60 HA1 GLY 60 -8.785 7.766 3.760 439 H ASP 61 HN ASP 61 -9.944 8.729 1.141 440 HA ASP 61 HA ASP 61 -12.332 7.136 1.354 441 HB2 ASP 61 HB2 ASP 61 -11.639 9.378 -0.562 442 HB3 ASP 61 HB1 ASP 61 -13.236 8.659 -0.368 443 H GLU 62 HN GLU 62 -9.874 7.802 -1.056 444 HA GLU 62 HA GLU 62 -10.900 5.924 -2.965 445 HB2 GLU 62 HB2 GLU 62 -8.316 7.389 -2.920 446 HB3 GLU 62 HB1 GLU 62 -9.031 6.606 -4.317 447 HG2 GLU 62 HG2 GLU 62 -10.311 8.880 -2.839 448 HG3 GLU 62 HG1 GLU 62 -9.260 9.100 -4.236 449 H LEU 63 HN LEU 63 -8.449 5.942 -0.501 450 HA LEU 63 HA LEU 63 -6.569 4.166 -1.281 451 HG LEU 63 HG LEU 63 -6.582 6.359 0.969 452 HB2 LEU 63 HB2 LEU 63 -7.905 4.511 1.395 453 HB3 LEU 63 HB1 LEU 63 -6.578 3.395 1.176 454 HD11 LEU 63 HD11 LEU 63 -5.664 4.399 2.847 455 HD12 LEU 63 HD12 LEU 63 -5.968 6.103 3.066 456 HD13 LEU 63 HD13 LEU 63 -4.417 5.565 2.421 457 HD21 LEU 63 HD23 LEU 63 -4.680 4.457 -0.285 458 HD22 LEU 63 HD21 LEU 63 -4.088 5.991 0.360 459 HD23 LEU 63 HD22 LEU 63 -5.323 5.987 -0.910 460 H LYS 64 HN LYS 64 -9.788 3.224 -0.016 461 HA LYS 64 HA LYS 64 -9.316 0.511 0.093 462 HB2 LYS 64 HB2 LYS 64 -11.861 0.370 -0.185 463 HB3 LYS 64 HB1 LYS 64 -11.217 1.215 1.202 464 HG2 LYS 64 HG2 LYS 64 -13.022 2.495 0.420 465 HG3 LYS 64 HG1 LYS 64 -11.582 3.356 -0.100 466 HD2 LYS 64 HD2 LYS 64 -13.055 3.381 -1.942 467 HD3 LYS 64 HD1 LYS 64 -11.849 2.156 -2.321 468 HE2 LYS 64 HE2 LYS 64 -13.976 1.255 -2.888 469 HE3 LYS 64 HE1 LYS 64 -13.426 0.441 -1.427 470 HZ1 LYS 64 HZ3 LYS 64 -15.765 1.091 -1.303 471 HZ2 LYS 64 HZ1 LYS 64 -15.335 2.715 -1.496 472 HZ3 LYS 64 HZ2 LYS 64 -14.845 1.868 -0.117 473 H TYR 65 HN TYR 65 -9.669 2.429 -2.747 474 HA TYR 65 HA TYR 65 -10.650 0.304 -4.418 475 HD1 TYR 65 HD1 TYR 65 -12.589 1.250 -4.749 476 HD2 TYR 65 HD2 TYR 65 -10.395 4.867 -5.187 477 HE1 TYR 65 HE1 TYR 65 -14.629 2.539 -4.278 478 HE2 TYR 65 HE2 TYR 65 -12.430 6.161 -4.713 479 HH TYR 65 HH TYR 65 -15.252 4.762 -3.456 480 HB2 TYR 65 HB2 TYR 65 -9.261 2.845 -5.272 481 HB3 TYR 65 HB1 TYR 65 -10.190 1.770 -6.299 482 H PHE 66 HN PHE 66 -7.654 0.944 -3.020 483 HA PHE 66 HA PHE 66 -5.737 0.491 -4.850 484 HD1 PHE 66 HD2 PHE 66 -7.747 -1.058 -1.919 485 HD2 PHE 66 HD1 PHE 66 -3.561 -1.492 -1.469 486 HE1 PHE 66 HE2 PHE 66 -8.102 -2.936 -0.395 487 HE2 PHE 66 HE1 PHE 66 -3.931 -3.362 0.082 488 HZ PHE 66 HZ PHE 66 -6.187 -4.084 0.623 489 HB2 PHE 66 HB2 PHE 66 -4.374 -0.035 -3.032 490 HB3 PHE 66 HB1 PHE 66 -5.637 0.888 -2.287 491 H LEU 67 HN LEU 67 -7.873 -1.931 -3.518 492 HA LEU 67 HA LEU 67 -6.482 -4.136 -4.680 493 HG LEU 67 HG LEU 67 -6.414 -4.444 -2.078 494 HB2 LEU 67 HB2 LEU 67 -8.678 -3.682 -2.765 495 HB3 LEU 67 HB1 LEU 67 -8.831 -5.133 -3.734 496 HD11 LEU 67 HD11 LEU 67 -8.774 -6.207 -1.479 497 HD12 LEU 67 HD12 LEU 67 -8.202 -4.807 -0.567 498 HD13 LEU 67 HD13 LEU 67 -7.241 -6.287 -0.607 499 HD21 LEU 67 HD23 LEU 67 -7.188 -7.060 -3.317 500 HD22 LEU 67 HD21 LEU 67 -5.644 -6.607 -2.585 501 HD23 LEU 67 HD22 LEU 67 -6.157 -5.862 -4.102 502 H GLN 68 HN GLN 68 -9.169 -2.055 -5.238 503 HA GLN 68 HA GLN 68 -10.531 -3.629 -7.137 504 HB2 GLN 68 HB2 GLN 68 -10.516 -0.678 -6.523 505 HB3 GLN 68 HB1 GLN 68 -11.557 -1.386 -7.742 506 HG2 GLN 68 HG2 GLN 68 -12.292 -2.975 -5.834 507 HG3 GLN 68 HG1 GLN 68 -11.614 -1.730 -4.786 508 HE21 GLN 68 HE21 GLN 68 -14.365 -2.590 -5.022 509 HE22 GLN 68 HE22 GLN 68 -15.279 -1.198 -5.479 510 H LYS 69 HN LYS 69 -8.123 -1.000 -7.408 511 HA LYS 69 HA LYS 69 -7.889 -0.768 -10.074 512 HB2 LYS 69 HB2 LYS 69 -5.445 -1.046 -8.355 513 HB3 LYS 69 HB1 LYS 69 -5.672 0.004 -9.740 514 HG2 LYS 69 HG2 LYS 69 -6.746 0.296 -6.964 515 HG3 LYS 69 HG1 LYS 69 -5.683 1.392 -7.841 516 HD2 LYS 69 HD2 LYS 69 -8.601 0.866 -8.291 517 HD3 LYS 69 HD1 LYS 69 -7.847 2.370 -7.775 518 HE2 LYS 69 HE2 LYS 69 -6.754 2.599 -9.929 519 HE3 LYS 69 HE1 LYS 69 -7.431 1.061 -10.460 520 HZ1 LYS 69 HZ3 LYS 69 -9.636 1.991 -10.308 521 HZ2 LYS 69 HZ1 LYS 69 -8.679 2.972 -11.300 522 HZ3 LYS 69 HZ2 LYS 69 -9.026 3.453 -9.716 523 H PHE 70 HN PHE 70 -5.853 -2.925 -8.154 524 HA PHE 70 HA PHE 70 -4.883 -4.338 -10.418 525 HD1 PHE 70 HD2 PHE 70 -2.928 -6.961 -9.469 526 HD2 PHE 70 HD1 PHE 70 -5.408 -5.785 -6.218 527 HE1 PHE 70 HE2 PHE 70 -2.858 -9.259 -8.586 528 HE2 PHE 70 HE1 PHE 70 -5.344 -8.071 -5.328 529 HZ PHE 70 HZ PHE 70 -4.067 -9.818 -6.512 530 HB2 PHE 70 HB2 PHE 70 -3.272 -4.598 -8.895 531 HB3 PHE 70 HB1 PHE 70 -4.345 -4.146 -7.587 532 H GLN 71 HN GLN 71 -7.240 -5.145 -7.876 533 HA GLN 71 HA GLN 71 -7.759 -7.726 -9.071 534 HB2 GLN 71 HB2 GLN 71 -7.870 -7.307 -6.591 535 HB3 GLN 71 HB1 GLN 71 -9.340 -6.392 -6.878 536 HG2 GLN 71 HG2 GLN 71 -10.384 -8.385 -7.846 537 HG3 GLN 71 HG1 GLN 71 -8.915 -9.299 -7.515 538 HE21 GLN 71 HE21 GLN 71 -10.336 -6.874 -5.389 539 HE22 GLN 71 HE22 GLN 71 -10.751 -7.966 -4.126 540 H SER 72 HN SER 72 -10.106 -5.262 -8.119 541 HA SER 72 HA SER 72 -11.486 -4.043 -9.649 542 HG SER 72 HG SER 72 -10.383 -4.142 -11.729 543 HB2 SER 72 HB2 SER 72 -11.638 -6.619 -11.195 544 HB3 SER 72 HB1 SER 72 -12.525 -5.149 -11.577 545 H ASP 73 HN ASP 73 -11.654 -6.056 -7.321 546 HA ASP 73 HA ASP 73 -14.505 -5.903 -7.032 547 HB2 ASP 73 HB2 ASP 73 -14.181 -8.009 -8.348 548 HB3 ASP 73 HB1 ASP 73 -13.226 -8.645 -7.012 549 H ALA 74 HN ALA 74 -12.121 -4.906 -5.667 550 HA ALA 74 HA ALA 74 -11.451 -6.296 -3.357 551 HB1 ALA 74 HB3 ALA 74 -10.455 -4.358 -2.635 552 HB2 ALA 74 HB1 ALA 74 -11.734 -3.331 -3.274 553 HB3 ALA 74 HB2 ALA 74 -10.558 -4.050 -4.369 554 H ARG 75 HN ARG 75 -12.102 -5.911 -1.147 555 HA ARG 75 HA ARG 75 -14.952 -5.828 -0.880 556 HE ARG 75 HE ARG 75 -9.683 -5.478 2.370 557 HB2 ARG 75 HB2 ARG 75 -14.629 -6.461 1.385 558 HB3 ARG 75 HB1 ARG 75 -13.441 -7.348 0.445 559 HG2 ARG 75 HG2 ARG 75 -12.755 -4.768 1.807 560 HG3 ARG 75 HG1 ARG 75 -12.700 -6.312 2.656 561 HD2 ARG 75 HD2 ARG 75 -11.285 -7.002 0.518 562 HD3 ARG 75 HD1 ARG 75 -10.971 -5.268 0.479 563 HH11 ARG 75 HH11 ARG 75 -11.481 -8.418 1.828 564 HH12 ARG 75 HH12 ARG 75 -10.656 -9.305 3.065 565 HH21 ARG 75 HH21 ARG 75 -8.611 -6.639 4.022 566 HH22 ARG 75 HH22 ARG 75 -9.023 -8.296 4.308 567 H GLU 76 HN GLU 76 -12.423 -3.576 -0.731 568 HA GLU 76 HA GLU 76 -12.615 -1.292 -0.766 569 HB2 GLU 76 HB2 GLU 76 -15.209 -1.558 0.759 570 HB3 GLU 76 HB1 GLU 76 -14.551 -0.104 0.037 571 HG2 GLU 76 HG2 GLU 76 -14.854 -0.950 -2.160 572 HG3 GLU 76 HG1 GLU 76 -15.268 -2.544 -1.549 573 H LEU 77 HN LEU 77 -11.171 -2.758 0.854 574 HA LEU 77 HA LEU 77 -10.259 -3.061 2.942 575 HG LEU 77 HG LEU 77 -8.864 -1.757 0.727 576 HB2 LEU 77 HB2 LEU 77 -9.999 -0.206 2.112 577 HB3 LEU 77 HB1 LEU 77 -9.142 -0.794 3.508 578 HD11 LEU 77 HD11 LEU 77 -7.693 0.370 2.082 579 HD12 LEU 77 HD12 LEU 77 -7.183 -0.349 0.565 580 HD13 LEU 77 HD13 LEU 77 -6.477 -0.909 2.072 581 HD21 LEU 77 HD23 LEU 77 -7.853 -3.613 1.447 582 HD22 LEU 77 HD21 LEU 77 -8.534 -3.267 3.017 583 HD23 LEU 77 HD22 LEU 77 -6.935 -2.707 2.639 584 H THR 78 HN THR 78 -13.145 -2.524 3.347 585 HA THR 78 HA THR 78 -14.628 -1.690 4.909 586 HB THR 78 HB THR 78 -14.315 -2.712 7.026 587 HG1 THR 78 HG1 THR 78 -12.141 -3.511 7.576 588 HG21 THR 78 HG23 THR 78 -13.585 -4.974 6.456 589 HG22 THR 78 HG21 THR 78 -12.815 -4.363 4.990 590 HG23 THR 78 HG22 THR 78 -14.569 -4.290 5.161 591 H GLU 79 HN GLU 79 -14.469 -0.735 7.405 592 HA GLU 79 HA GLU 79 -13.519 1.926 7.058 593 HB2 GLU 79 HB2 GLU 79 -14.438 0.465 9.543 594 HB3 GLU 79 HB1 GLU 79 -14.109 2.191 9.470 595 HG2 GLU 79 HG2 GLU 79 -15.876 2.448 7.795 596 HG3 GLU 79 HG1 GLU 79 -16.217 0.721 7.900 597 H SER 80 HN SER 80 -12.430 -0.901 8.798 598 HA SER 80 HA SER 80 -10.220 0.278 10.105 599 HG SER 80 HG SER 80 -9.411 -1.426 11.756 600 HB2 SER 80 HB2 SER 80 -11.423 -1.749 10.874 601 HB3 SER 80 HB1 SER 80 -10.689 -2.645 9.547 602 H GLU 81 HN GLU 81 -10.171 -2.001 7.253 603 HA GLU 81 HA GLU 81 -7.426 -2.113 7.149 604 HB2 GLU 81 HB2 GLU 81 -9.490 -3.175 5.651 605 HB3 GLU 81 HB1 GLU 81 -8.612 -2.182 4.521 606 HG2 GLU 81 HG2 GLU 81 -7.601 -4.509 6.076 607 HG3 GLU 81 HG1 GLU 81 -7.618 -4.284 4.331 608 H THR 82 HN THR 82 -9.507 0.288 5.406 609 HA THR 82 HA THR 82 -7.484 1.449 3.944 610 HB THR 82 HB THR 82 -8.734 3.603 4.146 611 HG1 THR 82 HG1 THR 82 -9.591 3.000 6.311 612 HG21 THR 82 HG23 THR 82 -10.346 1.156 3.443 613 HG22 THR 82 HG21 THR 82 -9.237 2.020 2.375 614 HG23 THR 82 HG22 THR 82 -10.717 2.804 2.934 615 H LYS 83 HN LYS 83 -7.967 1.483 7.366 616 HA LYS 83 HA LYS 83 -6.497 3.801 8.030 617 HB2 LYS 83 HB2 LYS 83 -7.902 2.473 9.632 618 HB3 LYS 83 HB1 LYS 83 -6.678 1.211 9.600 619 HG2 LYS 83 HG2 LYS 83 -5.040 2.753 10.521 620 HG3 LYS 83 HG1 LYS 83 -6.245 4.040 10.527 621 HD2 LYS 83 HD2 LYS 83 -7.581 2.851 12.138 622 HD3 LYS 83 HD1 LYS 83 -6.517 1.446 12.039 623 HE2 LYS 83 HE2 LYS 83 -6.101 2.810 14.049 624 HE3 LYS 83 HE1 LYS 83 -4.693 2.713 12.992 625 HZ1 LYS 83 HZ3 LYS 83 -5.199 4.897 12.141 626 HZ2 LYS 83 HZ1 LYS 83 -5.078 4.963 13.827 627 HZ3 LYS 83 HZ2 LYS 83 -6.598 4.990 13.086 628 H SER 84 HN SER 84 -5.571 0.482 7.222 629 HA SER 84 HA SER 84 -2.898 0.505 7.927 630 HG SER 84 HG SER 84 -4.473 -1.486 8.086 631 HB2 SER 84 HB2 SER 84 -4.473 -0.869 5.766 632 HB3 SER 84 HB1 SER 84 -2.751 -1.090 5.889 633 H LEU 85 HN LEU 85 -4.377 1.234 4.793 634 HA LEU 85 HA LEU 85 -2.131 2.229 3.515 635 HG LEU 85 HG LEU 85 -4.483 0.532 2.450 636 HB2 LEU 85 HB2 LEU 85 -5.086 2.649 3.284 637 HB3 LEU 85 HB1 LEU 85 -3.997 3.486 2.208 638 HD11 LEU 85 HD11 LEU 85 -4.805 2.551 0.250 639 HD12 LEU 85 HD12 LEU 85 -6.045 1.557 1.017 640 HD13 LEU 85 HD13 LEU 85 -4.838 0.811 -0.030 641 HD21 LEU 85 HD23 LEU 85 -2.106 0.752 2.310 642 HD22 LEU 85 HD21 LEU 85 -2.243 1.932 1.006 643 HD23 LEU 85 HD22 LEU 85 -2.719 0.257 0.741 644 H MET 86 HN MET 86 -4.541 3.764 5.535 645 HA MET 86 HA MET 86 -3.767 6.409 5.367 646 HB2 MET 86 HB2 MET 86 -5.729 5.210 6.649 647 HB3 MET 86 HB1 MET 86 -4.590 5.224 7.993 648 HG2 MET 86 HG2 MET 86 -4.801 7.419 8.307 649 HG3 MET 86 HG1 MET 86 -4.824 7.729 6.579 650 HE1 MET 86 HE3 MET 86 -8.021 8.283 5.466 651 HE2 MET 86 HE1 MET 86 -7.791 6.536 5.355 652 HE3 MET 86 HE2 MET 86 -6.415 7.623 5.140 653 H ASP 87 HN ASP 87 -2.703 3.867 7.570 654 HA ASP 87 HA ASP 87 -0.721 5.379 8.920 655 HB2 ASP 87 HB2 ASP 87 -1.052 2.402 8.647 656 HB3 ASP 87 HB1 ASP 87 -0.016 3.207 9.823 657 H ALA 88 HN ALA 88 -0.712 4.409 5.774 658 HA ALA 88 HA ALA 88 1.809 3.136 5.510 659 HB1 ALA 88 HB3 ALA 88 1.316 2.944 3.291 660 HB2 ALA 88 HB1 ALA 88 0.411 4.461 3.254 661 HB3 ALA 88 HB2 ALA 88 -0.280 3.042 4.038 662 H ALA 89 HN ALA 89 0.824 6.527 5.358 663 HA ALA 89 HA ALA 89 3.625 7.237 5.325 664 HB1 ALA 89 HB3 ALA 89 3.183 6.988 2.944 665 HB2 ALA 89 HB1 ALA 89 3.475 8.679 3.350 666 HB3 ALA 89 HB2 ALA 89 1.827 8.115 3.055 667 H ASP 90 HN ASP 90 0.800 9.131 4.313 668 HA ASP 90 HA ASP 90 1.450 11.082 6.384 669 HB2 ASP 90 HB2 ASP 90 0.525 11.337 3.758 670 HB3 ASP 90 HB1 ASP 90 -0.858 11.761 4.764 671 H ASN 91 HN ASN 91 0.821 9.471 7.981 672 HA ASN 91 HA ASN 91 -1.979 8.749 8.198 673 HB2 ASN 91 HB2 ASN 91 -0.278 8.292 10.547 674 HB3 ASN 91 HB1 ASN 91 -1.313 7.175 9.690 675 HD21 ASN 91 HD21 ASN 91 -0.192 7.344 7.220 676 HD22 ASN 91 HD22 ASN 91 1.361 6.646 7.316 677 H ASP 92 HN ASP 92 0.314 10.330 10.363 678 HA ASP 92 HA ASP 92 -1.910 11.650 11.724 679 HB2 ASP 92 HB2 ASP 92 0.940 11.087 12.478 680 HB3 ASP 92 HB1 ASP 92 -0.059 12.199 13.399 681 H GLY 93 HN GLY 93 -0.805 12.678 9.072 682 HA2 GLY 93 HA2 GLY 93 -0.433 15.388 10.034 683 HA3 GLY 93 HA1 GLY 93 0.884 14.718 9.088 684 H ASP 94 HN ASP 94 -2.238 13.585 8.193 685 HA ASP 94 HA ASP 94 -3.132 15.565 6.499 686 HB2 ASP 94 HB2 ASP 94 -0.852 15.154 5.411 687 HB3 ASP 94 HB1 ASP 94 -1.515 13.616 4.873 688 H GLY 95 HN GLY 95 -2.440 12.144 5.801 689 HA2 GLY 95 HA2 GLY 95 -4.165 10.438 6.202 690 HA3 GLY 95 HA1 GLY 95 -5.352 11.651 5.739 691 H LYS 96 HN LYS 96 -2.661 11.955 3.772 692 HA LYS 96 HA LYS 96 -3.948 10.369 1.666 693 HB2 LYS 96 HB2 LYS 96 -3.857 12.246 0.406 694 HB3 LYS 96 HB1 LYS 96 -3.173 13.091 1.771 695 HG2 LYS 96 HG2 LYS 96 -1.593 11.639 -0.334 696 HG3 LYS 96 HG1 LYS 96 -1.876 13.373 -0.279 697 HD2 LYS 96 HD2 LYS 96 -0.896 12.822 2.236 698 HD3 LYS 96 HD1 LYS 96 0.049 11.760 1.188 699 HE2 LYS 96 HE2 LYS 96 1.161 13.907 1.443 700 HE3 LYS 96 HE1 LYS 96 0.626 13.685 -0.222 701 HZ1 LYS 96 HZ3 LYS 96 -0.868 15.244 1.817 702 HZ2 LYS 96 HZ1 LYS 96 -1.216 15.138 0.165 703 HZ3 LYS 96 HZ2 LYS 96 0.186 15.927 0.684 704 H ILE 97 HN ILE 97 -2.557 9.218 0.161 705 HA ILE 97 HA ILE 97 0.161 8.729 1.197 706 HB ILE 97 HB ILE 97 -1.607 6.601 0.012 707 HG12 ILE 97 HG12 ILE 97 -2.460 7.293 2.210 708 HG13 ILE 97 HG11 ILE 97 -1.761 5.680 2.253 709 HG21 ILE 97 HG21 ILE 97 0.207 5.145 1.081 710 HG22 ILE 97 HG22 ILE 97 1.161 6.627 1.161 711 HG23 ILE 97 HG23 ILE 97 0.613 6.014 -0.399 712 HD11 ILE 97 HD13 ILE 97 0.344 6.757 3.129 713 HD12 ILE 97 HD11 ILE 97 -1.047 6.736 4.212 714 HD13 ILE 97 HD12 ILE 97 -0.622 8.213 3.355 715 H GLY 98 HN GLY 98 1.193 9.933 -0.419 716 HA2 GLY 98 HA2 GLY 98 0.810 9.066 -3.186 717 HA3 GLY 98 HA1 GLY 98 1.643 10.527 -2.662 718 H ALA 99 HN ALA 99 2.916 8.959 -4.503 719 HA ALA 99 HA ALA 99 4.478 6.849 -3.566 720 HB1 ALA 99 HB3 ALA 99 5.800 7.110 -5.466 721 HB2 ALA 99 HB1 ALA 99 5.607 8.863 -5.478 722 HB3 ALA 99 HB2 ALA 99 4.264 7.826 -5.950 723 H ASP 100 HN ASP 100 5.306 10.300 -3.637 724 HA ASP 100 HA ASP 100 7.758 10.157 -2.342 725 HB2 ASP 100 HB2 ASP 100 6.843 12.187 -3.464 726 HB3 ASP 100 HB1 ASP 100 5.749 12.409 -2.105 727 H GLU 101 HN GLU 101 4.550 10.684 -0.957 728 HA GLU 101 HA GLU 101 5.298 10.850 1.745 729 HB2 GLU 101 HB2 GLU 101 2.841 10.438 0.194 730 HB3 GLU 101 HB1 GLU 101 2.790 9.717 1.791 731 HG2 GLU 101 HG2 GLU 101 1.943 12.143 1.367 732 HG3 GLU 101 HG1 GLU 101 2.802 11.742 2.844 733 H PHE 102 HN PHE 102 4.158 8.153 -0.225 734 HA PHE 102 HA PHE 102 4.294 6.097 1.606 735 HD1 PHE 102 HD1 PHE 102 6.608 4.156 -0.179 736 HD2 PHE 102 HD2 PHE 102 2.380 3.831 -0.440 737 HE1 PHE 102 HE1 PHE 102 6.795 1.737 0.097 738 HE2 PHE 102 HE2 PHE 102 2.552 1.389 -0.167 739 HZ PHE 102 HZ PHE 102 4.764 0.335 0.102 740 HB2 PHE 102 HB2 PHE 102 3.351 5.893 -0.673 741 HB3 PHE 102 HB1 PHE 102 4.976 5.940 -1.345 742 H GLN 103 HN GLN 103 6.848 7.397 -0.518 743 HA GLN 103 HA GLN 103 8.915 5.651 0.176 744 HB2 GLN 103 HB2 GLN 103 9.093 8.598 -0.492 745 HB3 GLN 103 HB1 GLN 103 10.467 7.507 -0.430 746 HG2 GLN 103 HG2 GLN 103 8.765 6.251 -2.169 747 HG3 GLN 103 HG1 GLN 103 8.504 7.956 -2.506 748 HE21 GLN 103 HE21 GLN 103 9.711 6.008 -4.223 749 HE22 GLN 103 HE22 GLN 103 11.318 6.555 -4.545 750 H GLU 104 HN GLU 104 7.505 8.295 1.936 751 HA GLU 104 HA GLU 104 9.629 8.826 3.715 752 HB2 GLU 104 HB2 GLU 104 6.673 9.047 4.301 753 HB3 GLU 104 HB1 GLU 104 7.972 9.861 5.160 754 HG2 GLU 104 HG2 GLU 104 7.231 10.304 2.278 755 HG3 GLU 104 HG1 GLU 104 6.811 11.358 3.626 756 H MET 105 HN MET 105 7.036 6.461 3.778 757 HA MET 105 HA MET 105 7.422 5.536 6.391 758 HB2 MET 105 HB2 MET 105 5.623 5.050 4.457 759 HB3 MET 105 HB1 MET 105 6.550 3.558 4.388 760 HG2 MET 105 HG2 MET 105 5.454 4.663 6.948 761 HG3 MET 105 HG1 MET 105 4.518 3.602 5.903 762 HE1 MET 105 HE3 MET 105 6.472 0.269 6.017 763 HE2 MET 105 HE1 MET 105 6.648 1.533 4.800 764 HE3 MET 105 HE2 MET 105 5.051 1.130 5.428 765 H VAL 106 HN VAL 106 8.598 4.032 3.329 766 HA VAL 106 HA VAL 106 10.134 2.079 4.603 767 HB VAL 106 HB VAL 106 9.513 1.962 2.224 768 HG11 VAL 106 HG11 VAL 106 11.184 4.389 2.100 769 HG12 VAL 106 HG12 VAL 106 9.756 3.934 1.173 770 HG13 VAL 106 HG13 VAL 106 11.330 3.250 0.767 771 HG21 VAL 106 HG23 VAL 106 11.893 1.153 3.432 772 HG22 VAL 106 HG21 VAL 106 12.376 1.800 1.864 773 HG23 VAL 106 HG22 VAL 106 11.184 0.501 1.954 774 H HIS 107 HN HIS 107 10.776 5.422 3.886 775 HA HIS 107 HA HIS 107 13.615 5.207 4.370 776 HD1 HIS 107 HD1 HIS 107 13.198 9.429 5.279 777 HD2 HIS 107 HD2 HIS 107 15.591 6.972 2.934 778 HE1 HIS 107 HE1 HIS 107 15.487 10.469 5.334 779 HE2 HIS 107 HE2 HIS 107 16.890 9.025 3.822 780 HB2 HIS 107 HB2 HIS 107 12.679 6.846 2.759 781 HB3 HIS 107 HB1 HIS 107 11.878 7.671 4.090 782 H SER 108 HN SER 108 11.155 7.288 5.885 783 HA SER 108 HA SER 108 11.043 8.170 7.986 784 HG SER 108 HG SER 108 9.886 6.600 10.285 785 HB2 SER 108 HB2 SER 108 9.998 5.987 8.288 786 HB3 SER 108 HB1 SER 108 11.568 5.266 8.646 Start of MODEL 6 1 HA SER 1 HA SER 1 1.557 -6.989 -4.934 2 HG SER 1 HG SER 1 0.646 -10.170 -4.543 3 H1 SER 1 HT1 SER 1 0.952 -8.828 -7.174 4 H2 SER 1 HT2 SER 1 0.433 -7.225 -7.036 5 H3 SER 1 HT3 SER 1 -0.121 -8.389 -5.940 6 HB2 SER 1 HB2 SER 1 2.539 -9.808 -5.458 7 HB3 SER 1 HB1 SER 1 3.015 -8.777 -4.108 8 H ILE 2 HN ILE 2 3.054 -5.571 -5.461 9 HA ILE 2 HA ILE 2 4.384 -5.423 -7.888 10 HB ILE 2 HB ILE 2 5.909 -4.387 -5.610 11 HG12 ILE 2 HG12 ILE 2 4.205 -2.346 -5.766 12 HG13 ILE 2 HG11 ILE 2 3.078 -3.628 -6.168 13 HG21 ILE 2 HG21 ILE 2 5.001 -2.980 -8.089 14 HG22 ILE 2 HG22 ILE 2 6.349 -4.124 -8.084 15 HG23 ILE 2 HG23 ILE 2 6.426 -2.666 -7.098 16 HD11 ILE 2 HD13 ILE 2 3.811 -2.774 -3.653 17 HD12 ILE 2 HD11 ILE 2 4.682 -4.292 -3.868 18 HD13 ILE 2 HD12 ILE 2 2.932 -4.242 -4.066 19 H THR 3 HN THR 3 5.307 -7.259 -8.470 20 HA THR 3 HA THR 3 7.280 -8.593 -6.867 21 HB THR 3 HB THR 3 7.512 -10.125 -8.795 22 HG1 THR 3 HG1 THR 3 5.835 -9.786 -10.476 23 HG21 THR 3 HG23 THR 3 4.579 -9.880 -8.427 24 HG22 THR 3 HG21 THR 3 5.568 -10.058 -6.975 25 HG23 THR 3 HG22 THR 3 5.632 -11.285 -8.243 26 H ASP 4 HN ASP 4 7.371 -5.852 -8.854 27 HA ASP 4 HA ASP 4 9.541 -6.134 -10.479 28 HB2 ASP 4 HB2 ASP 4 8.756 -3.759 -8.781 29 HB3 ASP 4 HB1 ASP 4 9.948 -3.695 -10.075 30 H ILE 5 HN ILE 5 10.264 -4.160 -7.626 31 HA ILE 5 HA ILE 5 12.662 -5.840 -7.299 32 HB ILE 5 HB ILE 5 12.146 -3.027 -6.320 33 HG12 ILE 5 HG12 ILE 5 13.995 -3.879 -8.545 34 HG13 ILE 5 HG11 ILE 5 12.327 -3.390 -8.834 35 HG21 ILE 5 HG21 ILE 5 14.006 -4.885 -5.422 36 HG22 ILE 5 HG22 ILE 5 14.024 -3.142 -5.143 37 HG23 ILE 5 HG23 ILE 5 14.912 -3.828 -6.506 38 HD11 ILE 5 HD13 ILE 5 14.026 -1.605 -9.188 39 HD12 ILE 5 HD11 ILE 5 14.357 -1.656 -7.456 40 HD13 ILE 5 HD12 ILE 5 12.755 -1.195 -8.034 41 H LEU 6 HN LEU 6 11.716 -7.392 -6.081 42 HA LEU 6 HA LEU 6 11.768 -7.058 -3.268 43 HG LEU 6 HG LEU 6 10.216 -5.388 -2.703 44 HB2 LEU 6 HB2 LEU 6 9.089 -7.339 -4.600 45 HB3 LEU 6 HB1 LEU 6 9.369 -7.964 -2.995 46 HD11 LEU 6 HD11 LEU 6 7.698 -5.133 -4.298 47 HD12 LEU 6 HD12 LEU 6 9.267 -5.040 -5.083 48 HD13 LEU 6 HD13 LEU 6 8.852 -3.893 -3.821 49 HD21 LEU 6 HD23 LEU 6 8.553 -6.912 -1.420 50 HD22 LEU 6 HD21 LEU 6 7.328 -6.076 -2.371 51 HD23 LEU 6 HD22 LEU 6 8.390 -5.160 -1.304 52 H SER 7 HN SER 7 11.731 -9.114 -2.212 53 HA SER 7 HA SER 7 12.360 -11.270 -3.980 54 HG SER 7 HG SER 7 12.435 -13.550 -2.299 55 HB2 SER 7 HB2 SER 7 13.524 -11.641 -2.103 56 HB3 SER 7 HB1 SER 7 12.299 -11.033 -1.024 57 H ALA 8 HN ALA 8 10.327 -11.173 -5.112 58 HA ALA 8 HA ALA 8 7.920 -11.838 -4.560 59 HB1 ALA 8 HB3 ALA 8 8.810 -12.041 -6.841 60 HB2 ALA 8 HB1 ALA 8 7.683 -13.338 -6.444 61 HB3 ALA 8 HB2 ALA 8 9.420 -13.648 -6.445 62 H GLU 9 HN GLU 9 10.510 -13.932 -3.502 63 HA GLU 9 HA GLU 9 8.846 -16.162 -2.835 64 HB2 GLU 9 HB2 GLU 9 11.652 -15.474 -1.966 65 HB3 GLU 9 HB1 GLU 9 10.855 -17.025 -1.718 66 HG2 GLU 9 HG2 GLU 9 11.379 -15.788 -4.389 67 HG3 GLU 9 HG1 GLU 9 12.452 -16.957 -3.620 68 H ASP 10 HN ASP 10 10.105 -13.233 -1.169 69 HA ASP 10 HA ASP 10 9.334 -14.071 1.470 70 HB2 ASP 10 HB2 ASP 10 10.335 -11.986 2.148 71 HB3 ASP 10 HB1 ASP 10 11.379 -12.714 0.946 72 H ILE 11 HN ILE 11 7.913 -12.604 -1.169 73 HA ILE 11 HA ILE 11 6.245 -10.667 0.136 74 HB ILE 11 HB ILE 11 6.457 -11.732 -2.643 75 HG12 ILE 11 HG12 ILE 11 6.374 -8.886 -1.644 76 HG13 ILE 11 HG11 ILE 11 7.865 -9.817 -1.814 77 HG21 ILE 11 HG21 ILE 11 4.152 -10.065 -1.640 78 HG22 ILE 11 HG22 ILE 11 4.070 -11.662 -2.385 79 HG23 ILE 11 HG23 ILE 11 4.561 -10.266 -3.344 80 HD11 ILE 11 HD13 ILE 11 6.069 -8.687 -3.896 81 HD12 ILE 11 HD11 ILE 11 6.937 -10.176 -4.260 82 HD13 ILE 11 HD12 ILE 11 7.823 -8.728 -3.822 83 H ALA 12 HN ALA 12 5.905 -14.004 -1.095 84 HA ALA 12 HA ALA 12 3.116 -14.125 -0.752 85 HB1 ALA 12 HB3 ALA 12 4.980 -15.845 -1.731 86 HB2 ALA 12 HB1 ALA 12 3.321 -16.299 -1.331 87 HB3 ALA 12 HB2 ALA 12 4.614 -16.575 -0.167 88 H ALA 13 HN ALA 13 5.800 -15.190 1.384 89 HA ALA 13 HA ALA 13 4.080 -15.736 3.551 90 HB1 ALA 13 HB3 ALA 13 6.498 -16.432 3.312 91 HB2 ALA 13 HB1 ALA 13 6.033 -15.837 4.907 92 HB3 ALA 13 HB2 ALA 13 6.930 -14.793 3.805 93 H ALA 14 HN ALA 14 6.194 -12.990 3.041 94 HA ALA 14 HA ALA 14 5.431 -11.316 5.031 95 HB1 ALA 14 HB3 ALA 14 7.160 -10.550 3.650 96 HB2 ALA 14 HB1 ALA 14 5.854 -9.393 3.401 97 HB3 ALA 14 HB2 ALA 14 6.161 -10.640 2.201 98 H LEU 15 HN LEU 15 3.739 -11.692 1.935 99 HA LEU 15 HA LEU 15 1.696 -9.786 2.610 100 HG LEU 15 HG LEU 15 0.680 -8.958 0.367 101 HB2 LEU 15 HB2 LEU 15 2.518 -10.496 0.261 102 HB3 LEU 15 HB1 LEU 15 1.451 -11.873 0.469 103 HD11 LEU 15 HD11 LEU 15 -0.018 -11.302 -1.392 104 HD12 LEU 15 HD12 LEU 15 1.094 -9.993 -1.793 105 HD13 LEU 15 HD13 LEU 15 -0.623 -9.656 -1.577 106 HD21 LEU 15 HD23 LEU 15 -0.690 -9.946 2.057 107 HD22 LEU 15 HD21 LEU 15 -1.009 -11.354 1.047 108 HD23 LEU 15 HD22 LEU 15 -1.655 -9.780 0.591 109 H GLN 16 HN GLN 16 1.723 -13.329 2.131 110 HA GLN 16 HA GLN 16 -0.954 -13.726 2.876 111 HB2 GLN 16 HB2 GLN 16 1.362 -15.662 2.691 112 HB3 GLN 16 HB1 GLN 16 -0.357 -16.078 2.682 113 HG2 GLN 16 HG2 GLN 16 0.834 -14.254 0.638 114 HG3 GLN 16 HG1 GLN 16 0.897 -16.005 0.453 115 HE21 GLN 16 HE21 GLN 16 -1.099 -13.188 0.503 116 HE22 GLN 16 HE22 GLN 16 -2.521 -13.916 -0.141 117 H GLU 17 HN GLU 17 1.592 -12.888 4.896 118 HA GLU 17 HA GLU 17 1.403 -14.881 6.888 119 HB2 GLU 17 HB2 GLU 17 3.311 -13.411 6.741 120 HB3 GLU 17 HB1 GLU 17 2.292 -12.028 7.119 121 HG2 GLU 17 HG2 GLU 17 3.607 -12.913 9.013 122 HG3 GLU 17 HG1 GLU 17 1.882 -12.823 9.312 123 H CYS 18 HN CYS 18 0.408 -11.480 7.388 124 HA CYS 18 HA CYS 18 -1.773 -12.478 9.047 125 HG CYS 18 HG CYS 18 -0.999 -10.412 12.090 126 HB2 CYS 18 HB2 CYS 18 0.170 -10.879 9.826 127 HB3 CYS 18 HB1 CYS 18 -0.858 -9.644 9.117 128 H GLN 19 HN GLN 19 -1.524 -11.604 5.965 129 HA GLN 19 HA GLN 19 -2.906 -9.292 5.458 130 HB2 GLN 19 HB2 GLN 19 -1.979 -10.606 3.673 131 HB3 GLN 19 HB1 GLN 19 -3.074 -11.924 4.026 132 HG2 GLN 19 HG2 GLN 19 -4.962 -10.389 3.412 133 HG3 GLN 19 HG1 GLN 19 -3.743 -9.247 2.846 134 HE21 GLN 19 HE21 GLN 19 -4.386 -9.338 0.709 135 HE22 GLN 19 HE22 GLN 19 -4.146 -10.730 -0.283 136 H ASP 20 HN ASP 20 -4.948 -8.663 5.221 137 HA ASP 20 HA ASP 20 -7.313 -10.006 5.383 138 HB2 ASP 20 HB2 ASP 20 -5.963 -9.953 7.979 139 HB3 ASP 20 HB1 ASP 20 -7.582 -9.270 8.045 140 HA PRO 21 HA PRO 21 -8.765 -5.823 5.436 141 HB2 PRO 21 HB2 PRO 21 -11.263 -6.013 6.228 142 HB3 PRO 21 HB1 PRO 21 -10.740 -6.863 4.783 143 HG2 PRO 21 HG2 PRO 21 -11.173 -7.893 7.556 144 HG3 PRO 21 HG1 PRO 21 -11.645 -8.618 6.007 145 HD2 PRO 21 HD2 PRO 21 -9.391 -9.301 7.424 146 HD3 PRO 21 HD1 PRO 21 -9.596 -9.523 5.684 147 H ASP 22 HN ASP 22 -7.121 -6.029 7.652 148 HA ASP 22 HA ASP 22 -8.085 -4.005 9.339 149 HB2 ASP 22 HB2 ASP 22 -9.581 -5.945 10.005 150 HB3 ASP 22 HB1 ASP 22 -8.154 -6.676 10.722 151 H THR 23 HN THR 23 -5.536 -6.192 8.547 152 HA THR 23 HA THR 23 -4.000 -5.192 10.855 153 HB THR 23 HB THR 23 -4.240 -7.636 10.833 154 HG1 THR 23 HG1 THR 23 -2.354 -7.454 11.764 155 HG21 THR 23 HG23 THR 23 -3.154 -7.294 8.096 156 HG22 THR 23 HG21 THR 23 -4.342 -8.446 8.704 157 HG23 THR 23 HG22 THR 23 -2.621 -8.693 9.019 158 H PHE 24 HN PHE 24 -4.024 -5.412 7.402 159 HA PHE 24 HA PHE 24 -2.599 -3.563 6.381 160 HD1 PHE 24 HD1 PHE 24 -1.031 -1.940 5.960 161 HD2 PHE 24 HD2 PHE 24 0.124 -3.655 9.684 162 HE1 PHE 24 HE1 PHE 24 -0.544 0.301 6.839 163 HE2 PHE 24 HE2 PHE 24 0.609 -1.412 10.567 164 HZ PHE 24 HZ PHE 24 0.275 0.570 9.146 165 HB2 PHE 24 HB2 PHE 24 -0.591 -5.049 8.002 166 HB3 PHE 24 HB1 PHE 24 -0.086 -4.516 6.410 167 H GLU 25 HN GLU 25 -3.792 -4.635 4.696 168 HA GLU 25 HA GLU 25 -2.887 -7.048 3.577 169 HB2 GLU 25 HB2 GLU 25 -5.136 -6.346 3.208 170 HB3 GLU 25 HB1 GLU 25 -4.607 -4.817 2.519 171 HG2 GLU 25 HG2 GLU 25 -3.665 -5.973 0.636 172 HG3 GLU 25 HG1 GLU 25 -4.174 -7.520 1.298 173 HA PRO 26 HA PRO 26 -0.473 -4.434 0.479 174 HB2 PRO 26 HB2 PRO 26 -0.413 -1.743 0.696 175 HB3 PRO 26 HB1 PRO 26 -1.712 -2.634 -0.091 176 HG2 PRO 26 HG2 PRO 26 -1.754 -1.176 2.405 177 HG3 PRO 26 HG1 PRO 26 -3.097 -1.802 1.448 178 HD2 PRO 26 HD2 PRO 26 -1.852 -2.939 3.821 179 HD3 PRO 26 HD1 PRO 26 -3.360 -3.405 3.010 180 H GLN 27 HN GLN 27 -0.036 -2.247 3.281 181 HA GLN 27 HA GLN 27 2.673 -1.761 2.842 182 HB2 GLN 27 HB2 GLN 27 1.612 -1.755 5.631 183 HB3 GLN 27 HB1 GLN 27 2.721 -0.634 4.864 184 HG2 GLN 27 HG2 GLN 27 -0.256 -0.795 4.539 185 HG3 GLN 27 HG1 GLN 27 0.694 0.510 5.244 186 HE21 GLN 27 HE21 GLN 27 -1.200 0.776 3.202 187 HE22 GLN 27 HE22 GLN 27 -0.393 1.335 1.780 188 H LYS 28 HN LYS 28 1.194 -4.426 4.559 189 HA LYS 28 HA LYS 28 3.505 -5.147 6.042 190 HB2 LYS 28 HB2 LYS 28 0.844 -6.235 5.549 191 HB3 LYS 28 HB1 LYS 28 2.086 -7.409 5.854 192 HG2 LYS 28 HG2 LYS 28 1.632 -5.081 7.636 193 HG3 LYS 28 HG1 LYS 28 0.814 -6.624 7.866 194 HD2 LYS 28 HD2 LYS 28 2.931 -7.745 8.158 195 HD3 LYS 28 HD1 LYS 28 3.809 -6.265 7.772 196 HE2 LYS 28 HE2 LYS 28 2.897 -5.194 9.766 197 HE3 LYS 28 HE1 LYS 28 1.983 -6.655 10.143 198 HZ1 LYS 28 HZ3 LYS 28 4.947 -6.483 10.000 199 HZ2 LYS 28 HZ1 LYS 28 4.047 -7.853 10.424 200 HZ3 LYS 28 HZ2 LYS 28 4.039 -6.491 11.427 201 H PHE 29 HN PHE 29 2.117 -6.242 2.982 202 HA PHE 29 HA PHE 29 3.958 -8.301 2.532 203 HD1 PHE 29 HD1 PHE 29 5.184 -7.914 -0.287 204 HD2 PHE 29 HD2 PHE 29 1.287 -6.358 -0.994 205 HE1 PHE 29 HE1 PHE 29 5.848 -7.290 -2.561 206 HE2 PHE 29 HE2 PHE 29 1.961 -5.722 -3.269 207 HZ PHE 29 HZ PHE 29 4.248 -6.187 -4.044 208 HB2 PHE 29 HB2 PHE 29 2.515 -8.635 0.877 209 HB3 PHE 29 HB1 PHE 29 1.805 -7.060 1.121 210 H PHE 30 HN PHE 30 4.013 -4.889 1.580 211 HA PHE 30 HA PHE 30 6.425 -4.997 0.135 212 HD1 PHE 30 HD1 PHE 30 4.551 -4.405 -1.233 213 HD2 PHE 30 HD2 PHE 30 3.965 -1.183 1.473 214 HE1 PHE 30 HE1 PHE 30 2.411 -3.858 -2.291 215 HE2 PHE 30 HE2 PHE 30 1.814 -0.656 0.413 216 HZ PHE 30 HZ PHE 30 1.031 -2.007 -1.488 217 HB2 PHE 30 HB2 PHE 30 5.670 -2.638 1.793 218 HB3 PHE 30 HB1 PHE 30 6.476 -2.654 0.243 219 H GLN 31 HN GLN 31 5.820 -3.839 3.411 220 HA GLN 31 HA GLN 31 8.442 -3.409 4.160 221 HB2 GLN 31 HB2 GLN 31 6.262 -2.718 5.312 222 HB3 GLN 31 HB1 GLN 31 6.309 -4.295 6.087 223 HG2 GLN 31 HG2 GLN 31 7.378 -3.133 7.686 224 HG3 GLN 31 HG1 GLN 31 8.777 -3.470 6.667 225 HE21 GLN 31 HE21 GLN 31 7.979 -1.626 4.577 226 HE22 GLN 31 HE22 GLN 31 8.236 -0.038 5.197 227 H THR 32 HN THR 32 6.486 -6.161 5.299 228 HA THR 32 HA THR 32 8.517 -7.483 6.602 229 HB THR 32 HB THR 32 6.171 -8.706 5.146 230 HG1 THR 32 HG1 THR 32 5.853 -7.131 6.949 231 HG21 THR 32 HG23 THR 32 7.971 -9.879 7.269 232 HG22 THR 32 HG21 THR 32 7.859 -10.404 5.590 233 HG23 THR 32 HG22 THR 32 6.485 -10.618 6.674 234 H SER 33 HN SER 33 7.516 -7.906 3.201 235 HA SER 33 HA SER 33 9.627 -9.795 2.716 236 HG SER 33 HG SER 33 7.673 -8.261 -0.330 237 HB2 SER 33 HB2 SER 33 8.239 -10.403 1.110 238 HB3 SER 33 HB1 SER 33 7.160 -9.117 1.495 239 H GLY 34 HN GLY 34 8.804 -6.776 1.169 240 HA2 GLY 34 HA2 GLY 34 11.567 -6.641 0.208 241 HA3 GLY 34 HA1 GLY 34 10.234 -5.843 -0.563 242 H LEU 35 HN LEU 35 9.239 -4.084 1.176 243 HA LEU 35 HA LEU 35 10.854 -1.916 0.862 244 HG LEU 35 HG LEU 35 9.370 0.170 1.433 245 HB2 LEU 35 HB2 LEU 35 8.437 -2.575 2.277 246 HB3 LEU 35 HB1 LEU 35 9.399 -1.439 3.207 247 HD11 LEU 35 HD11 LEU 35 8.261 -2.079 -0.207 248 HD12 LEU 35 HD12 LEU 35 9.687 -1.089 -0.510 249 HD13 LEU 35 HD13 LEU 35 8.075 -0.393 -0.684 250 HD21 LEU 35 HD23 LEU 35 6.580 -0.926 1.423 251 HD22 LEU 35 HD21 LEU 35 7.110 0.754 1.414 252 HD23 LEU 35 HD22 LEU 35 7.281 -0.217 2.876 253 H SER 36 HN SER 36 10.755 -4.065 3.668 254 HA SER 36 HA SER 36 12.174 -3.000 5.574 255 HG SER 36 HG SER 36 13.807 -6.149 6.287 256 HB2 SER 36 HB2 SER 36 11.632 -5.364 5.579 257 HB3 SER 36 HB1 SER 36 12.868 -5.680 4.363 258 H LYS 37 HN LYS 37 13.669 -3.548 2.411 259 HA LYS 37 HA LYS 37 15.961 -2.036 3.370 260 HB2 LYS 37 HB2 LYS 37 17.247 -3.789 1.781 261 HB3 LYS 37 HB1 LYS 37 17.171 -3.892 3.528 262 HG2 LYS 37 HG2 LYS 37 15.361 -5.461 3.399 263 HG3 LYS 37 HG1 LYS 37 15.292 -5.266 1.649 264 HD2 LYS 37 HD2 LYS 37 17.567 -6.150 1.466 265 HD3 LYS 37 HD1 LYS 37 17.620 -6.352 3.217 266 HE2 LYS 37 HE2 LYS 37 15.668 -7.714 1.364 267 HE3 LYS 37 HE1 LYS 37 17.121 -8.457 2.032 268 HZ1 LYS 37 HZ3 LYS 37 15.134 -9.043 3.292 269 HZ2 LYS 37 HZ1 LYS 37 14.844 -7.409 3.628 270 HZ3 LYS 37 HZ2 LYS 37 16.223 -8.169 4.245 271 H MET 38 HN MET 38 13.851 -2.810 0.746 272 HA MET 38 HA MET 38 15.275 -2.165 -1.497 273 HB2 MET 38 HB2 MET 38 12.549 -0.992 -1.274 274 HB3 MET 38 HB1 MET 38 13.300 -1.837 -2.615 275 HG2 MET 38 HG2 MET 38 12.109 -2.986 -0.140 276 HG3 MET 38 HG1 MET 38 11.588 -3.228 -1.808 277 HE1 MET 38 HE3 MET 38 14.463 -5.334 -3.301 278 HE2 MET 38 HE1 MET 38 14.883 -3.652 -2.974 279 HE3 MET 38 HE2 MET 38 13.280 -4.056 -3.586 280 H SER 39 HN SER 39 15.548 -0.353 -2.754 281 HA SER 39 HA SER 39 16.293 2.015 -1.359 282 HG SER 39 HG SER 39 18.539 1.487 -3.847 283 HB2 SER 39 HB2 SER 39 16.128 1.466 -4.332 284 HB3 SER 39 HB1 SER 39 16.897 2.874 -3.601 285 H ALA 40 HN ALA 40 15.556 4.208 -2.059 286 HA ALA 40 HA ALA 40 12.769 4.479 -1.609 287 HB1 ALA 40 HB3 ALA 40 14.609 6.584 -2.736 288 HB2 ALA 40 HB1 ALA 40 14.470 6.198 -1.020 289 HB3 ALA 40 HB2 ALA 40 13.075 6.835 -1.895 290 H SER 41 HN SER 41 14.743 4.643 -4.538 291 HA SER 41 HA SER 41 12.909 5.621 -6.343 292 HG SER 41 HG SER 41 15.006 4.763 -8.925 293 HB2 SER 41 HB2 SER 41 15.334 5.154 -6.769 294 HB3 SER 41 HB1 SER 41 14.925 3.449 -6.933 295 H GLN 42 HN GLN 42 13.591 2.155 -5.793 296 HA GLN 42 HA GLN 42 11.625 1.134 -7.449 297 HB2 GLN 42 HB2 GLN 42 11.857 -0.926 -6.316 298 HB3 GLN 42 HB1 GLN 42 13.432 -0.149 -6.219 299 HG2 GLN 42 HG2 GLN 42 13.355 -0.565 -4.046 300 HG3 GLN 42 HG1 GLN 42 12.146 0.715 -3.946 301 HE21 GLN 42 HE21 GLN 42 11.081 -0.234 -2.238 302 HE22 GLN 42 HE22 GLN 42 10.130 -1.663 -2.399 303 H VAL 43 HN VAL 43 11.350 2.584 -4.361 304 HA VAL 43 HA VAL 43 8.870 1.597 -3.522 305 HB VAL 43 HB VAL 43 9.705 4.455 -3.109 306 HG11 VAL 43 HG11 VAL 43 8.343 3.009 -0.985 307 HG12 VAL 43 HG12 VAL 43 7.404 3.205 -2.463 308 HG13 VAL 43 HG13 VAL 43 8.050 4.616 -1.644 309 HG21 VAL 43 HG23 VAL 43 10.702 3.607 -0.961 310 HG22 VAL 43 HG21 VAL 43 11.584 3.169 -2.423 311 HG23 VAL 43 HG22 VAL 43 10.555 1.981 -1.629 312 H LYS 44 HN LYS 44 9.675 4.239 -5.712 313 HA LYS 44 HA LYS 44 7.162 5.264 -6.186 314 HB2 LYS 44 HB2 LYS 44 9.252 4.854 -8.268 315 HB3 LYS 44 HB1 LYS 44 7.975 6.043 -8.311 316 HG2 LYS 44 HG2 LYS 44 8.966 7.165 -6.384 317 HG3 LYS 44 HG1 LYS 44 10.258 5.967 -6.351 318 HD2 LYS 44 HD2 LYS 44 9.679 7.990 -8.507 319 HD3 LYS 44 HD1 LYS 44 11.091 7.912 -7.451 320 HE2 LYS 44 HE2 LYS 44 11.996 6.934 -9.290 321 HE3 LYS 44 HE1 LYS 44 11.287 5.498 -8.552 322 HZ1 LYS 44 HZ3 LYS 44 10.034 7.145 -10.684 323 HZ2 LYS 44 HZ1 LYS 44 9.354 5.765 -9.981 324 HZ3 LYS 44 HZ2 LYS 44 10.763 5.635 -10.904 325 H ASP 45 HN ASP 45 8.733 2.477 -7.660 326 HA ASP 45 HA ASP 45 6.571 1.824 -9.395 327 HB2 ASP 45 HB2 ASP 45 9.210 0.816 -8.781 328 HB3 ASP 45 HB1 ASP 45 8.055 -0.505 -8.872 329 H ILE 46 HN ILE 46 7.720 0.631 -6.277 330 HA ILE 46 HA ILE 46 5.874 -1.387 -5.838 331 HB ILE 46 HB ILE 46 7.601 0.316 -4.137 332 HG12 ILE 46 HG12 ILE 46 8.631 -1.758 -3.600 333 HG13 ILE 46 HG11 ILE 46 7.295 -2.666 -4.276 334 HG21 ILE 46 HG21 ILE 46 5.370 -1.365 -3.052 335 HG22 ILE 46 HG22 ILE 46 5.797 0.302 -2.657 336 HG23 ILE 46 HG23 ILE 46 6.829 -1.023 -2.121 337 HD11 ILE 46 HD13 ILE 46 7.933 -1.622 -6.503 338 HD12 ILE 46 HD11 ILE 46 9.019 -2.836 -5.837 339 HD13 ILE 46 HD12 ILE 46 9.425 -1.129 -5.708 340 H PHE 47 HN PHE 47 5.742 1.994 -4.740 341 HA PHE 47 HA PHE 47 3.354 2.122 -3.498 342 HD1 PHE 47 HD2 PHE 47 2.803 3.677 -2.164 343 HD2 PHE 47 HD1 PHE 47 3.035 6.038 -5.685 344 HE1 PHE 47 HE2 PHE 47 1.059 5.155 -1.283 345 HE2 PHE 47 HE1 PHE 47 1.276 7.523 -4.802 346 HZ PHE 47 HZ PHE 47 0.295 7.062 -2.607 347 HB2 PHE 47 HB2 PHE 47 4.962 3.972 -3.875 348 HB3 PHE 47 HB1 PHE 47 4.329 4.154 -5.503 349 H ARG 48 HN ARG 48 3.865 1.647 -6.876 350 HA ARG 48 HA ARG 48 1.421 2.533 -7.905 351 HE ARG 48 HE ARG 48 1.641 2.712 -11.106 352 HB2 ARG 48 HB2 ARG 48 3.148 0.248 -8.867 353 HB3 ARG 48 HB1 ARG 48 1.860 1.007 -9.793 354 HG2 ARG 48 HG2 ARG 48 4.423 2.282 -8.869 355 HG3 ARG 48 HG1 ARG 48 3.959 1.890 -10.525 356 HD2 ARG 48 HD2 ARG 48 2.616 3.909 -8.720 357 HD3 ARG 48 HD1 ARG 48 3.669 4.266 -10.091 358 HH11 ARG 48 HH11 ARG 48 1.885 5.757 -9.435 359 HH12 ARG 48 HH12 ARG 48 0.479 6.431 -10.189 360 HH21 ARG 48 HH21 ARG 48 -0.213 3.589 -12.104 361 HH22 ARG 48 HH22 ARG 48 -0.714 5.198 -11.705 362 H PHE 49 HN PHE 49 2.168 -0.210 -5.944 363 HA PHE 49 HA PHE 49 0.201 -2.018 -6.609 364 HD1 PHE 49 HD2 PHE 49 0.869 -4.456 -5.748 365 HD2 PHE 49 HD1 PHE 49 -0.646 -2.230 -2.449 366 HE1 PHE 49 HE2 PHE 49 -0.397 -6.428 -4.999 367 HE2 PHE 49 HE1 PHE 49 -1.910 -4.197 -1.697 368 HZ PHE 49 HZ PHE 49 -1.788 -6.301 -2.971 369 HB2 PHE 49 HB2 PHE 49 1.969 -2.338 -4.876 370 HB3 PHE 49 HB1 PHE 49 1.045 -1.312 -3.789 371 H ILE 50 HN ILE 50 -0.132 0.425 -4.002 372 HA ILE 50 HA ILE 50 -2.913 0.085 -3.815 373 HB ILE 50 HB ILE 50 -2.855 2.318 -2.563 374 HG12 ILE 50 HG12 ILE 50 0.135 1.897 -2.853 375 HG13 ILE 50 HG11 ILE 50 -0.778 3.252 -3.511 376 HG21 ILE 50 HG21 ILE 50 -1.508 -0.209 -1.835 377 HG22 ILE 50 HG22 ILE 50 -2.990 0.524 -1.218 378 HG23 ILE 50 HG23 ILE 50 -1.421 1.153 -0.718 379 HD11 ILE 50 HD13 ILE 50 -1.006 2.764 -0.605 380 HD12 ILE 50 HD11 ILE 50 -0.958 4.279 -1.498 381 HD13 ILE 50 HD12 ILE 50 0.535 3.388 -1.189 382 H ASP 51 HN ASP 51 -3.340 3.247 -3.967 383 HA ASP 51 HA ASP 51 -4.540 3.063 -6.541 384 HB2 ASP 51 HB2 ASP 51 -4.436 5.135 -4.398 385 HB3 ASP 51 HB1 ASP 51 -4.941 5.614 -6.019 386 H ASN 52 HN ASN 52 -4.289 5.229 -7.935 387 HA ASN 52 HA ASN 52 -1.571 5.070 -8.925 388 HB2 ASN 52 HB2 ASN 52 -2.457 6.385 -10.844 389 HB3 ASN 52 HB1 ASN 52 -3.327 4.883 -10.550 390 HD21 ASN 52 HD21 ASN 52 -4.189 7.299 -11.927 391 HD22 ASN 52 HD22 ASN 52 -5.612 7.836 -11.107 392 H ASP 53 HN ASP 53 -3.729 7.661 -7.778 393 HA ASP 53 HA ASP 53 -1.872 9.149 -6.442 394 HB2 ASP 53 HB2 ASP 53 -1.583 9.484 -9.343 395 HB3 ASP 53 HB1 ASP 53 -1.775 10.994 -8.457 396 H GLN 54 HN GLN 54 -4.630 9.208 -8.566 397 HA GLN 54 HA GLN 54 -6.450 10.501 -8.679 398 HB2 GLN 54 HB2 GLN 54 -7.482 10.909 -6.373 399 HB3 GLN 54 HB1 GLN 54 -7.467 9.310 -7.075 400 HG2 GLN 54 HG2 GLN 54 -5.157 9.937 -5.413 401 HG3 GLN 54 HG1 GLN 54 -6.692 9.921 -4.559 402 HE21 GLN 54 HE21 GLN 54 -6.172 8.118 -3.430 403 HE22 GLN 54 HE22 GLN 54 -6.070 6.571 -4.181 404 H SER 55 HN SER 55 -4.422 12.070 -8.978 405 HA SER 55 HA SER 55 -4.369 14.374 -9.423 406 HG SER 55 HG SER 55 -7.009 14.395 -9.257 407 HB2 SER 55 HB2 SER 55 -5.704 15.003 -6.804 408 HB3 SER 55 HB1 SER 55 -5.637 15.967 -8.282 409 H GLY 56 HN GLY 56 -2.364 12.842 -8.305 410 HA2 GLY 56 HA2 GLY 56 -0.218 13.622 -7.670 411 HA3 GLY 56 HA1 GLY 56 -0.981 14.976 -6.857 412 H TYR 57 HN TYR 57 -2.836 12.642 -5.695 413 HA TYR 57 HA TYR 57 -1.018 11.344 -3.946 414 HD1 TYR 57 HD2 TYR 57 -4.080 11.935 -1.589 415 HD2 TYR 57 HD1 TYR 57 -2.497 15.471 -3.274 416 HE1 TYR 57 HE2 TYR 57 -6.205 13.097 -1.133 417 HE2 TYR 57 HE1 TYR 57 -4.608 16.654 -2.851 418 HH TYR 57 HH TYR 57 -6.976 16.111 -2.480 419 HB2 TYR 57 HB2 TYR 57 -1.516 12.421 -1.895 420 HB3 TYR 57 HB1 TYR 57 -1.096 13.694 -3.024 421 H LEU 58 HN LEU 58 -1.954 9.883 -2.522 422 HA LEU 58 HA LEU 58 -4.654 9.110 -3.328 423 HG LEU 58 HG LEU 58 -1.538 7.866 -3.675 424 HB2 LEU 58 HB2 LEU 58 -2.799 7.470 -1.617 425 HB3 LEU 58 HB1 LEU 58 -4.170 6.918 -2.557 426 HD11 LEU 58 HD11 LEU 58 -2.784 5.156 -3.388 427 HD12 LEU 58 HD12 LEU 58 -1.233 5.714 -2.763 428 HD13 LEU 58 HD13 LEU 58 -1.457 5.492 -4.498 429 HD21 LEU 58 HD23 LEU 58 -2.492 7.021 -5.813 430 HD22 LEU 58 HD21 LEU 58 -3.193 8.519 -5.202 431 HD23 LEU 58 HD22 LEU 58 -4.048 7.005 -5.006 432 H ASP 59 HN ASP 59 -6.229 8.508 -1.601 433 HA ASP 59 HA ASP 59 -5.495 9.373 1.068 434 HB2 ASP 59 HB2 ASP 59 -6.121 11.363 -0.328 435 HB3 ASP 59 HB1 ASP 59 -7.768 10.732 -0.355 436 H GLY 60 HN GLY 60 -7.157 9.106 2.613 437 HA2 GLY 60 HA2 GLY 60 -7.968 6.528 2.889 438 HA3 GLY 60 HA1 GLY 60 -8.754 7.871 3.706 439 H ASP 61 HN ASP 61 -9.646 8.993 1.094 440 HA ASP 61 HA ASP 61 -12.175 7.652 1.006 441 HB2 ASP 61 HB2 ASP 61 -11.066 9.729 -0.895 442 HB3 ASP 61 HB1 ASP 61 -12.763 9.306 -0.670 443 H GLU 62 HN GLU 62 -9.518 8.135 -1.228 444 HA GLU 62 HA GLU 62 -10.584 6.411 -3.254 445 HB2 GLU 62 HB2 GLU 62 -7.949 7.792 -2.935 446 HB3 GLU 62 HB1 GLU 62 -8.414 6.892 -4.374 447 HG2 GLU 62 HG2 GLU 62 -9.809 9.317 -3.275 448 HG3 GLU 62 HG1 GLU 62 -8.727 9.291 -4.666 449 H LEU 63 HN LEU 63 -8.364 6.061 -0.614 450 HA LEU 63 HA LEU 63 -6.624 4.126 -1.357 451 HG LEU 63 HG LEU 63 -6.596 6.264 0.882 452 HB2 LEU 63 HB2 LEU 63 -8.117 4.512 1.221 453 HB3 LEU 63 HB1 LEU 63 -6.865 3.306 1.055 454 HD11 LEU 63 HD11 LEU 63 -4.644 5.033 2.496 455 HD12 LEU 63 HD12 LEU 63 -6.234 4.428 2.960 456 HD13 LEU 63 HD13 LEU 63 -5.916 6.160 2.957 457 HD21 LEU 63 HD23 LEU 63 -4.743 4.178 -0.131 458 HD22 LEU 63 HD21 LEU 63 -4.119 5.708 0.491 459 HD23 LEU 63 HD22 LEU 63 -5.237 5.705 -0.879 460 H LYS 64 HN LYS 64 -9.992 3.475 -0.278 461 HA LYS 64 HA LYS 64 -9.848 0.735 -0.355 462 HB2 LYS 64 HB2 LYS 64 -12.289 2.308 -1.146 463 HB3 LYS 64 HB1 LYS 64 -12.214 0.753 -0.345 464 HG2 LYS 64 HG2 LYS 64 -12.109 1.671 1.669 465 HG3 LYS 64 HG1 LYS 64 -10.867 2.814 1.164 466 HD2 LYS 64 HD2 LYS 64 -12.803 4.051 1.857 467 HD3 LYS 64 HD1 LYS 64 -12.645 4.194 0.106 468 HE2 LYS 64 HE2 LYS 64 -14.953 3.812 0.644 469 HE3 LYS 64 HE1 LYS 64 -14.308 2.373 -0.142 470 HZ1 LYS 64 HZ3 LYS 64 -14.715 2.737 2.778 471 HZ2 LYS 64 HZ1 LYS 64 -14.036 1.366 2.055 472 HZ3 LYS 64 HZ2 LYS 64 -15.650 1.769 1.754 473 H TYR 65 HN TYR 65 -9.947 2.933 -3.021 474 HA TYR 65 HA TYR 65 -11.032 1.056 -4.897 475 HD1 TYR 65 HD1 TYR 65 -12.515 2.287 -4.081 476 HD2 TYR 65 HD2 TYR 65 -10.788 5.564 -6.177 477 HE1 TYR 65 HE1 TYR 65 -14.416 3.703 -3.427 478 HE2 TYR 65 HE2 TYR 65 -12.687 6.983 -5.530 479 HH TYR 65 HH TYR 65 -15.029 6.728 -4.834 480 HB2 TYR 65 HB2 TYR 65 -9.449 3.548 -5.513 481 HB3 TYR 65 HB1 TYR 65 -10.491 2.665 -6.614 482 H PHE 66 HN PHE 66 -7.908 1.469 -3.536 483 HA PHE 66 HA PHE 66 -6.174 0.804 -5.556 484 HD1 PHE 66 HD2 PHE 66 -3.996 -1.523 -4.690 485 HD2 PHE 66 HD1 PHE 66 -6.351 -0.902 -1.218 486 HE1 PHE 66 HE2 PHE 66 -3.315 -3.731 -3.844 487 HE2 PHE 66 HE1 PHE 66 -5.682 -3.107 -0.349 488 HZ PHE 66 HZ PHE 66 -4.158 -4.527 -1.669 489 HB2 PHE 66 HB2 PHE 66 -4.755 0.815 -3.793 490 HB3 PHE 66 HB1 PHE 66 -6.124 0.809 -2.705 491 H LEU 67 HN LEU 67 -8.028 -1.437 -3.559 492 HA LEU 67 HA LEU 67 -7.263 -3.811 -4.900 493 HG LEU 67 HG LEU 67 -7.483 -3.850 -2.000 494 HB2 LEU 67 HB2 LEU 67 -9.483 -3.011 -3.074 495 HB3 LEU 67 HB1 LEU 67 -9.677 -4.501 -3.979 496 HD11 LEU 67 HD11 LEU 67 -9.803 -5.768 -1.951 497 HD12 LEU 67 HD12 LEU 67 -9.513 -4.397 -0.880 498 HD13 LEU 67 HD13 LEU 67 -8.464 -5.812 -0.804 499 HD21 LEU 67 HD23 LEU 67 -7.863 -6.258 -3.768 500 HD22 LEU 67 HD21 LEU 67 -6.776 -6.206 -2.381 501 HD23 LEU 67 HD22 LEU 67 -6.500 -5.139 -3.755 502 H GLN 68 HN GLN 68 -9.740 -1.425 -5.367 503 HA GLN 68 HA GLN 68 -11.237 -2.809 -7.308 504 HB2 GLN 68 HB2 GLN 68 -11.021 0.122 -6.639 505 HB3 GLN 68 HB1 GLN 68 -12.130 -0.505 -7.838 506 HG2 GLN 68 HG2 GLN 68 -12.947 -2.059 -5.968 507 HG3 GLN 68 HG1 GLN 68 -12.123 -0.935 -4.889 508 HE21 GLN 68 HE21 GLN 68 -14.966 -1.547 -5.139 509 HE22 GLN 68 HE22 GLN 68 -15.750 -0.044 -5.474 510 H LYS 69 HN LYS 69 -8.512 -0.509 -7.592 511 HA LYS 69 HA LYS 69 -8.532 -0.283 -10.350 512 HB2 LYS 69 HB2 LYS 69 -6.068 -0.375 -8.636 513 HB3 LYS 69 HB1 LYS 69 -6.298 0.527 -10.128 514 HG2 LYS 69 HG2 LYS 69 -7.302 1.095 -7.385 515 HG3 LYS 69 HG1 LYS 69 -6.407 2.149 -8.472 516 HD2 LYS 69 HD2 LYS 69 -9.281 1.292 -8.716 517 HD3 LYS 69 HD1 LYS 69 -8.695 2.898 -8.289 518 HE2 LYS 69 HE2 LYS 69 -8.137 1.529 -10.917 519 HE3 LYS 69 HE1 LYS 69 -9.436 2.692 -10.657 520 HZ1 LYS 69 HZ3 LYS 69 -7.762 4.338 -10.031 521 HZ2 LYS 69 HZ1 LYS 69 -7.510 3.768 -11.604 522 HZ3 LYS 69 HZ2 LYS 69 -6.530 3.220 -10.338 523 H PHE 70 HN PHE 70 -6.754 -2.436 -8.240 524 HA PHE 70 HA PHE 70 -5.509 -3.953 -10.281 525 HD1 PHE 70 HD2 PHE 70 -4.264 -6.561 -9.517 526 HD2 PHE 70 HD1 PHE 70 -6.337 -5.492 -5.959 527 HE1 PHE 70 HE2 PHE 70 -4.280 -8.924 -8.818 528 HE2 PHE 70 HE1 PHE 70 -6.359 -7.841 -5.253 529 HZ PHE 70 HZ PHE 70 -5.329 -9.567 -6.683 530 HB2 PHE 70 HB2 PHE 70 -4.281 -4.136 -8.396 531 HB3 PHE 70 HB1 PHE 70 -5.656 -3.840 -7.359 532 H GLN 71 HN GLN 71 -8.174 -4.697 -8.052 533 HA GLN 71 HA GLN 71 -8.797 -7.142 -9.483 534 HB2 GLN 71 HB2 GLN 71 -8.992 -7.149 -7.055 535 HB3 GLN 71 HB1 GLN 71 -10.159 -5.839 -7.130 536 HG2 GLN 71 HG2 GLN 71 -11.703 -7.302 -8.355 537 HG3 GLN 71 HG1 GLN 71 -10.536 -8.616 -8.225 538 HE21 GLN 71 HE21 GLN 71 -11.307 -6.254 -5.716 539 HE22 GLN 71 HE22 GLN 71 -11.987 -7.388 -4.614 540 H SER 72 HN SER 72 -10.938 -4.581 -8.356 541 HA SER 72 HA SER 72 -12.191 -3.121 -9.788 542 HG SER 72 HG SER 72 -11.547 -3.673 -12.965 543 HB2 SER 72 HB2 SER 72 -12.526 -5.535 -11.550 544 HB3 SER 72 HB1 SER 72 -13.300 -3.978 -11.809 545 H ASP 73 HN ASP 73 -12.585 -5.104 -7.566 546 HA ASP 73 HA ASP 73 -15.419 -4.819 -7.357 547 HB2 ASP 73 HB2 ASP 73 -15.152 -6.902 -8.756 548 HB3 ASP 73 HB1 ASP 73 -14.342 -7.643 -7.379 549 H ALA 74 HN ALA 74 -13.019 -4.016 -5.907 550 HA ALA 74 HA ALA 74 -12.521 -5.577 -3.641 551 HB1 ALA 74 HB3 ALA 74 -11.268 -3.809 -2.905 552 HB2 ALA 74 HB1 ALA 74 -12.429 -2.609 -3.470 553 HB3 ALA 74 HB2 ALA 74 -11.368 -3.413 -4.624 554 H ARG 75 HN ARG 75 -13.363 -5.531 -1.563 555 HA ARG 75 HA ARG 75 -16.124 -4.898 -1.315 556 HE ARG 75 HE ARG 75 -11.250 -5.774 1.615 557 HB2 ARG 75 HB2 ARG 75 -15.848 -5.589 1.034 558 HB3 ARG 75 HB1 ARG 75 -15.152 -6.759 -0.076 559 HG2 ARG 75 HG2 ARG 75 -13.230 -4.762 0.794 560 HG3 ARG 75 HG1 ARG 75 -13.924 -5.678 2.132 561 HD2 ARG 75 HD2 ARG 75 -13.223 -7.743 1.195 562 HD3 ARG 75 HD1 ARG 75 -12.802 -6.981 -0.339 563 HH11 ARG 75 HH11 ARG 75 -11.671 -8.953 0.256 564 HH12 ARG 75 HH12 ARG 75 -10.031 -9.432 0.539 565 HH21 ARG 75 HH21 ARG 75 -9.091 -6.392 1.992 566 HH22 ARG 75 HH22 ARG 75 -8.562 -7.974 1.525 567 H GLU 76 HN GLU 76 -13.372 -3.012 -1.151 568 HA GLU 76 HA GLU 76 -13.306 -0.709 -0.984 569 HB2 GLU 76 HB2 GLU 76 -15.627 -0.872 0.941 570 HB3 GLU 76 HB1 GLU 76 -14.892 0.577 0.283 571 HG2 GLU 76 HG2 GLU 76 -15.611 0.001 -1.937 572 HG3 GLU 76 HG1 GLU 76 -16.265 -1.523 -1.354 573 H LEU 77 HN LEU 77 -11.832 -2.564 0.179 574 HA LEU 77 HA LEU 77 -10.577 -3.208 2.010 575 HG LEU 77 HG LEU 77 -9.144 -1.895 -0.062 576 HB2 LEU 77 HB2 LEU 77 -10.241 -0.332 1.408 577 HB3 LEU 77 HB1 LEU 77 -9.387 -0.979 2.790 578 HD11 LEU 77 HD11 LEU 77 -7.561 -0.173 1.747 579 HD12 LEU 77 HD12 LEU 77 -7.876 -0.036 0.018 580 HD13 LEU 77 HD13 LEU 77 -6.699 -1.210 0.613 581 HD21 LEU 77 HD23 LEU 77 -7.114 -3.077 1.321 582 HD22 LEU 77 HD21 LEU 77 -8.606 -3.871 0.818 583 HD23 LEU 77 HD22 LEU 77 -8.468 -3.205 2.437 584 H THR 78 HN THR 78 -13.300 -2.696 2.853 585 HA THR 78 HA THR 78 -14.606 -2.151 4.663 586 HB THR 78 HB THR 78 -14.001 -3.306 6.632 587 HG1 THR 78 HG1 THR 78 -12.026 -3.193 7.380 588 HG21 THR 78 HG23 THR 78 -13.397 -5.450 5.851 589 HG22 THR 78 HG21 THR 78 -12.452 -4.782 4.521 590 HG23 THR 78 HG22 THR 78 -14.211 -4.672 4.494 591 H GLU 79 HN GLU 79 -14.445 -1.234 7.063 592 HA GLU 79 HA GLU 79 -13.521 1.433 6.843 593 HB2 GLU 79 HB2 GLU 79 -14.323 -0.127 9.310 594 HB3 GLU 79 HB1 GLU 79 -14.145 1.619 9.222 595 HG2 GLU 79 HG2 GLU 79 -15.963 1.720 7.590 596 HG3 GLU 79 HG1 GLU 79 -16.147 -0.030 7.695 597 H SER 80 HN SER 80 -12.387 -1.409 8.568 598 HA SER 80 HA SER 80 -10.183 -0.205 9.853 599 HG SER 80 HG SER 80 -8.541 -2.134 10.246 600 HB2 SER 80 HB2 SER 80 -11.322 -2.279 10.596 601 HB3 SER 80 HB1 SER 80 -10.573 -3.130 9.248 602 H GLU 81 HN GLU 81 -10.201 -2.335 6.910 603 HA GLU 81 HA GLU 81 -7.473 -2.507 6.678 604 HB2 GLU 81 HB2 GLU 81 -9.597 -3.381 5.165 605 HB3 GLU 81 HB1 GLU 81 -8.810 -2.230 4.103 606 HG2 GLU 81 HG2 GLU 81 -7.394 -4.495 5.450 607 HG3 GLU 81 HG1 GLU 81 -7.983 -4.520 3.788 608 H THR 82 HN THR 82 -9.530 0.050 5.188 609 HA THR 82 HA THR 82 -7.557 1.348 3.807 610 HB THR 82 HB THR 82 -8.811 3.445 4.162 611 HG1 THR 82 HG1 THR 82 -9.867 3.521 6.005 612 HG21 THR 82 HG23 THR 82 -10.387 0.973 3.482 613 HG22 THR 82 HG21 THR 82 -9.498 2.022 2.372 614 HG23 THR 82 HG22 THR 82 -10.955 2.614 3.178 615 H LYS 83 HN LYS 83 -7.931 1.096 7.243 616 HA LYS 83 HA LYS 83 -6.461 3.322 8.084 617 HB2 LYS 83 HB2 LYS 83 -7.672 1.793 9.627 618 HB3 LYS 83 HB1 LYS 83 -6.467 0.551 9.310 619 HG2 LYS 83 HG2 LYS 83 -4.736 1.974 10.274 620 HG3 LYS 83 HG1 LYS 83 -5.939 3.229 10.581 621 HD2 LYS 83 HD2 LYS 83 -7.145 1.713 12.072 622 HD3 LYS 83 HD1 LYS 83 -5.958 0.446 11.752 623 HE2 LYS 83 HE2 LYS 83 -4.200 1.867 12.705 624 HE3 LYS 83 HE1 LYS 83 -5.396 3.118 13.039 625 HZ1 LYS 83 HZ3 LYS 83 -6.537 1.562 14.512 626 HZ2 LYS 83 HZ1 LYS 83 -4.940 1.818 15.009 627 HZ3 LYS 83 HZ2 LYS 83 -5.357 0.387 14.208 628 H SER 84 HN SER 84 -5.511 0.170 6.868 629 HA SER 84 HA SER 84 -2.777 0.219 7.302 630 HG SER 84 HG SER 84 -3.397 -2.039 7.483 631 HB2 SER 84 HB2 SER 84 -4.447 -0.967 5.078 632 HB3 SER 84 HB1 SER 84 -2.760 -1.346 5.343 633 H LEU 85 HN LEU 85 -4.570 1.088 4.366 634 HA LEU 85 HA LEU 85 -2.467 2.192 2.952 635 HG LEU 85 HG LEU 85 -5.057 0.472 2.253 636 HB2 LEU 85 HB2 LEU 85 -5.429 2.713 2.896 637 HB3 LEU 85 HB1 LEU 85 -4.328 3.324 1.686 638 HD11 LEU 85 HD11 LEU 85 -5.294 2.284 -0.130 639 HD12 LEU 85 HD12 LEU 85 -6.576 1.451 0.748 640 HD13 LEU 85 HD13 LEU 85 -5.449 0.532 -0.247 641 HD21 LEU 85 HD23 LEU 85 -2.686 0.464 2.024 642 HD22 LEU 85 HD21 LEU 85 -2.767 1.518 0.616 643 HD23 LEU 85 HD22 LEU 85 -3.388 -0.130 0.521 644 H MET 86 HN MET 86 -4.631 3.600 5.288 645 HA MET 86 HA MET 86 -3.819 6.317 5.000 646 HB2 MET 86 HB2 MET 86 -4.943 4.915 7.442 647 HB3 MET 86 HB1 MET 86 -4.853 6.656 7.213 648 HG2 MET 86 HG2 MET 86 -6.243 5.305 5.049 649 HG3 MET 86 HG1 MET 86 -6.996 5.043 6.621 650 HE1 MET 86 HE3 MET 86 -4.988 8.431 5.909 651 HE2 MET 86 HE1 MET 86 -6.161 9.211 4.848 652 HE3 MET 86 HE2 MET 86 -5.386 7.705 4.352 653 H ASP 87 HN ASP 87 -2.885 3.684 7.116 654 HA ASP 87 HA ASP 87 -0.884 5.020 8.609 655 HB2 ASP 87 HB2 ASP 87 -1.414 2.105 8.083 656 HB3 ASP 87 HB1 ASP 87 -0.233 2.694 9.252 657 H ALA 88 HN ALA 88 -0.813 4.298 5.392 658 HA ALA 88 HA ALA 88 1.705 3.010 5.128 659 HB1 ALA 88 HB3 ALA 88 1.336 3.097 2.847 660 HB2 ALA 88 HB1 ALA 88 0.352 4.558 2.963 661 HB3 ALA 88 HB2 ALA 88 -0.286 3.017 3.538 662 H ALA 89 HN ALA 89 0.664 6.405 5.179 663 HA ALA 89 HA ALA 89 3.445 7.188 5.418 664 HB1 ALA 89 HB3 ALA 89 3.137 7.104 2.997 665 HB2 ALA 89 HB1 ALA 89 3.421 8.750 3.557 666 HB3 ALA 89 HB2 ALA 89 1.790 8.234 3.117 667 H ASP 90 HN ASP 90 0.652 9.110 4.369 668 HA ASP 90 HA ASP 90 1.151 10.902 6.629 669 HB2 ASP 90 HB2 ASP 90 0.647 11.463 3.988 670 HB3 ASP 90 HB1 ASP 90 -0.933 11.695 4.727 671 H ASN 91 HN ASN 91 0.314 9.276 8.044 672 HA ASN 91 HA ASN 91 -2.551 8.739 7.893 673 HB2 ASN 91 HB2 ASN 91 -1.687 7.402 10.140 674 HB3 ASN 91 HB1 ASN 91 -1.863 6.704 8.541 675 HD21 ASN 91 HD21 ASN 91 -0.010 6.460 7.229 676 HD22 ASN 91 HD22 ASN 91 1.571 6.422 7.928 677 H ASP 92 HN ASP 92 -0.283 9.661 10.481 678 HA ASP 92 HA ASP 92 -2.459 10.587 12.119 679 HB2 ASP 92 HB2 ASP 92 -0.491 9.449 13.079 680 HB3 ASP 92 HB1 ASP 92 0.518 10.802 12.579 681 H GLY 93 HN GLY 93 -1.446 12.082 9.480 682 HA2 GLY 93 HA2 GLY 93 -1.589 14.704 10.811 683 HA3 GLY 93 HA1 GLY 93 -0.431 14.399 9.530 684 H ASP 94 HN ASP 94 -1.138 14.266 7.394 685 HA ASP 94 HA ASP 94 -3.464 15.870 6.855 686 HB2 ASP 94 HB2 ASP 94 -1.347 16.118 5.582 687 HB3 ASP 94 HB1 ASP 94 -1.605 14.517 4.896 688 H GLY 95 HN GLY 95 -2.463 12.572 5.898 689 HA2 GLY 95 HA2 GLY 95 -4.095 10.770 6.026 690 HA3 GLY 95 HA1 GLY 95 -5.331 11.942 5.589 691 H LYS 96 HN LYS 96 -2.473 12.383 3.820 692 HA LYS 96 HA LYS 96 -3.692 11.056 1.506 693 HB2 LYS 96 HB2 LYS 96 -3.287 12.984 0.384 694 HB3 LYS 96 HB1 LYS 96 -2.578 13.667 1.844 695 HG2 LYS 96 HG2 LYS 96 -1.038 12.004 -0.129 696 HG3 LYS 96 HG1 LYS 96 -1.168 13.754 -0.237 697 HD2 LYS 96 HD2 LYS 96 0.290 12.071 1.764 698 HD3 LYS 96 HD1 LYS 96 0.855 13.454 0.836 699 HE2 LYS 96 HE2 LYS 96 -1.103 13.563 3.126 700 HE3 LYS 96 HE1 LYS 96 0.596 14.025 3.192 701 HZ1 LYS 96 HZ3 LYS 96 0.154 15.762 1.578 702 HZ2 LYS 96 HZ1 LYS 96 -0.845 15.948 2.931 703 HZ3 LYS 96 HZ2 LYS 96 -1.473 15.312 1.495 704 H ILE 97 HN ILE 97 -2.329 9.872 0.078 705 HA ILE 97 HA ILE 97 0.280 9.084 1.142 706 HB ILE 97 HB ILE 97 -1.532 7.082 -0.158 707 HG12 ILE 97 HG12 ILE 97 -2.544 7.774 2.000 708 HG13 ILE 97 HG11 ILE 97 -1.962 6.113 1.999 709 HG21 ILE 97 HG21 ILE 97 0.109 5.507 0.747 710 HG22 ILE 97 HG22 ILE 97 1.006 6.859 1.449 711 HG23 ILE 97 HG23 ILE 97 0.858 6.716 -0.297 712 HD11 ILE 97 HD13 ILE 97 0.179 7.176 3.038 713 HD12 ILE 97 HD11 ILE 97 -1.233 6.827 4.034 714 HD13 ILE 97 HD12 ILE 97 -0.937 8.468 3.475 715 H GLY 98 HN GLY 98 1.553 9.988 -0.433 716 HA2 GLY 98 HA2 GLY 98 1.002 9.214 -3.199 717 HA3 GLY 98 HA1 GLY 98 1.908 10.641 -2.706 718 H ALA 99 HN ALA 99 3.085 9.029 -4.518 719 HA ALA 99 HA ALA 99 4.564 6.838 -3.593 720 HB1 ALA 99 HB3 ALA 99 5.910 7.058 -5.499 721 HB2 ALA 99 HB1 ALA 99 5.723 8.812 -5.541 722 HB3 ALA 99 HB2 ALA 99 4.371 7.771 -5.981 723 H ASP 100 HN ASP 100 5.427 10.273 -3.612 724 HA ASP 100 HA ASP 100 7.906 10.034 -2.334 725 HB2 ASP 100 HB2 ASP 100 5.953 12.348 -2.260 726 HB3 ASP 100 HB1 ASP 100 7.644 12.435 -1.778 727 H GLU 101 HN GLU 101 4.704 10.794 -0.909 728 HA GLU 101 HA GLU 101 5.558 10.894 1.762 729 HB2 GLU 101 HB2 GLU 101 3.036 10.798 0.324 730 HB3 GLU 101 HB1 GLU 101 2.954 9.858 1.801 731 HG2 GLU 101 HG2 GLU 101 2.307 12.377 1.738 732 HG3 GLU 101 HG1 GLU 101 3.133 11.700 3.129 733 H PHE 102 HN PHE 102 4.136 8.237 -0.104 734 HA PHE 102 HA PHE 102 4.288 6.200 1.760 735 HD1 PHE 102 HD1 PHE 102 6.353 4.179 -0.488 736 HD2 PHE 102 HD2 PHE 102 2.184 3.994 0.303 737 HE1 PHE 102 HE1 PHE 102 6.536 1.769 -0.133 738 HE2 PHE 102 HE2 PHE 102 2.354 1.563 0.652 739 HZ PHE 102 HZ PHE 102 4.541 0.446 0.434 740 HB2 PHE 102 HB2 PHE 102 3.132 5.992 -0.387 741 HB3 PHE 102 HB1 PHE 102 4.684 5.981 -1.232 742 H GLN 103 HN GLN 103 6.728 7.156 -0.649 743 HA GLN 103 HA GLN 103 8.621 5.187 0.114 744 HB2 GLN 103 HB2 GLN 103 9.986 6.032 -1.525 745 HB3 GLN 103 HB1 GLN 103 8.427 6.619 -2.065 746 HG2 GLN 103 HG2 GLN 103 8.847 8.741 -1.238 747 HG3 GLN 103 HG1 GLN 103 10.320 8.233 -0.440 748 HE21 GLN 103 HE21 GLN 103 9.405 7.166 -3.644 749 HE22 GLN 103 HE22 GLN 103 10.643 8.018 -4.491 750 H GLU 104 HN GLU 104 8.396 8.632 0.879 751 HA GLU 104 HA GLU 104 10.696 8.850 2.414 752 HB2 GLU 104 HB2 GLU 104 9.993 10.948 2.871 753 HB3 GLU 104 HB1 GLU 104 8.767 10.575 1.677 754 HG2 GLU 104 HG2 GLU 104 7.187 10.023 3.411 755 HG3 GLU 104 HG1 GLU 104 8.421 10.280 4.641 756 H MET 105 HN MET 105 7.499 7.744 3.325 757 HA MET 105 HA MET 105 7.880 7.524 6.081 758 HB2 MET 105 HB2 MET 105 5.756 7.151 4.616 759 HB3 MET 105 HB1 MET 105 6.298 5.479 4.567 760 HG2 MET 105 HG2 MET 105 5.747 7.053 7.070 761 HG3 MET 105 HG1 MET 105 4.650 5.894 6.331 762 HE1 MET 105 HE3 MET 105 5.869 4.093 9.589 763 HE2 MET 105 HE1 MET 105 4.453 4.368 8.573 764 HE3 MET 105 HE2 MET 105 5.320 5.738 9.265 765 H VAL 106 HN VAL 106 8.097 4.878 3.694 766 HA VAL 106 HA VAL 106 9.331 3.077 5.461 767 HB VAL 106 HB VAL 106 8.090 2.481 3.352 768 HG11 VAL 106 HG11 VAL 106 10.701 3.314 2.109 769 HG12 VAL 106 HG12 VAL 106 9.079 3.891 1.725 770 HG13 VAL 106 HG13 VAL 106 9.546 2.240 1.319 771 HG21 VAL 106 HG23 VAL 106 9.008 0.435 3.485 772 HG22 VAL 106 HG21 VAL 106 9.921 1.146 4.810 773 HG23 VAL 106 HG22 VAL 106 10.643 1.032 3.209 774 H HIS 107 HN HIS 107 10.616 5.485 3.292 775 HA HIS 107 HA HIS 107 13.323 4.517 3.451 776 HD1 HIS 107 HD1 HIS 107 14.207 8.707 2.628 777 HD2 HIS 107 HD2 HIS 107 15.312 4.945 1.256 778 HE1 HIS 107 HE1 HIS 107 16.634 8.906 2.003 779 HE2 HIS 107 HE2 HIS 107 17.267 6.632 1.119 780 HB2 HIS 107 HB2 HIS 107 12.495 5.721 1.463 781 HB3 HIS 107 HB1 HIS 107 12.263 7.163 2.443 782 H SER 108 HN SER 108 11.309 6.599 5.312 783 HA SER 108 HA SER 108 13.044 8.409 6.419 784 HG SER 108 HG SER 108 10.911 9.133 8.932 785 HB2 SER 108 HB2 SER 108 10.665 8.420 6.930 786 HB3 SER 108 HB1 SER 108 10.820 6.900 7.812 Start of MODEL 7 1 HA SER 1 HA SER 1 3.945 -7.680 -3.350 2 HG SER 1 HG SER 1 1.445 -5.021 -2.010 3 H1 SER 1 HT1 SER 1 5.401 -5.743 -1.816 4 H2 SER 1 HT2 SER 1 5.087 -7.370 -1.486 5 H3 SER 1 HT3 SER 1 3.933 -6.193 -1.106 6 HB2 SER 1 HB2 SER 1 2.709 -5.143 -3.912 7 HB3 SER 1 HB1 SER 1 1.947 -6.678 -3.521 8 H ILE 2 HN ILE 2 3.587 -6.368 -5.606 9 HA ILE 2 HA ILE 2 4.609 -5.433 -7.404 10 HB ILE 2 HB ILE 2 6.508 -4.055 -5.608 11 HG12 ILE 2 HG12 ILE 2 4.521 -2.226 -5.928 12 HG13 ILE 2 HG11 ILE 2 3.595 -3.700 -5.742 13 HG21 ILE 2 HG21 ILE 2 5.199 -3.123 -8.136 14 HG22 ILE 2 HG22 ILE 2 6.726 -4.004 -8.077 15 HG23 ILE 2 HG23 ILE 2 6.598 -2.415 -7.324 16 HD11 ILE 2 HD13 ILE 2 4.385 -2.144 -3.711 17 HD12 ILE 2 HD11 ILE 2 5.737 -3.269 -3.776 18 HD13 ILE 2 HD12 ILE 2 4.096 -3.868 -3.562 19 H THR 3 HN THR 3 5.547 -7.122 -8.233 20 HA THR 3 HA THR 3 7.816 -8.449 -7.242 21 HB THR 3 HB THR 3 7.833 -9.683 -9.350 22 HG1 THR 3 HG1 THR 3 5.705 -7.976 -10.172 23 HG21 THR 3 HG23 THR 3 4.960 -9.303 -8.551 24 HG22 THR 3 HG21 THR 3 6.127 -10.079 -7.481 25 HG23 THR 3 HG22 THR 3 5.777 -10.782 -9.060 26 H ASP 4 HN ASP 4 7.689 -5.435 -8.832 27 HA ASP 4 HA ASP 4 9.636 -5.299 -10.638 28 HB2 ASP 4 HB2 ASP 4 9.037 -3.464 -8.336 29 HB3 ASP 4 HB1 ASP 4 10.319 -3.085 -9.482 30 H ILE 5 HN ILE 5 10.832 -4.208 -7.473 31 HA ILE 5 HA ILE 5 13.080 -6.092 -7.864 32 HB ILE 5 HB ILE 5 13.230 -3.272 -6.798 33 HG12 ILE 5 HG12 ILE 5 14.654 -4.009 -9.277 34 HG13 ILE 5 HG11 ILE 5 12.898 -3.945 -9.399 35 HG21 ILE 5 HG21 ILE 5 14.876 -5.045 -5.949 36 HG22 ILE 5 HG22 ILE 5 15.521 -3.521 -6.565 37 HG23 ILE 5 HG23 ILE 5 15.568 -4.973 -7.572 38 HD11 ILE 5 HD13 ILE 5 13.916 -1.826 -10.015 39 HD12 ILE 5 HD11 ILE 5 14.670 -1.718 -8.423 40 HD13 ILE 5 HD12 ILE 5 12.911 -1.659 -8.573 41 H LEU 6 HN LEU 6 12.107 -7.494 -6.412 42 HA LEU 6 HA LEU 6 13.158 -7.337 -3.839 43 HG LEU 6 HG LEU 6 9.072 -6.371 -3.229 44 HB2 LEU 6 HB2 LEU 6 10.997 -7.417 -2.539 45 HB3 LEU 6 HB1 LEU 6 11.555 -5.872 -3.111 46 HD11 LEU 6 HD11 LEU 6 10.100 -5.571 -5.903 47 HD12 LEU 6 HD12 LEU 6 10.512 -4.589 -4.494 48 HD13 LEU 6 HD13 LEU 6 8.822 -4.854 -4.920 49 HD21 LEU 6 HD23 LEU 6 9.604 -8.628 -4.233 50 HD22 LEU 6 HD21 LEU 6 9.809 -7.773 -5.755 51 HD23 LEU 6 HD22 LEU 6 8.254 -7.730 -4.915 52 H SER 7 HN SER 7 12.379 -9.136 -2.385 53 HA SER 7 HA SER 7 12.680 -11.572 -3.781 54 HG SER 7 HG SER 7 14.186 -11.966 -1.069 55 HB2 SER 7 HB2 SER 7 11.660 -11.174 -0.957 56 HB3 SER 7 HB1 SER 7 12.302 -12.673 -1.627 57 H ALA 8 HN ALA 8 11.251 -12.566 -4.997 58 HA ALA 8 HA ALA 8 8.527 -11.862 -5.200 59 HB1 ALA 8 HB3 ALA 8 9.840 -12.833 -7.040 60 HB2 ALA 8 HB1 ALA 8 8.340 -13.713 -6.741 61 HB3 ALA 8 HB2 ALA 8 9.877 -14.371 -6.178 62 H GLU 9 HN GLU 9 10.171 -14.519 -3.575 63 HA GLU 9 HA GLU 9 7.883 -15.999 -2.869 64 HB2 GLU 9 HB2 GLU 9 10.588 -15.818 -1.546 65 HB3 GLU 9 HB1 GLU 9 9.363 -17.010 -1.124 66 HG2 GLU 9 HG2 GLU 9 10.612 -16.674 -3.827 67 HG3 GLU 9 HG1 GLU 9 11.087 -17.885 -2.638 68 H ASP 10 HN ASP 10 9.821 -13.752 -0.912 69 HA ASP 10 HA ASP 10 8.263 -13.619 1.295 70 HB2 ASP 10 HB2 ASP 10 9.849 -11.423 -0.014 71 HB3 ASP 10 HB1 ASP 10 9.160 -11.294 1.600 72 H ILE 11 HN ILE 11 7.550 -12.291 -1.784 73 HA ILE 11 HA ILE 11 5.699 -10.331 -0.960 74 HB ILE 11 HB ILE 11 6.565 -11.541 -3.424 75 HG12 ILE 11 HG12 ILE 11 5.326 -8.869 -2.703 76 HG13 ILE 11 HG11 ILE 11 7.037 -9.277 -2.860 77 HG21 ILE 11 HG21 ILE 11 3.606 -11.241 -3.182 78 HG22 ILE 11 HG22 ILE 11 4.553 -12.471 -4.002 79 HG23 ILE 11 HG23 ILE 11 4.405 -10.863 -4.704 80 HD11 ILE 11 HD13 ILE 11 6.266 -8.017 -4.775 81 HD12 ILE 11 HD11 ILE 11 5.033 -9.234 -5.100 82 HD13 ILE 11 HD12 ILE 11 6.740 -9.648 -5.251 83 H ALA 12 HN ALA 12 5.199 -13.685 -1.999 84 HA ALA 12 HA ALA 12 2.442 -13.824 -1.558 85 HB1 ALA 12 HB3 ALA 12 4.228 -15.575 -2.504 86 HB2 ALA 12 HB1 ALA 12 2.630 -16.059 -1.930 87 HB3 ALA 12 HB2 ALA 12 4.030 -16.216 -0.872 88 H ALA 13 HN ALA 13 5.098 -14.690 0.649 89 HA ALA 13 HA ALA 13 3.415 -15.293 2.842 90 HB1 ALA 13 HB3 ALA 13 5.874 -15.878 2.598 91 HB2 ALA 13 HB1 ALA 13 5.376 -15.283 4.182 92 HB3 ALA 13 HB2 ALA 13 6.218 -14.211 3.065 93 H ALA 14 HN ALA 14 5.305 -12.463 2.065 94 HA ALA 14 HA ALA 14 4.633 -10.681 3.987 95 HB1 ALA 14 HB3 ALA 14 6.144 -10.066 2.206 96 HB2 ALA 14 HB1 ALA 14 4.846 -8.875 2.281 97 HB3 ALA 14 HB2 ALA 14 4.840 -10.116 1.021 98 H LEU 15 HN LEU 15 2.738 -11.383 1.083 99 HA LEU 15 HA LEU 15 0.586 -9.644 1.844 100 HG LEU 15 HG LEU 15 -0.751 -9.095 -0.372 101 HB2 LEU 15 HB2 LEU 15 1.276 -10.351 -0.522 102 HB3 LEU 15 HB1 LEU 15 0.449 -11.857 -0.190 103 HD11 LEU 15 HD11 LEU 15 -1.662 -11.519 -1.851 104 HD12 LEU 15 HD12 LEU 15 -0.239 -10.643 -2.406 105 HD13 LEU 15 HD13 LEU 15 -1.794 -9.817 -2.296 106 HD21 LEU 15 HD23 LEU 15 -1.890 -11.589 0.800 107 HD22 LEU 15 HD21 LEU 15 -2.929 -10.434 -0.026 108 HD23 LEU 15 HD22 LEU 15 -1.992 -9.931 1.379 109 H GLN 16 HN GLN 16 0.866 -13.174 1.426 110 HA GLN 16 HA GLN 16 -1.704 -13.770 2.393 111 HB2 GLN 16 HB2 GLN 16 0.741 -15.493 1.963 112 HB3 GLN 16 HB1 GLN 16 -0.936 -16.054 2.044 113 HG2 GLN 16 HG2 GLN 16 -0.094 -14.047 0.006 114 HG3 GLN 16 HG1 GLN 16 0.243 -15.757 -0.245 115 HE21 GLN 16 HE21 GLN 16 -2.164 -13.298 -0.064 116 HE22 GLN 16 HE22 GLN 16 -3.477 -14.235 -0.650 117 H GLU 17 HN GLU 17 1.009 -12.837 4.162 118 HA GLU 17 HA GLU 17 1.083 -14.904 6.089 119 HB2 GLU 17 HB2 GLU 17 2.997 -13.587 6.015 120 HB3 GLU 17 HB1 GLU 17 2.090 -12.086 5.998 121 HG2 GLU 17 HG2 GLU 17 1.580 -12.310 8.329 122 HG3 GLU 17 HG1 GLU 17 2.293 -13.916 8.368 123 H CYS 18 HN CYS 18 0.103 -11.559 6.841 124 HA CYS 18 HA CYS 18 -1.838 -12.643 8.715 125 HG CYS 18 HG CYS 18 0.967 -11.307 10.895 126 HB2 CYS 18 HB2 CYS 18 0.013 -10.370 8.718 127 HB3 CYS 18 HB1 CYS 18 -1.564 -10.057 9.415 128 H GLN 19 HN GLN 19 -2.050 -11.680 5.658 129 HA GLN 19 HA GLN 19 -3.421 -9.323 5.447 130 HB2 GLN 19 HB2 GLN 19 -2.783 -10.792 3.554 131 HB3 GLN 19 HB1 GLN 19 -4.135 -11.833 3.945 132 HG2 GLN 19 HG2 GLN 19 -5.671 -9.968 3.519 133 HG3 GLN 19 HG1 GLN 19 -4.294 -8.960 3.072 134 HE21 GLN 19 HE21 GLN 19 -4.936 -8.638 0.968 135 HE22 GLN 19 HE22 GLN 19 -4.941 -9.900 -0.215 136 H ASP 20 HN ASP 20 -5.378 -8.573 5.598 137 HA ASP 20 HA ASP 20 -7.810 -9.796 5.941 138 HB2 ASP 20 HB2 ASP 20 -6.224 -9.683 8.451 139 HB3 ASP 20 HB1 ASP 20 -7.905 -9.170 8.567 140 HA PRO 21 HA PRO 21 -8.945 -5.523 5.890 141 HB2 PRO 21 HB2 PRO 21 -11.385 -5.521 6.915 142 HB3 PRO 21 HB1 PRO 21 -11.056 -6.339 5.397 143 HG2 PRO 21 HG2 PRO 21 -11.297 -7.469 8.161 144 HG3 PRO 21 HG1 PRO 21 -12.020 -8.057 6.649 145 HD2 PRO 21 HD2 PRO 21 -9.754 -9.103 7.694 146 HD3 PRO 21 HD1 PRO 21 -10.075 -9.033 5.955 147 H ASP 22 HN ASP 22 -7.164 -5.801 7.933 148 HA ASP 22 HA ASP 22 -7.762 -3.721 9.689 149 HB2 ASP 22 HB2 ASP 22 -9.373 -5.561 10.511 150 HB3 ASP 22 HB1 ASP 22 -7.939 -6.325 11.173 151 H THR 23 HN THR 23 -5.656 -6.271 8.736 152 HA THR 23 HA THR 23 -3.777 -5.676 10.888 153 HB THR 23 HB THR 23 -4.296 -8.031 10.378 154 HG1 THR 23 HG1 THR 23 -1.588 -7.517 9.701 155 HG21 THR 23 HG23 THR 23 -3.616 -7.145 7.692 156 HG22 THR 23 HG21 THR 23 -4.501 -8.576 8.218 157 HG23 THR 23 HG22 THR 23 -2.737 -8.598 8.166 158 H PHE 24 HN PHE 24 -4.211 -5.091 7.520 159 HA PHE 24 HA PHE 24 -3.045 -3.323 6.406 160 HD1 PHE 24 HD2 PHE 24 -2.475 -3.012 9.692 161 HD2 PHE 24 HD1 PHE 24 -0.035 -1.234 6.703 162 HE1 PHE 24 HE2 PHE 24 -2.577 -0.880 10.890 163 HE2 PHE 24 HE1 PHE 24 -0.126 0.908 7.900 164 HZ PHE 24 HZ PHE 24 -1.401 1.089 9.998 165 HB2 PHE 24 HB2 PHE 24 -0.676 -4.311 7.986 166 HB3 PHE 24 HB1 PHE 24 -0.468 -3.409 6.514 167 H GLU 25 HN GLU 25 -3.825 -4.610 4.711 168 HA GLU 25 HA GLU 25 -2.479 -6.947 3.865 169 HB2 GLU 25 HB2 GLU 25 -4.294 -5.262 2.171 170 HB3 GLU 25 HB1 GLU 25 -3.977 -6.984 2.040 171 HG2 GLU 25 HG2 GLU 25 -5.057 -7.328 4.205 172 HG3 GLU 25 HG1 GLU 25 -5.421 -5.610 4.270 173 HA PRO 26 HA PRO 26 -0.585 -4.293 0.426 174 HB2 PRO 26 HB2 PRO 26 -0.608 -1.586 0.649 175 HB3 PRO 26 HB1 PRO 26 -1.874 -2.530 -0.124 176 HG2 PRO 26 HG2 PRO 26 -1.920 -1.111 2.403 177 HG3 PRO 26 HG1 PRO 26 -3.261 -1.707 1.433 178 HD2 PRO 26 HD2 PRO 26 -2.124 -2.863 3.805 179 HD3 PRO 26 HD1 PRO 26 -3.510 -3.435 2.857 180 H GLN 27 HN GLN 27 -0.052 -2.146 3.243 181 HA GLN 27 HA GLN 27 2.629 -1.611 2.615 182 HB2 GLN 27 HB2 GLN 27 1.114 -1.441 5.198 183 HB3 GLN 27 HB1 GLN 27 2.793 -0.940 5.064 184 HG2 GLN 27 HG2 GLN 27 1.355 0.976 4.878 185 HG3 GLN 27 HG1 GLN 27 2.153 0.677 3.335 186 HE21 GLN 27 HE21 GLN 27 -0.840 0.378 5.102 187 HE22 GLN 27 HE22 GLN 27 -1.878 0.300 3.724 188 H LYS 28 HN LYS 28 1.263 -4.152 4.673 189 HA LYS 28 HA LYS 28 3.730 -4.981 5.792 190 HB2 LYS 28 HB2 LYS 28 1.012 -6.189 5.473 191 HB3 LYS 28 HB1 LYS 28 2.338 -7.147 6.052 192 HG2 LYS 28 HG2 LYS 28 2.686 -5.490 7.859 193 HG3 LYS 28 HG1 LYS 28 1.211 -4.687 7.320 194 HD2 LYS 28 HD2 LYS 28 -0.094 -6.646 7.803 195 HD3 LYS 28 HD1 LYS 28 1.360 -7.577 8.167 196 HE2 LYS 28 HE2 LYS 28 0.419 -5.155 9.693 197 HE3 LYS 28 HE1 LYS 28 0.165 -6.826 10.194 198 HZ1 LYS 28 HZ3 LYS 28 2.800 -5.504 9.829 199 HZ2 LYS 28 HZ1 LYS 28 2.568 -7.116 10.291 200 HZ3 LYS 28 HZ2 LYS 28 2.069 -5.861 11.311 201 H PHE 29 HN PHE 29 1.796 -5.882 3.046 202 HA PHE 29 HA PHE 29 3.145 -7.990 1.954 203 HD1 PHE 29 HD1 PHE 29 3.898 -8.402 -0.069 204 HD2 PHE 29 HD2 PHE 29 0.035 -6.969 -1.078 205 HE1 PHE 29 HE1 PHE 29 3.844 -9.902 -1.984 206 HE2 PHE 29 HE2 PHE 29 -0.034 -8.492 -3.008 207 HZ PHE 29 HZ PHE 29 1.883 -9.970 -3.470 208 HB2 PHE 29 HB2 PHE 29 1.049 -6.665 1.193 209 HB3 PHE 29 HB1 PHE 29 2.181 -5.653 0.315 210 H PHE 30 HN PHE 30 3.898 -4.579 1.780 211 HA PHE 30 HA PHE 30 6.040 -4.794 -0.106 212 HD1 PHE 30 HD1 PHE 30 4.488 -4.134 -1.332 213 HD2 PHE 30 HD2 PHE 30 4.008 -0.812 1.292 214 HE1 PHE 30 HE1 PHE 30 2.510 -3.400 -2.570 215 HE2 PHE 30 HE2 PHE 30 2.010 -0.101 0.052 216 HZ PHE 30 HZ PHE 30 1.251 -1.404 -1.885 217 HB2 PHE 30 HB2 PHE 30 5.452 -2.564 1.816 218 HB3 PHE 30 HB1 PHE 30 6.441 -2.458 0.372 219 H GLN 31 HN GLN 31 5.855 -4.080 3.331 220 HA GLN 31 HA GLN 31 8.498 -3.745 3.918 221 HB2 GLN 31 HB2 GLN 31 6.353 -3.560 5.381 222 HB3 GLN 31 HB1 GLN 31 6.694 -5.230 5.809 223 HG2 GLN 31 HG2 GLN 31 7.652 -3.937 7.507 224 HG3 GLN 31 HG1 GLN 31 9.005 -4.421 6.481 225 HE21 GLN 31 HE21 GLN 31 9.851 -2.904 5.012 226 HE22 GLN 31 HE22 GLN 31 9.662 -1.210 5.263 227 H THR 32 HN THR 32 6.792 -6.800 4.454 228 HA THR 32 HA THR 32 9.020 -8.255 5.232 229 HB THR 32 HB THR 32 6.510 -9.184 3.854 230 HG1 THR 32 HG1 THR 32 5.991 -9.816 6.005 231 HG21 THR 32 HG23 THR 32 8.631 -10.864 5.196 232 HG22 THR 32 HG21 THR 32 8.272 -10.843 3.470 233 HG23 THR 32 HG22 THR 32 7.073 -11.449 4.613 234 H SER 33 HN SER 33 7.657 -7.985 1.931 235 HA SER 33 HA SER 33 9.875 -9.511 0.869 236 HG SER 33 HG SER 33 9.408 -9.990 -1.654 237 HB2 SER 33 HB2 SER 33 7.803 -10.035 -0.115 238 HB3 SER 33 HB1 SER 33 7.441 -8.354 -0.457 239 H GLY 34 HN GLY 34 8.549 -6.262 0.082 240 HA2 GLY 34 HA2 GLY 34 11.110 -5.772 -1.245 241 HA3 GLY 34 HA1 GLY 34 9.640 -4.888 -1.571 242 H LEU 35 HN LEU 35 8.925 -3.900 0.872 243 HA LEU 35 HA LEU 35 10.683 -1.727 1.165 244 HG LEU 35 HG LEU 35 9.178 0.258 1.943 245 HB2 LEU 35 HB2 LEU 35 8.062 -2.535 2.114 246 HB3 LEU 35 HB1 LEU 35 8.972 -1.668 3.329 247 HD11 LEU 35 HD11 LEU 35 8.052 -1.500 -0.221 248 HD12 LEU 35 HD12 LEU 35 9.624 -0.700 -0.183 249 HD13 LEU 35 HD13 LEU 35 8.151 0.256 -0.348 250 HD21 LEU 35 HD23 LEU 35 6.366 -0.745 1.565 251 HD22 LEU 35 HD21 LEU 35 6.907 0.926 1.724 252 HD23 LEU 35 HD22 LEU 35 6.994 -0.167 3.107 253 H SER 36 HN SER 36 11.464 -4.618 2.187 254 HA SER 36 HA SER 36 11.761 -4.651 4.956 255 HG SER 36 HG SER 36 12.026 -7.092 2.505 256 HB2 SER 36 HB2 SER 36 13.628 -5.796 2.865 257 HB3 SER 36 HB1 SER 36 13.566 -6.254 4.559 258 H LYS 37 HN LYS 37 14.357 -3.925 2.606 259 HA LYS 37 HA LYS 37 15.059 -1.480 3.961 260 HB2 LYS 37 HB2 LYS 37 17.339 -2.228 4.531 261 HB3 LYS 37 HB1 LYS 37 16.063 -3.001 5.447 262 HG2 LYS 37 HG2 LYS 37 16.229 -4.892 3.762 263 HG3 LYS 37 HG1 LYS 37 17.754 -4.152 3.274 264 HD2 LYS 37 HD2 LYS 37 18.706 -5.295 4.927 265 HD3 LYS 37 HD1 LYS 37 17.871 -4.198 6.030 266 HE2 LYS 37 HE2 LYS 37 15.955 -5.736 6.079 267 HE3 LYS 37 HE1 LYS 37 16.833 -6.845 5.025 268 HZ1 LYS 37 HZ3 LYS 37 17.016 -7.517 7.327 269 HZ2 LYS 37 HZ1 LYS 37 17.662 -6.013 7.754 270 HZ3 LYS 37 HZ2 LYS 37 18.533 -7.052 6.743 271 H MET 38 HN MET 38 14.308 -1.725 1.443 272 HA MET 38 HA MET 38 16.685 -1.795 -0.246 273 HB2 MET 38 HB2 MET 38 13.889 -1.314 -1.205 274 HB3 MET 38 HB1 MET 38 15.259 -1.996 -2.062 275 HG2 MET 38 HG2 MET 38 13.956 -3.320 0.275 276 HG3 MET 38 HG1 MET 38 13.493 -3.629 -1.402 277 HE1 MET 38 HE3 MET 38 14.740 -5.862 0.888 278 HE2 MET 38 HE1 MET 38 15.417 -6.872 -0.390 279 HE3 MET 38 HE2 MET 38 13.849 -6.096 -0.614 280 H SER 39 HN SER 39 16.486 -0.115 -2.179 281 HA SER 39 HA SER 39 16.854 2.453 -1.011 282 HG SER 39 HG SER 39 17.646 3.473 -4.445 283 HB2 SER 39 HB2 SER 39 18.306 1.918 -2.795 284 HB3 SER 39 HB1 SER 39 16.971 1.427 -3.840 285 H ALA 40 HN ALA 40 15.960 4.380 -2.208 286 HA ALA 40 HA ALA 40 13.136 4.497 -1.771 287 HB1 ALA 40 HB3 ALA 40 14.788 6.586 -3.167 288 HB2 ALA 40 HB1 ALA 40 14.798 6.365 -1.416 289 HB3 ALA 40 HB2 ALA 40 13.300 6.799 -2.241 290 H SER 41 HN SER 41 15.155 4.446 -4.704 291 HA SER 41 HA SER 41 13.390 5.147 -6.630 292 HG SER 41 HG SER 41 16.624 2.765 -6.964 293 HB2 SER 41 HB2 SER 41 14.693 3.607 -8.140 294 HB3 SER 41 HB1 SER 41 15.669 4.729 -7.192 295 H GLN 42 HN GLN 42 13.910 1.730 -5.675 296 HA GLN 42 HA GLN 42 11.860 0.760 -7.322 297 HB2 GLN 42 HB2 GLN 42 11.898 -1.291 -6.038 298 HB3 GLN 42 HB1 GLN 42 13.530 -0.727 -6.363 299 HG2 GLN 42 HG2 GLN 42 13.680 0.169 -4.135 300 HG3 GLN 42 HG1 GLN 42 12.042 -0.387 -3.784 301 HE21 GLN 42 HE21 GLN 42 11.658 -2.575 -3.430 302 HE22 GLN 42 HE22 GLN 42 12.933 -3.721 -3.239 303 H VAL 43 HN VAL 43 11.784 2.317 -4.312 304 HA VAL 43 HA VAL 43 9.301 1.448 -3.321 305 HB VAL 43 HB VAL 43 10.219 4.289 -2.999 306 HG11 VAL 43 HG11 VAL 43 8.986 2.617 -0.880 307 HG12 VAL 43 HG12 VAL 43 7.972 3.224 -2.189 308 HG13 VAL 43 HG13 VAL 43 8.860 4.354 -1.164 309 HG21 VAL 43 HG23 VAL 43 11.507 3.530 -1.032 310 HG22 VAL 43 HG21 VAL 43 12.152 2.917 -2.543 311 HG23 VAL 43 HG22 VAL 43 11.205 1.861 -1.512 312 H LYS 44 HN LYS 44 10.151 3.950 -5.662 313 HA LYS 44 HA LYS 44 7.632 5.108 -6.002 314 HB2 LYS 44 HB2 LYS 44 9.965 4.728 -7.866 315 HB3 LYS 44 HB1 LYS 44 8.485 5.513 -8.406 316 HG2 LYS 44 HG2 LYS 44 9.189 7.424 -7.555 317 HG3 LYS 44 HG1 LYS 44 9.242 6.695 -5.953 318 HD2 LYS 44 HD2 LYS 44 11.400 7.638 -6.538 319 HD3 LYS 44 HD1 LYS 44 11.514 5.886 -6.405 320 HE2 LYS 44 HE2 LYS 44 12.733 6.556 -8.340 321 HE3 LYS 44 HE1 LYS 44 11.250 5.778 -8.875 322 HZ1 LYS 44 HZ3 LYS 44 11.701 8.704 -8.723 323 HZ2 LYS 44 HZ1 LYS 44 10.269 7.958 -9.227 324 HZ3 LYS 44 HZ2 LYS 44 11.682 7.781 -10.140 325 H ASP 45 HN ASP 45 9.136 2.338 -7.617 326 HA ASP 45 HA ASP 45 6.911 1.703 -9.246 327 HB2 ASP 45 HB2 ASP 45 9.543 0.611 -8.642 328 HB3 ASP 45 HB1 ASP 45 8.337 -0.644 -8.872 329 H ILE 46 HN ILE 46 8.128 0.520 -6.155 330 HA ILE 46 HA ILE 46 6.277 -1.472 -5.685 331 HB ILE 46 HB ILE 46 8.142 0.137 -4.086 332 HG12 ILE 46 HG12 ILE 46 9.005 -2.029 -3.524 333 HG13 ILE 46 HG11 ILE 46 7.575 -2.810 -4.182 334 HG21 ILE 46 HG21 ILE 46 5.889 -1.374 -2.796 335 HG22 ILE 46 HG22 ILE 46 6.367 0.302 -2.537 336 HG23 ILE 46 HG23 ILE 46 7.403 -1.006 -1.975 337 HD11 ILE 46 HD13 ILE 46 8.245 -1.797 -6.409 338 HD12 ILE 46 HD11 ILE 46 9.244 -3.108 -5.786 339 HD13 ILE 46 HD12 ILE 46 9.796 -1.444 -5.649 340 H PHE 47 HN PHE 47 6.195 1.907 -4.561 341 HA PHE 47 HA PHE 47 3.806 1.996 -3.272 342 HD1 PHE 47 HD2 PHE 47 2.716 3.354 -2.293 343 HD2 PHE 47 HD1 PHE 47 3.839 6.159 -5.285 344 HE1 PHE 47 HE2 PHE 47 0.879 4.830 -1.605 345 HE2 PHE 47 HE1 PHE 47 1.982 7.635 -4.588 346 HZ PHE 47 HZ PHE 47 0.528 6.950 -2.764 347 HB2 PHE 47 HB2 PHE 47 5.326 3.901 -3.540 348 HB3 PHE 47 HB1 PHE 47 4.845 4.056 -5.220 349 H ARG 48 HN ARG 48 4.361 1.727 -6.679 350 HA ARG 48 HA ARG 48 1.927 2.518 -7.718 351 HE ARG 48 HE ARG 48 1.663 3.638 -9.853 352 HB2 ARG 48 HB2 ARG 48 3.581 0.209 -8.729 353 HB3 ARG 48 HB1 ARG 48 2.400 1.135 -9.644 354 HG2 ARG 48 HG2 ARG 48 5.025 2.111 -8.557 355 HG3 ARG 48 HG1 ARG 48 4.573 1.905 -10.250 356 HD2 ARG 48 HD2 ARG 48 3.358 3.861 -8.296 357 HD3 ARG 48 HD1 ARG 48 4.487 4.256 -9.591 358 HH11 ARG 48 HH11 ARG 48 4.724 4.073 -11.480 359 HH12 ARG 48 HH12 ARG 48 3.998 4.405 -13.016 360 HH21 ARG 48 HH21 ARG 48 0.714 4.068 -11.873 361 HH22 ARG 48 HH22 ARG 48 1.723 4.401 -13.240 362 H PHE 49 HN PHE 49 2.664 -0.364 -5.881 363 HA PHE 49 HA PHE 49 0.644 -2.096 -6.597 364 HD1 PHE 49 HD2 PHE 49 1.185 -4.636 -5.581 365 HD2 PHE 49 HD1 PHE 49 -0.433 -2.148 -2.523 366 HE1 PHE 49 HE2 PHE 49 -0.245 -6.492 -4.831 367 HE2 PHE 49 HE1 PHE 49 -1.859 -4.003 -1.770 368 HZ PHE 49 HZ PHE 49 -1.771 -6.175 -2.924 369 HB2 PHE 49 HB2 PHE 49 2.320 -2.552 -4.818 370 HB3 PHE 49 HB1 PHE 49 1.465 -1.441 -3.760 371 H ILE 50 HN ILE 50 0.360 0.234 -3.920 372 HA ILE 50 HA ILE 50 -2.509 0.264 -4.107 373 HB ILE 50 HB ILE 50 -2.195 2.345 -2.563 374 HG12 ILE 50 HG12 ILE 50 0.530 1.073 -2.214 375 HG13 ILE 50 HG11 ILE 50 0.245 2.598 -3.050 376 HG21 ILE 50 HG21 ILE 50 -1.977 -0.516 -2.006 377 HG22 ILE 50 HG22 ILE 50 -3.063 0.708 -1.342 378 HG23 ILE 50 HG23 ILE 50 -1.429 0.539 -0.701 379 HD11 ILE 50 HD13 ILE 50 -0.218 1.991 -0.139 380 HD12 ILE 50 HD11 ILE 50 -0.731 3.480 -0.930 381 HD13 ILE 50 HD12 ILE 50 0.988 3.083 -0.829 382 H ASP 51 HN ASP 51 -3.758 1.815 -5.092 383 HA ASP 51 HA ASP 51 -3.376 3.069 -7.324 384 HB2 ASP 51 HB2 ASP 51 -4.742 4.206 -4.904 385 HB3 ASP 51 HB1 ASP 51 -4.677 5.121 -6.413 386 H ASN 52 HN ASN 52 -2.539 5.028 -8.261 387 HA ASN 52 HA ASN 52 -0.424 6.245 -6.610 388 HB2 ASN 52 HB2 ASN 52 0.486 4.792 -8.356 389 HB3 ASN 52 HB1 ASN 52 -0.376 5.717 -9.581 390 HD21 ASN 52 HD21 ASN 52 0.957 6.948 -10.668 391 HD22 ASN 52 HD22 ASN 52 2.282 7.847 -10.020 392 H ASP 53 HN ASP 53 -2.676 6.875 -9.284 393 HA ASP 53 HA ASP 53 -2.089 9.723 -9.085 394 HB2 ASP 53 HB2 ASP 53 -3.720 8.100 -11.030 395 HB3 ASP 53 HB1 ASP 53 -3.706 9.861 -11.044 396 H GLN 54 HN GLN 54 -5.197 8.148 -9.625 397 HA GLN 54 HA GLN 54 -7.262 8.472 -8.793 398 HB2 GLN 54 HB2 GLN 54 -6.209 9.847 -6.363 399 HB3 GLN 54 HB1 GLN 54 -7.514 8.692 -6.527 400 HG2 GLN 54 HG2 GLN 54 -5.034 7.433 -7.197 401 HG3 GLN 54 HG1 GLN 54 -4.920 8.228 -5.632 402 HE21 GLN 54 HE21 GLN 54 -6.008 7.390 -3.911 403 HE22 GLN 54 HE22 GLN 54 -6.933 5.938 -3.970 404 H SER 55 HN SER 55 -5.413 11.168 -7.495 405 HA SER 55 HA SER 55 -6.475 13.022 -9.383 406 HG SER 55 HG SER 55 -7.062 15.311 -7.260 407 HB2 SER 55 HB2 SER 55 -8.382 12.886 -7.833 408 HB3 SER 55 HB1 SER 55 -7.316 13.274 -6.483 409 H GLY 56 HN GLY 56 -3.900 12.022 -8.313 410 HA2 GLY 56 HA2 GLY 56 -1.928 13.475 -8.456 411 HA3 GLY 56 HA1 GLY 56 -2.806 14.632 -7.458 412 H TYR 57 HN TYR 57 -3.784 12.179 -5.900 413 HA TYR 57 HA TYR 57 -1.470 11.173 -4.529 414 HD1 TYR 57 HD2 TYR 57 -0.406 14.446 -4.143 415 HD2 TYR 57 HD1 TYR 57 -4.548 14.087 -3.320 416 HE1 TYR 57 HE2 TYR 57 -0.735 16.766 -4.896 417 HE2 TYR 57 HE1 TYR 57 -4.910 16.409 -4.090 418 HH TYR 57 HH TYR 57 -2.563 18.168 -5.785 419 HB2 TYR 57 HB2 TYR 57 -3.050 12.503 -2.494 420 HB3 TYR 57 HB1 TYR 57 -1.327 12.607 -2.775 421 H LEU 58 HN LEU 58 -2.200 9.904 -2.558 422 HA LEU 58 HA LEU 58 -4.765 8.652 -3.228 423 HG LEU 58 HG LEU 58 -1.693 7.727 -3.593 424 HB2 LEU 58 HB2 LEU 58 -2.706 7.642 -1.275 425 HB3 LEU 58 HB1 LEU 58 -4.043 6.761 -1.961 426 HD11 LEU 58 HD11 LEU 58 -1.106 6.050 -1.822 427 HD12 LEU 58 HD12 LEU 58 -0.854 5.488 -3.459 428 HD13 LEU 58 HD13 LEU 58 -2.261 4.946 -2.557 429 HD21 LEU 58 HD23 LEU 58 -3.370 5.478 -4.432 430 HD22 LEU 58 HD21 LEU 58 -2.722 6.820 -5.371 431 HD23 LEU 58 HD22 LEU 58 -4.182 7.033 -4.410 432 H ASP 59 HN ASP 59 -6.408 8.453 -1.651 433 HA ASP 59 HA ASP 59 -5.884 9.638 0.958 434 HB2 ASP 59 HB2 ASP 59 -6.568 11.508 -0.514 435 HB3 ASP 59 HB1 ASP 59 -8.089 10.669 -0.828 436 H GLY 60 HN GLY 60 -7.600 9.329 2.478 437 HA2 GLY 60 HA2 GLY 60 -8.285 6.726 2.843 438 HA3 GLY 60 HA1 GLY 60 -9.204 8.051 3.538 439 H ASP 61 HN ASP 61 -10.058 8.972 0.828 440 HA ASP 61 HA ASP 61 -12.433 7.328 0.750 441 HB2 ASP 61 HB2 ASP 61 -12.224 9.909 0.344 442 HB3 ASP 61 HB1 ASP 61 -11.787 9.415 -1.292 443 H GLU 62 HN GLU 62 -9.722 8.103 -1.333 444 HA GLU 62 HA GLU 62 -10.591 6.381 -3.455 445 HB2 GLU 62 HB2 GLU 62 -7.950 7.776 -3.103 446 HB3 GLU 62 HB1 GLU 62 -8.636 7.151 -4.602 447 HG2 GLU 62 HG2 GLU 62 -9.970 9.292 -2.994 448 HG3 GLU 62 HG1 GLU 62 -8.769 9.648 -4.234 449 H LEU 63 HN LEU 63 -8.405 6.177 -0.745 450 HA LEU 63 HA LEU 63 -6.615 4.245 -1.447 451 HG LEU 63 HG LEU 63 -6.569 6.398 0.888 452 HB2 LEU 63 HB2 LEU 63 -8.085 4.652 1.158 453 HB3 LEU 63 HB1 LEU 63 -6.849 3.429 0.977 454 HD11 LEU 63 HD11 LEU 63 -5.971 4.279 2.742 455 HD12 LEU 63 HD12 LEU 63 -6.094 6.003 3.009 456 HD13 LEU 63 HD13 LEU 63 -4.581 5.310 2.427 457 HD21 LEU 63 HD23 LEU 63 -4.700 4.334 -0.198 458 HD22 LEU 63 HD21 LEU 63 -4.131 5.905 0.372 459 HD23 LEU 63 HD22 LEU 63 -5.288 5.816 -0.957 460 H LYS 64 HN LYS 64 -9.923 3.598 -0.251 461 HA LYS 64 HA LYS 64 -9.855 0.881 -0.339 462 HB2 LYS 64 HB2 LYS 64 -12.419 1.247 -0.985 463 HB3 LYS 64 HB1 LYS 64 -11.794 1.533 0.623 464 HG2 LYS 64 HG2 LYS 64 -11.677 3.911 0.191 465 HG3 LYS 64 HG1 LYS 64 -12.187 3.656 -1.480 466 HD2 LYS 64 HD2 LYS 64 -14.022 2.426 0.360 467 HD3 LYS 64 HD1 LYS 64 -13.802 4.128 0.755 468 HE2 LYS 64 HE2 LYS 64 -14.394 3.134 -2.014 469 HE3 LYS 64 HE1 LYS 64 -15.656 3.587 -0.869 470 HZ1 LYS 64 HZ3 LYS 64 -14.663 5.804 -0.739 471 HZ2 LYS 64 HZ1 LYS 64 -15.143 5.429 -2.318 472 HZ3 LYS 64 HZ2 LYS 64 -13.507 5.363 -1.892 473 H TYR 65 HN TYR 65 -9.703 2.937 -3.082 474 HA TYR 65 HA TYR 65 -10.928 1.095 -4.915 475 HD1 TYR 65 HD1 TYR 65 -12.231 2.572 -4.102 476 HD2 TYR 65 HD2 TYR 65 -10.221 5.456 -6.497 477 HE1 TYR 65 HE1 TYR 65 -13.960 4.237 -3.549 478 HE2 TYR 65 HE2 TYR 65 -11.953 7.117 -5.965 479 HH TYR 65 HH TYR 65 -14.204 6.692 -3.479 480 HB2 TYR 65 HB2 TYR 65 -9.077 3.374 -5.593 481 HB3 TYR 65 HB1 TYR 65 -10.184 2.556 -6.681 482 H PHE 66 HN PHE 66 -7.832 1.316 -3.471 483 HA PHE 66 HA PHE 66 -6.082 0.483 -5.406 484 HD1 PHE 66 HD2 PHE 66 -4.153 -1.797 -4.679 485 HD2 PHE 66 HD1 PHE 66 -6.006 -1.091 -0.918 486 HE1 PHE 66 HE2 PHE 66 -3.383 -3.997 -3.890 487 HE2 PHE 66 HE1 PHE 66 -5.255 -3.290 -0.124 488 HZ PHE 66 HZ PHE 66 -3.935 -4.748 -1.608 489 HB2 PHE 66 HB2 PHE 66 -4.757 0.629 -3.597 490 HB3 PHE 66 HB1 PHE 66 -6.141 0.528 -2.525 491 H LEU 67 HN LEU 67 -7.980 -1.692 -3.321 492 HA LEU 67 HA LEU 67 -7.160 -4.057 -4.655 493 HG LEU 67 HG LEU 67 -7.327 -3.747 -1.725 494 HB2 LEU 67 HB2 LEU 67 -9.480 -3.402 -2.866 495 HB3 LEU 67 HB1 LEU 67 -9.338 -4.980 -3.613 496 HD11 LEU 67 HD11 LEU 67 -9.169 -6.089 -1.288 497 HD12 LEU 67 HD12 LEU 67 -9.495 -4.456 -0.712 498 HD13 LEU 67 HD13 LEU 67 -8.090 -5.337 -0.113 499 HD21 LEU 67 HD23 LEU 67 -7.416 -6.494 -2.971 500 HD22 LEU 67 HD21 LEU 67 -6.244 -5.932 -1.780 501 HD23 LEU 67 HD22 LEU 67 -6.280 -5.213 -3.390 502 H GLN 68 HN GLN 68 -9.718 -1.780 -5.128 503 HA GLN 68 HA GLN 68 -11.249 -3.236 -6.954 504 HB2 GLN 68 HB2 GLN 68 -11.020 -0.401 -6.094 505 HB3 GLN 68 HB1 GLN 68 -11.939 -0.749 -7.539 506 HG2 GLN 68 HG2 GLN 68 -13.332 -2.284 -6.315 507 HG3 GLN 68 HG1 GLN 68 -12.398 -2.007 -4.864 508 HE21 GLN 68 HE21 GLN 68 -14.168 -1.273 -3.708 509 HE22 GLN 68 HE22 GLN 68 -14.899 0.265 -4.004 510 H LYS 69 HN LYS 69 -8.533 -0.950 -7.430 511 HA LYS 69 HA LYS 69 -8.577 -0.702 -10.119 512 HB2 LYS 69 HB2 LYS 69 -6.110 -1.318 -8.489 513 HB3 LYS 69 HB1 LYS 69 -6.151 -0.464 -10.025 514 HG2 LYS 69 HG2 LYS 69 -7.067 0.459 -7.327 515 HG3 LYS 69 HG1 LYS 69 -5.894 1.204 -8.407 516 HD2 LYS 69 HD2 LYS 69 -8.873 1.049 -8.785 517 HD3 LYS 69 HD1 LYS 69 -7.928 2.494 -8.436 518 HE2 LYS 69 HE2 LYS 69 -6.794 2.301 -10.576 519 HE3 LYS 69 HE1 LYS 69 -7.667 0.811 -10.926 520 HZ1 LYS 69 HZ3 LYS 69 -8.861 3.512 -10.607 521 HZ2 LYS 69 HZ1 LYS 69 -9.742 2.088 -10.857 522 HZ3 LYS 69 HZ2 LYS 69 -8.692 2.655 -12.056 523 H PHE 70 HN PHE 70 -6.939 -3.306 -8.366 524 HA PHE 70 HA PHE 70 -6.686 -4.845 -10.810 525 HD1 PHE 70 HD2 PHE 70 -5.347 -7.922 -9.982 526 HD2 PHE 70 HD1 PHE 70 -5.926 -5.690 -6.406 527 HE1 PHE 70 HE2 PHE 70 -5.467 -10.018 -8.697 528 HE2 PHE 70 HE1 PHE 70 -6.047 -7.778 -5.114 529 HZ PHE 70 HZ PHE 70 -5.818 -9.948 -6.259 530 HB2 PHE 70 HB2 PHE 70 -4.800 -5.505 -9.827 531 HB3 PHE 70 HB1 PHE 70 -5.230 -4.599 -8.390 532 H GLN 71 HN GLN 71 -8.097 -5.454 -7.585 533 HA GLN 71 HA GLN 71 -9.394 -7.865 -8.479 534 HB2 GLN 71 HB2 GLN 71 -8.449 -7.489 -6.188 535 HB3 GLN 71 HB1 GLN 71 -9.764 -6.372 -5.895 536 HG2 GLN 71 HG2 GLN 71 -11.260 -8.414 -6.548 537 HG3 GLN 71 HG1 GLN 71 -9.814 -9.337 -6.161 538 HE21 GLN 71 HE21 GLN 71 -10.967 -6.381 -4.582 539 HE22 GLN 71 HE22 GLN 71 -11.233 -7.101 -3.050 540 H SER 72 HN SER 72 -10.179 -4.688 -8.960 541 HA SER 72 HA SER 72 -12.245 -3.509 -8.782 542 HG SER 72 HG SER 72 -10.585 -4.210 -11.410 543 HB2 SER 72 HB2 SER 72 -12.387 -5.384 -11.142 544 HB3 SER 72 HB1 SER 72 -13.339 -3.913 -10.953 545 H ASP 73 HN ASP 73 -12.741 -5.001 -6.826 546 HA ASP 73 HA ASP 73 -15.557 -5.578 -7.044 547 HB2 ASP 73 HB2 ASP 73 -14.568 -7.751 -7.681 548 HB3 ASP 73 HB1 ASP 73 -13.641 -7.763 -6.184 549 H ALA 74 HN ALA 74 -12.627 -5.693 -5.163 550 HA ALA 74 HA ALA 74 -12.603 -5.779 -2.739 551 HB1 ALA 74 HB3 ALA 74 -11.236 -4.055 -2.557 552 HB2 ALA 74 HB1 ALA 74 -12.472 -2.892 -3.028 553 HB3 ALA 74 HB2 ALA 74 -11.565 -3.767 -4.269 554 H ARG 75 HN ARG 75 -13.540 -5.521 -0.869 555 HA ARG 75 HA ARG 75 -16.273 -4.717 -0.735 556 HE ARG 75 HE ARG 75 -11.401 -5.343 1.891 557 HB2 ARG 75 HB2 ARG 75 -16.098 -5.312 1.624 558 HB3 ARG 75 HB1 ARG 75 -15.363 -6.554 0.622 559 HG2 ARG 75 HG2 ARG 75 -13.473 -4.510 1.482 560 HG3 ARG 75 HG1 ARG 75 -14.225 -5.377 2.822 561 HD2 ARG 75 HD2 ARG 75 -13.382 -7.427 2.133 562 HD3 ARG 75 HD1 ARG 75 -13.111 -6.877 0.482 563 HH11 ARG 75 HH11 ARG 75 -12.005 -8.776 1.855 564 HH12 ARG 75 HH12 ARG 75 -10.376 -9.197 2.264 565 HH21 ARG 75 HH21 ARG 75 -9.254 -5.890 2.427 566 HH22 ARG 75 HH22 ARG 75 -8.813 -7.557 2.589 567 H GLU 76 HN GLU 76 -13.585 -2.838 -0.890 568 HA GLU 76 HA GLU 76 -13.458 -0.557 -0.746 569 HB2 GLU 76 HB2 GLU 76 -15.590 -0.645 1.399 570 HB3 GLU 76 HB1 GLU 76 -14.934 0.772 0.609 571 HG2 GLU 76 HG2 GLU 76 -15.896 0.125 -1.493 572 HG3 GLU 76 HG1 GLU 76 -16.463 -1.388 -0.799 573 H LEU 77 HN LEU 77 -11.970 -2.460 0.325 574 HA LEU 77 HA LEU 77 -10.665 -3.169 2.105 575 HG LEU 77 HG LEU 77 -9.479 -2.828 0.208 576 HB2 LEU 77 HB2 LEU 77 -10.033 -0.380 1.302 577 HB3 LEU 77 HB1 LEU 77 -9.075 -1.149 2.554 578 HD11 LEU 77 HD11 LEU 77 -7.814 -1.617 -1.161 579 HD12 LEU 77 HD12 LEU 77 -8.016 -0.232 -0.089 580 HD13 LEU 77 HD13 LEU 77 -9.378 -0.827 -1.040 581 HD21 LEU 77 HD23 LEU 77 -7.041 -1.934 1.724 582 HD22 LEU 77 HD21 LEU 77 -7.081 -3.193 0.488 583 HD23 LEU 77 HD22 LEU 77 -7.967 -3.413 1.998 584 H THR 78 HN THR 78 -13.140 -2.508 3.105 585 HA THR 78 HA THR 78 -14.333 -1.822 4.923 586 HB THR 78 HB THR 78 -13.632 -2.878 6.935 587 HG1 THR 78 HG1 THR 78 -11.537 -3.283 7.411 588 HG21 THR 78 HG23 THR 78 -13.127 -5.107 6.191 589 HG22 THR 78 HG21 THR 78 -12.460 -4.499 4.677 590 HG23 THR 78 HG22 THR 78 -14.187 -4.357 5.000 591 H GLU 79 HN GLU 79 -14.120 -0.867 7.218 592 HA GLU 79 HA GLU 79 -13.186 1.802 6.954 593 HB2 GLU 79 HB2 GLU 79 -13.930 0.322 9.488 594 HB3 GLU 79 HB1 GLU 79 -13.846 2.067 9.287 595 HG2 GLU 79 HG2 GLU 79 -15.701 2.007 7.732 596 HG3 GLU 79 HG1 GLU 79 -15.761 0.249 7.844 597 H SER 80 HN SER 80 -12.065 -1.066 8.618 598 HA SER 80 HA SER 80 -9.827 0.107 9.894 599 HG SER 80 HG SER 80 -8.727 -1.434 11.206 600 HB2 SER 80 HB2 SER 80 -10.988 -1.927 10.692 601 HB3 SER 80 HB1 SER 80 -10.329 -2.810 9.318 602 H GLU 81 HN GLU 81 -9.941 -2.107 7.004 603 HA GLU 81 HA GLU 81 -7.221 -2.259 6.675 604 HB2 GLU 81 HB2 GLU 81 -9.433 -3.196 5.314 605 HB3 GLU 81 HB1 GLU 81 -8.638 -2.162 4.142 606 HG2 GLU 81 HG2 GLU 81 -7.369 -4.445 5.607 607 HG3 GLU 81 HG1 GLU 81 -7.871 -4.436 3.919 608 H THR 82 HN THR 82 -9.379 0.195 5.137 609 HA THR 82 HA THR 82 -7.388 1.411 3.633 610 HB THR 82 HB THR 82 -8.721 3.468 3.722 611 HG1 THR 82 HG1 THR 82 -10.318 3.722 5.151 612 HG21 THR 82 HG23 THR 82 -10.251 0.908 3.293 613 HG22 THR 82 HG21 THR 82 -9.358 1.841 2.090 614 HG23 THR 82 HG22 THR 82 -10.835 2.497 2.799 615 H LYS 83 HN LYS 83 -7.970 1.444 7.043 616 HA LYS 83 HA LYS 83 -6.548 3.792 7.731 617 HB2 LYS 83 HB2 LYS 83 -7.995 2.357 9.284 618 HB3 LYS 83 HB1 LYS 83 -6.632 1.252 9.379 619 HG2 LYS 83 HG2 LYS 83 -5.244 3.001 10.320 620 HG3 LYS 83 HG1 LYS 83 -6.574 4.151 10.179 621 HD2 LYS 83 HD2 LYS 83 -6.367 3.288 12.463 622 HD3 LYS 83 HD1 LYS 83 -7.904 2.821 11.732 623 HE2 LYS 83 HE2 LYS 83 -6.903 0.961 12.955 624 HE3 LYS 83 HE1 LYS 83 -7.004 0.610 11.230 625 HZ1 LYS 83 HZ3 LYS 83 -4.873 -0.060 12.121 626 HZ2 LYS 83 HZ1 LYS 83 -4.575 1.506 12.687 627 HZ3 LYS 83 HZ2 LYS 83 -4.662 1.211 11.025 628 H SER 84 HN SER 84 -5.619 0.463 7.017 629 HA SER 84 HA SER 84 -2.944 0.536 7.693 630 HG SER 84 HG SER 84 -3.882 -2.177 7.745 631 HB2 SER 84 HB2 SER 84 -4.199 -0.865 5.325 632 HB3 SER 84 HB1 SER 84 -2.742 -1.323 6.177 633 H LEU 85 HN LEU 85 -4.502 1.131 4.578 634 HA LEU 85 HA LEU 85 -2.330 2.098 3.165 635 HG LEU 85 HG LEU 85 -4.770 0.405 2.348 636 HB2 LEU 85 HB2 LEU 85 -5.287 2.601 3.102 637 HB3 LEU 85 HB1 LEU 85 -4.236 3.334 1.915 638 HD11 LEU 85 HD11 LEU 85 -5.330 2.294 0.071 639 HD12 LEU 85 HD12 LEU 85 -6.507 1.499 1.118 640 HD13 LEU 85 HD13 LEU 85 -5.541 0.545 -0.005 641 HD21 LEU 85 HD23 LEU 85 -2.405 0.703 1.856 642 HD22 LEU 85 HD21 LEU 85 -2.812 1.688 0.450 643 HD23 LEU 85 HD22 LEU 85 -3.253 -0.017 0.493 644 H MET 86 HN MET 86 -4.631 3.674 5.251 645 HA MET 86 HA MET 86 -3.860 6.326 5.035 646 HB2 MET 86 HB2 MET 86 -5.840 5.163 6.297 647 HB3 MET 86 HB1 MET 86 -4.722 5.153 7.658 648 HG2 MET 86 HG2 MET 86 -5.150 7.264 8.079 649 HG3 MET 86 HG1 MET 86 -4.691 7.681 6.437 650 HE1 MET 86 HE3 MET 86 -7.529 8.368 4.505 651 HE2 MET 86 HE1 MET 86 -7.246 6.626 4.443 652 HE3 MET 86 HE2 MET 86 -5.882 7.735 4.595 653 H ASP 87 HN ASP 87 -2.792 3.831 7.293 654 HA ASP 87 HA ASP 87 -0.853 5.392 8.658 655 HB2 ASP 87 HB2 ASP 87 -1.209 2.413 8.448 656 HB3 ASP 87 HB1 ASP 87 -0.138 3.218 9.594 657 H ALA 88 HN ALA 88 -0.776 4.357 5.542 658 HA ALA 88 HA ALA 88 1.754 3.118 5.311 659 HB1 ALA 88 HB3 ALA 88 1.294 2.965 3.095 660 HB2 ALA 88 HB1 ALA 88 0.518 4.550 3.033 661 HB3 ALA 88 HB2 ALA 88 -0.328 3.182 3.751 662 H ALA 89 HN ALA 89 0.776 6.489 5.412 663 HA ALA 89 HA ALA 89 3.536 7.287 5.451 664 HB1 ALA 89 HB3 ALA 89 3.213 7.038 3.045 665 HB2 ALA 89 HB1 ALA 89 3.505 8.720 3.488 666 HB3 ALA 89 HB2 ALA 89 1.869 8.180 3.100 667 H ASP 90 HN ASP 90 0.704 9.106 4.329 668 HA ASP 90 HA ASP 90 1.239 11.073 6.440 669 HB2 ASP 90 HB2 ASP 90 0.785 11.566 3.843 670 HB3 ASP 90 HB1 ASP 90 -0.877 11.576 4.420 671 H ASN 91 HN ASN 91 0.437 9.668 8.056 672 HA ASN 91 HA ASN 91 -2.447 9.132 7.973 673 HB2 ASN 91 HB2 ASN 91 -1.580 7.770 10.176 674 HB3 ASN 91 HB1 ASN 91 -1.769 7.082 8.569 675 HD21 ASN 91 HD21 ASN 91 0.059 6.749 7.281 676 HD22 ASN 91 HD22 ASN 91 1.646 6.714 7.960 677 H ASP 92 HN ASP 92 0.041 10.216 10.265 678 HA ASP 92 HA ASP 92 -1.891 11.065 12.189 679 HB2 ASP 92 HB2 ASP 92 0.318 10.263 12.861 680 HB3 ASP 92 HB1 ASP 92 1.073 11.621 12.030 681 H GLY 93 HN GLY 93 -1.265 12.502 9.288 682 HA2 GLY 93 HA2 GLY 93 -1.782 15.142 10.492 683 HA3 GLY 93 HA1 GLY 93 -0.625 14.953 9.188 684 H ASP 94 HN ASP 94 -1.377 14.524 7.086 685 HA ASP 94 HA ASP 94 -3.879 15.814 6.520 686 HB2 ASP 94 HB2 ASP 94 -1.820 14.560 4.704 687 HB3 ASP 94 HB1 ASP 94 -3.248 15.417 4.137 688 H GLY 95 HN GLY 95 -2.592 12.556 5.781 689 HA2 GLY 95 HA2 GLY 95 -4.031 10.617 6.128 690 HA3 GLY 95 HA1 GLY 95 -5.393 11.626 5.669 691 H LYS 96 HN LYS 96 -2.581 12.094 3.783 692 HA LYS 96 HA LYS 96 -3.796 10.533 1.621 693 HB2 LYS 96 HB2 LYS 96 -3.667 12.415 0.408 694 HB3 LYS 96 HB1 LYS 96 -2.884 13.245 1.738 695 HG2 LYS 96 HG2 LYS 96 -1.437 11.630 -0.363 696 HG3 LYS 96 HG1 LYS 96 -1.679 13.368 -0.430 697 HD2 LYS 96 HD2 LYS 96 0.082 11.789 1.412 698 HD3 LYS 96 HD1 LYS 96 0.468 13.180 0.410 699 HE2 LYS 96 HE2 LYS 96 -1.238 13.218 2.894 700 HE3 LYS 96 HE1 LYS 96 0.423 13.795 2.763 701 HZ1 LYS 96 HZ3 LYS 96 -1.134 15.622 2.627 702 HZ2 LYS 96 HZ1 LYS 96 -1.924 14.901 1.317 703 HZ3 LYS 96 HZ2 LYS 96 -0.331 15.443 1.149 704 H ILE 97 HN ILE 97 -2.411 9.409 0.162 705 HA ILE 97 HA ILE 97 0.286 8.877 1.210 706 HB ILE 97 HB ILE 97 -1.404 6.786 -0.136 707 HG12 ILE 97 HG12 ILE 97 -2.393 7.297 2.045 708 HG13 ILE 97 HG11 ILE 97 -1.611 5.721 2.042 709 HG21 ILE 97 HG21 ILE 97 0.383 5.301 0.834 710 HG22 ILE 97 HG22 ILE 97 1.277 6.775 1.224 711 HG23 ILE 97 HG23 ILE 97 0.902 6.388 -0.453 712 HD11 ILE 97 HD13 ILE 97 0.396 6.919 3.063 713 HD12 ILE 97 HD11 ILE 97 -1.018 6.656 4.082 714 HD13 ILE 97 HD12 ILE 97 -0.727 8.239 3.374 715 H GLY 98 HN GLY 98 1.377 10.126 -0.340 716 HA2 GLY 98 HA2 GLY 98 1.077 9.303 -3.116 717 HA3 GLY 98 HA1 GLY 98 1.828 10.790 -2.549 718 H ALA 99 HN ALA 99 3.230 9.421 -4.352 719 HA ALA 99 HA ALA 99 4.843 7.289 -3.480 720 HB1 ALA 99 HB3 ALA 99 4.895 7.750 -5.781 721 HB2 ALA 99 HB1 ALA 99 6.501 8.193 -5.200 722 HB3 ALA 99 HB2 ALA 99 5.298 9.444 -5.512 723 H ASP 100 HN ASP 100 5.473 10.779 -3.366 724 HA ASP 100 HA ASP 100 7.934 10.661 -2.063 725 HB2 ASP 100 HB2 ASP 100 7.618 12.987 -1.507 726 HB3 ASP 100 HB1 ASP 100 6.951 12.702 -3.108 727 H GLU 101 HN GLU 101 4.684 11.015 -0.680 728 HA GLU 101 HA GLU 101 5.411 11.022 2.022 729 HB2 GLU 101 HB2 GLU 101 2.967 10.613 0.439 730 HB3 GLU 101 HB1 GLU 101 2.935 9.830 2.003 731 HG2 GLU 101 HG2 GLU 101 2.082 12.320 1.562 732 HG3 GLU 101 HG1 GLU 101 2.715 11.781 3.107 733 H PHE 102 HN PHE 102 4.283 8.358 -0.033 734 HA PHE 102 HA PHE 102 4.592 6.247 1.715 735 HD1 PHE 102 HD1 PHE 102 6.927 4.497 -0.432 736 HD2 PHE 102 HD2 PHE 102 2.723 3.959 -0.076 737 HE1 PHE 102 HE1 PHE 102 7.258 2.083 -0.198 738 HE2 PHE 102 HE2 PHE 102 3.050 1.532 0.147 739 HZ PHE 102 HZ PHE 102 5.324 0.587 0.087 740 HB2 PHE 102 HB2 PHE 102 3.551 6.057 -0.512 741 HB3 PHE 102 HB1 PHE 102 5.138 6.215 -1.267 742 H GLN 103 HN GLN 103 7.011 7.663 -0.477 743 HA GLN 103 HA GLN 103 9.141 5.934 0.056 744 HB2 GLN 103 HB2 GLN 103 9.124 8.874 -0.631 745 HB3 GLN 103 HB1 GLN 103 10.592 7.908 -0.549 746 HG2 GLN 103 HG2 GLN 103 8.466 6.788 -2.216 747 HG3 GLN 103 HG1 GLN 103 9.119 8.326 -2.760 748 HE21 GLN 103 HE21 GLN 103 10.182 7.556 -4.529 749 HE22 GLN 103 HE22 GLN 103 11.547 6.500 -4.439 750 H GLU 104 HN GLU 104 7.798 8.544 1.948 751 HA GLU 104 HA GLU 104 10.035 8.941 3.669 752 HB2 GLU 104 HB2 GLU 104 7.104 9.511 4.125 753 HB3 GLU 104 HB1 GLU 104 8.385 9.996 5.221 754 HG2 GLU 104 HG2 GLU 104 8.182 10.859 2.350 755 HG3 GLU 104 HG1 GLU 104 7.625 11.804 3.728 756 H MET 105 HN MET 105 7.197 6.850 3.816 757 HA MET 105 HA MET 105 7.545 5.871 6.414 758 HB2 MET 105 HB2 MET 105 5.625 5.547 4.626 759 HB3 MET 105 HB1 MET 105 6.513 4.070 4.270 760 HG2 MET 105 HG2 MET 105 5.513 4.846 6.997 761 HG3 MET 105 HG1 MET 105 4.669 3.771 5.887 762 HE1 MET 105 HE3 MET 105 7.109 0.735 5.647 763 HE2 MET 105 HE1 MET 105 7.043 2.133 4.574 764 HE3 MET 105 HE2 MET 105 5.550 1.400 5.158 765 H VAL 106 HN VAL 106 8.532 4.348 3.333 766 HA VAL 106 HA VAL 106 9.983 2.252 4.470 767 HB VAL 106 HB VAL 106 9.305 2.192 2.143 768 HG11 VAL 106 HG11 VAL 106 11.231 4.461 1.700 769 HG12 VAL 106 HG12 VAL 106 9.471 4.571 1.667 770 HG13 VAL 106 HG13 VAL 106 10.315 3.611 0.457 771 HG21 VAL 106 HG23 VAL 106 12.279 2.146 2.605 772 HG22 VAL 106 HG21 VAL 106 11.555 1.667 1.070 773 HG23 VAL 106 HG22 VAL 106 11.162 0.781 2.542 774 H HIS 107 HN HIS 107 10.886 5.521 3.595 775 HA HIS 107 HA HIS 107 13.692 5.148 4.057 776 HD1 HIS 107 HD1 HIS 107 15.436 7.299 2.316 777 HD2 HIS 107 HD2 HIS 107 13.649 9.105 5.603 778 HE1 HIS 107 HE1 HIS 107 17.162 8.880 3.235 779 HE2 HIS 107 HE2 HIS 107 16.030 10.018 5.177 780 HB2 HIS 107 HB2 HIS 107 12.940 6.842 2.485 781 HB3 HIS 107 HB1 HIS 107 12.042 7.664 3.756 782 H SER 108 HN SER 108 10.956 6.024 5.997 783 HA SER 108 HA SER 108 12.269 7.388 8.068 784 HG SER 108 HG SER 108 10.823 6.301 10.248 785 HB2 SER 108 HB2 SER 108 9.834 7.399 7.833 786 HB3 SER 108 HB1 SER 108 9.776 5.676 8.201 Start of MODEL 8 1 HA SER 1 HA SER 1 8.558 -4.447 -2.717 2 HG SER 1 HG SER 1 6.909 -7.170 -0.193 3 H1 SER 1 HT1 SER 1 7.523 -2.684 -1.812 4 H2 SER 1 HT2 SER 1 7.757 -3.617 -0.424 5 H3 SER 1 HT3 SER 1 6.244 -3.586 -1.180 6 HB2 SER 1 HB2 SER 1 8.662 -6.596 -1.779 7 HB3 SER 1 HB1 SER 1 8.376 -5.595 -0.365 8 H ILE 2 HN ILE 2 7.300 -3.705 -4.461 9 HA ILE 2 HA ILE 2 4.749 -4.979 -4.904 10 HB ILE 2 HB ILE 2 5.968 -2.536 -5.535 11 HG12 ILE 2 HG12 ILE 2 3.857 -2.112 -4.856 12 HG13 ILE 2 HG11 ILE 2 3.489 -2.204 -6.558 13 HG21 ILE 2 HG21 ILE 2 4.863 -3.710 -8.054 14 HG22 ILE 2 HG22 ILE 2 6.585 -3.591 -7.663 15 HG23 ILE 2 HG23 ILE 2 5.608 -2.122 -7.824 16 HD11 ILE 2 HD13 ILE 2 3.125 -4.749 -5.957 17 HD12 ILE 2 HD11 ILE 2 1.864 -3.528 -5.765 18 HD13 ILE 2 HD12 ILE 2 2.825 -4.026 -4.372 19 H THR 3 HN THR 3 7.719 -5.979 -5.536 20 HA THR 3 HA THR 3 8.299 -7.940 -6.647 21 HB THR 3 HB THR 3 7.250 -8.805 -8.569 22 HG1 THR 3 HG1 THR 3 6.251 -6.222 -8.858 23 HG21 THR 3 HG23 THR 3 4.798 -7.881 -7.206 24 HG22 THR 3 HG21 THR 3 6.040 -8.634 -6.205 25 HG23 THR 3 HG22 THR 3 5.357 -9.512 -7.574 26 H ASP 4 HN ASP 4 8.107 -4.712 -7.932 27 HA ASP 4 HA ASP 4 9.607 -4.967 -10.228 28 HB2 ASP 4 HB2 ASP 4 9.427 -2.783 -8.166 29 HB3 ASP 4 HB1 ASP 4 10.494 -2.630 -9.561 30 H ILE 5 HN ILE 5 11.113 -3.801 -7.181 31 HA ILE 5 HA ILE 5 13.361 -5.624 -7.810 32 HB ILE 5 HB ILE 5 13.558 -2.911 -6.521 33 HG12 ILE 5 HG12 ILE 5 14.744 -2.477 -8.847 34 HG13 ILE 5 HG11 ILE 5 13.619 -3.727 -9.344 35 HG21 ILE 5 HG21 ILE 5 15.351 -4.988 -6.496 36 HG22 ILE 5 HG22 ILE 5 15.706 -3.289 -6.179 37 HG23 ILE 5 HG23 ILE 5 15.933 -3.950 -7.800 38 HD11 ILE 5 HD13 ILE 5 12.389 -1.855 -9.765 39 HD12 ILE 5 HD11 ILE 5 13.066 -0.975 -8.396 40 HD13 ILE 5 HD12 ILE 5 11.857 -2.232 -8.124 41 H LEU 6 HN LEU 6 12.282 -7.068 -6.393 42 HA LEU 6 HA LEU 6 13.423 -7.072 -3.797 43 HG LEU 6 HG LEU 6 9.380 -5.950 -3.334 44 HB2 LEU 6 HB2 LEU 6 11.261 -7.095 -2.531 45 HB3 LEU 6 HB1 LEU 6 11.797 -5.554 -3.141 46 HD11 LEU 6 HD11 LEU 6 10.427 -5.694 -6.102 47 HD12 LEU 6 HD12 LEU 6 10.787 -4.443 -4.905 48 HD13 LEU 6 HD13 LEU 6 9.118 -4.815 -5.316 49 HD21 LEU 6 HD23 LEU 6 9.650 -8.353 -3.795 50 HD22 LEU 6 HD21 LEU 6 10.106 -7.919 -5.442 51 HD23 LEU 6 HD22 LEU 6 8.504 -7.518 -4.833 52 H SER 7 HN SER 7 12.545 -8.929 -2.392 53 HA SER 7 HA SER 7 12.705 -11.327 -3.922 54 HG SER 7 HG SER 7 13.912 -11.062 -0.454 55 HB2 SER 7 HB2 SER 7 11.784 -11.178 -1.050 56 HB3 SER 7 HB1 SER 7 12.616 -12.504 -1.859 57 H ALA 8 HN ALA 8 11.164 -12.273 -5.012 58 HA ALA 8 HA ALA 8 8.433 -11.490 -4.966 59 HB1 ALA 8 HB3 ALA 8 9.714 -12.388 -6.932 60 HB2 ALA 8 HB1 ALA 8 8.124 -13.110 -6.673 61 HB3 ALA 8 HB2 ALA 8 9.579 -13.985 -6.192 62 H GLU 9 HN GLU 9 10.148 -14.325 -3.606 63 HA GLU 9 HA GLU 9 7.821 -15.775 -2.954 64 HB2 GLU 9 HB2 GLU 9 10.610 -15.816 -1.817 65 HB3 GLU 9 HB1 GLU 9 9.370 -17.001 -1.407 66 HG2 GLU 9 HG2 GLU 9 10.434 -16.458 -4.158 67 HG3 GLU 9 HG1 GLU 9 10.938 -17.793 -3.124 68 H ASP 10 HN ASP 10 9.992 -13.934 -0.812 69 HA ASP 10 HA ASP 10 8.513 -13.950 1.448 70 HB2 ASP 10 HB2 ASP 10 10.380 -11.910 0.323 71 HB3 ASP 10 HB1 ASP 10 9.549 -11.603 1.844 72 H ILE 11 HN ILE 11 7.709 -12.308 -1.443 73 HA ILE 11 HA ILE 11 6.052 -10.309 -0.317 74 HB ILE 11 HB ILE 11 6.404 -11.515 -2.994 75 HG12 ILE 11 HG12 ILE 11 6.108 -8.650 -2.151 76 HG13 ILE 11 HG11 ILE 11 7.634 -9.530 -2.099 77 HG21 ILE 11 HG21 ILE 11 3.878 -10.138 -2.188 78 HG22 ILE 11 HG22 ILE 11 4.087 -11.608 -3.140 79 HG23 ILE 11 HG23 ILE 11 4.491 -10.041 -3.838 80 HD11 ILE 11 HD13 ILE 11 7.925 -9.399 -4.300 81 HD12 ILE 11 HD11 ILE 11 6.764 -8.074 -4.195 82 HD13 ILE 11 HD12 ILE 11 6.221 -9.694 -4.634 83 H ALA 12 HN ALA 12 5.366 -13.566 -1.569 84 HA ALA 12 HA ALA 12 2.641 -13.662 -1.075 85 HB1 ALA 12 HB3 ALA 12 4.352 -15.447 -2.054 86 HB2 ALA 12 HB1 ALA 12 2.772 -15.911 -1.417 87 HB3 ALA 12 HB2 ALA 12 4.210 -16.080 -0.412 88 H ALA 13 HN ALA 13 5.288 -14.610 1.131 89 HA ALA 13 HA ALA 13 3.539 -15.167 3.310 90 HB1 ALA 13 HB3 ALA 13 5.973 -15.881 3.075 91 HB2 ALA 13 HB1 ALA 13 5.484 -15.290 4.665 92 HB3 ALA 13 HB2 ALA 13 6.394 -14.242 3.577 93 H ALA 14 HN ALA 14 5.504 -12.421 2.448 94 HA ALA 14 HA ALA 14 4.958 -10.626 4.427 95 HB1 ALA 14 HB3 ALA 14 6.492 -9.972 2.766 96 HB2 ALA 14 HB1 ALA 14 5.142 -8.856 2.586 97 HB3 ALA 14 HB2 ALA 14 5.318 -10.206 1.474 98 H LEU 15 HN LEU 15 3.027 -11.117 1.484 99 HA LEU 15 HA LEU 15 0.930 -9.349 2.268 100 HG LEU 15 HG LEU 15 -0.625 -8.934 0.157 101 HB2 LEU 15 HB2 LEU 15 1.567 -9.968 -0.085 102 HB3 LEU 15 HB1 LEU 15 0.886 -11.547 0.203 103 HD11 LEU 15 HD11 LEU 15 -1.223 -11.185 -1.662 104 HD12 LEU 15 HD12 LEU 15 0.244 -10.261 -1.974 105 HD13 LEU 15 HD13 LEU 15 -1.319 -9.446 -1.938 106 HD21 LEU 15 HD23 LEU 15 -1.410 -11.664 1.019 107 HD22 LEU 15 HD21 LEU 15 -2.582 -10.694 0.130 108 HD23 LEU 15 HD22 LEU 15 -1.911 -10.098 1.647 109 H GLN 16 HN GLN 16 1.149 -12.900 1.957 110 HA GLN 16 HA GLN 16 -1.396 -13.505 2.982 111 HB2 GLN 16 HB2 GLN 16 1.115 -15.080 2.549 112 HB3 GLN 16 HB1 GLN 16 -0.354 -15.794 3.180 113 HG2 GLN 16 HG2 GLN 16 0.347 -15.647 0.562 114 HG3 GLN 16 HG1 GLN 16 -1.268 -15.945 1.190 115 HE21 GLN 16 HE21 GLN 16 -2.796 -14.310 1.111 116 HE22 GLN 16 HE22 GLN 16 -2.599 -12.932 0.091 117 H GLU 17 HN GLU 17 1.155 -12.242 4.778 118 HA GLU 17 HA GLU 17 1.378 -14.194 6.812 119 HB2 GLU 17 HB2 GLU 17 3.106 -12.574 6.584 120 HB3 GLU 17 HB1 GLU 17 1.970 -11.278 6.778 121 HG2 GLU 17 HG2 GLU 17 3.337 -11.603 8.767 122 HG3 GLU 17 HG1 GLU 17 1.624 -11.868 9.087 123 H CYS 18 HN CYS 18 0.149 -10.907 7.413 124 HA CYS 18 HA CYS 18 -1.847 -12.047 9.165 125 HG CYS 18 HG CYS 18 -2.696 -10.563 11.392 126 HB2 CYS 18 HB2 CYS 18 0.138 -10.173 9.501 127 HB3 CYS 18 HB1 CYS 18 -1.315 -9.187 9.314 128 H GLN 19 HN GLN 19 -1.938 -11.140 6.038 129 HA GLN 19 HA GLN 19 -3.490 -8.897 5.758 130 HB2 GLN 19 HB2 GLN 19 -2.641 -10.103 3.858 131 HB3 GLN 19 HB1 GLN 19 -3.714 -11.440 4.208 132 HG2 GLN 19 HG2 GLN 19 -5.647 -10.044 3.733 133 HG3 GLN 19 HG1 GLN 19 -4.584 -8.673 3.421 134 HE21 GLN 19 HE21 GLN 19 -5.198 -8.394 1.295 135 HE22 GLN 19 HE22 GLN 19 -4.824 -9.533 0.052 136 H ASP 20 HN ASP 20 -5.569 -8.342 5.770 137 HA ASP 20 HA ASP 20 -7.838 -9.875 6.118 138 HB2 ASP 20 HB2 ASP 20 -6.232 -9.663 8.535 139 HB3 ASP 20 HB1 ASP 20 -7.850 -9.021 8.779 140 HA PRO 21 HA PRO 21 -9.673 -5.808 6.115 141 HB2 PRO 21 HB2 PRO 21 -11.959 -6.074 7.403 142 HB3 PRO 21 HB1 PRO 21 -11.658 -6.995 5.939 143 HG2 PRO 21 HG2 PRO 21 -11.467 -7.843 8.803 144 HG3 PRO 21 HG1 PRO 21 -12.197 -8.699 7.431 145 HD2 PRO 21 HD2 PRO 21 -9.689 -9.201 8.379 146 HD3 PRO 21 HD1 PRO 21 -10.196 -9.488 6.709 147 H ASP 22 HN ASP 22 -7.671 -5.525 7.820 148 HA ASP 22 HA ASP 22 -8.455 -3.466 9.561 149 HB2 ASP 22 HB2 ASP 22 -9.305 -5.385 10.914 150 HB3 ASP 22 HB1 ASP 22 -7.667 -6.022 10.982 151 H THR 23 HN THR 23 -6.084 -6.056 9.849 152 HA THR 23 HA THR 23 -3.895 -4.263 10.065 153 HB THR 23 HB THR 23 -3.614 -6.457 11.008 154 HG1 THR 23 HG1 THR 23 -1.927 -6.210 8.726 155 HG21 THR 23 HG23 THR 23 -3.607 -7.700 8.277 156 HG22 THR 23 HG21 THR 23 -5.088 -7.571 9.226 157 HG23 THR 23 HG22 THR 23 -3.720 -8.483 9.854 158 H PHE 24 HN PHE 24 -4.882 -6.410 7.378 159 HA PHE 24 HA PHE 24 -4.915 -5.973 5.175 160 HD1 PHE 24 HD2 PHE 24 -5.784 -5.606 3.696 161 HD2 PHE 24 HD1 PHE 24 -4.132 -1.676 3.914 162 HE1 PHE 24 HE2 PHE 24 -6.760 -5.080 1.517 163 HE2 PHE 24 HE1 PHE 24 -5.144 -1.165 1.733 164 HZ PHE 24 HZ PHE 24 -6.440 -2.851 0.539 165 HB2 PHE 24 HB2 PHE 24 -4.884 -3.481 6.066 166 HB3 PHE 24 HB1 PHE 24 -3.292 -3.513 5.330 167 H GLU 25 HN GLU 25 -3.551 -5.812 3.348 168 HA GLU 25 HA GLU 25 -1.155 -7.348 3.842 169 HB2 GLU 25 HB2 GLU 25 -1.333 -8.256 1.762 170 HB3 GLU 25 HB1 GLU 25 -2.956 -8.276 2.449 171 HG2 GLU 25 HG2 GLU 25 -1.949 -6.170 0.605 172 HG3 GLU 25 HG1 GLU 25 -2.721 -7.632 0.012 173 HA PRO 26 HA PRO 26 -0.013 -3.819 0.529 174 HB2 PRO 26 HB2 PRO 26 -0.190 -1.540 2.259 175 HB3 PRO 26 HB1 PRO 26 -0.887 -1.800 0.681 176 HG2 PRO 26 HG2 PRO 26 -2.173 -1.818 3.173 177 HG3 PRO 26 HG1 PRO 26 -2.876 -2.044 1.581 178 HD2 PRO 26 HD2 PRO 26 -2.524 -3.972 3.628 179 HD3 PRO 26 HD1 PRO 26 -3.136 -4.249 1.999 180 H GLN 27 HN GLN 27 0.300 -2.634 3.779 181 HA GLN 27 HA GLN 27 3.049 -2.116 3.583 182 HB2 GLN 27 HB2 GLN 27 1.399 -2.506 6.082 183 HB3 GLN 27 HB1 GLN 27 3.004 -1.792 6.035 184 HG2 GLN 27 HG2 GLN 27 2.159 0.002 4.610 185 HG3 GLN 27 HG1 GLN 27 0.548 -0.709 4.678 186 HE21 GLN 27 HE21 GLN 27 -0.604 -0.638 6.615 187 HE22 GLN 27 HE22 GLN 27 -0.212 0.483 7.866 188 H LYS 28 HN LYS 28 1.443 -4.964 4.967 189 HA LYS 28 HA LYS 28 3.789 -6.097 6.027 190 HB2 LYS 28 HB2 LYS 28 1.080 -7.135 5.259 191 HB3 LYS 28 HB1 LYS 28 2.341 -8.195 5.823 192 HG2 LYS 28 HG2 LYS 28 1.829 -5.834 7.464 193 HG3 LYS 28 HG1 LYS 28 0.569 -7.069 7.452 194 HD2 LYS 28 HD2 LYS 28 2.145 -7.438 9.281 195 HD3 LYS 28 HD1 LYS 28 2.231 -8.749 8.104 196 HE2 LYS 28 HE2 LYS 28 4.212 -7.727 7.105 197 HE3 LYS 28 HE1 LYS 28 4.120 -6.404 8.267 198 HZ1 LYS 28 HZ3 LYS 28 4.498 -7.968 10.050 199 HZ2 LYS 28 HZ1 LYS 28 5.746 -8.088 8.912 200 HZ3 LYS 28 HZ2 LYS 28 4.529 -9.262 8.963 201 H PHE 29 HN PHE 29 2.043 -6.459 3.011 202 HA PHE 29 HA PHE 29 3.487 -8.370 1.674 203 HD1 PHE 29 HD1 PHE 29 4.633 -6.862 -0.990 204 HD2 PHE 29 HD2 PHE 29 0.537 -7.988 -0.963 205 HE1 PHE 29 HE1 PHE 29 4.839 -7.728 -3.295 206 HE2 PHE 29 HE2 PHE 29 0.737 -8.836 -3.254 207 HZ PHE 29 HZ PHE 29 2.891 -8.702 -4.424 208 HB2 PHE 29 HB2 PHE 29 1.418 -7.171 0.913 209 HB3 PHE 29 HB1 PHE 29 2.399 -5.771 0.538 210 H PHE 30 HN PHE 30 4.067 -4.918 1.833 211 HA PHE 30 HA PHE 30 6.418 -4.916 0.234 212 HD1 PHE 30 HD1 PHE 30 4.437 -4.423 -0.901 213 HD2 PHE 30 HD2 PHE 30 4.011 -1.167 1.816 214 HE1 PHE 30 HE1 PHE 30 2.225 -3.948 -1.792 215 HE2 PHE 30 HE2 PHE 30 1.787 -0.688 0.886 216 HZ PHE 30 HZ PHE 30 0.906 -2.105 -0.918 217 HB2 PHE 30 HB2 PHE 30 5.685 -2.745 2.129 218 HB3 PHE 30 HB1 PHE 30 6.457 -2.599 0.558 219 H GLN 31 HN GLN 31 5.894 -4.201 3.649 220 HA GLN 31 HA GLN 31 8.509 -3.764 4.388 221 HB2 GLN 31 HB2 GLN 31 6.371 -3.314 5.674 222 HB3 GLN 31 HB1 GLN 31 6.432 -4.995 6.178 223 HG2 GLN 31 HG2 GLN 31 7.461 -4.053 7.948 224 HG3 GLN 31 HG1 GLN 31 8.871 -4.309 6.921 225 HE21 GLN 31 HE21 GLN 31 8.057 -2.113 5.100 226 HE22 GLN 31 HE22 GLN 31 8.442 -0.659 5.941 227 H THR 32 HN THR 32 6.748 -6.722 5.218 228 HA THR 32 HA THR 32 8.833 -8.128 6.287 229 HB THR 32 HB THR 32 6.628 -9.284 4.575 230 HG1 THR 32 HG1 THR 32 6.808 -8.504 7.284 231 HG21 THR 32 HG23 THR 32 8.458 -10.876 4.942 232 HG22 THR 32 HG21 THR 32 7.011 -11.349 5.834 233 HG23 THR 32 HG22 THR 32 8.359 -10.588 6.678 234 H SER 33 HN SER 33 7.854 -8.233 2.870 235 HA SER 33 HA SER 33 10.146 -9.836 2.170 236 HG SER 33 HG SER 33 9.637 -9.476 -0.942 237 HB2 SER 33 HB2 SER 33 7.900 -10.142 1.136 238 HB3 SER 33 HB1 SER 33 8.125 -8.611 0.300 239 H GLY 34 HN GLY 34 8.971 -6.692 1.043 240 HA2 GLY 34 HA2 GLY 34 11.658 -6.311 -0.084 241 HA3 GLY 34 HA1 GLY 34 10.246 -5.469 -0.650 242 H LEU 35 HN LEU 35 9.288 -4.040 1.384 243 HA LEU 35 HA LEU 35 10.805 -1.784 1.349 244 HG LEU 35 HG LEU 35 9.397 0.147 2.539 245 HB2 LEU 35 HB2 LEU 35 8.487 -2.725 2.705 246 HB3 LEU 35 HB1 LEU 35 9.483 -1.848 3.852 247 HD11 LEU 35 HD11 LEU 35 8.057 0.165 0.403 248 HD12 LEU 35 HD12 LEU 35 8.137 -1.596 0.437 249 HD13 LEU 35 HD13 LEU 35 9.618 -0.647 0.323 250 HD21 LEU 35 HD23 LEU 35 6.625 -1.020 2.464 251 HD22 LEU 35 HD21 LEU 35 7.085 0.672 2.650 252 HD23 LEU 35 HD22 LEU 35 7.411 -0.481 3.946 253 H SER 36 HN SER 36 10.921 -4.298 3.831 254 HA SER 36 HA SER 36 12.433 -3.377 5.781 255 HG SER 36 HG SER 36 13.662 -6.926 4.358 256 HB2 SER 36 HB2 SER 36 13.522 -5.564 5.995 257 HB3 SER 36 HB1 SER 36 11.818 -5.735 5.572 258 H LYS 37 HN LYS 37 13.767 -3.822 2.513 259 HA LYS 37 HA LYS 37 16.120 -2.330 3.430 260 HB2 LYS 37 HB2 LYS 37 16.266 -4.964 1.974 261 HB3 LYS 37 HB1 LYS 37 17.633 -3.896 2.235 262 HG2 LYS 37 HG2 LYS 37 15.993 -5.123 4.422 263 HG3 LYS 37 HG1 LYS 37 17.526 -5.762 3.836 264 HD2 LYS 37 HD2 LYS 37 18.615 -3.640 4.454 265 HD3 LYS 37 HD1 LYS 37 17.078 -3.057 5.095 266 HE2 LYS 37 HE2 LYS 37 18.480 -3.890 6.892 267 HE3 LYS 37 HE1 LYS 37 17.057 -4.913 6.700 268 HZ1 LYS 37 HZ3 LYS 37 18.428 -6.473 5.430 269 HZ2 LYS 37 HZ1 LYS 37 19.021 -6.256 7.000 270 HZ3 LYS 37 HZ2 LYS 37 19.789 -5.505 5.693 271 H MET 38 HN MET 38 14.087 -3.267 0.723 272 HA MET 38 HA MET 38 15.521 -2.488 -1.459 273 HB2 MET 38 HB2 MET 38 12.613 -1.837 -1.008 274 HB3 MET 38 HB1 MET 38 13.430 -1.998 -2.553 275 HG2 MET 38 HG2 MET 38 12.937 -4.149 -0.548 276 HG3 MET 38 HG1 MET 38 12.182 -3.984 -2.116 277 HE1 MET 38 HE3 MET 38 14.330 -6.347 -0.470 278 HE2 MET 38 HE1 MET 38 14.736 -7.151 -1.986 279 HE3 MET 38 HE2 MET 38 13.069 -6.680 -1.657 280 H SER 39 HN SER 39 15.871 -0.639 -2.629 281 HA SER 39 HA SER 39 16.319 1.739 -1.143 282 HG SER 39 HG SER 39 18.777 1.236 -3.515 283 HB2 SER 39 HB2 SER 39 16.433 1.278 -4.131 284 HB3 SER 39 HB1 SER 39 17.126 2.654 -3.269 285 H ALA 40 HN ALA 40 15.627 3.905 -2.192 286 HA ALA 40 HA ALA 40 12.823 4.153 -1.890 287 HB1 ALA 40 HB3 ALA 40 14.608 6.214 -3.154 288 HB2 ALA 40 HB1 ALA 40 14.553 5.924 -1.415 289 HB3 ALA 40 HB2 ALA 40 13.102 6.464 -2.264 290 H SER 41 HN SER 41 14.907 4.232 -4.780 291 HA SER 41 HA SER 41 13.194 5.028 -6.713 292 HG SER 41 HG SER 41 16.028 2.230 -7.467 293 HB2 SER 41 HB2 SER 41 14.505 3.575 -8.273 294 HB3 SER 41 HB1 SER 41 15.496 4.581 -7.217 295 H GLN 42 HN GLN 42 13.680 1.589 -5.894 296 HA GLN 42 HA GLN 42 11.696 0.594 -7.583 297 HB2 GLN 42 HB2 GLN 42 11.695 -1.430 -6.171 298 HB3 GLN 42 HB1 GLN 42 13.334 -0.853 -6.483 299 HG2 GLN 42 HG2 GLN 42 13.524 -1.233 -4.287 300 HG3 GLN 42 HG1 GLN 42 12.915 0.421 -4.225 301 HE21 GLN 42 HE21 GLN 42 12.077 -2.949 -3.883 302 HE22 GLN 42 HE22 GLN 42 10.629 -2.704 -2.976 303 H VAL 43 HN VAL 43 11.460 2.165 -4.542 304 HA VAL 43 HA VAL 43 8.894 1.305 -3.754 305 HB VAL 43 HB VAL 43 9.909 4.077 -3.207 306 HG11 VAL 43 HG11 VAL 43 8.069 2.198 -1.752 307 HG12 VAL 43 HG12 VAL 43 7.651 3.730 -2.518 308 HG13 VAL 43 HG13 VAL 43 8.667 3.713 -1.077 309 HG21 VAL 43 HG23 VAL 43 10.879 3.025 -1.118 310 HG22 VAL 43 HG21 VAL 43 11.743 2.734 -2.621 311 HG23 VAL 43 HG22 VAL 43 10.715 1.478 -1.942 312 H LYS 44 HN LYS 44 9.956 3.779 -6.010 313 HA LYS 44 HA LYS 44 7.612 5.214 -6.387 314 HB2 LYS 44 HB2 LYS 44 9.843 4.423 -8.220 315 HB3 LYS 44 HB1 LYS 44 8.431 5.234 -8.881 316 HG2 LYS 44 HG2 LYS 44 9.339 7.165 -8.323 317 HG3 LYS 44 HG1 LYS 44 9.172 6.707 -6.641 318 HD2 LYS 44 HD2 LYS 44 11.457 7.339 -7.093 319 HD3 LYS 44 HD1 LYS 44 11.363 5.617 -6.720 320 HE2 LYS 44 HE2 LYS 44 12.795 5.792 -8.587 321 HE3 LYS 44 HE1 LYS 44 11.244 5.223 -9.200 322 HZ1 LYS 44 HZ3 LYS 44 12.162 6.953 -10.608 323 HZ2 LYS 44 HZ1 LYS 44 12.205 8.028 -9.301 324 HZ3 LYS 44 HZ2 LYS 44 10.721 7.473 -9.892 325 H ASP 45 HN ASP 45 8.606 2.086 -7.626 326 HA ASP 45 HA ASP 45 6.303 1.655 -9.224 327 HB2 ASP 45 HB2 ASP 45 8.583 0.010 -8.230 328 HB3 ASP 45 HB1 ASP 45 7.198 -0.782 -8.940 329 H ILE 46 HN ILE 46 7.328 0.805 -5.936 330 HA ILE 46 HA ILE 46 5.294 -0.873 -5.197 331 HB ILE 46 HB ILE 46 7.006 1.052 -3.725 332 HG12 ILE 46 HG12 ILE 46 7.815 -0.959 -2.658 333 HG13 ILE 46 HG11 ILE 46 6.581 -1.912 -3.452 334 HG21 ILE 46 HG21 ILE 46 4.604 -0.294 -2.561 335 HG22 ILE 46 HG22 ILE 46 5.142 1.378 -2.394 336 HG23 ILE 46 HG23 ILE 46 6.017 0.088 -1.573 337 HD11 ILE 46 HD13 ILE 46 7.633 -1.227 -5.630 338 HD12 ILE 46 HD11 ILE 46 8.595 -2.287 -4.603 339 HD13 ILE 46 HD12 ILE 46 8.956 -0.569 -4.668 340 H PHE 47 HN PHE 47 5.430 2.620 -4.681 341 HA PHE 47 HA PHE 47 3.083 3.383 -3.763 342 HD1 PHE 47 HD1 PHE 47 1.895 5.664 -3.889 343 HD2 PHE 47 HD2 PHE 47 3.763 5.760 -7.710 344 HE1 PHE 47 HE1 PHE 47 0.186 7.238 -4.688 345 HE2 PHE 47 HE2 PHE 47 2.059 7.344 -8.510 346 HZ PHE 47 HZ PHE 47 0.264 8.085 -6.995 347 HB2 PHE 47 HB2 PHE 47 4.534 5.081 -4.474 348 HB3 PHE 47 HB1 PHE 47 4.653 4.435 -6.091 349 H ARG 48 HN ARG 48 3.560 2.248 -7.029 350 HA ARG 48 HA ARG 48 1.059 2.801 -8.093 351 HE ARG 48 HE ARG 48 0.643 3.876 -10.048 352 HB2 ARG 48 HB2 ARG 48 2.858 0.493 -8.806 353 HB3 ARG 48 HB1 ARG 48 1.596 1.188 -9.818 354 HG2 ARG 48 HG2 ARG 48 4.178 2.451 -8.958 355 HG3 ARG 48 HG1 ARG 48 3.648 2.067 -10.596 356 HD2 ARG 48 HD2 ARG 48 2.500 4.171 -8.748 357 HD3 ARG 48 HD1 ARG 48 3.438 4.445 -10.223 358 HH11 ARG 48 HH11 ARG 48 3.471 3.506 -12.048 359 HH12 ARG 48 HH12 ARG 48 2.570 3.400 -13.525 360 HH21 ARG 48 HH21 ARG 48 -0.548 3.732 -11.980 361 HH22 ARG 48 HH22 ARG 48 0.284 3.532 -13.486 362 H PHE 49 HN PHE 49 2.038 0.082 -6.038 363 HA PHE 49 HA PHE 49 0.058 -1.711 -6.481 364 HD1 PHE 49 HD1 PHE 49 -1.307 -2.053 -3.107 365 HD2 PHE 49 HD2 PHE 49 2.362 0.105 -2.982 366 HE1 PHE 49 HE1 PHE 49 -1.946 -1.101 -0.942 367 HE2 PHE 49 HE2 PHE 49 1.719 1.072 -0.814 368 HZ PHE 49 HZ PHE 49 -0.444 0.481 0.204 369 HB2 PHE 49 HB2 PHE 49 0.680 -2.649 -4.505 370 HB3 PHE 49 HB1 PHE 49 2.011 -1.518 -4.649 371 H ILE 50 HN ILE 50 -0.244 1.000 -4.126 372 HA ILE 50 HA ILE 50 -3.006 0.610 -3.731 373 HB ILE 50 HB ILE 50 -2.753 3.259 -3.134 374 HG12 ILE 50 HG12 ILE 50 -0.026 2.092 -2.636 375 HG13 ILE 50 HG11 ILE 50 -0.396 3.407 -3.748 376 HG21 ILE 50 HG21 ILE 50 -1.749 1.852 -0.912 377 HG22 ILE 50 HG22 ILE 50 -2.953 0.863 -1.732 378 HG23 ILE 50 HG23 ILE 50 -3.364 2.487 -1.200 379 HD11 ILE 50 HD13 ILE 50 -0.939 3.533 -0.796 380 HD12 ILE 50 HD11 ILE 50 -0.955 4.856 -1.958 381 HD13 ILE 50 HD12 ILE 50 0.569 4.081 -1.526 382 H ASP 51 HN ASP 51 -3.990 3.381 -4.272 383 HA ASP 51 HA ASP 51 -4.987 2.913 -6.825 384 HB2 ASP 51 HB2 ASP 51 -5.053 5.127 -4.859 385 HB3 ASP 51 HB1 ASP 51 -5.468 5.531 -6.528 386 H ASN 52 HN ASN 52 -4.861 4.784 -8.508 387 HA ASN 52 HA ASN 52 -2.036 5.013 -9.272 388 HB2 ASN 52 HB2 ASN 52 -3.644 3.781 -10.759 389 HB3 ASN 52 HB1 ASN 52 -4.453 5.317 -11.054 390 HD21 ASN 52 HD21 ASN 52 -3.154 3.586 -12.951 391 HD22 ASN 52 HD22 ASN 52 -1.893 4.511 -13.685 392 H ASP 53 HN ASP 53 -2.786 6.921 -7.456 393 HA ASP 53 HA ASP 53 -2.344 9.173 -7.184 394 HB2 ASP 53 HB2 ASP 53 -2.817 9.605 -10.137 395 HB3 ASP 53 HB1 ASP 53 -1.997 10.675 -9.006 396 H GLN 54 HN GLN 54 -4.853 8.481 -9.572 397 HA GLN 54 HA GLN 54 -7.024 8.983 -9.726 398 HB2 GLN 54 HB2 GLN 54 -6.926 9.583 -6.788 399 HB3 GLN 54 HB1 GLN 54 -8.265 8.952 -7.738 400 HG2 GLN 54 HG2 GLN 54 -6.963 6.904 -8.168 401 HG3 GLN 54 HG1 GLN 54 -5.695 7.527 -7.113 402 HE21 GLN 54 HE21 GLN 54 -5.921 7.375 -4.955 403 HE22 GLN 54 HE22 GLN 54 -7.211 6.549 -4.175 404 H SER 55 HN SER 55 -5.650 11.373 -7.454 405 HA SER 55 HA SER 55 -6.511 13.503 -9.225 406 HG SER 55 HG SER 55 -7.038 15.486 -7.574 407 HB2 SER 55 HB2 SER 55 -8.486 13.090 -7.783 408 HB3 SER 55 HB1 SER 55 -7.487 13.387 -6.360 409 H GLY 56 HN GLY 56 -3.950 12.510 -8.364 410 HA2 GLY 56 HA2 GLY 56 -2.029 13.964 -8.150 411 HA3 GLY 56 HA1 GLY 56 -2.985 14.981 -7.076 412 H TYR 57 HN TYR 57 -4.023 12.519 -5.733 413 HA TYR 57 HA TYR 57 -1.775 11.277 -4.463 414 HD1 TYR 57 HD1 TYR 57 -4.784 14.043 -3.086 415 HD2 TYR 57 HD2 TYR 57 -0.649 14.678 -3.736 416 HE1 TYR 57 HE1 TYR 57 -5.246 16.409 -3.639 417 HE2 TYR 57 HE2 TYR 57 -1.074 17.042 -4.275 418 HH TYR 57 HH TYR 57 -2.915 18.448 -5.057 419 HB2 TYR 57 HB2 TYR 57 -3.160 12.499 -2.271 420 HB3 TYR 57 HB1 TYR 57 -1.469 12.653 -2.701 421 H LEU 58 HN LEU 58 -2.517 9.898 -2.641 422 HA LEU 58 HA LEU 58 -5.212 8.870 -3.219 423 HG LEU 58 HG LEU 58 -1.957 8.033 -3.726 424 HB2 LEU 58 HB2 LEU 58 -3.097 7.413 -1.661 425 HB3 LEU 58 HB1 LEU 58 -4.438 6.747 -2.580 426 HD11 LEU 58 HD11 LEU 58 -2.626 5.314 -3.025 427 HD12 LEU 58 HD12 LEU 58 -1.081 5.995 -3.553 428 HD13 LEU 58 HD13 LEU 58 -2.276 5.471 -4.746 429 HD21 LEU 58 HD23 LEU 58 -3.999 6.662 -5.390 430 HD22 LEU 58 HD21 LEU 58 -2.824 7.897 -5.824 431 HD23 LEU 58 HD22 LEU 58 -4.264 8.338 -4.910 432 H ASP 59 HN ASP 59 -6.661 8.429 -1.445 433 HA ASP 59 HA ASP 59 -5.826 9.414 1.165 434 HB2 ASP 59 HB2 ASP 59 -6.613 11.388 -0.200 435 HB3 ASP 59 HB1 ASP 59 -8.215 10.652 -0.202 436 H GLY 60 HN GLY 60 -7.558 9.229 2.807 437 HA2 GLY 60 HA2 GLY 60 -8.270 6.702 3.316 438 HA3 GLY 60 HA1 GLY 60 -9.202 8.057 3.898 439 H ASP 61 HN ASP 61 -10.189 8.849 1.284 440 HA ASP 61 HA ASP 61 -12.451 7.047 1.261 441 HB2 ASP 61 HB2 ASP 61 -12.047 9.245 -0.732 442 HB3 ASP 61 HB1 ASP 61 -13.549 8.638 -0.042 443 H GLU 62 HN GLU 62 -9.885 8.043 -0.909 444 HA GLU 62 HA GLU 62 -10.798 6.409 -3.065 445 HB2 GLU 62 HB2 GLU 62 -8.153 7.796 -2.788 446 HB3 GLU 62 HB1 GLU 62 -8.953 7.280 -4.268 447 HG2 GLU 62 HG2 GLU 62 -10.024 9.345 -2.404 448 HG3 GLU 62 HG1 GLU 62 -9.082 9.709 -3.844 449 H LEU 63 HN LEU 63 -8.455 6.087 -0.493 450 HA LEU 63 HA LEU 63 -6.739 4.197 -1.472 451 HG LEU 63 HG LEU 63 -6.460 6.332 0.811 452 HB2 LEU 63 HB2 LEU 63 -7.879 4.502 1.304 453 HB3 LEU 63 HB1 LEU 63 -6.629 3.339 0.935 454 HD11 LEU 63 HD11 LEU 63 -4.224 5.035 1.999 455 HD12 LEU 63 HD12 LEU 63 -5.720 4.485 2.766 456 HD13 LEU 63 HD13 LEU 63 -5.343 6.205 2.687 457 HD21 LEU 63 HD23 LEU 63 -4.636 4.342 -0.477 458 HD22 LEU 63 HD21 LEU 63 -4.131 5.982 -0.065 459 HD23 LEU 63 HD22 LEU 63 -5.452 5.727 -1.209 460 H LYS 64 HN LYS 64 -10.007 3.519 -0.148 461 HA LYS 64 HA LYS 64 -9.928 0.817 -0.327 462 HB2 LYS 64 HB2 LYS 64 -12.311 2.499 -1.073 463 HB3 LYS 64 HB1 LYS 64 -12.321 0.876 -0.416 464 HG2 LYS 64 HG2 LYS 64 -12.099 1.581 1.693 465 HG3 LYS 64 HG1 LYS 64 -10.957 2.844 1.248 466 HD2 LYS 64 HD2 LYS 64 -13.086 3.731 2.149 467 HD3 LYS 64 HD1 LYS 64 -12.744 4.277 0.506 468 HE2 LYS 64 HE2 LYS 64 -14.233 2.506 -0.354 469 HE3 LYS 64 HE1 LYS 64 -14.618 2.054 1.306 470 HZ1 LYS 64 HZ3 LYS 64 -16.310 3.496 0.366 471 HZ2 LYS 64 HZ1 LYS 64 -15.159 4.700 0.069 472 HZ3 LYS 64 HZ2 LYS 64 -15.533 4.261 1.659 473 H TYR 65 HN TYR 65 -9.963 3.059 -2.934 474 HA TYR 65 HA TYR 65 -11.016 1.231 -4.872 475 HD1 TYR 65 HD1 TYR 65 -12.429 2.579 -3.911 476 HD2 TYR 65 HD2 TYR 65 -10.634 5.764 -6.082 477 HE1 TYR 65 HE1 TYR 65 -14.206 4.110 -3.140 478 HE2 TYR 65 HE2 TYR 65 -12.407 7.290 -5.332 479 HH TYR 65 HH TYR 65 -14.732 7.152 -4.517 480 HB2 TYR 65 HB2 TYR 65 -9.372 3.684 -5.448 481 HB3 TYR 65 HB1 TYR 65 -10.486 2.874 -6.532 482 H PHE 66 HN PHE 66 -7.962 1.532 -3.373 483 HA PHE 66 HA PHE 66 -6.125 0.951 -5.331 484 HD1 PHE 66 HD2 PHE 66 -4.099 -1.181 -4.894 485 HD2 PHE 66 HD1 PHE 66 -5.993 -1.230 -1.093 486 HE1 PHE 66 HE2 PHE 66 -3.165 -3.418 -4.464 487 HE2 PHE 66 HE1 PHE 66 -5.094 -3.475 -0.663 488 HZ PHE 66 HZ PHE 66 -3.665 -4.570 -2.344 489 HB2 PHE 66 HB2 PHE 66 -4.886 0.993 -3.394 490 HB3 PHE 66 HB1 PHE 66 -6.291 0.580 -2.432 491 H LEU 67 HN LEU 67 -7.997 -1.421 -3.483 492 HA LEU 67 HA LEU 67 -7.177 -3.684 -4.972 493 HG LEU 67 HG LEU 67 -7.306 -3.763 -2.083 494 HB2 LEU 67 HB2 LEU 67 -9.411 -3.067 -3.091 495 HB3 LEU 67 HB1 LEU 67 -9.489 -4.553 -4.024 496 HD11 LEU 67 HD11 LEU 67 -9.425 -5.900 -1.926 497 HD12 LEU 67 HD12 LEU 67 -9.390 -4.400 -0.999 498 HD13 LEU 67 HD13 LEU 67 -8.144 -5.622 -0.746 499 HD21 LEU 67 HD23 LEU 67 -7.628 -6.214 -3.805 500 HD22 LEU 67 HD21 LEU 67 -6.489 -6.076 -2.465 501 HD23 LEU 67 HD22 LEU 67 -6.331 -5.022 -3.870 502 H GLN 68 HN GLN 68 -9.647 -1.308 -5.340 503 HA GLN 68 HA GLN 68 -11.169 -2.660 -7.289 504 HB2 GLN 68 HB2 GLN 68 -10.973 0.246 -6.518 505 HB3 GLN 68 HB1 GLN 68 -12.116 -0.347 -7.701 506 HG2 GLN 68 HG2 GLN 68 -12.829 -1.997 -5.852 507 HG3 GLN 68 HG1 GLN 68 -12.009 -0.868 -4.772 508 HE21 GLN 68 HE21 GLN 68 -14.835 -1.581 -4.970 509 HE22 GLN 68 HE22 GLN 68 -15.682 -0.097 -5.235 510 H LYS 69 HN LYS 69 -8.506 -0.290 -7.546 511 HA LYS 69 HA LYS 69 -8.521 0.032 -10.254 512 HB2 LYS 69 HB2 LYS 69 -6.031 -0.330 -8.597 513 HB3 LYS 69 HB1 LYS 69 -6.184 0.600 -10.081 514 HG2 LYS 69 HG2 LYS 69 -7.146 1.243 -7.332 515 HG3 LYS 69 HG1 LYS 69 -6.149 2.211 -8.408 516 HD2 LYS 69 HD2 LYS 69 -9.083 1.626 -8.667 517 HD3 LYS 69 HD1 LYS 69 -8.352 3.174 -8.264 518 HE2 LYS 69 HE2 LYS 69 -7.382 3.368 -10.443 519 HE3 LYS 69 HE1 LYS 69 -7.878 1.732 -10.868 520 HZ1 LYS 69 HZ3 LYS 69 -10.188 2.439 -10.719 521 HZ2 LYS 69 HZ1 LYS 69 -9.344 3.383 -11.843 522 HZ3 LYS 69 HZ2 LYS 69 -9.705 4.007 -10.313 523 H PHE 70 HN PHE 70 -6.772 -2.428 -8.417 524 HA PHE 70 HA PHE 70 -6.060 -3.842 -10.835 525 HD1 PHE 70 HD2 PHE 70 -4.668 -6.676 -10.262 526 HD2 PHE 70 HD1 PHE 70 -5.552 -5.117 -6.401 527 HE1 PHE 70 HE2 PHE 70 -4.618 -8.955 -9.333 528 HE2 PHE 70 HE1 PHE 70 -5.505 -7.392 -5.463 529 HZ PHE 70 HZ PHE 70 -5.038 -9.315 -6.933 530 HB2 PHE 70 HB2 PHE 70 -4.261 -4.219 -9.568 531 HB3 PHE 70 HB1 PHE 70 -5.086 -3.653 -8.130 532 H GLN 71 HN GLN 71 -7.808 -4.758 -7.853 533 HA GLN 71 HA GLN 71 -8.727 -7.214 -9.054 534 HB2 GLN 71 HB2 GLN 71 -8.083 -6.875 -6.623 535 HB3 GLN 71 HB1 GLN 71 -9.615 -6.038 -6.435 536 HG2 GLN 71 HG2 GLN 71 -10.581 -8.236 -7.494 537 HG3 GLN 71 HG1 GLN 71 -9.069 -8.922 -6.911 538 HE21 GLN 71 HE21 GLN 71 -11.187 -6.439 -5.497 539 HE22 GLN 71 HE22 GLN 71 -11.476 -7.295 -4.027 540 H SER 72 HN SER 72 -9.801 -4.131 -9.454 541 HA SER 72 HA SER 72 -11.958 -3.125 -9.439 542 HG SER 72 HG SER 72 -11.331 -2.851 -12.663 543 HB2 SER 72 HB2 SER 72 -11.856 -5.106 -11.687 544 HB3 SER 72 HB1 SER 72 -12.961 -3.739 -11.613 545 H ASP 73 HN ASP 73 -12.169 -5.047 -7.470 546 HA ASP 73 HA ASP 73 -14.987 -5.514 -7.501 547 HB2 ASP 73 HB2 ASP 73 -14.150 -7.473 -8.801 548 HB3 ASP 73 HB1 ASP 73 -13.184 -7.943 -7.406 549 H ALA 74 HN ALA 74 -12.835 -4.185 -5.903 550 HA ALA 74 HA ALA 74 -12.342 -5.640 -3.534 551 HB1 ALA 74 HB3 ALA 74 -11.153 -3.836 -2.911 552 HB2 ALA 74 HB1 ALA 74 -12.420 -2.703 -3.376 553 HB3 ALA 74 HB2 ALA 74 -11.345 -3.368 -4.605 554 H ARG 75 HN ARG 75 -13.232 -5.289 -1.454 555 HA ARG 75 HA ARG 75 -16.084 -4.767 -1.523 556 HE ARG 75 HE ARG 75 -10.901 -5.669 0.320 557 HB2 ARG 75 HB2 ARG 75 -15.578 -5.222 1.115 558 HB3 ARG 75 HB1 ARG 75 -15.977 -6.468 -0.054 559 HG2 ARG 75 HG2 ARG 75 -14.097 -7.162 1.265 560 HG3 ARG 75 HG1 ARG 75 -13.575 -6.884 -0.396 561 HD2 ARG 75 HD2 ARG 75 -12.887 -4.559 0.374 562 HD3 ARG 75 HD1 ARG 75 -13.113 -5.153 2.019 563 HH11 ARG 75 HH11 ARG 75 -12.899 -7.115 2.781 564 HH12 ARG 75 HH12 ARG 75 -11.680 -8.229 3.299 565 HH21 ARG 75 HH21 ARG 75 -9.287 -7.128 0.999 566 HH22 ARG 75 HH22 ARG 75 -9.625 -8.234 2.288 567 H GLU 76 HN GLU 76 -13.487 -2.839 -1.369 568 HA GLU 76 HA GLU 76 -13.413 -0.577 -1.097 569 HB2 GLU 76 HB2 GLU 76 -15.835 -0.765 0.687 570 HB3 GLU 76 HB1 GLU 76 -15.129 0.680 -0.013 571 HG2 GLU 76 HG2 GLU 76 -15.785 0.067 -2.197 572 HG3 GLU 76 HG1 GLU 76 -16.231 -1.553 -1.673 573 H LEU 77 HN LEU 77 -11.882 -2.265 0.195 574 HA LEU 77 HA LEU 77 -10.829 -2.865 2.169 575 HG LEU 77 HG LEU 77 -9.871 -1.142 -0.235 576 HB2 LEU 77 HB2 LEU 77 -10.462 0.078 1.743 577 HB3 LEU 77 HB1 LEU 77 -9.401 -0.916 2.722 578 HD11 LEU 77 HD11 LEU 77 -7.667 -0.477 -0.497 579 HD12 LEU 77 HD12 LEU 77 -7.300 -0.829 1.184 580 HD13 LEU 77 HD13 LEU 77 -8.273 0.578 0.783 581 HD21 LEU 77 HD23 LEU 77 -8.223 -2.996 -0.126 582 HD22 LEU 77 HD21 LEU 77 -9.787 -3.365 0.601 583 HD23 LEU 77 HD22 LEU 77 -8.415 -2.968 1.627 584 H THR 78 HN THR 78 -13.586 -2.361 2.869 585 HA THR 78 HA THR 78 -14.947 -1.640 4.602 586 HB THR 78 HB THR 78 -14.526 -2.899 6.563 587 HG1 THR 78 HG1 THR 78 -12.530 -3.374 7.283 588 HG21 THR 78 HG23 THR 78 -14.546 -4.937 5.613 589 HG22 THR 78 HG21 THR 78 -12.974 -4.702 4.847 590 HG23 THR 78 HG22 THR 78 -14.430 -4.054 4.090 591 H GLU 79 HN GLU 79 -14.433 -1.102 7.243 592 HA GLU 79 HA GLU 79 -13.606 1.624 7.146 593 HB2 GLU 79 HB2 GLU 79 -14.430 -0.201 9.380 594 HB3 GLU 79 HB1 GLU 79 -13.879 1.445 9.675 595 HG2 GLU 79 HG2 GLU 79 -16.289 0.553 8.124 596 HG3 GLU 79 HG1 GLU 79 -16.225 1.510 9.595 597 H SER 80 HN SER 80 -12.288 -1.325 8.571 598 HA SER 80 HA SER 80 -9.955 -0.026 9.656 599 HG SER 80 HG SER 80 -8.563 -1.632 10.655 600 HB2 SER 80 HB2 SER 80 -11.342 -1.981 10.596 601 HB3 SER 80 HB1 SER 80 -10.333 -2.977 9.561 602 H GLU 81 HN GLU 81 -10.620 -1.714 6.679 603 HA GLU 81 HA GLU 81 -8.030 -2.869 6.375 604 HB2 GLU 81 HB2 GLU 81 -10.357 -3.315 5.124 605 HB3 GLU 81 HB1 GLU 81 -9.587 -2.283 3.943 606 HG2 GLU 81 HG2 GLU 81 -7.838 -3.740 3.620 607 HG3 GLU 81 HG1 GLU 81 -8.202 -4.659 5.073 608 H THR 82 HN THR 82 -9.465 0.167 5.211 609 HA THR 82 HA THR 82 -7.251 1.018 3.655 610 HB THR 82 HB THR 82 -8.162 3.251 3.838 611 HG1 THR 82 HG1 THR 82 -10.198 3.391 5.148 612 HG21 THR 82 HG23 THR 82 -10.130 1.023 3.412 613 HG22 THR 82 HG21 THR 82 -9.237 1.952 2.206 614 HG23 THR 82 HG22 THR 82 -10.545 2.713 3.118 615 H LYS 83 HN LYS 83 -7.593 0.634 7.027 616 HA LYS 83 HA LYS 83 -6.251 2.800 8.134 617 HB2 LYS 83 HB2 LYS 83 -7.427 1.035 9.414 618 HB3 LYS 83 HB1 LYS 83 -6.111 -0.071 9.040 619 HG2 LYS 83 HG2 LYS 83 -5.985 0.942 11.289 620 HG3 LYS 83 HG1 LYS 83 -4.564 1.233 10.300 621 HD2 LYS 83 HD2 LYS 83 -5.177 3.251 11.479 622 HD3 LYS 83 HD1 LYS 83 -5.447 3.469 9.750 623 HE2 LYS 83 HE2 LYS 83 -7.796 3.140 10.007 624 HE3 LYS 83 HE1 LYS 83 -7.589 2.642 11.684 625 HZ1 LYS 83 HZ3 LYS 83 -8.385 4.910 11.551 626 HZ2 LYS 83 HZ1 LYS 83 -7.061 5.355 10.597 627 HZ3 LYS 83 HZ2 LYS 83 -6.825 4.886 12.205 628 H SER 84 HN SER 84 -4.968 -0.284 6.961 629 HA SER 84 HA SER 84 -2.273 0.130 7.473 630 HG SER 84 HG SER 84 -2.258 -2.332 7.450 631 HB2 SER 84 HB2 SER 84 -3.826 -1.701 5.968 632 HB3 SER 84 HB1 SER 84 -2.554 -1.120 4.908 633 H LEU 85 HN LEU 85 -4.119 0.914 4.543 634 HA LEU 85 HA LEU 85 -2.137 2.224 3.152 635 HG LEU 85 HG LEU 85 -4.749 0.406 2.760 636 HB2 LEU 85 HB2 LEU 85 -5.100 2.754 3.143 637 HB3 LEU 85 HB1 LEU 85 -3.979 3.155 1.864 638 HD11 LEU 85 HD11 LEU 85 -5.251 1.915 0.201 639 HD12 LEU 85 HD12 LEU 85 -6.452 1.476 1.413 640 HD13 LEU 85 HD13 LEU 85 -5.649 0.220 0.473 641 HD21 LEU 85 HD23 LEU 85 -2.458 0.287 2.173 642 HD22 LEU 85 HD21 LEU 85 -2.697 1.321 0.765 643 HD23 LEU 85 HD22 LEU 85 -3.369 -0.311 0.784 644 H MET 86 HN MET 86 -4.540 3.484 5.413 645 HA MET 86 HA MET 86 -3.874 6.197 5.330 646 HB2 MET 86 HB2 MET 86 -4.664 4.728 7.830 647 HB3 MET 86 HB1 MET 86 -4.942 6.424 7.476 648 HG2 MET 86 HG2 MET 86 -6.444 4.020 6.651 649 HG3 MET 86 HG1 MET 86 -7.023 5.580 7.163 650 HE1 MET 86 HE3 MET 86 -6.719 7.754 4.079 651 HE2 MET 86 HE1 MET 86 -5.076 7.260 4.434 652 HE3 MET 86 HE2 MET 86 -6.184 7.647 5.732 653 H ASP 87 HN ASP 87 -2.701 3.611 7.416 654 HA ASP 87 HA ASP 87 -0.714 5.193 8.734 655 HB2 ASP 87 HB2 ASP 87 -1.304 2.246 8.681 656 HB3 ASP 87 HB1 ASP 87 -0.022 2.956 9.658 657 H ALA 88 HN ALA 88 -0.832 4.012 5.672 658 HA ALA 88 HA ALA 88 1.654 2.662 5.401 659 HB1 ALA 88 HB3 ALA 88 1.117 2.426 3.181 660 HB2 ALA 88 HB1 ALA 88 0.220 3.948 3.131 661 HB3 ALA 88 HB2 ALA 88 -0.455 2.554 3.968 662 H ALA 89 HN ALA 89 0.755 6.038 5.254 663 HA ALA 89 HA ALA 89 3.549 6.722 5.017 664 HB1 ALA 89 HB3 ALA 89 2.884 6.417 2.666 665 HB2 ALA 89 HB1 ALA 89 3.381 8.069 3.023 666 HB3 ALA 89 HB2 ALA 89 1.668 7.679 2.853 667 H ASP 90 HN ASP 90 0.784 8.745 4.102 668 HA ASP 90 HA ASP 90 1.607 10.656 6.115 669 HB2 ASP 90 HB2 ASP 90 0.636 10.974 3.589 670 HB3 ASP 90 HB1 ASP 90 -0.807 11.264 4.555 671 H ASN 91 HN ASN 91 1.071 9.188 7.824 672 HA ASN 91 HA ASN 91 -1.739 8.658 8.384 673 HB2 ASN 91 HB2 ASN 91 0.219 8.086 10.501 674 HB3 ASN 91 HB1 ASN 91 -1.020 7.053 9.824 675 HD21 ASN 91 HD21 ASN 91 -0.251 7.080 7.221 676 HD22 ASN 91 HD22 ASN 91 1.237 6.256 7.114 677 H ASP 92 HN ASP 92 0.988 10.211 9.975 678 HA ASP 92 HA ASP 92 -0.872 11.760 11.651 679 HB2 ASP 92 HB2 ASP 92 0.787 10.343 12.829 680 HB3 ASP 92 HB1 ASP 92 2.080 11.266 12.070 681 H GLY 93 HN GLY 93 -0.222 12.499 8.870 682 HA2 GLY 93 HA2 GLY 93 0.791 15.166 9.453 683 HA3 GLY 93 HA1 GLY 93 1.688 14.241 8.265 684 H ASP 94 HN ASP 94 -1.525 13.359 7.918 685 HA ASP 94 HA ASP 94 -2.684 15.473 6.580 686 HB2 ASP 94 HB2 ASP 94 -0.626 15.136 5.086 687 HB3 ASP 94 HB1 ASP 94 -1.400 13.647 4.559 688 H GLY 95 HN GLY 95 -2.113 12.075 5.689 689 HA2 GLY 95 HA2 GLY 95 -3.825 10.415 6.345 690 HA3 GLY 95 HA1 GLY 95 -5.025 11.622 5.906 691 H LYS 96 HN LYS 96 -2.604 11.908 3.675 692 HA LYS 96 HA LYS 96 -4.035 10.183 1.779 693 HB2 LYS 96 HB2 LYS 96 -3.864 11.862 0.268 694 HB3 LYS 96 HB1 LYS 96 -3.444 12.867 1.636 695 HG2 LYS 96 HG2 LYS 96 -1.533 11.541 -0.278 696 HG3 LYS 96 HG1 LYS 96 -1.903 13.259 -0.165 697 HD2 LYS 96 HD2 LYS 96 -1.129 12.680 2.387 698 HD3 LYS 96 HD1 LYS 96 -0.089 11.618 1.430 699 HE2 LYS 96 HE2 LYS 96 -0.403 14.601 1.082 700 HE3 LYS 96 HE1 LYS 96 0.983 13.775 1.793 701 HZ1 LYS 96 HZ3 LYS 96 0.056 13.445 -1.008 702 HZ2 LYS 96 HZ1 LYS 96 1.421 12.721 -0.318 703 HZ3 LYS 96 HZ2 LYS 96 1.365 14.400 -0.522 704 H ILE 97 HN ILE 97 -2.722 9.025 0.137 705 HA ILE 97 HA ILE 97 0.006 8.465 1.099 706 HB ILE 97 HB ILE 97 -1.783 6.403 -0.155 707 HG12 ILE 97 HG12 ILE 97 -2.679 7.056 2.038 708 HG13 ILE 97 HG11 ILE 97 -2.001 5.432 2.057 709 HG21 ILE 97 HG21 ILE 97 -0.003 4.906 0.901 710 HG22 ILE 97 HG22 ILE 97 0.953 6.381 1.069 711 HG23 ILE 97 HG23 ILE 97 0.453 5.831 -0.529 712 HD11 ILE 97 HD13 ILE 97 -0.012 6.235 3.162 713 HD12 ILE 97 HD11 ILE 97 -1.445 6.708 4.073 714 HD13 ILE 97 HD12 ILE 97 -0.608 7.889 3.071 715 H GLY 98 HN GLY 98 1.061 9.678 -0.461 716 HA2 GLY 98 HA2 GLY 98 0.679 8.867 -3.247 717 HA3 GLY 98 HA1 GLY 98 1.407 10.377 -2.711 718 H ALA 99 HN ALA 99 2.745 8.935 -4.553 719 HA ALA 99 HA ALA 99 4.478 6.921 -3.652 720 HB1 ALA 99 HB3 ALA 99 5.680 7.208 -5.601 721 HB2 ALA 99 HB1 ALA 99 5.498 8.962 -5.582 722 HB3 ALA 99 HB2 ALA 99 4.140 7.942 -6.041 723 H ASP 100 HN ASP 100 5.000 10.426 -3.700 724 HA ASP 100 HA ASP 100 7.515 10.465 -2.511 725 HB2 ASP 100 HB2 ASP 100 5.283 12.501 -2.312 726 HB3 ASP 100 HB1 ASP 100 6.947 12.794 -1.812 727 H GLU 101 HN GLU 101 4.320 10.689 -1.003 728 HA GLU 101 HA GLU 101 5.166 10.827 1.663 729 HB2 GLU 101 HB2 GLU 101 2.680 10.446 0.195 730 HB3 GLU 101 HB1 GLU 101 2.704 9.505 1.674 731 HG2 GLU 101 HG2 GLU 101 1.783 11.958 1.584 732 HG3 GLU 101 HG1 GLU 101 2.608 11.337 3.001 733 H PHE 102 HN PHE 102 4.028 8.052 -0.254 734 HA PHE 102 HA PHE 102 4.468 6.069 1.626 735 HD1 PHE 102 HD1 PHE 102 6.690 4.220 -0.552 736 HD2 PHE 102 HD2 PHE 102 2.547 3.604 0.191 737 HE1 PHE 102 HE1 PHE 102 7.125 1.851 -0.111 738 HE2 PHE 102 HE2 PHE 102 2.979 1.219 0.623 739 HZ PHE 102 HZ PHE 102 5.272 0.337 0.469 740 HB2 PHE 102 HB2 PHE 102 3.268 5.681 -0.487 741 HB3 PHE 102 HB1 PHE 102 4.783 5.819 -1.384 742 H GLN 103 HN GLN 103 6.709 7.444 -0.764 743 HA GLN 103 HA GLN 103 8.896 5.794 -0.304 744 HB2 GLN 103 HB2 GLN 103 8.762 8.718 -1.024 745 HB3 GLN 103 HB1 GLN 103 10.281 7.833 -0.928 746 HG2 GLN 103 HG2 GLN 103 8.144 6.650 -2.577 747 HG3 GLN 103 HG1 GLN 103 8.889 8.134 -3.156 748 HE21 GLN 103 HE21 GLN 103 9.867 7.122 -4.891 749 HE22 GLN 103 HE22 GLN 103 11.213 6.056 -4.707 750 H GLU 104 HN GLU 104 7.548 8.336 1.651 751 HA GLU 104 HA GLU 104 9.821 8.794 3.303 752 HB2 GLU 104 HB2 GLU 104 6.901 9.163 3.998 753 HB3 GLU 104 HB1 GLU 104 8.265 9.843 4.873 754 HG2 GLU 104 HG2 GLU 104 7.344 10.528 2.100 755 HG3 GLU 104 HG1 GLU 104 7.331 11.558 3.527 756 H MET 105 HN MET 105 7.169 6.510 3.392 757 HA MET 105 HA MET 105 7.500 5.516 5.981 758 HB2 MET 105 HB2 MET 105 5.689 5.073 4.122 759 HB3 MET 105 HB1 MET 105 6.705 3.683 3.764 760 HG2 MET 105 HG2 MET 105 5.573 4.300 6.478 761 HG3 MET 105 HG1 MET 105 4.826 3.214 5.311 762 HE1 MET 105 HE3 MET 105 5.728 2.487 8.388 763 HE2 MET 105 HE1 MET 105 6.283 0.838 8.106 764 HE3 MET 105 HE2 MET 105 4.821 1.424 7.312 765 H VAL 106 HN VAL 106 8.750 4.115 2.930 766 HA VAL 106 HA VAL 106 10.292 2.123 4.119 767 HB VAL 106 HB VAL 106 9.756 2.178 1.712 768 HG11 VAL 106 HG11 VAL 106 11.297 4.669 1.877 769 HG12 VAL 106 HG12 VAL 106 10.016 4.187 0.772 770 HG13 VAL 106 HG13 VAL 106 11.671 3.648 0.492 771 HG21 VAL 106 HG23 VAL 106 12.195 1.400 2.923 772 HG22 VAL 106 HG21 VAL 106 12.580 2.047 1.328 773 HG23 VAL 106 HG22 VAL 106 11.428 0.717 1.486 774 H HIS 107 HN HIS 107 10.812 5.501 3.812 775 HA HIS 107 HA HIS 107 13.662 5.442 4.167 776 HD1 HIS 107 HD1 HIS 107 13.237 9.170 6.021 777 HD2 HIS 107 HD2 HIS 107 15.230 7.740 2.666 778 HE1 HIS 107 HE1 HIS 107 15.439 10.383 5.979 779 HE2 HIS 107 HE2 HIS 107 16.585 9.575 3.885 780 HB2 HIS 107 HB2 HIS 107 12.433 7.258 2.962 781 HB3 HIS 107 HB1 HIS 107 11.764 7.768 4.508 782 H SER 108 HN SER 108 10.911 5.360 6.233 783 HA SER 108 HA SER 108 11.772 6.586 8.537 784 HG SER 108 HG SER 108 10.486 3.079 8.936 785 HB2 SER 108 HB2 SER 108 10.294 5.051 9.755 786 HB3 SER 108 HB1 SER 108 9.533 5.615 8.269 Start of MODEL 9 1 HA SER 1 HA SER 1 3.634 -1.712 -9.964 2 HG SER 1 HG SER 1 0.855 -3.895 -8.290 3 H1 SER 1 HT1 SER 1 4.197 -3.860 -10.865 4 H2 SER 1 HT2 SER 1 2.541 -3.562 -11.045 5 H3 SER 1 HT3 SER 1 3.083 -4.619 -9.841 6 HB2 SER 1 HB2 SER 1 2.149 -1.575 -7.993 7 HB3 SER 1 HB1 SER 1 1.293 -2.185 -9.409 8 H ILE 2 HN ILE 2 3.561 -4.475 -7.707 9 HA ILE 2 HA ILE 2 5.851 -3.352 -6.292 10 HB ILE 2 HB ILE 2 4.047 -5.649 -5.621 11 HG12 ILE 2 HG12 ILE 2 4.420 -2.943 -4.451 12 HG13 ILE 2 HG11 ILE 2 3.021 -3.502 -5.346 13 HG21 ILE 2 HG21 ILE 2 6.478 -4.603 -4.232 14 HG22 ILE 2 HG22 ILE 2 6.160 -6.246 -4.788 15 HG23 ILE 2 HG23 ILE 2 5.265 -5.583 -3.418 16 HD11 ILE 2 HD13 ILE 2 3.948 -4.699 -2.761 17 HD12 ILE 2 HD11 ILE 2 2.428 -4.996 -3.608 18 HD13 ILE 2 HD12 ILE 2 2.755 -3.423 -2.905 19 H THR 3 HN THR 3 4.882 -6.256 -7.999 20 HA THR 3 HA THR 3 7.116 -7.839 -7.621 21 HB THR 3 HB THR 3 6.506 -9.009 -9.687 22 HG1 THR 3 HG1 THR 3 4.686 -8.137 -10.886 23 HG21 THR 3 HG23 THR 3 4.012 -8.191 -8.203 24 HG22 THR 3 HG21 THR 3 5.209 -9.315 -7.558 25 HG23 THR 3 HG22 THR 3 4.321 -9.719 -9.029 26 H ASP 4 HN ASP 4 6.833 -4.938 -9.437 27 HA ASP 4 HA ASP 4 8.660 -5.092 -11.452 28 HB2 ASP 4 HB2 ASP 4 8.418 -2.869 -9.406 29 HB3 ASP 4 HB1 ASP 4 9.311 -2.730 -10.918 30 H ILE 5 HN ILE 5 9.472 -4.406 -8.048 31 HA ILE 5 HA ILE 5 11.958 -5.933 -8.382 32 HB ILE 5 HB ILE 5 11.910 -3.298 -6.912 33 HG12 ILE 5 HG12 ILE 5 13.109 -3.648 -9.651 34 HG13 ILE 5 HG11 ILE 5 11.436 -3.141 -9.446 35 HG21 ILE 5 HG21 ILE 5 13.654 -4.906 -6.294 36 HG22 ILE 5 HG22 ILE 5 14.325 -3.459 -7.046 37 HG23 ILE 5 HG23 ILE 5 14.193 -4.953 -7.973 38 HD11 ILE 5 HD13 ILE 5 13.253 -1.360 -9.756 39 HD12 ILE 5 HD11 ILE 5 13.628 -1.675 -8.062 40 HD13 ILE 5 HD12 ILE 5 12.014 -1.122 -8.525 41 H LEU 6 HN LEU 6 11.078 -7.546 -7.156 42 HA LEU 6 HA LEU 6 11.326 -7.360 -4.337 43 HG LEU 6 HG LEU 6 10.154 -6.288 -2.951 44 HB2 LEU 6 HB2 LEU 6 8.736 -6.740 -5.444 45 HB3 LEU 6 HB1 LEU 6 8.638 -8.123 -4.380 46 HD11 LEU 6 HD11 LEU 6 8.427 -4.900 -4.835 47 HD12 LEU 6 HD12 LEU 6 9.716 -4.274 -3.810 48 HD13 LEU 6 HD13 LEU 6 8.095 -4.481 -3.156 49 HD21 LEU 6 HD23 LEU 6 7.293 -7.173 -2.889 50 HD22 LEU 6 HD21 LEU 6 7.909 -6.014 -1.711 51 HD23 LEU 6 HD22 LEU 6 8.621 -7.623 -1.820 52 H SER 7 HN SER 7 10.663 -9.335 -3.181 53 HA SER 7 HA SER 7 11.149 -11.704 -4.790 54 HG SER 7 HG SER 7 10.871 -13.799 -2.913 55 HB2 SER 7 HB2 SER 7 12.198 -12.037 -2.747 56 HB3 SER 7 HB1 SER 7 10.952 -11.184 -1.843 57 H ALA 8 HN ALA 8 9.539 -12.766 -5.759 58 HA ALA 8 HA ALA 8 6.842 -12.016 -5.509 59 HB1 ALA 8 HB3 ALA 8 7.742 -13.173 -7.487 60 HB2 ALA 8 HB1 ALA 8 6.340 -14.014 -6.822 61 HB3 ALA 8 HB2 ALA 8 7.965 -14.634 -6.523 62 H GLU 9 HN GLU 9 8.745 -14.581 -3.992 63 HA GLU 9 HA GLU 9 6.601 -15.856 -2.682 64 HB2 GLU 9 HB2 GLU 9 9.567 -15.761 -2.122 65 HB3 GLU 9 HB1 GLU 9 8.442 -16.852 -1.309 66 HG2 GLU 9 HG2 GLU 9 7.920 -17.920 -3.409 67 HG3 GLU 9 HG1 GLU 9 8.937 -16.761 -4.264 68 H ASP 10 HN ASP 10 9.174 -13.732 -1.420 69 HA ASP 10 HA ASP 10 8.236 -13.341 1.075 70 HB2 ASP 10 HB2 ASP 10 9.441 -11.199 -0.668 71 HB3 ASP 10 HB1 ASP 10 9.371 -11.174 1.090 72 H ILE 11 HN ILE 11 6.901 -11.939 -1.825 73 HA ILE 11 HA ILE 11 5.314 -9.999 -0.449 74 HB ILE 11 HB ILE 11 5.443 -11.102 -3.203 75 HG12 ILE 11 HG12 ILE 11 5.241 -8.272 -2.135 76 HG13 ILE 11 HG11 ILE 11 6.746 -9.126 -2.488 77 HG21 ILE 11 HG21 ILE 11 2.965 -9.884 -2.073 78 HG22 ILE 11 HG22 ILE 11 3.144 -11.225 -3.204 79 HG23 ILE 11 HG23 ILE 11 3.410 -9.569 -3.750 80 HD11 ILE 11 HD13 ILE 11 6.632 -8.229 -4.510 81 HD12 ILE 11 HD11 ILE 11 4.972 -7.696 -4.258 82 HD13 ILE 11 HD12 ILE 11 5.293 -9.328 -4.829 83 H ALA 12 HN ALA 12 4.721 -13.266 -1.675 84 HA ALA 12 HA ALA 12 2.012 -13.441 -0.986 85 HB1 ALA 12 HB3 ALA 12 3.696 -15.114 -2.234 86 HB2 ALA 12 HB1 ALA 12 2.147 -15.631 -1.563 87 HB3 ALA 12 HB2 ALA 12 3.630 -15.881 -0.646 88 H ALA 13 HN ALA 13 4.871 -14.505 0.862 89 HA ALA 13 HA ALA 13 3.418 -15.191 3.178 90 HB1 ALA 13 HB3 ALA 13 5.824 -15.804 2.634 91 HB2 ALA 13 HB1 ALA 13 5.506 -15.312 4.298 92 HB3 ALA 13 HB2 ALA 13 6.255 -14.179 3.172 93 H ALA 14 HN ALA 14 5.342 -12.348 2.433 94 HA ALA 14 HA ALA 14 4.817 -10.729 4.557 95 HB1 ALA 14 HB3 ALA 14 6.284 -9.899 2.899 96 HB2 ALA 14 HB1 ALA 14 4.932 -8.770 2.954 97 HB3 ALA 14 HB2 ALA 14 5.035 -9.959 1.652 98 H LEU 15 HN LEU 15 2.769 -11.120 1.693 99 HA LEU 15 HA LEU 15 0.707 -9.385 2.649 100 HG LEU 15 HG LEU 15 -1.582 -11.083 0.837 101 HB2 LEU 15 HB2 LEU 15 1.050 -9.755 0.259 102 HB3 LEU 15 HB1 LEU 15 0.703 -11.455 0.457 103 HD11 LEU 15 HD11 LEU 15 -2.311 -8.526 0.855 104 HD12 LEU 15 HD12 LEU 15 -0.719 -8.361 1.599 105 HD13 LEU 15 HD13 LEU 15 -1.925 -9.421 2.324 106 HD21 LEU 15 HD23 LEU 15 -1.310 -8.884 -1.099 107 HD22 LEU 15 HD21 LEU 15 -2.207 -10.396 -1.213 108 HD23 LEU 15 HD22 LEU 15 -0.467 -10.380 -1.504 109 H GLN 16 HN GLN 16 0.820 -12.876 2.050 110 HA GLN 16 HA GLN 16 -1.683 -13.461 3.174 111 HB2 GLN 16 HB2 GLN 16 0.663 -15.250 2.540 112 HB3 GLN 16 HB1 GLN 16 -1.024 -15.747 2.714 113 HG2 GLN 16 HG2 GLN 16 -0.217 -13.723 0.676 114 HG3 GLN 16 HG1 GLN 16 -0.022 -15.443 0.358 115 HE21 GLN 16 HE21 GLN 16 -2.272 -12.873 0.978 116 HE22 GLN 16 HE22 GLN 16 -3.676 -13.681 0.394 117 H GLU 17 HN GLU 17 1.096 -12.579 4.840 118 HA GLU 17 HA GLU 17 1.356 -14.738 6.644 119 HB2 GLU 17 HB2 GLU 17 3.188 -13.291 6.552 120 HB3 GLU 17 HB1 GLU 17 2.189 -11.856 6.669 121 HG2 GLU 17 HG2 GLU 17 1.821 -12.232 8.998 122 HG3 GLU 17 HG1 GLU 17 2.594 -13.810 8.908 123 H CYS 18 HN CYS 18 0.302 -11.484 7.661 124 HA CYS 18 HA CYS 18 -1.681 -12.747 9.369 125 HG CYS 18 HG CYS 18 1.108 -12.496 11.014 126 HB2 CYS 18 HB2 CYS 18 0.099 -10.403 9.615 127 HB3 CYS 18 HB1 CYS 18 -1.459 -10.330 10.417 128 H GLN 19 HN GLN 19 -1.714 -11.418 6.434 129 HA GLN 19 HA GLN 19 -3.137 -9.076 6.475 130 HB2 GLN 19 HB2 GLN 19 -2.346 -9.771 4.410 131 HB3 GLN 19 HB1 GLN 19 -3.145 -11.323 4.529 132 HG2 GLN 19 HG2 GLN 19 -5.323 -10.143 4.300 133 HG3 GLN 19 HG1 GLN 19 -4.423 -8.653 4.027 134 HE21 GLN 19 HE21 GLN 19 -5.165 -8.347 1.955 135 HE22 GLN 19 HE22 GLN 19 -4.708 -9.362 0.634 136 H ASP 20 HN ASP 20 -5.200 -8.441 6.347 137 HA ASP 20 HA ASP 20 -7.555 -9.806 6.398 138 HB2 ASP 20 HB2 ASP 20 -6.865 -11.110 8.320 139 HB3 ASP 20 HB1 ASP 20 -6.410 -9.659 9.185 140 HA PRO 21 HA PRO 21 -8.969 -5.605 6.565 141 HB2 PRO 21 HB2 PRO 21 -11.472 -6.021 7.533 142 HB3 PRO 21 HB1 PRO 21 -11.029 -6.247 5.852 143 HG2 PRO 21 HG2 PRO 21 -11.273 -8.272 8.046 144 HG3 PRO 21 HG1 PRO 21 -11.850 -8.364 6.369 145 HD2 PRO 21 HD2 PRO 21 -9.610 -9.584 7.075 146 HD3 PRO 21 HD1 PRO 21 -9.715 -8.726 5.530 147 H ASP 22 HN ASP 22 -7.312 -5.504 8.419 148 HA ASP 22 HA ASP 22 -7.994 -3.915 10.444 149 HB2 ASP 22 HB2 ASP 22 -9.044 -6.548 11.023 150 HB3 ASP 22 HB1 ASP 22 -7.980 -5.976 12.300 151 H THR 23 HN THR 23 -5.963 -6.417 9.290 152 HA THR 23 HA THR 23 -3.897 -5.886 11.316 153 HB THR 23 HB THR 23 -4.435 -8.252 10.875 154 HG1 THR 23 HG1 THR 23 -2.318 -7.877 11.488 155 HG21 THR 23 HG23 THR 23 -3.134 -8.422 8.298 156 HG22 THR 23 HG21 THR 23 -4.568 -7.400 8.228 157 HG23 THR 23 HG22 THR 23 -4.694 -9.052 8.809 158 H PHE 24 HN PHE 24 -4.721 -4.288 8.825 159 HA PHE 24 HA PHE 24 -3.760 -3.252 6.987 160 HD1 PHE 24 HD2 PHE 24 -2.023 -3.865 10.694 161 HD2 PHE 24 HD1 PHE 24 0.231 -1.934 7.638 162 HE1 PHE 24 HE2 PHE 24 0.059 -4.467 11.857 163 HE2 PHE 24 HE1 PHE 24 2.318 -2.535 8.800 164 HZ PHE 24 HZ PHE 24 2.233 -3.800 10.910 165 HB2 PHE 24 HB2 PHE 24 -2.039 -1.750 7.645 166 HB3 PHE 24 HB1 PHE 24 -2.969 -2.045 9.098 167 H GLU 25 HN GLU 25 -3.384 -4.608 5.399 168 HA GLU 25 HA GLU 25 -1.188 -6.479 5.507 169 HB2 GLU 25 HB2 GLU 25 -2.225 -7.076 3.153 170 HB3 GLU 25 HB1 GLU 25 -2.843 -7.720 4.671 171 HG2 GLU 25 HG2 GLU 25 -3.875 -5.198 3.609 172 HG3 GLU 25 HG1 GLU 25 -4.421 -6.693 2.871 173 HA PRO 26 HA PRO 26 -0.093 -3.968 1.506 174 HB2 PRO 26 HB2 PRO 26 -0.190 -1.260 1.885 175 HB3 PRO 26 HB1 PRO 26 -1.419 -2.204 1.053 176 HG2 PRO 26 HG2 PRO 26 -1.398 -1.155 3.800 177 HG3 PRO 26 HG1 PRO 26 -2.744 -1.322 2.677 178 HD2 PRO 26 HD2 PRO 26 -2.316 -2.998 4.767 179 HD3 PRO 26 HD1 PRO 26 -3.130 -3.491 3.273 180 H GLN 27 HN GLN 27 0.455 -2.016 4.444 181 HA GLN 27 HA GLN 27 3.077 -1.300 3.883 182 HB2 GLN 27 HB2 GLN 27 1.939 -1.938 6.600 183 HB3 GLN 27 HB1 GLN 27 3.331 -0.909 6.278 184 HG2 GLN 27 HG2 GLN 27 1.857 0.662 5.084 185 HG3 GLN 27 HG1 GLN 27 0.475 -0.351 5.503 186 HE21 GLN 27 HE21 GLN 27 -0.506 1.310 6.654 187 HE22 GLN 27 HE22 GLN 27 0.070 1.822 8.201 188 H LYS 28 HN LYS 28 1.885 -4.068 5.679 189 HA LYS 28 HA LYS 28 4.393 -5.178 6.313 190 HB2 LYS 28 HB2 LYS 28 1.754 -6.604 5.982 191 HB3 LYS 28 HB1 LYS 28 3.121 -7.110 6.939 192 HG2 LYS 28 HG2 LYS 28 2.792 -4.922 8.220 193 HG3 LYS 28 HG1 LYS 28 1.202 -4.905 7.469 194 HD2 LYS 28 HD2 LYS 28 1.089 -5.920 9.665 195 HD3 LYS 28 HD1 LYS 28 0.751 -7.126 8.421 196 HE2 LYS 28 HE2 LYS 28 2.922 -8.066 8.627 197 HE3 LYS 28 HE1 LYS 28 3.477 -6.718 9.618 198 HZ1 LYS 28 HZ3 LYS 28 1.404 -8.690 10.418 199 HZ2 LYS 28 HZ1 LYS 28 1.997 -7.427 11.376 200 HZ3 LYS 28 HZ2 LYS 28 3.013 -8.706 10.937 201 H PHE 29 HN PHE 29 2.068 -5.662 3.736 202 HA PHE 29 HA PHE 29 3.264 -7.668 2.262 203 HD1 PHE 29 HD1 PHE 29 3.917 -5.894 -0.632 204 HD2 PHE 29 HD2 PHE 29 0.139 -7.755 -0.004 205 HE1 PHE 29 HE1 PHE 29 3.958 -6.767 -2.913 206 HE2 PHE 29 HE2 PHE 29 0.184 -8.607 -2.308 207 HZ PHE 29 HZ PHE 29 2.094 -8.112 -3.765 208 HB2 PHE 29 HB2 PHE 29 1.072 -6.641 1.722 209 HB3 PHE 29 HB1 PHE 29 1.879 -5.175 1.215 210 H PHE 30 HN PHE 30 3.820 -4.220 2.142 211 HA PHE 30 HA PHE 30 5.830 -4.282 0.110 212 HD1 PHE 30 HD1 PHE 30 3.717 -3.965 -0.522 213 HD2 PHE 30 HD2 PHE 30 3.742 -0.352 1.740 214 HE1 PHE 30 HE1 PHE 30 1.396 -3.536 -1.155 215 HE2 PHE 30 HE2 PHE 30 1.410 0.079 1.087 216 HZ PHE 30 HZ PHE 30 0.229 -1.519 -0.367 217 HB2 PHE 30 HB2 PHE 30 5.437 -2.033 2.053 218 HB3 PHE 30 HB1 PHE 30 5.954 -1.953 0.372 219 H GLN 31 HN GLN 31 5.984 -3.498 3.565 220 HA GLN 31 HA GLN 31 8.715 -3.166 3.777 221 HB2 GLN 31 HB2 GLN 31 6.874 -2.666 5.470 222 HB3 GLN 31 HB1 GLN 31 7.013 -4.352 5.948 223 HG2 GLN 31 HG2 GLN 31 8.416 -3.447 7.463 224 HG3 GLN 31 HG1 GLN 31 9.568 -3.694 6.152 225 HE21 GLN 31 HE21 GLN 31 8.454 -1.490 4.561 226 HE22 GLN 31 HE22 GLN 31 8.991 -0.041 5.320 227 H THR 32 HN THR 32 7.000 -6.053 4.909 228 HA THR 32 HA THR 32 9.163 -7.587 5.555 229 HB THR 32 HB THR 32 6.607 -8.563 4.279 230 HG1 THR 32 HG1 THR 32 6.204 -7.433 6.186 231 HG21 THR 32 HG23 THR 32 7.103 -10.685 5.450 232 HG22 THR 32 HG21 THR 32 8.679 -10.038 5.910 233 HG23 THR 32 HG22 THR 32 8.297 -10.304 4.209 234 H SER 33 HN SER 33 7.546 -7.648 2.370 235 HA SER 33 HA SER 33 9.626 -9.296 1.266 236 HG SER 33 HG SER 33 6.148 -7.959 0.151 237 HB2 SER 33 HB2 SER 33 8.296 -9.245 -0.774 238 HB3 SER 33 HB1 SER 33 7.297 -9.635 0.622 239 H GLY 34 HN GLY 34 8.386 -6.079 0.409 240 HA2 GLY 34 HA2 GLY 34 10.822 -5.772 -1.191 241 HA3 GLY 34 HA1 GLY 34 9.382 -4.808 -1.390 242 H LEU 35 HN LEU 35 8.944 -3.454 0.764 243 HA LEU 35 HA LEU 35 10.839 -1.421 0.673 244 HG LEU 35 HG LEU 35 9.441 0.517 1.078 245 HB2 LEU 35 HB2 LEU 35 8.449 -2.074 2.246 246 HB3 LEU 35 HB1 LEU 35 9.568 -0.973 3.028 247 HD11 LEU 35 HD11 LEU 35 7.826 -1.718 0.013 248 HD12 LEU 35 HD12 LEU 35 8.951 -0.635 -0.808 249 HD13 LEU 35 HD13 LEU 35 7.329 -0.077 -0.398 250 HD21 LEU 35 HD23 LEU 35 6.645 -0.092 1.964 251 HD22 LEU 35 HD21 LEU 35 7.384 1.474 1.633 252 HD23 LEU 35 HD22 LEU 35 7.839 0.571 3.078 253 H SER 36 HN SER 36 10.625 -4.148 2.871 254 HA SER 36 HA SER 36 12.014 -3.717 5.004 255 HG SER 36 HG SER 36 13.631 -5.872 5.615 256 HB2 SER 36 HB2 SER 36 11.648 -5.969 4.624 257 HB3 SER 36 HB1 SER 36 12.440 -5.938 3.049 258 H LYS 37 HN LYS 37 13.896 -3.968 1.932 259 HA LYS 37 HA LYS 37 15.862 -2.186 3.141 260 HB2 LYS 37 HB2 LYS 37 16.652 -4.921 2.132 261 HB3 LYS 37 HB1 LYS 37 17.752 -3.664 2.671 262 HG2 LYS 37 HG2 LYS 37 15.668 -4.873 4.442 263 HG3 LYS 37 HG1 LYS 37 17.315 -5.482 4.320 264 HD2 LYS 37 HD2 LYS 37 18.226 -3.606 5.301 265 HD3 LYS 37 HD1 LYS 37 16.855 -2.587 4.861 266 HE2 LYS 37 HE2 LYS 37 15.470 -3.763 6.513 267 HE3 LYS 37 HE1 LYS 37 16.853 -4.762 6.955 268 HZ1 LYS 37 HZ3 LYS 37 16.542 -2.933 8.502 269 HZ2 LYS 37 HZ1 LYS 37 16.695 -1.810 7.245 270 HZ3 LYS 37 HZ2 LYS 37 18.013 -2.775 7.683 271 H MET 38 HN MET 38 14.188 -1.631 0.949 272 HA MET 38 HA MET 38 16.055 -1.746 -1.309 273 HB2 MET 38 HB2 MET 38 13.131 -1.075 -1.387 274 HB3 MET 38 HB1 MET 38 14.194 -1.484 -2.717 275 HG2 MET 38 HG2 MET 38 13.761 -3.397 -0.501 276 HG3 MET 38 HG1 MET 38 12.586 -3.263 -1.800 277 HE1 MET 38 HE3 MET 38 14.587 -5.909 -0.891 278 HE2 MET 38 HE1 MET 38 14.599 -6.591 -2.518 279 HE3 MET 38 HE2 MET 38 13.116 -5.898 -1.861 280 H SER 39 HN SER 39 15.955 0.111 -2.835 281 HA SER 39 HA SER 39 16.434 2.549 -1.443 282 HG SER 39 HG SER 39 18.016 0.925 -2.931 283 HB2 SER 39 HB2 SER 39 16.370 1.928 -4.403 284 HB3 SER 39 HB1 SER 39 16.962 3.431 -3.693 285 H ALA 40 HN ALA 40 15.503 4.613 -2.400 286 HA ALA 40 HA ALA 40 12.714 4.662 -1.903 287 HB1 ALA 40 HB3 ALA 40 14.432 6.773 -3.210 288 HB2 ALA 40 HB1 ALA 40 14.206 6.567 -1.474 289 HB3 ALA 40 HB2 ALA 40 12.839 7.016 -2.493 290 H SER 41 HN SER 41 14.617 4.752 -4.893 291 HA SER 41 HA SER 41 12.780 5.477 -6.746 292 HG SER 41 HG SER 41 15.857 5.391 -6.605 293 HB2 SER 41 HB2 SER 41 14.977 3.425 -6.966 294 HB3 SER 41 HB1 SER 41 14.089 4.061 -8.349 295 H GLN 42 HN GLN 42 13.428 2.044 -5.935 296 HA GLN 42 HA GLN 42 11.332 1.127 -7.574 297 HB2 GLN 42 HB2 GLN 42 11.609 -1.026 -6.656 298 HB3 GLN 42 HB1 GLN 42 13.200 -0.292 -6.776 299 HG2 GLN 42 HG2 GLN 42 13.288 0.108 -4.487 300 HG3 GLN 42 HG1 GLN 42 11.586 -0.289 -4.264 301 HE21 GLN 42 HE21 GLN 42 10.951 -2.397 -4.130 302 HE22 GLN 42 HE22 GLN 42 12.052 -3.726 -4.054 303 H VAL 43 HN VAL 43 11.367 2.342 -4.384 304 HA VAL 43 HA VAL 43 8.962 1.250 -3.422 305 HB VAL 43 HB VAL 43 10.009 4.013 -2.808 306 HG11 VAL 43 HG11 VAL 43 8.388 2.259 -1.012 307 HG12 VAL 43 HG12 VAL 43 7.618 3.338 -2.174 308 HG13 VAL 43 HG13 VAL 43 8.656 3.998 -0.908 309 HG21 VAL 43 HG23 VAL 43 11.454 1.803 -2.474 310 HG22 VAL 43 HG21 VAL 43 10.479 1.700 -1.012 311 HG23 VAL 43 HG22 VAL 43 11.480 3.119 -1.305 312 H LYS 44 HN LYS 44 9.668 3.800 -5.655 313 HA LYS 44 HA LYS 44 7.190 5.088 -5.829 314 HB2 LYS 44 HB2 LYS 44 9.244 4.511 -7.975 315 HB3 LYS 44 HB1 LYS 44 7.850 5.551 -8.218 316 HG2 LYS 44 HG2 LYS 44 8.674 7.200 -6.819 317 HG3 LYS 44 HG1 LYS 44 9.757 6.086 -5.990 318 HD2 LYS 44 HD2 LYS 44 10.874 7.712 -7.554 319 HD3 LYS 44 HD1 LYS 44 11.244 6.011 -7.836 320 HE2 LYS 44 HE2 LYS 44 9.629 5.943 -9.654 321 HE3 LYS 44 HE1 LYS 44 9.197 7.627 -9.354 322 HZ1 LYS 44 HZ3 LYS 44 11.891 6.678 -10.171 323 HZ2 LYS 44 HZ1 LYS 44 11.428 8.290 -9.949 324 HZ3 LYS 44 HZ2 LYS 44 10.753 7.382 -11.207 325 H ASP 45 HN ASP 45 8.469 2.290 -7.581 326 HA ASP 45 HA ASP 45 6.144 1.748 -9.059 327 HB2 ASP 45 HB2 ASP 45 8.725 0.485 -8.541 328 HB3 ASP 45 HB1 ASP 45 7.429 -0.676 -8.766 329 H ILE 46 HN ILE 46 7.407 0.537 -5.973 330 HA ILE 46 HA ILE 46 5.458 -1.335 -5.398 331 HB ILE 46 HB ILE 46 7.299 0.337 -3.771 332 HG12 ILE 46 HG12 ILE 46 8.274 -1.750 -3.210 333 HG13 ILE 46 HG11 ILE 46 6.880 -2.641 -3.782 334 HG21 ILE 46 HG21 ILE 46 4.910 -1.060 -2.689 335 HG22 ILE 46 HG22 ILE 46 5.667 0.455 -2.196 336 HG23 ILE 46 HG23 ILE 46 6.413 -1.083 -1.766 337 HD11 ILE 46 HD13 ILE 46 7.443 -1.761 -6.084 338 HD12 ILE 46 HD11 ILE 46 8.552 -2.945 -5.391 339 HD13 ILE 46 HD12 ILE 46 8.975 -1.235 -5.389 340 H PHE 47 HN PHE 47 5.572 2.080 -4.377 341 HA PHE 47 HA PHE 47 3.246 2.558 -3.181 342 HD1 PHE 47 HD1 PHE 47 1.795 4.885 -3.109 343 HD2 PHE 47 HD2 PHE 47 3.981 5.577 -6.695 344 HE1 PHE 47 HE1 PHE 47 0.094 6.520 -3.836 345 HE2 PHE 47 HE2 PHE 47 2.292 7.209 -7.418 346 HZ PHE 47 HZ PHE 47 0.346 7.681 -5.987 347 HB2 PHE 47 HB2 PHE 47 4.489 4.461 -3.523 348 HB3 PHE 47 HB1 PHE 47 4.812 4.096 -5.194 349 H ARG 48 HN ARG 48 3.595 2.040 -6.618 350 HA ARG 48 HA ARG 48 1.053 2.751 -7.493 351 HE ARG 48 HE ARG 48 2.510 5.066 -11.028 352 HB2 ARG 48 HB2 ARG 48 2.841 0.572 -8.569 353 HB3 ARG 48 HB1 ARG 48 1.442 1.232 -9.402 354 HG2 ARG 48 HG2 ARG 48 4.010 2.630 -8.720 355 HG3 ARG 48 HG1 ARG 48 3.346 2.289 -10.319 356 HD2 ARG 48 HD2 ARG 48 1.360 3.742 -9.575 357 HD3 ARG 48 HD1 ARG 48 2.427 4.297 -8.284 358 HH11 ARG 48 HH11 ARG 48 4.511 4.504 -8.233 359 HH12 ARG 48 HH12 ARG 48 5.751 5.604 -8.740 360 HH21 ARG 48 HH21 ARG 48 4.133 6.516 -11.702 361 HH22 ARG 48 HH22 ARG 48 5.535 6.748 -10.711 362 H PHE 49 HN PHE 49 2.010 0.035 -5.598 363 HA PHE 49 HA PHE 49 0.092 -1.854 -6.204 364 HD1 PHE 49 HD2 PHE 49 0.887 -4.219 -5.537 365 HD2 PHE 49 HD1 PHE 49 -0.516 -2.285 -2.014 366 HE1 PHE 49 HE2 PHE 49 -0.234 -6.297 -4.846 367 HE2 PHE 49 HE1 PHE 49 -1.632 -4.358 -1.316 368 HZ PHE 49 HZ PHE 49 -1.497 -6.369 -2.732 369 HB2 PHE 49 HB2 PHE 49 1.962 -2.093 -4.531 370 HB3 PHE 49 HB1 PHE 49 0.976 -1.178 -3.395 371 H ILE 50 HN ILE 50 -0.190 0.555 -3.566 372 HA ILE 50 HA ILE 50 -2.930 0.163 -3.170 373 HB ILE 50 HB ILE 50 -2.892 2.410 -2.045 374 HG12 ILE 50 HG12 ILE 50 0.029 2.342 -2.833 375 HG13 ILE 50 HG11 ILE 50 -1.163 3.513 -3.394 376 HG21 ILE 50 HG21 ILE 50 -1.010 0.211 -1.367 377 HG22 ILE 50 HG22 ILE 50 -2.550 0.654 -0.628 378 HG23 ILE 50 HG23 ILE 50 -1.119 1.643 -0.344 379 HD11 ILE 50 HD13 ILE 50 -0.393 3.153 -0.507 380 HD12 ILE 50 HD11 ILE 50 -1.382 4.435 -1.198 381 HD13 ILE 50 HD12 ILE 50 0.336 4.346 -1.579 382 H ASP 51 HN ASP 51 -3.775 3.086 -3.439 383 HA ASP 51 HA ASP 51 -5.016 2.771 -5.933 384 HB2 ASP 51 HB2 ASP 51 -4.726 5.102 -4.058 385 HB3 ASP 51 HB1 ASP 51 -5.532 5.278 -5.613 386 H ASN 52 HN ASN 52 -4.639 3.640 -7.883 387 HA ASN 52 HA ASN 52 -2.061 4.985 -8.312 388 HB2 ASN 52 HB2 ASN 52 -2.031 2.648 -9.105 389 HB3 ASN 52 HB1 ASN 52 -3.406 2.994 -10.149 390 HD21 ASN 52 HD21 ASN 52 -2.292 2.486 -12.009 391 HD22 ASN 52 HD22 ASN 52 -1.047 3.497 -12.655 392 H ASP 53 HN ASP 53 -5.453 5.019 -8.856 393 HA ASP 53 HA ASP 53 -5.377 6.759 -11.144 394 HB2 ASP 53 HB2 ASP 53 -7.208 5.132 -10.784 395 HB3 ASP 53 HB1 ASP 53 -7.704 6.032 -9.356 396 H GLN 54 HN GLN 54 -3.858 8.146 -9.622 397 HA GLN 54 HA GLN 54 -5.357 10.494 -9.022 398 HB2 GLN 54 HB2 GLN 54 -3.742 9.104 -6.882 399 HB3 GLN 54 HB1 GLN 54 -4.449 10.702 -6.746 400 HG2 GLN 54 HG2 GLN 54 -6.691 9.542 -7.185 401 HG3 GLN 54 HG1 GLN 54 -5.827 8.045 -6.830 402 HE21 GLN 54 HE21 GLN 54 -6.781 7.522 -4.917 403 HE22 GLN 54 HE22 GLN 54 -6.678 8.487 -3.481 404 H SER 55 HN SER 55 -3.766 12.265 -8.388 405 HA SER 55 HA SER 55 -1.509 12.043 -10.205 406 HG SER 55 HG SER 55 -3.831 14.714 -10.652 407 HB2 SER 55 HB2 SER 55 -2.706 14.470 -8.861 408 HB3 SER 55 HB1 SER 55 -1.395 14.500 -10.038 409 H GLY 56 HN GLY 56 -0.497 10.601 -8.477 410 HA2 GLY 56 HA2 GLY 56 1.428 10.442 -7.195 411 HA3 GLY 56 HA1 GLY 56 1.541 12.194 -7.222 412 H TYR 57 HN TYR 57 -1.437 10.815 -6.132 413 HA TYR 57 HA TYR 57 -0.639 10.680 -3.393 414 HD1 TYR 57 HD2 TYR 57 -3.776 12.718 -5.333 415 HD2 TYR 57 HD1 TYR 57 -0.106 14.514 -4.201 416 HE1 TYR 57 HE2 TYR 57 -4.058 14.387 -7.120 417 HE2 TYR 57 HE1 TYR 57 -0.364 16.196 -5.987 418 HH TYR 57 HH TYR 57 -1.542 16.457 -8.109 419 HB2 TYR 57 HB2 TYR 57 -2.643 12.470 -2.978 420 HB3 TYR 57 HB1 TYR 57 -0.930 12.847 -2.912 421 H LEU 58 HN LEU 58 -2.386 10.171 -1.934 422 HA LEU 58 HA LEU 58 -4.780 9.111 -3.207 423 HG LEU 58 HG LEU 58 -1.911 7.821 -3.511 424 HB2 LEU 58 HB2 LEU 58 -3.108 7.463 -1.327 425 HB3 LEU 58 HB1 LEU 58 -4.507 6.940 -2.253 426 HD11 LEU 58 HD11 LEU 58 -2.803 5.174 -2.504 427 HD12 LEU 58 HD12 LEU 58 -1.183 5.882 -2.544 428 HD13 LEU 58 HD13 LEU 58 -1.907 5.235 -4.020 429 HD21 LEU 58 HD23 LEU 58 -3.433 6.097 -5.128 430 HD22 LEU 58 HD21 LEU 58 -3.027 7.781 -5.406 431 HD23 LEU 58 HD22 LEU 58 -4.506 7.360 -4.545 432 H ASP 59 HN ASP 59 -6.489 8.605 -1.576 433 HA ASP 59 HA ASP 59 -5.984 9.803 1.044 434 HB2 ASP 59 HB2 ASP 59 -6.843 11.528 -0.559 435 HB3 ASP 59 HB1 ASP 59 -8.344 10.614 -0.638 436 H GLY 60 HN GLY 60 -7.475 9.333 2.609 437 HA2 GLY 60 HA2 GLY 60 -8.054 6.713 3.013 438 HA3 GLY 60 HA1 GLY 60 -8.962 8.010 3.778 439 H ASP 61 HN ASP 61 -10.025 8.941 1.187 440 HA ASP 61 HA ASP 61 -12.380 7.311 1.158 441 HB2 ASP 61 HB2 ASP 61 -11.538 9.469 -0.794 442 HB3 ASP 61 HB1 ASP 61 -13.172 8.848 -0.553 443 H GLU 62 HN GLU 62 -9.767 8.000 -1.058 444 HA GLU 62 HA GLU 62 -10.610 6.163 -3.084 445 HB2 GLU 62 HB2 GLU 62 -8.130 7.772 -2.673 446 HB3 GLU 62 HB1 GLU 62 -8.436 6.813 -4.115 447 HG2 GLU 62 HG2 GLU 62 -10.127 9.103 -3.141 448 HG3 GLU 62 HG1 GLU 62 -8.945 9.189 -4.446 449 H LEU 63 HN LEU 63 -8.514 6.030 -0.312 450 HA LEU 63 HA LEU 63 -6.558 4.267 -1.038 451 HG LEU 63 HG LEU 63 -6.994 6.458 1.419 452 HB2 LEU 63 HB2 LEU 63 -8.086 4.451 1.553 453 HB3 LEU 63 HB1 LEU 63 -6.622 3.522 1.363 454 HD11 LEU 63 HD11 LEU 63 -4.616 5.364 2.616 455 HD12 LEU 63 HD12 LEU 63 -6.096 4.642 3.246 456 HD13 LEU 63 HD13 LEU 63 -5.868 6.388 3.309 457 HD21 LEU 63 HD23 LEU 63 -4.751 5.030 0.039 458 HD22 LEU 63 HD21 LEU 63 -4.593 6.675 0.657 459 HD23 LEU 63 HD22 LEU 63 -5.781 6.318 -0.602 460 H LYS 64 HN LYS 64 -9.756 3.372 0.305 461 HA LYS 64 HA LYS 64 -9.481 0.697 0.213 462 HB2 LYS 64 HB2 LYS 64 -12.108 0.880 -0.285 463 HB3 LYS 64 HB1 LYS 64 -11.404 1.200 1.284 464 HG2 LYS 64 HG2 LYS 64 -11.573 3.526 0.992 465 HG3 LYS 64 HG1 LYS 64 -11.850 3.368 -0.742 466 HD2 LYS 64 HD2 LYS 64 -13.822 1.966 0.891 467 HD3 LYS 64 HD1 LYS 64 -13.796 3.711 1.158 468 HE2 LYS 64 HE2 LYS 64 -13.941 4.009 -1.306 469 HE3 LYS 64 HE1 LYS 64 -14.131 2.263 -1.456 470 HZ1 LYS 64 HZ3 LYS 64 -16.122 2.461 -0.022 471 HZ2 LYS 64 HZ1 LYS 64 -16.276 3.275 -1.497 472 HZ3 LYS 64 HZ2 LYS 64 -15.968 4.143 -0.079 473 H TYR 65 HN TYR 65 -9.949 2.657 -2.629 474 HA TYR 65 HA TYR 65 -11.007 0.471 -4.160 475 HD1 TYR 65 HD1 TYR 65 -12.855 1.373 -4.083 476 HD2 TYR 65 HD2 TYR 65 -10.955 5.018 -5.171 477 HE1 TYR 65 HE1 TYR 65 -14.818 2.629 -3.287 478 HE2 TYR 65 HE2 TYR 65 -12.918 6.283 -4.401 479 HH TYR 65 HH TYR 65 -15.299 5.927 -4.002 480 HB2 TYR 65 HB2 TYR 65 -9.737 3.006 -5.209 481 HB3 TYR 65 HB1 TYR 65 -10.786 1.906 -6.095 482 H PHE 66 HN PHE 66 -7.901 1.192 -3.033 483 HA PHE 66 HA PHE 66 -6.160 0.639 -5.055 484 HD1 PHE 66 HD2 PHE 66 -3.953 -1.573 -4.358 485 HD2 PHE 66 HD1 PHE 66 -5.858 -0.954 -0.613 486 HE1 PHE 66 HE2 PHE 66 -3.039 -3.708 -3.545 487 HE2 PHE 66 HE1 PHE 66 -4.954 -3.085 0.211 488 HZ PHE 66 HZ PHE 66 -3.544 -4.469 -1.256 489 HB2 PHE 66 HB2 PHE 66 -4.741 0.816 -3.325 490 HB3 PHE 66 HB1 PHE 66 -6.068 0.648 -2.206 491 H LEU 67 HN LEU 67 -7.658 -1.853 -2.972 492 HA LEU 67 HA LEU 67 -6.524 -4.050 -4.275 493 HG LEU 67 HG LEU 67 -6.972 -3.766 -1.449 494 HB2 LEU 67 HB2 LEU 67 -9.108 -3.743 -2.768 495 HB3 LEU 67 HB1 LEU 67 -8.626 -5.271 -3.476 496 HD11 LEU 67 HD11 LEU 67 -8.840 -6.103 -1.079 497 HD12 LEU 67 HD12 LEU 67 -9.052 -4.473 -0.442 498 HD13 LEU 67 HD13 LEU 67 -7.727 -5.479 0.140 499 HD21 LEU 67 HD23 LEU 67 -6.773 -6.613 -2.426 500 HD22 LEU 67 HD21 LEU 67 -5.692 -5.800 -1.295 501 HD23 LEU 67 HD22 LEU 67 -5.748 -5.291 -2.984 502 H GLN 68 HN GLN 68 -9.419 -2.177 -4.939 503 HA GLN 68 HA GLN 68 -10.273 -3.768 -7.115 504 HB2 GLN 68 HB2 GLN 68 -10.930 -1.062 -6.055 505 HB3 GLN 68 HB1 GLN 68 -11.412 -1.444 -7.700 506 HG2 GLN 68 HG2 GLN 68 -12.584 -3.442 -6.867 507 HG3 GLN 68 HG1 GLN 68 -12.154 -2.977 -5.224 508 HE21 GLN 68 HE21 GLN 68 -14.349 -2.903 -4.698 509 HE22 GLN 68 HE22 GLN 68 -15.345 -1.569 -5.165 510 H LYS 69 HN LYS 69 -8.258 -0.768 -6.940 511 HA LYS 69 HA LYS 69 -7.827 -0.413 -9.604 512 HB2 LYS 69 HB2 LYS 69 -5.692 -0.210 -7.482 513 HB3 LYS 69 HB1 LYS 69 -5.739 0.660 -9.006 514 HG2 LYS 69 HG2 LYS 69 -7.420 1.051 -6.563 515 HG3 LYS 69 HG1 LYS 69 -6.381 2.211 -7.380 516 HD2 LYS 69 HD2 LYS 69 -8.987 1.092 -8.382 517 HD3 LYS 69 HD1 LYS 69 -8.687 2.743 -7.840 518 HE2 LYS 69 HE2 LYS 69 -7.069 3.016 -9.686 519 HE3 LYS 69 HE1 LYS 69 -7.471 1.394 -10.249 520 HZ1 LYS 69 HZ3 LYS 69 -9.341 3.696 -10.069 521 HZ2 LYS 69 HZ1 LYS 69 -9.768 2.133 -10.558 522 HZ3 LYS 69 HZ2 LYS 69 -8.691 3.047 -11.490 523 H PHE 70 HN PHE 70 -5.673 -2.199 -7.440 524 HA PHE 70 HA PHE 70 -4.097 -3.318 -9.476 525 HD1 PHE 70 HD2 PHE 70 -2.390 -5.799 -8.725 526 HD2 PHE 70 HD1 PHE 70 -4.889 -5.251 -5.325 527 HE1 PHE 70 HE2 PHE 70 -2.086 -8.167 -8.123 528 HE2 PHE 70 HE1 PHE 70 -4.592 -7.612 -4.714 529 HZ PHE 70 HZ PHE 70 -3.187 -9.078 -6.115 530 HB2 PHE 70 HB2 PHE 70 -2.879 -3.489 -7.601 531 HB3 PHE 70 HB1 PHE 70 -4.298 -3.421 -6.576 532 H GLN 71 HN GLN 71 -6.854 -4.642 -7.664 533 HA GLN 71 HA GLN 71 -6.718 -7.133 -9.149 534 HB2 GLN 71 HB2 GLN 71 -7.416 -6.972 -6.718 535 HB3 GLN 71 HB1 GLN 71 -8.920 -6.270 -7.294 536 HG2 GLN 71 HG2 GLN 71 -9.382 -8.292 -8.581 537 HG3 GLN 71 HG1 GLN 71 -7.866 -8.993 -8.023 538 HE21 GLN 71 HE21 GLN 71 -10.115 -7.091 -6.107 539 HE22 GLN 71 HE22 GLN 71 -10.551 -8.353 -5.023 540 H SER 72 HN SER 72 -9.389 -4.888 -8.562 541 HA SER 72 HA SER 72 -10.635 -3.722 -10.191 542 HG SER 72 HG SER 72 -10.715 -3.539 -13.055 543 HB2 SER 72 HB2 SER 72 -9.216 -4.639 -12.073 544 HB3 SER 72 HB1 SER 72 -10.275 -6.044 -12.062 545 H ASP 73 HN ASP 73 -11.033 -5.996 -8.204 546 HA ASP 73 HA ASP 73 -13.861 -6.183 -8.588 547 HB2 ASP 73 HB2 ASP 73 -12.127 -8.649 -8.764 548 HB3 ASP 73 HB1 ASP 73 -13.853 -8.695 -8.436 549 H ALA 74 HN ALA 74 -11.653 -5.339 -6.573 550 HA ALA 74 HA ALA 74 -11.921 -7.133 -4.366 551 HB1 ALA 74 HB3 ALA 74 -9.928 -5.703 -4.829 552 HB2 ALA 74 HB1 ALA 74 -10.585 -5.539 -3.205 553 HB3 ALA 74 HB2 ALA 74 -10.908 -4.300 -4.418 554 H ARG 75 HN ARG 75 -12.273 -5.503 -2.303 555 HA ARG 75 HA ARG 75 -15.050 -4.669 -2.555 556 HE ARG 75 HE ARG 75 -11.328 -4.505 2.030 557 HB2 ARG 75 HB2 ARG 75 -14.866 -4.621 0.011 558 HB3 ARG 75 HB1 ARG 75 -14.969 -6.168 -0.814 559 HG2 ARG 75 HG2 ARG 75 -12.935 -6.799 -0.135 560 HG3 ARG 75 HG1 ARG 75 -12.237 -5.198 -0.419 561 HD2 ARG 75 HD2 ARG 75 -13.632 -4.501 1.613 562 HD3 ARG 75 HD1 ARG 75 -13.692 -6.222 1.979 563 HH11 ARG 75 HH11 ARG 75 -12.642 -7.735 2.364 564 HH12 ARG 75 HH12 ARG 75 -11.266 -8.329 3.226 565 HH21 ARG 75 HH21 ARG 75 -9.526 -5.303 3.154 566 HH22 ARG 75 HH22 ARG 75 -9.501 -6.957 3.671 567 H GLU 76 HN GLU 76 -13.255 -3.332 0.039 568 HA GLU 76 HA GLU 76 -12.433 -0.917 -1.162 569 HB2 GLU 76 HB2 GLU 76 -14.633 -0.562 0.826 570 HB3 GLU 76 HB1 GLU 76 -14.058 0.549 -0.403 571 HG2 GLU 76 HG2 GLU 76 -15.176 -0.731 -2.109 572 HG3 GLU 76 HG1 GLU 76 -15.658 -1.928 -0.913 573 H LEU 77 HN LEU 77 -10.986 -2.567 0.192 574 HA LEU 77 HA LEU 77 -9.912 -3.185 2.181 575 HG LEU 77 HG LEU 77 -8.353 -1.711 0.353 576 HB2 LEU 77 HB2 LEU 77 -9.732 -0.243 1.804 577 HB3 LEU 77 HB1 LEU 77 -8.981 -0.964 3.201 578 HD11 LEU 77 HD11 LEU 77 -7.261 0.293 2.250 579 HD12 LEU 77 HD12 LEU 77 -7.449 0.368 0.500 580 HD13 LEU 77 HD13 LEU 77 -6.134 -0.571 1.209 581 HD21 LEU 77 HD23 LEU 77 -6.875 -2.376 2.888 582 HD22 LEU 77 HD21 LEU 77 -6.555 -2.983 1.268 583 HD23 LEU 77 HD22 LEU 77 -8.018 -3.470 2.117 584 H THR 78 HN THR 78 -12.758 -2.916 2.663 585 HA THR 78 HA THR 78 -14.334 -2.409 4.268 586 HB THR 78 HB THR 78 -13.915 -3.518 6.326 587 HG1 THR 78 HG1 THR 78 -11.967 -3.621 7.237 588 HG21 THR 78 HG23 THR 78 -13.459 -5.616 5.554 589 HG22 THR 78 HG21 THR 78 -12.034 -5.089 4.659 590 HG23 THR 78 HG22 THR 78 -13.644 -4.793 4.004 591 H GLU 79 HN GLU 79 -14.423 -1.554 6.761 592 HA GLU 79 HA GLU 79 -13.775 1.174 6.641 593 HB2 GLU 79 HB2 GLU 79 -15.667 0.387 7.927 594 HB3 GLU 79 HB1 GLU 79 -14.620 -0.616 8.922 595 HG2 GLU 79 HG2 GLU 79 -13.580 1.325 9.861 596 HG3 GLU 79 HG1 GLU 79 -14.508 2.372 8.792 597 H SER 80 HN SER 80 -12.493 -1.528 8.507 598 HA SER 80 HA SER 80 -10.479 -0.075 9.856 599 HG SER 80 HG SER 80 -10.964 -4.089 9.777 600 HB2 SER 80 HB2 SER 80 -9.775 -2.197 10.721 601 HB3 SER 80 HB1 SER 80 -11.536 -2.174 10.658 602 H GLU 81 HN GLU 81 -10.210 -2.321 7.033 603 HA GLU 81 HA GLU 81 -7.451 -2.391 6.999 604 HB2 GLU 81 HB2 GLU 81 -9.467 -3.467 5.457 605 HB3 GLU 81 HB1 GLU 81 -8.598 -2.445 4.333 606 HG2 GLU 81 HG2 GLU 81 -7.429 -4.643 5.999 607 HG3 GLU 81 HG1 GLU 81 -7.692 -4.665 4.257 608 H THR 82 HN THR 82 -9.542 0.049 5.369 609 HA THR 82 HA THR 82 -7.473 1.268 3.946 610 HB THR 82 HB THR 82 -8.811 3.368 4.097 611 HG1 THR 82 HG1 THR 82 -10.552 1.699 5.617 612 HG21 THR 82 HG23 THR 82 -10.335 0.897 3.289 613 HG22 THR 82 HG21 THR 82 -9.129 1.734 2.308 614 HG23 THR 82 HG22 THR 82 -10.643 2.541 2.726 615 H LYS 83 HN LYS 83 -8.103 1.162 7.323 616 HA LYS 83 HA LYS 83 -6.874 3.541 8.179 617 HB2 LYS 83 HB2 LYS 83 -8.163 1.897 9.619 618 HB3 LYS 83 HB1 LYS 83 -6.741 0.864 9.588 619 HG2 LYS 83 HG2 LYS 83 -5.434 2.618 10.665 620 HG3 LYS 83 HG1 LYS 83 -6.854 3.666 10.686 621 HD2 LYS 83 HD2 LYS 83 -8.025 1.983 12.071 622 HD3 LYS 83 HD1 LYS 83 -6.545 1.023 12.108 623 HE2 LYS 83 HE2 LYS 83 -6.694 2.305 14.137 624 HE3 LYS 83 HE1 LYS 83 -5.379 2.945 13.151 625 HZ1 LYS 83 HZ3 LYS 83 -6.872 4.703 12.395 626 HZ2 LYS 83 HZ1 LYS 83 -6.698 4.726 14.078 627 HZ3 LYS 83 HZ2 LYS 83 -8.105 4.099 13.382 628 H SER 84 HN SER 84 -5.686 0.432 7.161 629 HA SER 84 HA SER 84 -2.995 0.566 7.850 630 HG SER 84 HG SER 84 -1.682 -0.568 6.161 631 HB2 SER 84 HB2 SER 84 -3.930 -1.446 6.929 632 HB3 SER 84 HB1 SER 84 -4.366 -0.633 5.439 633 H LEU 85 HN LEU 85 -4.518 1.374 4.777 634 HA LEU 85 HA LEU 85 -2.302 2.513 3.556 635 HG LEU 85 HG LEU 85 -4.803 0.736 2.532 636 HB2 LEU 85 HB2 LEU 85 -5.263 2.921 3.202 637 HB3 LEU 85 HB1 LEU 85 -4.085 3.604 2.117 638 HD11 LEU 85 HD11 LEU 85 -4.593 2.539 0.133 639 HD12 LEU 85 HD12 LEU 85 -6.047 1.815 0.819 640 HD13 LEU 85 HD13 LEU 85 -4.845 0.797 0.030 641 HD21 LEU 85 HD23 LEU 85 -2.384 0.796 2.691 642 HD22 LEU 85 HD21 LEU 85 -2.294 1.731 1.199 643 HD23 LEU 85 HD22 LEU 85 -2.892 0.070 1.167 644 H MET 86 HN MET 86 -4.793 3.857 5.574 645 HA MET 86 HA MET 86 -4.085 6.578 5.455 646 HB2 MET 86 HB2 MET 86 -5.287 5.040 7.772 647 HB3 MET 86 HB1 MET 86 -5.268 6.793 7.620 648 HG2 MET 86 HG2 MET 86 -6.433 5.419 5.323 649 HG3 MET 86 HG1 MET 86 -7.297 5.149 6.836 650 HE1 MET 86 HE3 MET 86 -5.266 8.481 6.216 651 HE2 MET 86 HE1 MET 86 -6.407 9.368 5.205 652 HE3 MET 86 HE2 MET 86 -5.657 7.889 4.601 653 H ASP 87 HN ASP 87 -3.158 4.033 7.732 654 HA ASP 87 HA ASP 87 -1.246 5.630 9.164 655 HB2 ASP 87 HB2 ASP 87 -1.947 2.705 9.184 656 HB3 ASP 87 HB1 ASP 87 -0.692 3.396 10.213 657 H ALA 88 HN ALA 88 -1.154 4.295 6.163 658 HA ALA 88 HA ALA 88 1.381 2.993 6.164 659 HB1 ALA 88 HB3 ALA 88 1.004 2.577 3.936 660 HB2 ALA 88 HB1 ALA 88 0.060 4.053 3.715 661 HB3 ALA 88 HB2 ALA 88 -0.622 2.698 4.610 662 H ALA 89 HN ALA 89 0.472 6.311 5.989 663 HA ALA 89 HA ALA 89 3.214 7.084 5.765 664 HB1 ALA 89 HB3 ALA 89 2.786 6.646 3.406 665 HB2 ALA 89 HB1 ALA 89 3.097 8.356 3.692 666 HB3 ALA 89 HB2 ALA 89 1.448 7.794 3.416 667 H ASP 90 HN ASP 90 0.539 9.005 4.504 668 HA ASP 90 HA ASP 90 1.130 11.026 6.508 669 HB2 ASP 90 HB2 ASP 90 0.508 11.259 3.866 670 HB3 ASP 90 HB1 ASP 90 -1.059 11.554 4.617 671 H ASN 91 HN ASN 91 0.357 9.790 8.248 672 HA ASN 91 HA ASN 91 -2.559 9.444 8.379 673 HB2 ASN 91 HB2 ASN 91 -1.638 8.158 10.606 674 HB3 ASN 91 HB1 ASN 91 -1.987 7.382 9.068 675 HD21 ASN 91 HD21 ASN 91 -0.280 6.791 7.706 676 HD22 ASN 91 HD22 ASN 91 1.348 6.712 8.280 677 H ASP 92 HN ASP 92 0.232 10.707 10.094 678 HA ASP 92 HA ASP 92 -1.538 12.150 11.930 679 HB2 ASP 92 HB2 ASP 92 1.317 11.232 12.128 680 HB3 ASP 92 HB1 ASP 92 0.670 12.460 13.203 681 H GLY 93 HN GLY 93 -0.917 13.003 9.148 682 HA2 GLY 93 HA2 GLY 93 -0.020 15.674 9.810 683 HA3 GLY 93 HA1 GLY 93 1.032 14.806 8.711 684 H ASP 94 HN ASP 94 -2.088 13.783 8.034 685 HA ASP 94 HA ASP 94 -3.208 15.869 6.620 686 HB2 ASP 94 HB2 ASP 94 -1.025 15.646 5.306 687 HB3 ASP 94 HB1 ASP 94 -1.663 14.118 4.714 688 H GLY 95 HN GLY 95 -2.450 12.539 5.602 689 HA2 GLY 95 HA2 GLY 95 -4.152 10.811 6.224 690 HA3 GLY 95 HA1 GLY 95 -5.347 11.970 5.668 691 H LYS 96 HN LYS 96 -2.629 12.153 3.705 692 HA LYS 96 HA LYS 96 -3.936 10.448 1.719 693 HB2 LYS 96 HB2 LYS 96 -3.818 12.259 0.393 694 HB3 LYS 96 HB1 LYS 96 -2.952 13.133 1.636 695 HG2 LYS 96 HG2 LYS 96 -1.614 11.356 -0.403 696 HG3 LYS 96 HG1 LYS 96 -1.864 13.081 -0.608 697 HD2 LYS 96 HD2 LYS 96 -0.113 11.697 1.407 698 HD3 LYS 96 HD1 LYS 96 0.343 12.858 0.168 699 HE2 LYS 96 HE2 LYS 96 -1.305 13.418 2.629 700 HE3 LYS 96 HE1 LYS 96 0.361 13.919 2.341 701 HZ1 LYS 96 HZ3 LYS 96 -1.146 15.734 1.917 702 HZ2 LYS 96 HZ1 LYS 96 -2.022 14.806 0.806 703 HZ3 LYS 96 HZ2 LYS 96 -0.426 15.253 0.465 704 H ILE 97 HN ILE 97 -2.609 9.207 0.240 705 HA ILE 97 HA ILE 97 0.080 8.585 1.285 706 HB ILE 97 HB ILE 97 -1.784 6.589 0.017 707 HG12 ILE 97 HG12 ILE 97 -2.661 7.212 2.197 708 HG13 ILE 97 HG11 ILE 97 -1.962 5.600 2.248 709 HG21 ILE 97 HG21 ILE 97 -0.054 5.013 1.071 710 HG22 ILE 97 HG22 ILE 97 0.975 6.444 1.172 711 HG23 ILE 97 HG23 ILE 97 0.393 5.884 -0.395 712 HD11 ILE 97 HD13 ILE 97 -0.006 6.422 3.367 713 HD12 ILE 97 HD11 ILE 97 -1.440 6.961 4.238 714 HD13 ILE 97 HD12 ILE 97 -0.573 8.079 3.201 715 H GLY 98 HN GLY 98 1.176 9.785 -0.260 716 HA2 GLY 98 HA2 GLY 98 0.821 9.025 -3.059 717 HA3 GLY 98 HA1 GLY 98 1.568 10.509 -2.485 718 H ALA 99 HN ALA 99 2.934 9.217 -4.334 719 HA ALA 99 HA ALA 99 4.614 7.091 -3.575 720 HB1 ALA 99 HB3 ALA 99 4.697 7.615 -5.846 721 HB2 ALA 99 HB1 ALA 99 6.247 8.208 -5.255 722 HB3 ALA 99 HB2 ALA 99 4.919 9.335 -5.540 723 H ASP 100 HN ASP 100 5.162 10.598 -3.340 724 HA ASP 100 HA ASP 100 7.645 10.501 -2.059 725 HB2 ASP 100 HB2 ASP 100 5.468 12.595 -1.887 726 HB3 ASP 100 HB1 ASP 100 7.110 12.819 -1.291 727 H GLU 101 HN GLU 101 4.414 10.872 -0.640 728 HA GLU 101 HA GLU 101 5.149 10.855 2.057 729 HB2 GLU 101 HB2 GLU 101 2.724 10.529 0.452 730 HB3 GLU 101 HB1 GLU 101 2.654 9.633 1.955 731 HG2 GLU 101 HG2 GLU 101 1.860 12.189 1.626 732 HG3 GLU 101 HG1 GLU 101 2.326 11.481 3.163 733 H PHE 102 HN PHE 102 3.943 8.228 0.019 734 HA PHE 102 HA PHE 102 4.218 6.104 1.741 735 HD1 PHE 102 HD1 PHE 102 6.489 4.299 -0.318 736 HD2 PHE 102 HD2 PHE 102 2.255 3.877 -0.272 737 HE1 PHE 102 HE1 PHE 102 6.738 1.879 -0.149 738 HE2 PHE 102 HE2 PHE 102 2.502 1.432 -0.126 739 HZ PHE 102 HZ PHE 102 4.751 0.428 -0.065 740 HB2 PHE 102 HB2 PHE 102 3.147 5.964 -0.476 741 HB3 PHE 102 HB1 PHE 102 4.719 6.103 -1.258 742 H GLN 103 HN GLN 103 6.648 7.562 -0.382 743 HA GLN 103 HA GLN 103 8.756 5.774 0.101 744 HB2 GLN 103 HB2 GLN 103 8.748 8.704 -0.604 745 HB3 GLN 103 HB1 GLN 103 10.223 7.752 -0.495 746 HG2 GLN 103 HG2 GLN 103 8.184 6.517 -2.150 747 HG3 GLN 103 HG1 GLN 103 8.674 8.109 -2.711 748 HE21 GLN 103 HE21 GLN 103 9.783 7.481 -4.479 749 HE22 GLN 103 HE22 GLN 103 11.239 6.556 -4.424 750 H GLU 104 HN GLU 104 7.424 8.333 2.036 751 HA GLU 104 HA GLU 104 9.668 8.806 3.712 752 HB2 GLU 104 HB2 GLU 104 6.729 9.148 4.338 753 HB3 GLU 104 HB1 GLU 104 8.053 9.791 5.296 754 HG2 GLU 104 HG2 GLU 104 7.327 10.554 2.481 755 HG3 GLU 104 HG1 GLU 104 7.134 11.532 3.932 756 H MET 105 HN MET 105 6.972 6.544 3.898 757 HA MET 105 HA MET 105 7.428 5.561 6.472 758 HB2 MET 105 HB2 MET 105 5.543 5.144 4.608 759 HB3 MET 105 HB1 MET 105 6.453 3.651 4.434 760 HG2 MET 105 HG2 MET 105 5.409 4.664 7.059 761 HG3 MET 105 HG1 MET 105 4.508 3.573 6.011 762 HE1 MET 105 HE3 MET 105 5.208 2.930 9.074 763 HE2 MET 105 HE1 MET 105 5.651 1.230 8.932 764 HE3 MET 105 HE2 MET 105 4.282 1.862 8.018 765 H VAL 106 HN VAL 106 8.523 4.208 3.352 766 HA VAL 106 HA VAL 106 10.011 2.102 4.431 767 HB VAL 106 HB VAL 106 9.435 2.096 2.100 768 HG11 VAL 106 HG11 VAL 106 10.955 4.655 2.035 769 HG12 VAL 106 HG12 VAL 106 9.348 4.272 1.409 770 HG13 VAL 106 HG13 VAL 106 10.785 3.678 0.574 771 HG21 VAL 106 HG23 VAL 106 12.288 1.947 2.877 772 HG22 VAL 106 HG21 VAL 106 11.950 2.015 1.150 773 HG23 VAL 106 HG22 VAL 106 11.256 0.726 2.133 774 H HIS 107 HN HIS 107 10.802 5.444 3.825 775 HA HIS 107 HA HIS 107 13.599 5.165 4.354 776 HD1 HIS 107 HD1 HIS 107 12.372 8.745 1.770 777 HD2 HIS 107 HD2 HIS 107 14.759 5.436 2.552 778 HE1 HIS 107 HE1 HIS 107 13.672 8.341 -0.343 779 HE2 HIS 107 HE2 HIS 107 15.195 6.407 0.195 780 HB2 HIS 107 HB2 HIS 107 11.733 7.457 3.919 781 HB3 HIS 107 HB1 HIS 107 13.315 7.772 4.621 782 H SER 108 HN SER 108 10.814 5.441 6.331 783 HA SER 108 HA SER 108 11.960 6.743 8.567 784 HG SER 108 HG SER 108 10.211 6.705 10.445 785 HB2 SER 108 HB2 SER 108 9.545 6.567 8.317 786 HB3 SER 108 HB1 SER 108 9.637 4.809 8.418 Start of MODEL 10 1 HA SER 1 HA SER 1 3.792 -1.913 -9.247 2 HG SER 1 HG SER 1 1.725 -5.083 -8.094 3 H1 SER 1 HT1 SER 1 4.915 -3.525 -10.611 4 H2 SER 1 HT2 SER 1 3.240 -3.694 -10.766 5 H3 SER 1 HT3 SER 1 4.115 -4.796 -9.829 6 HB2 SER 1 HB2 SER 1 2.416 -2.682 -7.339 7 HB3 SER 1 HB1 SER 1 1.710 -3.142 -8.887 8 H ILE 2 HN ILE 2 4.247 -4.783 -7.240 9 HA ILE 2 HA ILE 2 6.569 -3.485 -6.013 10 HB ILE 2 HB ILE 2 4.853 -5.753 -5.045 11 HG12 ILE 2 HG12 ILE 2 5.225 -3.065 -3.769 12 HG13 ILE 2 HG11 ILE 2 4.052 -3.301 -5.049 13 HG21 ILE 2 HG21 ILE 2 7.231 -4.420 -3.776 14 HG22 ILE 2 HG22 ILE 2 7.126 -6.084 -4.355 15 HG23 ILE 2 HG23 ILE 2 6.167 -5.566 -2.962 16 HD11 ILE 2 HD13 ILE 2 4.136 -4.576 -2.364 17 HD12 ILE 2 HD11 ILE 2 3.114 -5.168 -3.674 18 HD13 ILE 2 HD12 ILE 2 2.923 -3.536 -3.076 19 H THR 3 HN THR 3 5.493 -6.463 -7.471 20 HA THR 3 HA THR 3 7.699 -8.087 -7.067 21 HB THR 3 HB THR 3 7.022 -9.319 -9.098 22 HG1 THR 3 HG1 THR 3 5.416 -8.514 -10.412 23 HG21 THR 3 HG23 THR 3 4.544 -8.505 -7.601 24 HG22 THR 3 HG21 THR 3 5.810 -9.483 -6.858 25 HG23 THR 3 HG22 THR 3 4.951 -10.082 -8.278 26 H ASP 4 HN ASP 4 7.308 -5.321 -9.093 27 HA ASP 4 HA ASP 4 9.225 -5.635 -11.038 28 HB2 ASP 4 HB2 ASP 4 7.806 -3.589 -10.708 29 HB3 ASP 4 HB1 ASP 4 8.865 -3.120 -9.381 30 H ILE 5 HN ILE 5 9.733 -4.411 -7.721 31 HA ILE 5 HA ILE 5 12.436 -5.596 -7.779 32 HB ILE 5 HB ILE 5 11.790 -2.968 -6.448 33 HG12 ILE 5 HG12 ILE 5 13.487 -2.844 -8.839 34 HG13 ILE 5 HG11 ILE 5 11.813 -3.261 -9.160 35 HG21 ILE 5 HG21 ILE 5 14.137 -4.687 -6.619 36 HG22 ILE 5 HG22 ILE 5 13.722 -3.434 -5.443 37 HG23 ILE 5 HG23 ILE 5 14.464 -2.992 -6.982 38 HD11 ILE 5 HD13 ILE 5 12.968 -0.738 -8.182 39 HD12 ILE 5 HD11 ILE 5 11.395 -1.210 -7.539 40 HD13 ILE 5 HD12 ILE 5 11.613 -1.029 -9.271 41 H LEU 6 HN LEU 6 11.670 -7.297 -6.546 42 HA LEU 6 HA LEU 6 11.800 -7.028 -3.754 43 HG LEU 6 HG LEU 6 10.539 -6.446 -2.159 44 HB2 LEU 6 HB2 LEU 6 9.235 -6.442 -4.786 45 HB3 LEU 6 HB1 LEU 6 9.117 -7.962 -3.929 46 HD11 LEU 6 HD11 LEU 6 8.691 -4.423 -2.259 47 HD12 LEU 6 HD12 LEU 6 9.151 -4.637 -3.948 48 HD13 LEU 6 HD13 LEU 6 10.385 -4.310 -2.734 49 HD21 LEU 6 HD23 LEU 6 8.740 -7.832 -1.484 50 HD22 LEU 6 HD21 LEU 6 7.577 -6.894 -2.417 51 HD23 LEU 6 HD22 LEU 6 8.328 -6.192 -0.986 52 H SER 7 HN SER 7 11.201 -9.011 -2.524 53 HA SER 7 HA SER 7 11.902 -11.379 -4.054 54 HG SER 7 HG SER 7 13.610 -11.195 -0.924 55 HB2 SER 7 HB2 SER 7 11.292 -11.108 -1.095 56 HB3 SER 7 HB1 SER 7 12.021 -12.502 -1.887 57 H ALA 8 HN ALA 8 10.369 -12.639 -4.933 58 HA ALA 8 HA ALA 8 7.632 -12.023 -4.769 59 HB1 ALA 8 HB3 ALA 8 8.656 -13.113 -6.706 60 HB2 ALA 8 HB1 ALA 8 7.277 -14.028 -6.094 61 HB3 ALA 8 HB2 ALA 8 8.918 -14.569 -5.746 62 H GLU 9 HN GLU 9 9.467 -14.694 -3.257 63 HA GLU 9 HA GLU 9 7.213 -15.958 -2.136 64 HB2 GLU 9 HB2 GLU 9 10.117 -15.991 -1.326 65 HB3 GLU 9 HB1 GLU 9 8.894 -17.067 -0.654 66 HG2 GLU 9 HG2 GLU 9 8.506 -18.020 -2.842 67 HG3 GLU 9 HG1 GLU 9 9.650 -16.882 -3.548 68 H ASP 10 HN ASP 10 9.686 -13.937 -0.554 69 HA ASP 10 HA ASP 10 8.518 -13.638 1.863 70 HB2 ASP 10 HB2 ASP 10 10.033 -11.572 0.286 71 HB3 ASP 10 HB1 ASP 10 9.648 -11.405 1.994 72 H ILE 11 HN ILE 11 7.549 -12.089 -1.090 73 HA ILE 11 HA ILE 11 5.887 -10.122 0.102 74 HB ILE 11 HB ILE 11 6.175 -11.314 -2.617 75 HG12 ILE 11 HG12 ILE 11 5.981 -8.437 -1.720 76 HG13 ILE 11 HG11 ILE 11 7.487 -9.355 -1.787 77 HG21 ILE 11 HG21 ILE 11 3.735 -9.788 -1.757 78 HG22 ILE 11 HG22 ILE 11 3.817 -11.341 -2.588 79 HG23 ILE 11 HG23 ILE 11 4.275 -9.863 -3.435 80 HD11 ILE 11 HD13 ILE 11 7.633 -9.197 -4.010 81 HD12 ILE 11 HD11 ILE 11 6.551 -7.824 -3.788 82 HD13 ILE 11 HD12 ILE 11 5.899 -9.398 -4.237 83 H ALA 12 HN ALA 12 5.220 -13.340 -1.218 84 HA ALA 12 HA ALA 12 2.478 -13.428 -0.669 85 HB1 ALA 12 HB3 ALA 12 4.109 -15.138 -1.884 86 HB2 ALA 12 HB1 ALA 12 2.557 -15.645 -1.211 87 HB3 ALA 12 HB2 ALA 12 4.043 -15.919 -0.304 88 H ALA 13 HN ALA 13 5.166 -14.617 1.354 89 HA ALA 13 HA ALA 13 3.494 -15.332 3.519 90 HB1 ALA 13 HB3 ALA 13 5.915 -16.028 3.157 91 HB2 ALA 13 HB1 ALA 13 5.477 -15.570 4.805 92 HB3 ALA 13 HB2 ALA 13 6.360 -14.438 3.782 93 H ALA 14 HN ALA 14 5.529 -12.533 2.950 94 HA ALA 14 HA ALA 14 4.982 -10.935 5.075 95 HB1 ALA 14 HB3 ALA 14 6.516 -10.121 3.480 96 HB2 ALA 14 HB1 ALA 14 5.184 -8.965 3.479 97 HB3 ALA 14 HB2 ALA 14 5.318 -10.160 2.183 98 H LEU 15 HN LEU 15 3.001 -11.182 2.138 99 HA LEU 15 HA LEU 15 0.964 -9.429 3.162 100 HG LEU 15 HG LEU 15 -0.307 -8.472 1.015 101 HB2 LEU 15 HB2 LEU 15 1.618 -9.824 0.715 102 HB3 LEU 15 HB1 LEU 15 0.694 -11.304 0.832 103 HD11 LEU 15 HD11 LEU 15 -1.112 -10.771 -0.760 104 HD12 LEU 15 HD12 LEU 15 -0.028 -9.466 -1.227 105 HD13 LEU 15 HD13 LEU 15 -1.712 -9.118 -0.843 106 HD21 LEU 15 HD23 LEU 15 -1.731 -10.999 1.796 107 HD22 LEU 15 HD21 LEU 15 -2.563 -9.501 1.380 108 HD23 LEU 15 HD22 LEU 15 -1.472 -9.549 2.764 109 H GLN 16 HN GLN 16 1.158 -12.923 2.453 110 HA GLN 16 HA GLN 16 -1.458 -13.573 3.287 111 HB2 GLN 16 HB2 GLN 16 1.026 -15.197 2.789 112 HB3 GLN 16 HB1 GLN 16 -0.522 -15.903 3.206 113 HG2 GLN 16 HG2 GLN 16 0.323 -15.637 0.719 114 HG3 GLN 16 HG1 GLN 16 -1.383 -15.585 1.161 115 HE21 GLN 16 HE21 GLN 16 -2.422 -13.541 1.228 116 HE22 GLN 16 HE22 GLN 16 -1.808 -12.216 0.310 117 H GLU 17 HN GLU 17 1.091 -12.621 5.257 118 HA GLU 17 HA GLU 17 1.180 -14.770 7.086 119 HB2 GLU 17 HB2 GLU 17 3.001 -13.325 7.187 120 HB3 GLU 17 HB1 GLU 17 1.996 -11.888 7.182 121 HG2 GLU 17 HG2 GLU 17 1.387 -12.235 9.461 122 HG3 GLU 17 HG1 GLU 17 2.150 -13.821 9.469 123 H CYS 18 HN CYS 18 -0.065 -11.521 7.919 124 HA CYS 18 HA CYS 18 -2.114 -12.833 9.518 125 HG CYS 18 HG CYS 18 -1.378 -11.377 12.727 126 HB2 CYS 18 HB2 CYS 18 -0.419 -10.450 9.851 127 HB3 CYS 18 HB1 CYS 18 -2.055 -10.347 10.480 128 H GLN 19 HN GLN 19 -2.008 -11.583 6.553 129 HA GLN 19 HA GLN 19 -3.507 -9.299 6.405 130 HB2 GLN 19 HB2 GLN 19 -2.550 -10.185 4.434 131 HB3 GLN 19 HB1 GLN 19 -3.493 -11.652 4.572 132 HG2 GLN 19 HG2 GLN 19 -5.544 -10.215 4.247 133 HG3 GLN 19 HG1 GLN 19 -4.441 -8.909 3.820 134 HE21 GLN 19 HE21 GLN 19 -5.136 -8.743 1.712 135 HE22 GLN 19 HE22 GLN 19 -4.823 -9.965 0.527 136 H ASP 20 HN ASP 20 -5.587 -8.715 6.177 137 HA ASP 20 HA ASP 20 -7.842 -10.439 6.377 138 HB2 ASP 20 HB2 ASP 20 -6.649 -9.417 8.947 139 HB3 ASP 20 HB1 ASP 20 -8.398 -9.542 8.811 140 HA PRO 21 HA PRO 21 -9.791 -6.437 5.747 141 HB2 PRO 21 HB2 PRO 21 -12.105 -6.574 7.119 142 HB3 PRO 21 HB1 PRO 21 -11.887 -7.481 5.635 143 HG2 PRO 21 HG2 PRO 21 -11.644 -8.395 8.477 144 HG3 PRO 21 HG1 PRO 21 -12.448 -9.193 7.110 145 HD2 PRO 21 HD2 PRO 21 -9.998 -9.909 7.925 146 HD3 PRO 21 HD1 PRO 21 -10.468 -9.946 6.221 147 H ASP 22 HN ASP 22 -7.900 -6.026 6.998 148 HA ASP 22 HA ASP 22 -7.711 -4.070 8.672 149 HB2 ASP 22 HB2 ASP 22 -7.590 -4.987 10.990 150 HB3 ASP 22 HB1 ASP 22 -9.214 -5.127 10.336 151 H THR 23 HN THR 23 -5.745 -5.044 10.477 152 HA THR 23 HA THR 23 -3.576 -5.690 10.633 153 HB THR 23 HB THR 23 -4.527 -7.956 10.475 154 HG1 THR 23 HG1 THR 23 -2.467 -8.817 9.360 155 HG21 THR 23 HG23 THR 23 -4.137 -7.461 7.539 156 HG22 THR 23 HG21 THR 23 -5.597 -7.954 8.387 157 HG23 THR 23 HG22 THR 23 -4.256 -9.071 8.216 158 H PHE 24 HN PHE 24 -4.720 -4.242 8.050 159 HA PHE 24 HA PHE 24 -3.935 -3.461 6.044 160 HD1 PHE 24 HD2 PHE 24 -3.202 -3.067 9.725 161 HD2 PHE 24 HD1 PHE 24 0.307 -2.526 7.388 162 HE1 PHE 24 HE2 PHE 24 -1.819 -3.394 11.736 163 HE2 PHE 24 HE1 PHE 24 1.701 -2.852 9.392 164 HZ PHE 24 HZ PHE 24 0.636 -3.284 11.571 165 HB2 PHE 24 HB2 PHE 24 -1.689 -2.260 6.409 166 HB3 PHE 24 HB1 PHE 24 -3.063 -1.767 7.392 167 H GLU 25 HN GLU 25 -3.515 -4.707 4.371 168 HA GLU 25 HA GLU 25 -1.520 -6.763 4.476 169 HB2 GLU 25 HB2 GLU 25 -3.028 -7.709 3.213 170 HB3 GLU 25 HB1 GLU 25 -3.940 -6.230 3.082 171 HG2 GLU 25 HG2 GLU 25 -2.459 -5.630 1.141 172 HG3 GLU 25 HG1 GLU 25 -1.781 -7.235 1.272 173 HA PRO 26 HA PRO 26 0.196 -4.352 0.745 174 HB2 PRO 26 HB2 PRO 26 -0.312 -1.653 0.782 175 HB3 PRO 26 HB1 PRO 26 -1.090 -2.825 -0.256 176 HG2 PRO 26 HG2 PRO 26 -2.046 -1.446 2.104 177 HG3 PRO 26 HG1 PRO 26 -2.968 -2.206 0.814 178 HD2 PRO 26 HD2 PRO 26 -2.623 -3.224 3.384 179 HD3 PRO 26 HD1 PRO 26 -3.171 -4.105 1.968 180 H GLN 27 HN GLN 27 -0.102 -2.229 3.554 181 HA GLN 27 HA GLN 27 2.463 -1.202 3.452 182 HB2 GLN 27 HB2 GLN 27 0.286 -0.887 5.061 183 HB3 GLN 27 HB1 GLN 27 1.419 -1.665 6.142 184 HG2 GLN 27 HG2 GLN 27 2.275 0.673 4.523 185 HG3 GLN 27 HG1 GLN 27 1.333 0.905 5.994 186 HE21 GLN 27 HE21 GLN 27 2.238 0.368 7.979 187 HE22 GLN 27 HE22 GLN 27 3.935 0.131 8.180 188 H LYS 28 HN LYS 28 1.308 -4.172 4.926 189 HA LYS 28 HA LYS 28 3.833 -4.798 6.160 190 HB2 LYS 28 HB2 LYS 28 1.272 -5.636 6.537 191 HB3 LYS 28 HB1 LYS 28 1.993 -7.026 5.744 192 HG2 LYS 28 HG2 LYS 28 3.708 -7.138 7.432 193 HG3 LYS 28 HG1 LYS 28 3.091 -5.661 8.172 194 HD2 LYS 28 HD2 LYS 28 1.502 -8.205 7.897 195 HD3 LYS 28 HD1 LYS 28 2.404 -7.752 9.345 196 HE2 LYS 28 HE2 LYS 28 1.065 -5.652 9.438 197 HE3 LYS 28 HE1 LYS 28 0.093 -6.269 8.102 198 HZ1 LYS 28 HZ3 LYS 28 -0.984 -6.717 10.195 199 HZ2 LYS 28 HZ1 LYS 28 0.386 -7.521 10.779 200 HZ3 LYS 28 HZ2 LYS 28 -0.497 -8.176 9.494 201 H PHE 29 HN PHE 29 2.042 -5.741 3.333 202 HA PHE 29 HA PHE 29 3.494 -7.755 2.209 203 HD1 PHE 29 HD1 PHE 29 4.527 -6.019 -0.678 204 HD2 PHE 29 HD2 PHE 29 0.728 -7.907 -0.479 205 HE1 PHE 29 HE1 PHE 29 4.821 -6.868 -2.963 206 HE2 PHE 29 HE2 PHE 29 1.019 -8.759 -2.763 207 HZ PHE 29 HZ PHE 29 3.071 -8.232 -4.011 208 HB2 PHE 29 HB2 PHE 29 1.414 -6.809 1.313 209 HB3 PHE 29 HB1 PHE 29 2.238 -5.320 0.913 210 H PHE 30 HN PHE 30 4.129 -4.345 2.240 211 HA PHE 30 HA PHE 30 6.369 -4.436 0.445 212 HD1 PHE 30 HD1 PHE 30 4.329 -4.109 -0.513 213 HD2 PHE 30 HD2 PHE 30 4.040 -0.509 1.738 214 HE1 PHE 30 HE1 PHE 30 2.087 -3.702 -1.434 215 HE2 PHE 30 HE2 PHE 30 1.804 -0.095 0.802 216 HZ PHE 30 HZ PHE 30 0.825 -1.696 -0.791 217 HB2 PHE 30 HB2 PHE 30 5.705 -2.137 2.242 218 HB3 PHE 30 HB1 PHE 30 6.422 -2.108 0.635 219 H GLN 31 HN GLN 31 5.941 -3.674 3.876 220 HA GLN 31 HA GLN 31 8.578 -3.211 4.526 221 HB2 GLN 31 HB2 GLN 31 6.326 -2.927 5.841 222 HB3 GLN 31 HB1 GLN 31 6.785 -4.480 6.528 223 HG2 GLN 31 HG2 GLN 31 7.617 -2.865 8.010 224 HG3 GLN 31 HG1 GLN 31 9.016 -3.405 7.081 225 HE21 GLN 31 HE21 GLN 31 9.805 -2.047 5.395 226 HE22 GLN 31 HE22 GLN 31 9.503 -0.348 5.423 227 H THR 32 HN THR 32 6.865 -6.171 5.470 228 HA THR 32 HA THR 32 9.019 -7.535 6.452 229 HB THR 32 HB THR 32 6.740 -8.752 4.893 230 HG1 THR 32 HG1 THR 32 7.018 -7.812 7.530 231 HG21 THR 32 HG23 THR 32 7.197 -10.761 6.245 232 HG22 THR 32 HG21 THR 32 8.615 -9.963 6.928 233 HG23 THR 32 HG22 THR 32 8.558 -10.340 5.206 234 H SER 33 HN SER 33 7.830 -7.812 3.104 235 HA SER 33 HA SER 33 10.106 -9.416 2.356 236 HG SER 33 HG SER 33 8.697 -10.288 -0.583 237 HB2 SER 33 HB2 SER 33 7.956 -9.953 1.419 238 HB3 SER 33 HB1 SER 33 7.830 -8.362 0.689 239 H GLY 34 HN GLY 34 8.859 -6.286 1.225 240 HA2 GLY 34 HA2 GLY 34 11.430 -5.985 -0.168 241 HA3 GLY 34 HA1 GLY 34 9.981 -5.119 -0.592 242 H LEU 35 HN LEU 35 9.257 -3.608 1.340 243 HA LEU 35 HA LEU 35 10.906 -1.434 1.203 244 HG LEU 35 HG LEU 35 8.031 -1.132 0.915 245 HB2 LEU 35 HB2 LEU 35 8.640 -2.302 2.886 246 HB3 LEU 35 HB1 LEU 35 9.569 -0.954 3.485 247 HD11 LEU 35 HD11 LEU 35 7.849 0.768 3.243 248 HD12 LEU 35 HD12 LEU 35 6.752 -0.577 2.928 249 HD13 LEU 35 HD13 LEU 35 6.831 0.780 1.803 250 HD21 LEU 35 HD23 LEU 35 10.192 0.727 1.728 251 HD22 LEU 35 HD21 LEU 35 8.858 1.317 0.739 252 HD23 LEU 35 HD22 LEU 35 9.868 -0.011 0.163 253 H SER 36 HN SER 36 10.915 -3.997 3.607 254 HA SER 36 HA SER 36 12.286 -3.237 5.681 255 HG SER 36 HG SER 36 13.687 -4.852 6.666 256 HB2 SER 36 HB2 SER 36 11.860 -5.584 5.246 257 HB3 SER 36 HB1 SER 36 13.115 -5.612 4.009 258 H LYS 37 HN LYS 37 13.943 -3.423 2.510 259 HA LYS 37 HA LYS 37 15.991 -1.685 3.656 260 HB2 LYS 37 HB2 LYS 37 16.715 -4.292 2.335 261 HB3 LYS 37 HB1 LYS 37 17.839 -3.088 2.943 262 HG2 LYS 37 HG2 LYS 37 17.071 -3.462 5.204 263 HG3 LYS 37 HG1 LYS 37 15.877 -4.617 4.614 264 HD2 LYS 37 HD2 LYS 37 17.652 -6.049 3.772 265 HD3 LYS 37 HD1 LYS 37 18.862 -4.891 4.328 266 HE2 LYS 37 HE2 LYS 37 17.968 -5.212 6.647 267 HE3 LYS 37 HE1 LYS 37 16.966 -6.517 6.014 268 HZ1 LYS 37 HZ3 LYS 37 19.015 -7.625 5.270 269 HZ2 LYS 37 HZ1 LYS 37 18.970 -7.415 6.949 270 HZ3 LYS 37 HZ2 LYS 37 19.933 -6.404 5.996 271 H MET 38 HN MET 38 14.371 -2.820 0.791 272 HA MET 38 HA MET 38 16.065 -2.093 -1.238 273 HB2 MET 38 HB2 MET 38 13.388 -1.060 -1.765 274 HB3 MET 38 HB1 MET 38 14.325 -2.256 -2.639 275 HG2 MET 38 HG2 MET 38 12.701 -2.758 -0.177 276 HG3 MET 38 HG1 MET 38 12.226 -3.154 -1.820 277 HE1 MET 38 HE3 MET 38 14.175 -5.947 -2.988 278 HE2 MET 38 HE1 MET 38 15.360 -4.643 -2.889 279 HE3 MET 38 HE2 MET 38 13.697 -4.287 -3.358 280 H SER 39 HN SER 39 16.171 -0.204 -2.608 281 HA SER 39 HA SER 39 16.660 2.168 -1.122 282 HG SER 39 HG SER 39 18.239 0.512 -3.433 283 HB2 SER 39 HB2 SER 39 16.605 1.741 -4.118 284 HB3 SER 39 HB1 SER 39 17.287 3.141 -3.290 285 H ALA 40 HN ALA 40 15.779 4.330 -1.895 286 HA ALA 40 HA ALA 40 12.994 4.393 -1.442 287 HB1 ALA 40 HB3 ALA 40 14.700 6.569 -2.640 288 HB2 ALA 40 HB1 ALA 40 14.489 6.272 -0.914 289 HB3 ALA 40 HB2 ALA 40 13.108 6.763 -1.899 290 H SER 41 HN SER 41 14.892 4.733 -4.416 291 HA SER 41 HA SER 41 12.952 5.464 -6.207 292 HG SER 41 HG SER 41 14.376 3.594 -8.660 293 HB2 SER 41 HB2 SER 41 15.366 5.230 -6.724 294 HB3 SER 41 HB1 SER 41 15.175 3.479 -6.725 295 H GLN 42 HN GLN 42 13.951 2.101 -5.575 296 HA GLN 42 HA GLN 42 12.047 0.853 -7.143 297 HB2 GLN 42 HB2 GLN 42 12.573 -1.138 -6.027 298 HB3 GLN 42 HB1 GLN 42 14.029 -0.167 -5.871 299 HG2 GLN 42 HG2 GLN 42 13.907 -0.742 -3.731 300 HG3 GLN 42 HG1 GLN 42 12.691 0.527 -3.630 301 HE21 GLN 42 HE21 GLN 42 11.518 -0.428 -2.000 302 HE22 GLN 42 HE22 GLN 42 10.595 -1.869 -2.216 303 H VAL 43 HN VAL 43 11.771 2.210 -3.978 304 HA VAL 43 HA VAL 43 9.321 1.048 -3.202 305 HB VAL 43 HB VAL 43 10.228 3.819 -2.429 306 HG11 VAL 43 HG11 VAL 43 8.423 1.820 -1.090 307 HG12 VAL 43 HG12 VAL 43 7.929 3.334 -1.848 308 HG13 VAL 43 HG13 VAL 43 8.927 3.359 -0.393 309 HG21 VAL 43 HG23 VAL 43 11.742 1.613 -2.097 310 HG22 VAL 43 HG21 VAL 43 10.757 1.535 -0.645 311 HG23 VAL 43 HG22 VAL 43 11.734 2.962 -0.964 312 H LYS 44 HN LYS 44 10.132 3.693 -5.301 313 HA LYS 44 HA LYS 44 7.687 4.986 -5.592 314 HB2 LYS 44 HB2 LYS 44 9.702 4.304 -7.745 315 HB3 LYS 44 HB1 LYS 44 8.431 5.492 -7.893 316 HG2 LYS 44 HG2 LYS 44 9.424 6.824 -6.136 317 HG3 LYS 44 HG1 LYS 44 10.662 5.597 -5.921 318 HD2 LYS 44 HD2 LYS 44 10.241 7.386 -8.295 319 HD3 LYS 44 HD1 LYS 44 11.634 7.322 -7.214 320 HE2 LYS 44 HE2 LYS 44 12.107 5.032 -8.014 321 HE3 LYS 44 HE1 LYS 44 10.766 5.178 -9.148 322 HZ1 LYS 44 HZ3 LYS 44 11.912 7.061 -10.174 323 HZ2 LYS 44 HZ1 LYS 44 12.850 5.653 -10.238 324 HZ3 LYS 44 HZ2 LYS 44 13.212 6.862 -9.110 325 H ASP 45 HN ASP 45 8.950 2.121 -7.195 326 HA ASP 45 HA ASP 45 6.701 1.618 -8.791 327 HB2 ASP 45 HB2 ASP 45 9.201 0.286 -8.098 328 HB3 ASP 45 HB1 ASP 45 7.880 -0.845 -8.322 329 H ILE 46 HN ILE 46 7.746 0.489 -5.606 330 HA ILE 46 HA ILE 46 5.745 -1.320 -5.042 331 HB ILE 46 HB ILE 46 7.503 0.431 -3.407 332 HG12 ILE 46 HG12 ILE 46 8.370 -1.663 -2.643 333 HG13 ILE 46 HG11 ILE 46 7.025 -2.535 -3.348 334 HG21 ILE 46 HG21 ILE 46 5.109 -1.003 -2.320 335 HG22 ILE 46 HG22 ILE 46 5.656 0.646 -2.014 336 HG23 ILE 46 HG23 ILE 46 6.547 -0.717 -1.338 337 HD11 ILE 46 HD13 ILE 46 7.828 -1.758 -5.586 338 HD12 ILE 46 HD11 ILE 46 8.895 -2.878 -4.741 339 HD13 ILE 46 HD12 ILE 46 9.267 -1.160 -4.768 340 H PHE 47 HN PHE 47 5.813 2.140 -4.181 341 HA PHE 47 HA PHE 47 3.437 2.706 -3.154 342 HD1 PHE 47 HD1 PHE 47 1.999 5.092 -3.366 343 HD2 PHE 47 HD2 PHE 47 4.337 5.348 -6.914 344 HE1 PHE 47 HE1 PHE 47 0.355 6.647 -4.342 345 HE2 PHE 47 HE2 PHE 47 2.701 6.904 -7.888 346 HZ PHE 47 HZ PHE 47 0.706 7.554 -6.601 347 HB2 PHE 47 HB2 PHE 47 4.675 4.593 -3.594 348 HB3 PHE 47 HB1 PHE 47 5.103 4.077 -5.199 349 H ARG 48 HN ARG 48 3.963 1.918 -6.496 350 HA ARG 48 HA ARG 48 1.476 2.472 -7.589 351 HE ARG 48 HE ARG 48 1.363 3.406 -10.235 352 HB2 ARG 48 HB2 ARG 48 3.257 0.173 -8.384 353 HB3 ARG 48 HB1 ARG 48 2.061 0.984 -9.386 354 HG2 ARG 48 HG2 ARG 48 4.605 2.175 -8.313 355 HG3 ARG 48 HG1 ARG 48 4.264 1.739 -9.988 356 HD2 ARG 48 HD2 ARG 48 2.716 3.794 -8.410 357 HD3 ARG 48 HD1 ARG 48 4.049 4.176 -9.500 358 HH11 ARG 48 HH11 ARG 48 4.677 3.732 -11.274 359 HH12 ARG 48 HH12 ARG 48 4.274 3.805 -12.956 360 HH21 ARG 48 HH21 ARG 48 0.833 3.499 -12.447 361 HH22 ARG 48 HH22 ARG 48 2.090 3.676 -13.622 362 H PHE 49 HN PHE 49 2.477 -0.337 -5.692 363 HA PHE 49 HA PHE 49 0.516 -2.160 -6.277 364 HD1 PHE 49 HD2 PHE 49 1.586 -4.672 -5.380 365 HD2 PHE 49 HD1 PHE 49 -0.492 -2.540 -2.329 366 HE1 PHE 49 HE2 PHE 49 0.410 -6.733 -4.735 367 HE2 PHE 49 HE1 PHE 49 -1.664 -4.591 -1.687 368 HZ PHE 49 HZ PHE 49 -1.217 -6.696 -2.888 369 HB2 PHE 49 HB2 PHE 49 2.357 -2.485 -4.613 370 HB3 PHE 49 HB1 PHE 49 1.420 -1.555 -3.453 371 H ILE 50 HN ILE 50 0.218 0.216 -3.608 372 HA ILE 50 HA ILE 50 -2.540 -0.142 -3.277 373 HB ILE 50 HB ILE 50 -2.485 2.157 -2.197 374 HG12 ILE 50 HG12 ILE 50 0.481 1.918 -2.759 375 HG13 ILE 50 HG11 ILE 50 -0.600 3.106 -3.482 376 HG21 ILE 50 HG21 ILE 50 -0.820 -0.158 -1.380 377 HG22 ILE 50 HG22 ILE 50 -2.350 0.438 -0.718 378 HG23 ILE 50 HG23 ILE 50 -0.843 1.303 -0.390 379 HD11 ILE 50 HD13 ILE 50 -0.142 2.882 -0.521 380 HD12 ILE 50 HD11 ILE 50 -0.934 4.188 -1.398 381 HD13 ILE 50 HD12 ILE 50 0.806 3.936 -1.570 382 H ASP 51 HN ASP 51 -3.312 2.815 -3.605 383 HA ASP 51 HA ASP 51 -4.520 2.545 -6.087 384 HB2 ASP 51 HB2 ASP 51 -4.051 4.861 -4.252 385 HB3 ASP 51 HB1 ASP 51 -4.713 5.148 -5.862 386 H ASN 52 HN ASN 52 -3.960 2.973 -8.101 387 HA ASN 52 HA ASN 52 -1.222 3.708 -8.706 388 HB2 ASN 52 HB2 ASN 52 -2.454 1.814 -9.846 389 HB3 ASN 52 HB1 ASN 52 -3.435 3.024 -10.646 390 HD21 ASN 52 HD21 ASN 52 -2.427 4.464 -12.054 391 HD22 ASN 52 HD22 ASN 52 -0.972 4.030 -12.889 392 H ASP 53 HN ASP 53 -2.417 5.840 -7.591 393 HA ASP 53 HA ASP 53 -2.639 8.081 -7.924 394 HB2 ASP 53 HB2 ASP 53 -2.597 7.610 -10.913 395 HB3 ASP 53 HB1 ASP 53 -2.263 9.103 -10.047 396 H GLN 54 HN GLN 54 -4.399 9.500 -8.437 397 HA GLN 54 HA GLN 54 -6.742 8.410 -9.672 398 HB2 GLN 54 HB2 GLN 54 -6.889 9.177 -6.762 399 HB3 GLN 54 HB1 GLN 54 -8.113 8.393 -7.737 400 HG2 GLN 54 HG2 GLN 54 -6.738 6.385 -7.885 401 HG3 GLN 54 HG1 GLN 54 -5.486 7.174 -6.931 402 HE21 GLN 54 HE21 GLN 54 -5.839 7.556 -4.746 403 HE22 GLN 54 HE22 GLN 54 -6.971 6.621 -3.849 404 H SER 55 HN SER 55 -5.421 10.957 -7.593 405 HA SER 55 HA SER 55 -6.469 12.977 -9.389 406 HG SER 55 HG SER 55 -8.552 11.629 -7.960 407 HB2 SER 55 HB2 SER 55 -7.267 12.865 -6.469 408 HB3 SER 55 HB1 SER 55 -7.541 14.247 -7.529 409 H GLY 56 HN GLY 56 -3.855 12.171 -8.914 410 HA2 GLY 56 HA2 GLY 56 -1.907 13.535 -8.832 411 HA3 GLY 56 HA1 GLY 56 -2.769 14.641 -7.765 412 H TYR 57 HN TYR 57 -3.734 12.238 -6.233 413 HA TYR 57 HA TYR 57 -1.414 11.085 -4.996 414 HD1 TYR 57 HD1 TYR 57 -4.372 13.998 -3.644 415 HD2 TYR 57 HD2 TYR 57 -0.248 14.405 -4.515 416 HE1 TYR 57 HE1 TYR 57 -4.760 16.342 -4.318 417 HE2 TYR 57 HE2 TYR 57 -0.600 16.751 -5.179 418 HH TYR 57 HH TYR 57 -3.479 18.431 -4.517 419 HB2 TYR 57 HB2 TYR 57 -2.824 12.410 -2.852 420 HB3 TYR 57 HB1 TYR 57 -1.122 12.499 -3.250 421 H LEU 58 HN LEU 58 -2.114 9.772 -3.055 422 HA LEU 58 HA LEU 58 -4.805 8.702 -3.590 423 HG LEU 58 HG LEU 58 -1.589 7.734 -3.926 424 HB2 LEU 58 HB2 LEU 58 -2.794 7.398 -1.780 425 HB3 LEU 58 HB1 LEU 58 -4.112 6.659 -2.667 426 HD11 LEU 58 HD11 LEU 58 -2.344 5.073 -2.867 427 HD12 LEU 58 HD12 LEU 58 -0.757 5.843 -2.962 428 HD13 LEU 58 HD13 LEU 58 -1.476 5.119 -4.396 429 HD21 LEU 58 HD23 LEU 58 -2.700 6.032 -5.708 430 HD22 LEU 58 HD21 LEU 58 -2.869 7.785 -5.745 431 HD23 LEU 58 HD22 LEU 58 -4.120 6.793 -5.012 432 H ASP 59 HN ASP 59 -6.294 8.456 -1.789 433 HA ASP 59 HA ASP 59 -5.438 9.730 0.701 434 HB2 ASP 59 HB2 ASP 59 -6.381 11.511 -0.745 435 HB3 ASP 59 HB1 ASP 59 -7.903 10.624 -0.795 436 H GLY 60 HN GLY 60 -6.916 9.497 2.452 437 HA2 GLY 60 HA2 GLY 60 -7.471 6.949 3.134 438 HA3 GLY 60 HA1 GLY 60 -8.366 8.308 3.786 439 H ASP 61 HN ASP 61 -9.742 9.021 1.378 440 HA ASP 61 HA ASP 61 -11.895 7.109 1.637 441 HB2 ASP 61 HB2 ASP 61 -11.800 9.354 -0.366 442 HB3 ASP 61 HB1 ASP 61 -13.210 8.618 0.389 443 H GLU 62 HN GLU 62 -9.621 8.138 -0.785 444 HA GLU 62 HA GLU 62 -10.607 6.429 -2.842 445 HB2 GLU 62 HB2 GLU 62 -7.977 7.887 -2.720 446 HB3 GLU 62 HB1 GLU 62 -8.808 7.303 -4.157 447 HG2 GLU 62 HG2 GLU 62 -10.015 9.335 -2.324 448 HG3 GLU 62 HG1 GLU 62 -8.958 9.782 -3.662 449 H LEU 63 HN LEU 63 -8.183 6.148 -0.348 450 HA LEU 63 HA LEU 63 -6.380 4.321 -1.218 451 HG LEU 63 HG LEU 63 -6.652 6.322 1.361 452 HB2 LEU 63 HB2 LEU 63 -7.866 4.330 1.411 453 HB3 LEU 63 HB1 LEU 63 -6.453 3.355 1.105 454 HD11 LEU 63 HD11 LEU 63 -4.409 5.278 2.660 455 HD12 LEU 63 HD12 LEU 63 -5.753 4.193 3.012 456 HD13 LEU 63 HD13 LEU 63 -5.886 5.909 3.378 457 HD21 LEU 63 HD23 LEU 63 -4.398 4.774 0.110 458 HD22 LEU 63 HD21 LEU 63 -4.258 6.435 0.684 459 HD23 LEU 63 HD22 LEU 63 -5.361 6.050 -0.638 460 H LYS 64 HN LYS 64 -9.582 3.485 0.090 461 HA LYS 64 HA LYS 64 -9.500 0.768 -0.252 462 HB2 LYS 64 HB2 LYS 64 -12.059 1.076 -0.406 463 HB3 LYS 64 HB1 LYS 64 -11.235 1.605 1.051 464 HG2 LYS 64 HG2 LYS 64 -11.490 3.840 0.545 465 HG3 LYS 64 HG1 LYS 64 -11.682 3.536 -1.181 466 HD2 LYS 64 HD2 LYS 64 -13.802 4.195 -0.292 467 HD3 LYS 64 HD1 LYS 64 -13.872 2.474 -0.678 468 HE2 LYS 64 HE2 LYS 64 -13.521 1.921 1.651 469 HE3 LYS 64 HE1 LYS 64 -13.370 3.627 2.061 470 HZ1 LYS 64 HZ3 LYS 64 -15.568 2.857 2.589 471 HZ2 LYS 64 HZ1 LYS 64 -15.796 2.271 1.018 472 HZ3 LYS 64 HZ2 LYS 64 -15.669 3.934 1.288 473 H TYR 65 HN TYR 65 -9.749 3.135 -2.735 474 HA TYR 65 HA TYR 65 -11.205 1.477 -4.554 475 HD1 TYR 65 HD1 TYR 65 -12.309 2.750 -3.272 476 HD2 TYR 65 HD2 TYR 65 -11.008 6.000 -5.689 477 HE1 TYR 65 HE1 TYR 65 -13.988 4.201 -2.207 478 HE2 TYR 65 HE2 TYR 65 -12.691 7.456 -4.644 479 HH TYR 65 HH TYR 65 -14.359 6.617 -1.824 480 HB2 TYR 65 HB2 TYR 65 -9.559 3.912 -5.212 481 HB3 TYR 65 HB1 TYR 65 -10.804 3.178 -6.209 482 H PHE 66 HN PHE 66 -7.884 1.683 -3.662 483 HA PHE 66 HA PHE 66 -6.484 1.118 -5.929 484 HD1 PHE 66 HD2 PHE 66 -4.615 -1.541 -5.570 485 HD2 PHE 66 HD1 PHE 66 -5.810 -0.664 -1.591 486 HE1 PHE 66 HE2 PHE 66 -3.935 -3.801 -4.875 487 HE2 PHE 66 HE1 PHE 66 -5.148 -2.933 -0.878 488 HZ PHE 66 HZ PHE 66 -4.203 -4.500 -2.528 489 HB2 PHE 66 HB2 PHE 66 -4.831 0.927 -4.449 490 HB3 PHE 66 HB1 PHE 66 -6.006 0.970 -3.159 491 H LEU 67 HN LEU 67 -8.042 -1.317 -3.883 492 HA LEU 67 HA LEU 67 -7.443 -3.513 -5.576 493 HG LEU 67 HG LEU 67 -7.268 -3.676 -2.656 494 HB2 LEU 67 HB2 LEU 67 -9.511 -3.042 -3.449 495 HB3 LEU 67 HB1 LEU 67 -9.579 -4.490 -4.434 496 HD11 LEU 67 HD11 LEU 67 -9.365 -5.819 -2.347 497 HD12 LEU 67 HD12 LEU 67 -9.182 -4.375 -1.352 498 HD13 LEU 67 HD13 LEU 67 -7.944 -5.631 -1.320 499 HD21 LEU 67 HD23 LEU 67 -7.703 -6.169 -4.299 500 HD22 LEU 67 HD21 LEU 67 -6.377 -5.898 -3.169 501 HD23 LEU 67 HD22 LEU 67 -6.513 -4.908 -4.622 502 H GLN 68 HN GLN 68 -9.964 -1.154 -5.443 503 HA GLN 68 HA GLN 68 -11.702 -2.457 -7.289 504 HB2 GLN 68 HB2 GLN 68 -11.694 0.049 -5.716 505 HB3 GLN 68 HB1 GLN 68 -12.706 0.010 -7.141 506 HG2 GLN 68 HG2 GLN 68 -13.706 -2.113 -6.253 507 HG3 GLN 68 HG1 GLN 68 -12.814 -1.815 -4.763 508 HE21 GLN 68 HE21 GLN 68 -14.687 -1.650 -3.560 509 HE22 GLN 68 HE22 GLN 68 -15.726 -0.271 -3.652 510 H LYS 69 HN LYS 69 -8.809 -0.871 -7.754 511 HA LYS 69 HA LYS 69 -9.581 0.558 -10.151 512 HB2 LYS 69 HB2 LYS 69 -6.820 -0.093 -9.113 513 HB3 LYS 69 HB1 LYS 69 -7.239 1.127 -10.311 514 HG2 LYS 69 HG2 LYS 69 -7.788 1.147 -7.371 515 HG3 LYS 69 HG1 LYS 69 -6.812 2.255 -8.301 516 HD2 LYS 69 HD2 LYS 69 -9.803 1.962 -8.398 517 HD3 LYS 69 HD1 LYS 69 -8.890 3.336 -7.774 518 HE2 LYS 69 HE2 LYS 69 -8.041 3.816 -9.992 519 HE3 LYS 69 HE1 LYS 69 -8.856 2.390 -10.635 520 HZ1 LYS 69 HZ3 LYS 69 -10.219 4.732 -9.418 521 HZ2 LYS 69 HZ1 LYS 69 -10.977 3.381 -10.099 522 HZ3 LYS 69 HZ2 LYS 69 -10.088 4.436 -11.077 523 H PHE 70 HN PHE 70 -7.588 -2.151 -9.167 524 HA PHE 70 HA PHE 70 -7.397 -3.199 -11.851 525 HD1 PHE 70 HD2 PHE 70 -5.914 -6.206 -11.677 526 HD2 PHE 70 HD1 PHE 70 -6.166 -4.743 -7.686 527 HE1 PHE 70 HE2 PHE 70 -5.780 -8.512 -10.825 528 HE2 PHE 70 HE1 PHE 70 -6.033 -7.043 -6.828 529 HZ PHE 70 HZ PHE 70 -5.840 -8.933 -8.398 530 HB2 PHE 70 HB2 PHE 70 -5.405 -3.795 -11.036 531 HB3 PHE 70 HB1 PHE 70 -5.863 -3.244 -9.445 532 H GLN 71 HN GLN 71 -8.596 -4.313 -8.695 533 HA GLN 71 HA GLN 71 -9.760 -6.699 -9.856 534 HB2 GLN 71 HB2 GLN 71 -8.733 -6.698 -7.602 535 HB3 GLN 71 HB1 GLN 71 -9.984 -5.596 -7.059 536 HG2 GLN 71 HG2 GLN 71 -11.402 -7.698 -8.139 537 HG3 GLN 71 HG1 GLN 71 -10.041 -8.468 -7.326 538 HE21 GLN 71 HE21 GLN 71 -9.789 -6.347 -5.332 539 HE22 GLN 71 HE22 GLN 71 -11.108 -6.544 -4.246 540 H SER 72 HN SER 72 -10.717 -3.498 -9.625 541 HA SER 72 HA SER 72 -12.784 -2.456 -9.226 542 HG SER 72 HG SER 72 -14.874 -3.010 -12.022 543 HB2 SER 72 HB2 SER 72 -12.323 -2.472 -11.602 544 HB3 SER 72 HB1 SER 72 -13.083 -4.051 -11.751 545 H ASP 73 HN ASP 73 -12.853 -4.681 -7.585 546 HA ASP 73 HA ASP 73 -15.689 -5.073 -7.386 547 HB2 ASP 73 HB2 ASP 73 -15.071 -6.851 -8.982 548 HB3 ASP 73 HB1 ASP 73 -13.922 -7.489 -7.812 549 H ALA 74 HN ALA 74 -13.188 -4.117 -5.840 550 HA ALA 74 HA ALA 74 -12.820 -5.919 -3.675 551 HB1 ALA 74 HB3 ALA 74 -11.113 -4.543 -3.316 552 HB2 ALA 74 HB1 ALA 74 -12.237 -3.262 -2.879 553 HB3 ALA 74 HB2 ALA 74 -11.718 -3.437 -4.557 554 H ARG 75 HN ARG 75 -13.280 -5.114 -1.386 555 HA ARG 75 HA ARG 75 -16.102 -4.338 -1.286 556 HE ARG 75 HE ARG 75 -10.943 -6.138 0.857 557 HB2 ARG 75 HB2 ARG 75 -15.539 -4.956 1.287 558 HB3 ARG 75 HB1 ARG 75 -16.103 -6.122 0.102 559 HG2 ARG 75 HG2 ARG 75 -14.276 -7.086 1.271 560 HG3 ARG 75 HG1 ARG 75 -13.723 -6.701 -0.359 561 HD2 ARG 75 HD2 ARG 75 -12.649 -4.678 0.468 562 HD3 ARG 75 HD1 ARG 75 -13.242 -5.013 2.095 563 HH11 ARG 75 HH11 ARG 75 -13.538 -6.846 3.069 564 HH12 ARG 75 HH12 ARG 75 -12.655 -8.071 3.918 565 HH21 ARG 75 HH21 ARG 75 -9.772 -7.757 1.968 566 HH22 ARG 75 HH22 ARG 75 -10.515 -8.586 3.295 567 H GLU 76 HN GLU 76 -13.418 -2.699 -1.466 568 HA GLU 76 HA GLU 76 -13.006 -0.484 -1.085 569 HB2 GLU 76 HB2 GLU 76 -15.151 -0.514 1.030 570 HB3 GLU 76 HB1 GLU 76 -14.419 0.875 0.255 571 HG2 GLU 76 HG2 GLU 76 -15.488 0.452 -1.789 572 HG3 GLU 76 HG1 GLU 76 -15.955 -1.171 -1.286 573 H LEU 77 HN LEU 77 -11.502 -2.396 -0.107 574 HA LEU 77 HA LEU 77 -10.220 -3.207 1.655 575 HG LEU 77 HG LEU 77 -8.783 -1.873 -0.344 576 HB2 LEU 77 HB2 LEU 77 -9.733 -0.295 1.329 577 HB3 LEU 77 HB1 LEU 77 -8.873 -1.165 2.580 578 HD11 LEU 77 HD11 LEU 77 -7.170 -0.075 1.380 579 HD12 LEU 77 HD12 LEU 77 -7.617 0.077 -0.315 580 HD13 LEU 77 HD13 LEU 77 -6.339 -1.040 0.164 581 HD21 LEU 77 HD23 LEU 77 -7.072 -2.805 1.957 582 HD22 LEU 77 HD21 LEU 77 -6.983 -3.343 0.280 583 HD23 LEU 77 HD22 LEU 77 -8.396 -3.733 1.260 584 H THR 78 HN THR 78 -12.843 -2.831 2.562 585 HA THR 78 HA THR 78 -14.132 -2.402 4.415 586 HB THR 78 HB THR 78 -13.675 -4.029 5.883 587 HG1 THR 78 HG1 THR 78 -11.629 -4.018 7.105 588 HG21 THR 78 HG23 THR 78 -11.394 -4.296 3.991 589 HG22 THR 78 HG21 THR 78 -12.711 -5.397 4.332 590 HG23 THR 78 HG22 THR 78 -11.370 -5.261 5.453 591 H GLU 79 HN GLU 79 -13.788 -1.771 6.942 592 HA GLU 79 HA GLU 79 -13.046 0.960 6.944 593 HB2 GLU 79 HB2 GLU 79 -14.856 -0.011 8.350 594 HB3 GLU 79 HB1 GLU 79 -13.637 -0.891 9.264 595 HG2 GLU 79 HG2 GLU 79 -12.652 1.171 9.997 596 HG3 GLU 79 HG1 GLU 79 -13.792 2.085 9.016 597 H SER 80 HN SER 80 -11.730 -2.035 8.241 598 HA SER 80 HA SER 80 -9.433 -0.808 9.457 599 HG SER 80 HG SER 80 -7.961 -2.699 10.223 600 HB2 SER 80 HB2 SER 80 -10.782 -2.852 10.228 601 HB3 SER 80 HB1 SER 80 -9.787 -3.746 9.090 602 H GLU 81 HN GLU 81 -10.052 -2.369 6.368 603 HA GLU 81 HA GLU 81 -7.357 -3.281 6.010 604 HB2 GLU 81 HB2 GLU 81 -9.696 -3.853 4.724 605 HB3 GLU 81 HB1 GLU 81 -8.866 -2.847 3.549 606 HG2 GLU 81 HG2 GLU 81 -7.225 -4.356 3.185 607 HG3 GLU 81 HG1 GLU 81 -7.311 -5.017 4.819 608 H THR 82 HN THR 82 -9.181 -0.425 4.841 609 HA THR 82 HA THR 82 -7.119 0.726 3.358 610 HB THR 82 HB THR 82 -8.227 2.901 3.822 611 HG1 THR 82 HG1 THR 82 -8.968 2.287 5.973 612 HG21 THR 82 HG23 THR 82 -10.026 0.621 3.022 613 HG22 THR 82 HG21 THR 82 -8.991 1.579 1.961 614 HG23 THR 82 HG22 THR 82 -10.382 2.326 2.747 615 H LYS 83 HN LYS 83 -7.335 0.202 6.724 616 HA LYS 83 HA LYS 83 -6.008 2.384 7.815 617 HB2 LYS 83 HB2 LYS 83 -7.105 0.368 8.972 618 HB3 LYS 83 HB1 LYS 83 -5.574 -0.454 8.704 619 HG2 LYS 83 HG2 LYS 83 -5.766 0.522 10.929 620 HG3 LYS 83 HG1 LYS 83 -4.410 1.180 10.024 621 HD2 LYS 83 HD2 LYS 83 -5.652 3.187 9.544 622 HD3 LYS 83 HD1 LYS 83 -7.110 2.507 10.268 623 HE2 LYS 83 HE2 LYS 83 -4.538 3.182 11.692 624 HE3 LYS 83 HE1 LYS 83 -6.058 4.069 11.797 625 HZ1 LYS 83 HZ3 LYS 83 -7.075 2.053 12.742 626 HZ2 LYS 83 HZ1 LYS 83 -5.821 2.657 13.704 627 HZ3 LYS 83 HZ2 LYS 83 -5.563 1.295 12.735 628 H SER 84 HN SER 84 -4.906 -0.400 6.020 629 HA SER 84 HA SER 84 -2.159 -0.309 6.486 630 HG SER 84 HG SER 84 -1.208 -0.738 3.834 631 HB2 SER 84 HB2 SER 84 -3.378 -2.040 5.087 632 HB3 SER 84 HB1 SER 84 -3.484 -0.848 3.818 633 H LEU 85 HN LEU 85 -3.978 0.999 3.819 634 HA LEU 85 HA LEU 85 -1.889 2.428 2.684 635 HG LEU 85 HG LEU 85 -2.756 1.897 0.475 636 HB2 LEU 85 HB2 LEU 85 -4.871 2.564 2.512 637 HB3 LEU 85 HB1 LEU 85 -3.885 3.719 1.655 638 HD11 LEU 85 HD11 LEU 85 -3.069 0.196 2.234 639 HD12 LEU 85 HD12 LEU 85 -3.484 -0.354 0.626 640 HD13 LEU 85 HD13 LEU 85 -4.761 0.074 1.762 641 HD21 LEU 85 HD23 LEU 85 -4.592 1.276 -0.979 642 HD22 LEU 85 HD21 LEU 85 -4.723 2.973 -0.517 643 HD23 LEU 85 HD22 LEU 85 -5.750 1.767 0.254 644 H MET 86 HN MET 86 -4.344 3.393 5.013 645 HA MET 86 HA MET 86 -3.635 6.110 5.221 646 HB2 MET 86 HB2 MET 86 -4.847 4.291 7.316 647 HB3 MET 86 HB1 MET 86 -4.787 6.044 7.418 648 HG2 MET 86 HG2 MET 86 -6.053 4.877 5.016 649 HG3 MET 86 HG1 MET 86 -6.910 4.705 6.544 650 HE1 MET 86 HE3 MET 86 -4.541 7.746 5.963 651 HE2 MET 86 HE1 MET 86 -5.571 8.870 5.078 652 HE3 MET 86 HE2 MET 86 -5.026 7.381 4.307 653 H ASP 87 HN ASP 87 -2.724 3.315 7.204 654 HA ASP 87 HA ASP 87 -0.883 4.760 8.852 655 HB2 ASP 87 HB2 ASP 87 -1.423 1.822 8.475 656 HB3 ASP 87 HB1 ASP 87 -0.280 2.458 9.657 657 H ALA 88 HN ALA 88 -0.637 3.782 5.707 658 HA ALA 88 HA ALA 88 2.013 2.700 5.727 659 HB1 ALA 88 HB3 ALA 88 1.822 2.687 3.329 660 HB2 ALA 88 HB1 ALA 88 0.367 3.688 3.421 661 HB3 ALA 88 HB2 ALA 88 0.363 2.059 4.093 662 H ALA 89 HN ALA 89 0.714 5.944 5.514 663 HA ALA 89 HA ALA 89 3.429 6.944 5.529 664 HB1 ALA 89 HB3 ALA 89 2.762 6.650 3.096 665 HB2 ALA 89 HB1 ALA 89 3.372 8.233 3.569 666 HB3 ALA 89 HB2 ALA 89 1.638 7.992 3.336 667 H ASP 90 HN ASP 90 0.344 8.496 4.665 668 HA ASP 90 HA ASP 90 0.807 10.718 6.339 669 HB2 ASP 90 HB2 ASP 90 -1.302 11.416 5.493 670 HB3 ASP 90 HB1 ASP 90 -0.377 10.730 4.205 671 H ASN 91 HN ASN 91 0.885 8.708 8.142 672 HA ASN 91 HA ASN 91 -1.697 8.344 9.392 673 HB2 ASN 91 HB2 ASN 91 0.537 7.508 11.040 674 HB3 ASN 91 HB1 ASN 91 -0.793 6.559 10.421 675 HD21 ASN 91 HD21 ASN 91 -0.350 6.745 7.766 676 HD22 ASN 91 HD22 ASN 91 1.124 5.956 7.418 677 H ASP 92 HN ASP 92 1.393 9.840 10.186 678 HA ASP 92 HA ASP 92 0.601 10.935 12.622 679 HB2 ASP 92 HB2 ASP 92 2.943 10.734 11.984 680 HB3 ASP 92 HB1 ASP 92 2.721 11.930 10.712 681 H GLY 93 HN GLY 93 -0.111 12.070 9.385 682 HA2 GLY 93 HA2 GLY 93 -2.205 13.599 9.983 683 HA3 GLY 93 HA1 GLY 93 -0.885 14.661 10.429 684 H ASP 94 HN ASP 94 -2.289 12.847 7.729 685 HA ASP 94 HA ASP 94 -1.887 15.066 5.986 686 HB2 ASP 94 HB2 ASP 94 0.077 12.940 6.045 687 HB3 ASP 94 HB1 ASP 94 -0.600 13.186 4.444 688 H GLY 95 HN GLY 95 -2.960 11.716 6.442 689 HA2 GLY 95 HA2 GLY 95 -4.781 10.653 5.538 690 HA3 GLY 95 HA1 GLY 95 -5.281 12.198 4.893 691 H LYS 96 HN LYS 96 -2.522 12.095 3.283 692 HA LYS 96 HA LYS 96 -3.688 10.405 1.199 693 HB2 LYS 96 HB2 LYS 96 -3.530 12.172 -0.147 694 HB3 LYS 96 HB1 LYS 96 -2.813 13.102 1.151 695 HG2 LYS 96 HG2 LYS 96 -1.209 11.369 -0.714 696 HG3 LYS 96 HG1 LYS 96 -1.562 13.061 -1.025 697 HD2 LYS 96 HD2 LYS 96 0.059 11.911 1.228 698 HD3 LYS 96 HD1 LYS 96 0.594 12.981 -0.061 699 HE2 LYS 96 HE2 LYS 96 -0.948 14.722 0.835 700 HE3 LYS 96 HE1 LYS 96 -1.275 13.657 2.202 701 HZ1 LYS 96 HZ3 LYS 96 0.443 15.328 2.673 702 HZ2 LYS 96 HZ1 LYS 96 1.418 14.665 1.459 703 HZ3 LYS 96 HZ2 LYS 96 1.028 13.749 2.827 704 H ILE 97 HN ILE 97 -2.398 9.101 -0.134 705 HA ILE 97 HA ILE 97 0.289 8.517 0.921 706 HB ILE 97 HB ILE 97 -1.618 6.534 -0.320 707 HG12 ILE 97 HG12 ILE 97 -2.341 7.199 1.926 708 HG13 ILE 97 HG11 ILE 97 -1.753 5.544 1.886 709 HG21 ILE 97 HG21 ILE 97 0.139 4.929 0.657 710 HG22 ILE 97 HG22 ILE 97 1.190 6.346 0.704 711 HG23 ILE 97 HG23 ILE 97 0.528 5.788 -0.832 712 HD11 ILE 97 HD13 ILE 97 0.383 6.284 2.817 713 HD12 ILE 97 HD11 ILE 97 -0.973 6.674 3.876 714 HD13 ILE 97 HD12 ILE 97 -0.243 7.929 2.885 715 H GLY 98 HN GLY 98 1.392 9.715 -0.628 716 HA2 GLY 98 HA2 GLY 98 1.053 8.882 -3.412 717 HA3 GLY 98 HA1 GLY 98 1.786 10.391 -2.878 718 H ALA 99 HN ALA 99 3.136 8.956 -4.676 719 HA ALA 99 HA ALA 99 4.855 6.935 -3.747 720 HB1 ALA 99 HB3 ALA 99 6.213 7.351 -5.630 721 HB2 ALA 99 HB1 ALA 99 5.733 9.047 -5.706 722 HB3 ALA 99 HB2 ALA 99 4.579 7.785 -6.132 723 H ASP 100 HN ASP 100 5.277 10.453 -3.747 724 HA ASP 100 HA ASP 100 7.774 10.549 -2.484 725 HB2 ASP 100 HB2 ASP 100 6.675 12.465 -3.638 726 HB3 ASP 100 HB1 ASP 100 5.554 12.595 -2.287 727 H GLU 101 HN GLU 101 4.524 10.923 -1.066 728 HA GLU 101 HA GLU 101 5.324 11.098 1.611 729 HB2 GLU 101 HB2 GLU 101 2.843 10.706 0.129 730 HB3 GLU 101 HB1 GLU 101 2.840 9.799 1.626 731 HG2 GLU 101 HG2 GLU 101 2.003 12.335 1.371 732 HG3 GLU 101 HG1 GLU 101 2.565 11.632 2.873 733 H PHE 102 HN PHE 102 4.200 8.320 -0.266 734 HA PHE 102 HA PHE 102 4.534 6.324 1.590 735 HD1 PHE 102 HD1 PHE 102 6.873 4.378 -0.128 736 HD2 PHE 102 HD2 PHE 102 2.643 3.958 -0.366 737 HE1 PHE 102 HE1 PHE 102 7.096 1.983 0.282 738 HE2 PHE 102 HE2 PHE 102 2.867 1.539 0.026 739 HZ PHE 102 HZ PHE 102 5.101 0.552 0.350 740 HB2 PHE 102 HB2 PHE 102 3.544 6.021 -0.669 741 HB3 PHE 102 HB1 PHE 102 5.155 6.095 -1.373 742 H GLN 103 HN GLN 103 6.958 7.816 -0.528 743 HA GLN 103 HA GLN 103 9.127 6.141 0.094 744 HB2 GLN 103 HB2 GLN 103 9.099 9.076 -0.637 745 HB3 GLN 103 HB1 GLN 103 10.562 8.116 -0.509 746 HG2 GLN 103 HG2 GLN 103 8.835 6.716 -2.219 747 HG3 GLN 103 HG1 GLN 103 8.764 8.411 -2.684 748 HE21 GLN 103 HE21 GLN 103 9.889 6.175 -4.125 749 HE22 GLN 103 HE22 GLN 103 11.553 6.560 -4.395 750 H GLU 104 HN GLU 104 7.623 8.760 1.819 751 HA GLU 104 HA GLU 104 9.698 9.391 3.618 752 HB2 GLU 104 HB2 GLU 104 6.729 9.509 4.173 753 HB3 GLU 104 HB1 GLU 104 7.990 10.402 5.009 754 HG2 GLU 104 HG2 GLU 104 7.253 10.723 2.110 755 HG3 GLU 104 HG1 GLU 104 6.770 11.798 3.421 756 H MET 105 HN MET 105 7.104 6.993 3.785 757 HA MET 105 HA MET 105 7.526 6.111 6.399 758 HB2 MET 105 HB2 MET 105 5.650 5.532 4.717 759 HB3 MET 105 HB1 MET 105 6.725 4.247 4.190 760 HG2 MET 105 HG2 MET 105 5.818 4.623 7.028 761 HG3 MET 105 HG1 MET 105 5.026 3.563 5.869 762 HE1 MET 105 HE3 MET 105 6.851 1.085 8.304 763 HE2 MET 105 HE1 MET 105 5.378 1.279 7.353 764 HE3 MET 105 HE2 MET 105 5.822 2.497 8.549 765 H VAL 106 HN VAL 106 8.720 4.633 3.380 766 HA VAL 106 HA VAL 106 10.378 2.750 4.600 767 HB VAL 106 HB VAL 106 9.769 2.537 2.270 768 HG11 VAL 106 HG11 VAL 106 11.198 5.144 1.999 769 HG12 VAL 106 HG12 VAL 106 9.591 4.672 1.439 770 HG13 VAL 106 HG13 VAL 106 11.027 4.053 0.622 771 HG21 VAL 106 HG23 VAL 106 12.712 2.803 2.828 772 HG22 VAL 106 HG21 VAL 106 12.103 2.233 1.274 773 HG23 VAL 106 HG22 VAL 106 11.732 1.337 2.747 774 H HIS 107 HN HIS 107 10.819 6.126 3.970 775 HA HIS 107 HA HIS 107 13.680 6.097 4.300 776 HD1 HIS 107 HD1 HIS 107 13.414 9.745 5.976 777 HD2 HIS 107 HD2 HIS 107 15.122 8.485 2.404 778 HE1 HIS 107 HE1 HIS 107 15.584 11.003 5.788 779 HE2 HIS 107 HE2 HIS 107 16.640 10.159 3.662 780 HB2 HIS 107 HB2 HIS 107 12.474 7.794 2.915 781 HB3 HIS 107 HB1 HIS 107 11.791 8.457 4.395 782 H SER 108 HN SER 108 10.906 6.351 6.344 783 HA SER 108 HA SER 108 11.818 7.760 8.518 784 HG SER 108 HG SER 108 9.350 6.690 10.469 785 HB2 SER 108 HB2 SER 108 9.535 6.923 8.370 786 HB3 SER 108 HB1 SER 108 10.109 5.263 8.514 Start of MODEL 11 1 HA SER 1 HA SER 1 4.207 -3.267 -10.436 2 HG SER 1 HG SER 1 5.015 -1.038 -10.367 3 H1 SER 1 HT1 SER 1 1.577 -3.478 -9.093 4 H2 SER 1 HT2 SER 1 2.524 -4.769 -9.640 5 H3 SER 1 HT3 SER 1 1.857 -3.680 -10.750 6 HB2 SER 1 HB2 SER 1 2.744 -1.389 -10.996 7 HB3 SER 1 HB1 SER 1 2.398 -1.129 -9.287 8 H ILE 2 HN ILE 2 5.162 -4.629 -8.919 9 HA ILE 2 HA ILE 2 6.020 -3.405 -6.504 10 HB ILE 2 HB ILE 2 4.193 -5.774 -6.193 11 HG12 ILE 2 HG12 ILE 2 4.024 -2.979 -5.182 12 HG13 ILE 2 HG11 ILE 2 2.936 -3.751 -6.316 13 HG21 ILE 2 HG21 ILE 2 6.183 -4.566 -4.336 14 HG22 ILE 2 HG22 ILE 2 5.898 -6.263 -4.726 15 HG23 ILE 2 HG23 ILE 2 4.755 -5.384 -3.711 16 HD11 ILE 2 HD13 ILE 2 3.046 -5.289 -3.934 17 HD12 ILE 2 HD11 ILE 2 1.678 -4.452 -4.664 18 HD13 ILE 2 HD12 ILE 2 2.736 -3.603 -3.549 19 H THR 3 HN THR 3 5.542 -6.537 -8.057 20 HA THR 3 HA THR 3 7.795 -7.808 -6.997 21 HB THR 3 HB THR 3 7.539 -9.451 -8.800 22 HG1 THR 3 HG1 THR 3 6.203 -9.076 -10.501 23 HG21 THR 3 HG23 THR 3 4.802 -8.634 -7.850 24 HG22 THR 3 HG21 THR 3 6.005 -9.346 -6.775 25 HG23 THR 3 HG22 THR 3 5.412 -10.259 -8.163 26 H ASP 4 HN ASP 4 7.666 -5.275 -9.272 27 HA ASP 4 HA ASP 4 9.688 -5.789 -11.057 28 HB2 ASP 4 HB2 ASP 4 9.226 -3.193 -9.561 29 HB3 ASP 4 HB1 ASP 4 10.134 -3.361 -11.061 30 H ILE 5 HN ILE 5 10.049 -4.341 -7.825 31 HA ILE 5 HA ILE 5 12.666 -5.660 -7.588 32 HB ILE 5 HB ILE 5 12.192 -2.859 -6.587 33 HG12 ILE 5 HG12 ILE 5 13.941 -3.292 -8.950 34 HG13 ILE 5 HG11 ILE 5 12.207 -3.341 -9.230 35 HG21 ILE 5 HG21 ILE 5 13.944 -4.101 -5.467 36 HG22 ILE 5 HG22 ILE 5 14.638 -2.804 -6.439 37 HG23 ILE 5 HG23 ILE 5 14.698 -4.469 -7.017 38 HD11 ILE 5 HD13 ILE 5 13.012 -1.131 -9.645 39 HD12 ILE 5 HD11 ILE 5 13.770 -1.065 -8.053 40 HD13 ILE 5 HD12 ILE 5 12.010 -1.114 -8.190 41 H LEU 6 HN LEU 6 11.982 -7.124 -6.179 42 HA LEU 6 HA LEU 6 11.654 -6.435 -3.452 43 HG LEU 6 HG LEU 6 9.838 -6.641 -1.927 44 HB2 LEU 6 HB2 LEU 6 9.297 -6.192 -4.832 45 HB3 LEU 6 HB1 LEU 6 9.174 -7.799 -4.146 46 HD11 LEU 6 HD11 LEU 6 9.037 -4.312 -1.793 47 HD12 LEU 6 HD12 LEU 6 8.888 -4.313 -3.547 48 HD13 LEU 6 HD13 LEU 6 10.471 -4.508 -2.803 49 HD21 LEU 6 HD23 LEU 6 7.712 -7.615 -2.084 50 HD22 LEU 6 HD21 LEU 6 7.166 -6.429 -3.269 51 HD23 LEU 6 HD22 LEU 6 7.417 -5.949 -1.591 52 H SER 7 HN SER 7 11.090 -8.320 -2.047 53 HA SER 7 HA SER 7 12.458 -10.667 -3.040 54 HG SER 7 HG SER 7 13.520 -10.069 0.187 55 HB2 SER 7 HB2 SER 7 11.154 -10.224 -0.351 56 HB3 SER 7 HB1 SER 7 12.232 -11.539 -0.801 57 H ALA 8 HN ALA 8 10.482 -10.562 -4.600 58 HA ALA 8 HA ALA 8 8.045 -11.388 -4.331 59 HB1 ALA 8 HB3 ALA 8 9.258 -11.307 -6.492 60 HB2 ALA 8 HB1 ALA 8 8.122 -12.652 -6.362 61 HB3 ALA 8 HB2 ALA 8 9.852 -12.937 -6.165 62 H GLU 9 HN GLU 9 10.698 -13.453 -3.334 63 HA GLU 9 HA GLU 9 9.159 -15.821 -3.084 64 HB2 GLU 9 HB2 GLU 9 11.659 -14.932 -1.639 65 HB3 GLU 9 HB1 GLU 9 10.998 -16.564 -1.579 66 HG2 GLU 9 HG2 GLU 9 11.891 -15.156 -4.067 67 HG3 GLU 9 HG1 GLU 9 12.878 -16.298 -3.158 68 H ASP 10 HN ASP 10 10.057 -13.248 -0.840 69 HA ASP 10 HA ASP 10 8.544 -14.251 1.354 70 HB2 ASP 10 HB2 ASP 10 10.286 -11.873 0.848 71 HB3 ASP 10 HB1 ASP 10 9.228 -11.905 2.256 72 H ILE 11 HN ILE 11 7.655 -12.737 -1.448 73 HA ILE 11 HA ILE 11 6.011 -10.665 -0.358 74 HB ILE 11 HB ILE 11 6.476 -11.789 -3.046 75 HG12 ILE 11 HG12 ILE 11 6.083 -8.985 -1.956 76 HG13 ILE 11 HG11 ILE 11 7.629 -9.786 -2.236 77 HG21 ILE 11 HG21 ILE 11 3.867 -10.463 -2.345 78 HG22 ILE 11 HG22 ILE 11 4.119 -11.993 -3.185 79 HG23 ILE 11 HG23 ILE 11 4.523 -10.472 -3.981 80 HD11 ILE 11 HD13 ILE 11 5.652 -8.801 -4.259 81 HD12 ILE 11 HD11 ILE 11 6.937 -9.922 -4.678 82 HD13 ILE 11 HD12 ILE 11 7.330 -8.333 -4.037 83 H ALA 12 HN ALA 12 5.424 -13.988 -1.474 84 HA ALA 12 HA ALA 12 2.664 -14.029 -1.036 85 HB1 ALA 12 HB3 ALA 12 4.444 -15.862 -1.916 86 HB2 ALA 12 HB1 ALA 12 2.803 -16.264 -1.402 87 HB3 ALA 12 HB2 ALA 12 4.149 -16.452 -0.280 88 H ALA 13 HN ALA 13 5.362 -14.935 1.143 89 HA ALA 13 HA ALA 13 3.701 -15.365 3.389 90 HB1 ALA 13 HB3 ALA 13 6.131 -16.035 3.127 91 HB2 ALA 13 HB1 ALA 13 5.687 -15.354 4.693 92 HB3 ALA 13 HB2 ALA 13 6.539 -14.361 3.511 93 H ALA 14 HN ALA 14 5.709 -12.644 2.551 94 HA ALA 14 HA ALA 14 5.064 -10.784 4.405 95 HB1 ALA 14 HB3 ALA 14 6.657 -10.274 2.680 96 HB2 ALA 14 HB1 ALA 14 5.403 -9.034 2.660 97 HB3 ALA 14 HB2 ALA 14 5.401 -10.314 1.445 98 H LEU 15 HN LEU 15 3.186 -11.444 1.458 99 HA LEU 15 HA LEU 15 1.132 -9.564 2.144 100 HG LEU 15 HG LEU 15 -0.328 -9.063 0.136 101 HB2 LEU 15 HB2 LEU 15 1.770 -10.325 -0.201 102 HB3 LEU 15 HB1 LEU 15 0.920 -11.818 0.158 103 HD11 LEU 15 HD11 LEU 15 -0.775 -11.311 -1.810 104 HD12 LEU 15 HD12 LEU 15 0.391 -10.020 -2.082 105 HD13 LEU 15 HD13 LEU 15 -1.321 -9.637 -1.928 106 HD21 LEU 15 HD23 LEU 15 -1.286 -11.700 1.006 107 HD22 LEU 15 HD21 LEU 15 -2.375 -10.800 -0.037 108 HD23 LEU 15 HD22 LEU 15 -1.815 -10.090 1.475 109 H GLN 16 HN GLN 16 1.199 -13.139 1.885 110 HA GLN 16 HA GLN 16 -1.379 -13.554 2.908 111 HB2 GLN 16 HB2 GLN 16 0.994 -15.420 2.635 112 HB3 GLN 16 HB1 GLN 16 -0.708 -15.892 2.746 113 HG2 GLN 16 HG2 GLN 16 0.180 -14.099 0.545 114 HG3 GLN 16 HG1 GLN 16 0.552 -15.817 0.452 115 HE21 GLN 16 HE21 GLN 16 -1.886 -13.407 0.364 116 HE22 GLN 16 HE22 GLN 16 -3.175 -14.411 -0.145 117 H GLU 17 HN GLU 17 1.326 -12.546 4.636 118 HA GLU 17 HA GLU 17 1.425 -14.500 6.675 119 HB2 GLU 17 HB2 GLU 17 3.320 -13.121 6.430 120 HB3 GLU 17 HB1 GLU 17 2.365 -11.650 6.520 121 HG2 GLU 17 HG2 GLU 17 1.918 -12.120 8.888 122 HG3 GLU 17 HG1 GLU 17 2.914 -13.568 8.768 123 H CYS 18 HN CYS 18 0.383 -11.108 7.224 124 HA CYS 18 HA CYS 18 -1.521 -12.127 9.179 125 HG CYS 18 HG CYS 18 -1.562 -10.994 11.726 126 HB2 CYS 18 HB2 CYS 18 0.374 -10.534 9.804 127 HB3 CYS 18 HB1 CYS 18 -0.531 -9.302 8.938 128 H GLN 19 HN GLN 19 -1.714 -11.421 6.073 129 HA GLN 19 HA GLN 19 -3.212 -9.150 5.671 130 HB2 GLN 19 HB2 GLN 19 -2.468 -10.413 3.780 131 HB3 GLN 19 HB1 GLN 19 -3.388 -11.811 4.300 132 HG2 GLN 19 HG2 GLN 19 -5.456 -10.754 3.796 133 HG3 GLN 19 HG1 GLN 19 -4.666 -9.206 3.533 134 HE21 GLN 19 HE21 GLN 19 -3.849 -8.743 1.575 135 HE22 GLN 19 HE22 GLN 19 -3.972 -9.788 0.209 136 H ASP 20 HN ASP 20 -5.288 -8.617 5.584 137 HA ASP 20 HA ASP 20 -7.590 -9.999 5.930 138 HB2 ASP 20 HB2 ASP 20 -6.081 -10.168 8.339 139 HB3 ASP 20 HB1 ASP 20 -7.501 -9.178 8.663 140 HA PRO 21 HA PRO 21 -9.166 -5.862 5.879 141 HB2 PRO 21 HB2 PRO 21 -11.636 -6.143 6.784 142 HB3 PRO 21 HB1 PRO 21 -11.152 -6.917 5.283 143 HG2 PRO 21 HG2 PRO 21 -11.397 -8.071 8.036 144 HG3 PRO 21 HG1 PRO 21 -11.969 -8.738 6.492 145 HD2 PRO 21 HD2 PRO 21 -9.645 -9.503 7.670 146 HD3 PRO 21 HD1 PRO 21 -9.902 -9.507 5.918 147 H ASP 22 HN ASP 22 -7.460 -5.665 7.770 148 HA ASP 22 HA ASP 22 -7.967 -3.767 9.524 149 HB2 ASP 22 HB2 ASP 22 -8.546 -4.862 11.722 150 HB3 ASP 22 HB1 ASP 22 -9.856 -4.808 10.550 151 H THR 23 HN THR 23 -6.193 -6.531 8.740 152 HA THR 23 HA THR 23 -4.357 -6.337 10.975 153 HB THR 23 HB THR 23 -3.160 -8.166 9.695 154 HG1 THR 23 HG1 THR 23 -3.933 -8.724 7.802 155 HG21 THR 23 HG23 THR 23 -4.326 -9.186 11.341 156 HG22 THR 23 HG21 THR 23 -5.378 -9.689 10.019 157 HG23 THR 23 HG22 THR 23 -5.800 -8.281 10.992 158 H PHE 24 HN PHE 24 -4.511 -5.511 7.601 159 HA PHE 24 HA PHE 24 -3.216 -3.662 6.737 160 HD1 PHE 24 HD2 PHE 24 -2.958 -3.434 9.886 161 HD2 PHE 24 HD1 PHE 24 0.123 -1.937 7.365 162 HE1 PHE 24 HE2 PHE 24 -2.910 -1.363 11.189 163 HE2 PHE 24 HE1 PHE 24 0.190 0.138 8.680 164 HZ PHE 24 HZ PHE 24 -1.332 0.430 10.594 165 HB2 PHE 24 HB2 PHE 24 -1.035 -4.909 8.379 166 HB3 PHE 24 HB1 PHE 24 -0.645 -3.991 6.958 167 H GLU 25 HN GLU 25 -3.966 -4.726 4.899 168 HA GLU 25 HA GLU 25 -2.672 -7.046 3.886 169 HB2 GLU 25 HB2 GLU 25 -4.400 -5.146 2.327 170 HB3 GLU 25 HB1 GLU 25 -4.105 -6.847 2.003 171 HG2 GLU 25 HG2 GLU 25 -5.250 -7.418 4.093 172 HG3 GLU 25 HG1 GLU 25 -5.593 -5.711 4.339 173 HA PRO 26 HA PRO 26 -0.542 -4.059 0.862 174 HB2 PRO 26 HB2 PRO 26 -0.257 -1.450 1.613 175 HB3 PRO 26 HB1 PRO 26 -1.576 -2.075 0.632 176 HG2 PRO 26 HG2 PRO 26 -1.619 -1.139 3.367 177 HG3 PRO 26 HG1 PRO 26 -2.965 -1.460 2.274 178 HD2 PRO 26 HD2 PRO 26 -1.966 -3.083 4.435 179 HD3 PRO 26 HD1 PRO 26 -3.390 -3.346 3.417 180 H GLN 27 HN GLN 27 0.181 -2.385 3.924 181 HA GLN 27 HA GLN 27 2.906 -2.094 3.469 182 HB2 GLN 27 HB2 GLN 27 1.537 -2.326 6.143 183 HB3 GLN 27 HB1 GLN 27 3.101 -1.589 5.839 184 HG2 GLN 27 HG2 GLN 27 0.543 -0.606 4.609 185 HG3 GLN 27 HG1 GLN 27 1.198 0.008 6.127 186 HE21 GLN 27 HE21 GLN 27 3.029 1.275 6.108 187 HE22 GLN 27 HE22 GLN 27 3.670 1.967 4.660 188 H LYS 28 HN LYS 28 1.213 -4.856 4.866 189 HA LYS 28 HA LYS 28 3.486 -6.074 6.013 190 HB2 LYS 28 HB2 LYS 28 0.720 -6.788 5.433 191 HB3 LYS 28 HB1 LYS 28 1.840 -8.119 5.324 192 HG2 LYS 28 HG2 LYS 28 1.029 -8.139 7.531 193 HG3 LYS 28 HG1 LYS 28 2.662 -7.479 7.610 194 HD2 LYS 28 HD2 LYS 28 0.527 -5.506 7.217 195 HD3 LYS 28 HD1 LYS 28 0.507 -6.334 8.774 196 HE2 LYS 28 HE2 LYS 28 2.922 -4.963 7.599 197 HE3 LYS 28 HE1 LYS 28 1.819 -4.213 8.752 198 HZ1 LYS 28 HZ3 LYS 28 3.457 -6.644 9.228 199 HZ2 LYS 28 HZ1 LYS 28 2.360 -5.979 10.332 200 HZ3 LYS 28 HZ2 LYS 28 3.737 -5.109 9.879 201 H PHE 29 HN PHE 29 1.886 -6.367 2.909 202 HA PHE 29 HA PHE 29 3.367 -8.341 1.697 203 HD1 PHE 29 HD1 PHE 29 4.695 -6.413 -0.896 204 HD2 PHE 29 HD2 PHE 29 0.939 -8.392 -1.163 205 HE1 PHE 29 HE1 PHE 29 5.305 -7.264 -3.105 206 HE2 PHE 29 HE2 PHE 29 1.542 -9.232 -3.394 207 HZ PHE 29 HZ PHE 29 3.723 -8.668 -4.366 208 HB2 PHE 29 HB2 PHE 29 1.387 -7.207 0.709 209 HB3 PHE 29 HB1 PHE 29 2.355 -5.763 0.455 210 H PHE 30 HN PHE 30 3.957 -4.883 1.710 211 HA PHE 30 HA PHE 30 6.384 -4.967 0.249 212 HD1 PHE 30 HD1 PHE 30 4.295 -4.517 -0.850 213 HD2 PHE 30 HD2 PHE 30 4.072 -1.065 1.659 214 HE1 PHE 30 HE1 PHE 30 2.093 -3.912 -1.815 215 HE2 PHE 30 HE2 PHE 30 1.893 -0.485 0.690 216 HZ PHE 30 HZ PHE 30 0.905 -1.913 -1.050 217 HB2 PHE 30 HB2 PHE 30 5.660 -2.736 2.091 218 HB3 PHE 30 HB1 PHE 30 6.433 -2.658 0.511 219 H GLN 31 HN GLN 31 5.740 -4.198 3.652 220 HA GLN 31 HA GLN 31 8.318 -3.839 4.504 221 HB2 GLN 31 HB2 GLN 31 6.156 -3.406 5.744 222 HB3 GLN 31 HB1 GLN 31 6.173 -5.106 6.186 223 HG2 GLN 31 HG2 GLN 31 7.194 -4.290 8.017 224 HG3 GLN 31 HG1 GLN 31 8.621 -4.454 6.994 225 HE21 GLN 31 HE21 GLN 31 7.846 -2.199 5.291 226 HE22 GLN 31 HE22 GLN 31 8.157 -0.777 6.213 227 H THR 32 HN THR 32 6.498 -6.792 5.160 228 HA THR 32 HA THR 32 8.553 -8.229 6.289 229 HB THR 32 HB THR 32 6.277 -9.276 4.616 230 HG1 THR 32 HG1 THR 32 6.004 -8.063 6.733 231 HG21 THR 32 HG23 THR 32 8.095 -10.769 6.507 232 HG22 THR 32 HG21 THR 32 8.049 -10.958 4.755 233 HG23 THR 32 HG22 THR 32 6.657 -11.429 5.729 234 H SER 33 HN SER 33 7.662 -8.268 2.810 235 HA SER 33 HA SER 33 9.966 -9.895 2.206 236 HG SER 33 HG SER 33 6.887 -8.880 -0.180 237 HB2 SER 33 HB2 SER 33 9.124 -9.754 -0.122 238 HB3 SER 33 HB1 SER 33 7.943 -10.378 1.024 239 H GLY 34 HN GLY 34 8.833 -6.710 1.072 240 HA2 GLY 34 HA2 GLY 34 11.544 -6.313 0.049 241 HA3 GLY 34 HA1 GLY 34 10.140 -5.440 -0.493 242 H LEU 35 HN LEU 35 9.180 -4.052 1.561 243 HA LEU 35 HA LEU 35 10.712 -1.818 1.575 244 HG LEU 35 HG LEU 35 9.497 0.103 3.085 245 HB2 LEU 35 HB2 LEU 35 8.327 -2.663 2.750 246 HB3 LEU 35 HB1 LEU 35 9.309 -2.072 4.079 247 HD11 LEU 35 HD11 LEU 35 8.154 -1.150 0.699 248 HD12 LEU 35 HD12 LEU 35 9.744 -0.390 0.771 249 HD13 LEU 35 HD13 LEU 35 8.292 0.589 0.937 250 HD21 LEU 35 HD23 LEU 35 6.629 -0.701 2.689 251 HD22 LEU 35 HD21 LEU 35 7.269 0.841 3.253 252 HD23 LEU 35 HD22 LEU 35 7.367 -0.584 4.285 253 H SER 36 HN SER 36 10.771 -4.325 4.074 254 HA SER 36 HA SER 36 12.272 -3.465 6.024 255 HG SER 36 HG SER 36 12.903 -7.135 4.413 256 HB2 SER 36 HB2 SER 36 13.438 -5.635 6.164 257 HB3 SER 36 HB1 SER 36 11.726 -5.820 5.783 258 H LYS 37 HN LYS 37 13.663 -3.780 2.769 259 HA LYS 37 HA LYS 37 15.918 -2.191 3.722 260 HB2 LYS 37 HB2 LYS 37 17.595 -3.669 2.825 261 HB3 LYS 37 HB1 LYS 37 16.611 -4.499 4.015 262 HG2 LYS 37 HG2 LYS 37 15.375 -5.621 2.295 263 HG3 LYS 37 HG1 LYS 37 16.244 -4.713 1.062 264 HD2 LYS 37 HD2 LYS 37 18.332 -5.732 1.735 265 HD3 LYS 37 HD1 LYS 37 17.510 -6.591 3.036 266 HE2 LYS 37 HE2 LYS 37 16.992 -6.940 0.084 267 HE3 LYS 37 HE1 LYS 37 17.909 -8.047 1.105 268 HZ1 LYS 37 HZ3 LYS 37 15.039 -7.370 1.464 269 HZ2 LYS 37 HZ1 LYS 37 15.926 -8.468 2.397 270 HZ3 LYS 37 HZ2 LYS 37 15.626 -8.793 0.764 271 H MET 38 HN MET 38 13.884 -3.080 1.065 272 HA MET 38 HA MET 38 15.364 -2.454 -1.142 273 HB2 MET 38 HB2 MET 38 12.480 -1.707 -0.688 274 HB3 MET 38 HB1 MET 38 13.289 -1.836 -2.241 275 HG2 MET 38 HG2 MET 38 12.961 -4.095 -0.313 276 HG3 MET 38 HG1 MET 38 11.897 -3.793 -1.676 277 HE1 MET 38 HE3 MET 38 14.128 -6.467 -0.873 278 HE2 MET 38 HE1 MET 38 14.083 -6.996 -2.555 279 HE3 MET 38 HE2 MET 38 12.606 -6.442 -1.763 280 H SER 39 HN SER 39 15.732 -0.692 -2.391 281 HA SER 39 HA SER 39 16.328 1.738 -1.051 282 HG SER 39 HG SER 39 18.623 1.237 -2.418 283 HB2 SER 39 HB2 SER 39 16.326 1.144 -4.019 284 HB3 SER 39 HB1 SER 39 17.099 2.524 -3.242 285 H ALA 40 HN ALA 40 15.645 3.899 -2.081 286 HA ALA 40 HA ALA 40 12.858 4.203 -1.719 287 HB1 ALA 40 HB3 ALA 40 14.733 6.178 -3.000 288 HB2 ALA 40 HB1 ALA 40 14.525 5.970 -1.259 289 HB3 ALA 40 HB2 ALA 40 13.169 6.517 -2.251 290 H SER 41 HN SER 41 14.841 4.166 -4.668 291 HA SER 41 HA SER 41 13.079 5.039 -6.545 292 HG SER 41 HG SER 41 16.362 4.446 -6.584 293 HB2 SER 41 HB2 SER 41 15.081 2.790 -6.786 294 HB3 SER 41 HB1 SER 41 14.292 3.573 -8.155 295 H GLN 42 HN GLN 42 13.484 1.595 -5.709 296 HA GLN 42 HA GLN 42 11.426 0.629 -7.314 297 HB2 GLN 42 HB2 GLN 42 11.386 -1.328 -5.826 298 HB3 GLN 42 HB1 GLN 42 13.016 -0.855 -6.275 299 HG2 GLN 42 HG2 GLN 42 13.341 -1.190 -4.071 300 HG3 GLN 42 HG1 GLN 42 12.853 0.502 -4.044 301 HE21 GLN 42 HE21 GLN 42 11.791 -2.784 -3.497 302 HE22 GLN 42 HE22 GLN 42 10.461 -2.388 -2.469 303 H VAL 43 HN VAL 43 11.305 2.214 -4.273 304 HA VAL 43 HA VAL 43 8.760 1.390 -3.386 305 HB VAL 43 HB VAL 43 9.754 4.187 -2.937 306 HG11 VAL 43 HG11 VAL 43 8.271 2.331 -1.104 307 HG12 VAL 43 HG12 VAL 43 7.482 3.469 -2.194 308 HG13 VAL 43 HG13 VAL 43 8.534 4.064 -0.909 309 HG21 VAL 43 HG23 VAL 43 10.996 3.376 -0.992 310 HG22 VAL 43 HG21 VAL 43 11.649 2.726 -2.487 311 HG23 VAL 43 HG22 VAL 43 10.646 1.714 -1.457 312 H LYS 44 HN LYS 44 9.769 4.047 -5.489 313 HA LYS 44 HA LYS 44 7.340 5.297 -5.891 314 HB2 LYS 44 HB2 LYS 44 9.353 4.806 -8.030 315 HB3 LYS 44 HB1 LYS 44 8.183 6.102 -7.985 316 HG2 LYS 44 HG2 LYS 44 9.312 7.093 -6.093 317 HG3 LYS 44 HG1 LYS 44 10.456 5.752 -6.044 318 HD2 LYS 44 HD2 LYS 44 10.137 7.800 -8.230 319 HD3 LYS 44 HD1 LYS 44 11.510 7.603 -7.140 320 HE2 LYS 44 HE2 LYS 44 11.802 5.295 -8.105 321 HE3 LYS 44 HE1 LYS 44 10.605 5.738 -9.321 322 HZ1 LYS 44 HZ3 LYS 44 12.033 7.557 -10.016 323 HZ2 LYS 44 HZ1 LYS 44 12.848 6.079 -10.135 324 HZ3 LYS 44 HZ2 LYS 44 13.186 7.130 -8.854 325 H ASP 45 HN ASP 45 8.633 2.376 -7.285 326 HA ASP 45 HA ASP 45 6.489 1.916 -9.109 327 HB2 ASP 45 HB2 ASP 45 8.738 0.899 -9.362 328 HB3 ASP 45 HB1 ASP 45 8.433 -0.056 -7.921 329 H ILE 46 HN ILE 46 7.353 0.587 -5.926 330 HA ILE 46 HA ILE 46 5.274 -1.118 -5.500 331 HB ILE 46 HB ILE 46 7.017 0.535 -3.785 332 HG12 ILE 46 HG12 ILE 46 6.696 -2.224 -3.076 333 HG13 ILE 46 HG11 ILE 46 6.909 -2.082 -4.809 334 HG21 ILE 46 HG21 ILE 46 4.459 -0.656 -2.820 335 HG22 ILE 46 HG22 ILE 46 5.263 0.845 -2.363 336 HG23 ILE 46 HG23 ILE 46 5.885 -0.696 -1.779 337 HD11 ILE 46 HD13 ILE 46 9.026 -2.404 -3.755 338 HD12 ILE 46 HD11 ILE 46 8.749 -1.030 -2.685 339 HD13 ILE 46 HD12 ILE 46 8.941 -0.778 -4.419 340 H PHE 47 HN PHE 47 5.345 2.313 -4.601 341 HA PHE 47 HA PHE 47 2.986 2.905 -3.580 342 HD1 PHE 47 HD1 PHE 47 1.686 5.258 -3.621 343 HD2 PHE 47 HD2 PHE 47 3.798 5.606 -7.296 344 HE1 PHE 47 HE1 PHE 47 0.014 6.863 -4.431 345 HE2 PHE 47 HE2 PHE 47 2.129 7.222 -8.109 346 HZ PHE 47 HZ PHE 47 0.230 7.852 -6.673 347 HB2 PHE 47 HB2 PHE 47 4.324 4.717 -4.035 348 HB3 PHE 47 HB1 PHE 47 4.632 4.226 -5.678 349 H ARG 48 HN ARG 48 3.448 1.981 -6.904 350 HA ARG 48 HA ARG 48 1.000 2.710 -7.984 351 HE ARG 48 HE ARG 48 4.958 4.532 -9.993 352 HB2 ARG 48 HB2 ARG 48 2.971 0.622 -8.712 353 HB3 ARG 48 HB1 ARG 48 1.454 0.771 -9.583 354 HG2 ARG 48 HG2 ARG 48 3.433 2.027 -10.505 355 HG3 ARG 48 HG1 ARG 48 1.945 2.923 -10.312 356 HD2 ARG 48 HD2 ARG 48 2.796 3.861 -8.206 357 HD3 ARG 48 HD1 ARG 48 4.301 2.965 -8.445 358 HH11 ARG 48 HH11 ARG 48 1.568 4.919 -9.297 359 HH12 ARG 48 HH12 ARG 48 1.429 6.418 -10.154 360 HH21 ARG 48 HH21 ARG 48 4.785 6.508 -11.129 361 HH22 ARG 48 HH22 ARG 48 3.256 7.320 -11.197 362 H PHE 49 HN PHE 49 1.801 -0.089 -5.981 363 HA PHE 49 HA PHE 49 -0.393 -1.696 -6.563 364 HD1 PHE 49 HD2 PHE 49 -0.227 -4.306 -5.658 365 HD2 PHE 49 HD1 PHE 49 -0.840 -1.739 -2.318 366 HE1 PHE 49 HE2 PHE 49 -1.808 -5.929 -4.704 367 HE2 PHE 49 HE1 PHE 49 -2.423 -3.360 -1.360 368 HZ PHE 49 HZ PHE 49 -2.909 -5.458 -2.552 369 HB2 PHE 49 HB2 PHE 49 1.374 -2.473 -5.057 370 HB3 PHE 49 HB1 PHE 49 0.905 -1.294 -3.840 371 H ILE 50 HN ILE 50 -0.186 0.656 -3.869 372 HA ILE 50 HA ILE 50 -3.020 0.807 -3.680 373 HB ILE 50 HB ILE 50 -2.654 2.695 -2.157 374 HG12 ILE 50 HG12 ILE 50 0.293 2.197 -2.656 375 HG13 ILE 50 HG11 ILE 50 -0.598 3.594 -3.247 376 HG21 ILE 50 HG21 ILE 50 -1.323 0.064 -1.811 377 HG22 ILE 50 HG22 ILE 50 -2.714 0.749 -0.973 378 HG23 ILE 50 HG23 ILE 50 -1.085 1.287 -0.567 379 HD11 ILE 50 HD13 ILE 50 -0.046 2.871 -0.381 380 HD12 ILE 50 HD11 ILE 50 -1.101 4.190 -0.889 381 HD13 ILE 50 HD12 ILE 50 0.614 4.229 -1.291 382 H ASP 51 HN ASP 51 -4.341 1.962 -4.812 383 HA ASP 51 HA ASP 51 -4.893 2.991 -6.832 384 HB2 ASP 51 HB2 ASP 51 -4.684 4.785 -4.544 385 HB3 ASP 51 HB1 ASP 51 -4.687 5.617 -6.113 386 H ASN 52 HN ASN 52 -4.123 3.305 -8.671 387 HA ASN 52 HA ASN 52 -1.328 3.870 -9.075 388 HB2 ASN 52 HB2 ASN 52 -1.827 3.399 -11.464 389 HB3 ASN 52 HB1 ASN 52 -2.286 2.096 -10.381 390 HD21 ASN 52 HD21 ASN 52 -3.293 4.260 -12.740 391 HD22 ASN 52 HD22 ASN 52 -4.979 3.884 -12.732 392 H ASP 53 HN ASP 53 -4.390 5.564 -9.671 393 HA ASP 53 HA ASP 53 -2.898 7.990 -10.062 394 HB2 ASP 53 HB2 ASP 53 -4.536 6.904 -12.353 395 HB3 ASP 53 HB1 ASP 53 -3.845 8.521 -12.287 396 H GLN 54 HN GLN 54 -4.302 8.046 -8.084 397 HA GLN 54 HA GLN 54 -7.058 8.507 -8.289 398 HB2 GLN 54 HB2 GLN 54 -4.958 9.102 -6.278 399 HB3 GLN 54 HB1 GLN 54 -6.482 9.962 -6.132 400 HG2 GLN 54 HG2 GLN 54 -7.641 7.758 -6.139 401 HG3 GLN 54 HG1 GLN 54 -6.056 6.982 -6.067 402 HE21 GLN 54 HE21 GLN 54 -6.305 6.125 -4.008 403 HE22 GLN 54 HE22 GLN 54 -6.435 7.091 -2.593 404 H SER 55 HN SER 55 -4.899 11.100 -7.260 405 HA SER 55 HA SER 55 -5.647 12.868 -9.389 406 HG SER 55 HG SER 55 -8.728 13.127 -7.540 407 HB2 SER 55 HB2 SER 55 -6.730 13.456 -6.622 408 HB3 SER 55 HB1 SER 55 -6.856 14.510 -8.031 409 H GLY 56 HN GLY 56 -3.190 11.958 -8.378 410 HA2 GLY 56 HA2 GLY 56 -1.185 13.313 -8.325 411 HA3 GLY 56 HA1 GLY 56 -2.082 14.506 -7.386 412 H TYR 57 HN TYR 57 -3.287 12.242 -5.825 413 HA TYR 57 HA TYR 57 -1.132 11.037 -4.364 414 HD1 TYR 57 HD1 TYR 57 -4.023 14.155 -3.350 415 HD2 TYR 57 HD2 TYR 57 0.169 14.279 -3.942 416 HE1 TYR 57 HE1 TYR 57 -4.219 16.481 -4.162 417 HE2 TYR 57 HE2 TYR 57 0.008 16.603 -4.737 418 HH TYR 57 HH TYR 57 -1.679 18.095 -5.730 419 HB2 TYR 57 HB2 TYR 57 -2.644 12.516 -2.395 420 HB3 TYR 57 HB1 TYR 57 -0.912 12.497 -2.648 421 H LEU 58 HN LEU 58 -2.015 9.803 -2.488 422 HA LEU 58 HA LEU 58 -4.702 8.862 -3.152 423 HG LEU 58 HG LEU 58 -1.669 7.670 -3.593 424 HB2 LEU 58 HB2 LEU 58 -2.710 7.474 -1.376 425 HB3 LEU 58 HB1 LEU 58 -4.145 6.790 -2.116 426 HD11 LEU 58 HD11 LEU 58 -2.289 5.249 -2.241 427 HD12 LEU 58 HD12 LEU 58 -0.857 5.646 -3.196 428 HD13 LEU 58 HD13 LEU 58 -2.276 4.942 -3.977 429 HD21 LEU 58 HD23 LEU 58 -2.928 6.313 -5.423 430 HD22 LEU 58 HD21 LEU 58 -3.296 8.016 -5.147 431 HD23 LEU 58 HD22 LEU 58 -4.340 6.769 -4.479 432 H ASP 59 HN ASP 59 -6.268 8.544 -1.409 433 HA ASP 59 HA ASP 59 -5.488 9.733 1.144 434 HB2 ASP 59 HB2 ASP 59 -6.424 11.513 -0.333 435 HB3 ASP 59 HB1 ASP 59 -7.947 10.627 -0.355 436 H GLY 60 HN GLY 60 -6.889 9.327 2.833 437 HA2 GLY 60 HA2 GLY 60 -7.468 6.707 3.288 438 HA3 GLY 60 HA1 GLY 60 -8.254 8.023 4.145 439 H ASP 61 HN ASP 61 -9.513 8.962 1.613 440 HA ASP 61 HA ASP 61 -11.914 7.400 1.876 441 HB2 ASP 61 HB2 ASP 61 -11.301 9.513 -0.194 442 HB3 ASP 61 HB1 ASP 61 -12.892 8.968 0.339 443 H GLU 62 HN GLU 62 -9.583 8.075 -0.640 444 HA GLU 62 HA GLU 62 -10.749 6.277 -2.527 445 HB2 GLU 62 HB2 GLU 62 -8.224 7.878 -2.535 446 HB3 GLU 62 HB1 GLU 62 -8.784 6.923 -3.906 447 HG2 GLU 62 HG2 GLU 62 -10.869 8.251 -3.920 448 HG3 GLU 62 HG1 GLU 62 -10.201 9.240 -2.625 449 H LEU 63 HN LEU 63 -8.178 6.077 -0.205 450 HA LEU 63 HA LEU 63 -6.438 4.223 -1.073 451 HG LEU 63 HG LEU 63 -6.540 6.281 1.423 452 HB2 LEU 63 HB2 LEU 63 -7.819 4.340 1.606 453 HB3 LEU 63 HB1 LEU 63 -6.452 3.308 1.288 454 HD11 LEU 63 HD11 LEU 63 -4.297 5.123 2.683 455 HD12 LEU 63 HD12 LEU 63 -5.739 4.237 3.178 456 HD13 LEU 63 HD13 LEU 63 -5.654 5.981 3.408 457 HD21 LEU 63 HD23 LEU 63 -4.498 4.574 0.059 458 HD22 LEU 63 HD21 LEU 63 -4.096 6.157 0.726 459 HD23 LEU 63 HD22 LEU 63 -5.310 6.022 -0.547 460 H LYS 64 HN LYS 64 -9.748 3.486 -0.006 461 HA LYS 64 HA LYS 64 -9.682 0.753 -0.007 462 HB2 LYS 64 HB2 LYS 64 -11.933 2.542 -0.912 463 HB3 LYS 64 HB1 LYS 64 -12.091 0.908 -0.328 464 HG2 LYS 64 HG2 LYS 64 -11.407 1.555 1.875 465 HG3 LYS 64 HG1 LYS 64 -11.045 3.187 1.311 466 HD2 LYS 64 HD2 LYS 64 -13.787 2.018 1.004 467 HD3 LYS 64 HD1 LYS 64 -13.289 2.785 2.514 468 HE2 LYS 64 HE2 LYS 64 -12.877 4.857 1.388 469 HE3 LYS 64 HE1 LYS 64 -13.124 4.107 -0.187 470 HZ1 LYS 64 HZ3 LYS 64 -15.057 5.378 0.518 471 HZ2 LYS 64 HZ1 LYS 64 -15.204 4.427 1.910 472 HZ3 LYS 64 HZ2 LYS 64 -15.436 3.735 0.384 473 H TYR 65 HN TYR 65 -9.808 2.894 -2.763 474 HA TYR 65 HA TYR 65 -10.804 1.007 -4.637 475 HD1 TYR 65 HD1 TYR 65 -12.173 2.349 -3.701 476 HD2 TYR 65 HD2 TYR 65 -10.309 5.549 -5.798 477 HE1 TYR 65 HE1 TYR 65 -13.895 3.894 -2.857 478 HE2 TYR 65 HE2 TYR 65 -12.034 7.098 -4.975 479 HH TYR 65 HH TYR 65 -14.225 6.261 -2.486 480 HB2 TYR 65 HB2 TYR 65 -9.101 3.415 -5.296 481 HB3 TYR 65 HB1 TYR 65 -10.291 2.614 -6.321 482 H PHE 66 HN PHE 66 -7.773 1.190 -3.146 483 HA PHE 66 HA PHE 66 -5.932 0.664 -5.052 484 HD1 PHE 66 HD2 PHE 66 -8.002 -0.870 -2.113 485 HD2 PHE 66 HD1 PHE 66 -3.865 -1.759 -1.906 486 HE1 PHE 66 HE2 PHE 66 -8.486 -2.793 -0.674 487 HE2 PHE 66 HE1 PHE 66 -4.351 -3.670 -0.437 488 HZ PHE 66 HZ PHE 66 -6.658 -4.196 0.170 489 HB2 PHE 66 HB2 PHE 66 -4.582 -0.114 -3.334 490 HB3 PHE 66 HB1 PHE 66 -5.719 0.882 -2.475 491 H LEU 67 HN LEU 67 -8.232 -1.634 -3.773 492 HA LEU 67 HA LEU 67 -7.103 -3.853 -5.186 493 HG LEU 67 HG LEU 67 -6.867 -4.293 -2.584 494 HB2 LEU 67 HB2 LEU 67 -9.117 -3.391 -3.073 495 HB3 LEU 67 HB1 LEU 67 -9.415 -4.776 -4.108 496 HD11 LEU 67 HD11 LEU 67 -9.261 -5.990 -1.932 497 HD12 LEU 67 HD12 LEU 67 -8.539 -4.708 -0.954 498 HD13 LEU 67 HD13 LEU 67 -7.675 -6.229 -1.197 499 HD21 LEU 67 HD23 LEU 67 -7.843 -6.723 -4.044 500 HD22 LEU 67 HD21 LEU 67 -6.294 -6.530 -3.217 501 HD23 LEU 67 HD22 LEU 67 -6.661 -5.559 -4.643 502 H GLN 68 HN GLN 68 -9.584 -1.498 -5.405 503 HA GLN 68 HA GLN 68 -11.246 -2.809 -7.275 504 HB2 GLN 68 HB2 GLN 68 -10.944 0.033 -6.333 505 HB3 GLN 68 HB1 GLN 68 -12.072 -0.396 -7.600 506 HG2 GLN 68 HG2 GLN 68 -12.956 -2.141 -5.927 507 HG3 GLN 68 HG1 GLN 68 -12.102 -1.174 -4.726 508 HE21 GLN 68 HE21 GLN 68 -14.973 -1.681 -5.131 509 HE22 GLN 68 HE22 GLN 68 -15.704 -0.121 -5.262 510 H LYS 69 HN LYS 69 -8.679 -0.295 -7.571 511 HA LYS 69 HA LYS 69 -8.681 0.151 -10.202 512 HB2 LYS 69 HB2 LYS 69 -6.114 -0.464 -8.776 513 HB3 LYS 69 HB1 LYS 69 -6.371 0.694 -10.067 514 HG2 LYS 69 HG2 LYS 69 -7.026 0.887 -7.176 515 HG3 LYS 69 HG1 LYS 69 -6.121 2.010 -8.179 516 HD2 LYS 69 HD2 LYS 69 -9.083 1.516 -8.202 517 HD3 LYS 69 HD1 LYS 69 -8.263 2.950 -7.597 518 HE2 LYS 69 HE2 LYS 69 -7.403 3.389 -9.869 519 HE3 LYS 69 HE1 LYS 69 -8.322 2.010 -10.465 520 HZ1 LYS 69 HZ3 LYS 69 -9.542 4.014 -10.870 521 HZ2 LYS 69 HZ1 LYS 69 -9.429 4.481 -9.247 522 HZ3 LYS 69 HZ2 LYS 69 -10.353 3.132 -9.678 523 H PHE 70 HN PHE 70 -6.633 -2.338 -8.743 524 HA PHE 70 HA PHE 70 -6.012 -3.524 -11.255 525 HD1 PHE 70 HD1 PHE 70 -6.414 -5.346 -7.303 526 HD2 PHE 70 HD2 PHE 70 -3.978 -6.399 -10.628 527 HE1 PHE 70 HE1 PHE 70 -6.485 -7.695 -6.598 528 HE2 PHE 70 HE2 PHE 70 -4.043 -8.760 -9.931 529 HZ PHE 70 HZ PHE 70 -5.300 -9.412 -7.914 530 HB2 PHE 70 HB2 PHE 70 -4.261 -4.111 -10.005 531 HB3 PHE 70 HB1 PHE 70 -5.100 -3.666 -8.533 532 H GLN 71 HN GLN 71 -8.202 -4.387 -8.608 533 HA GLN 71 HA GLN 71 -8.969 -6.827 -9.988 534 HB2 GLN 71 HB2 GLN 71 -8.790 -6.670 -7.465 535 HB3 GLN 71 HB1 GLN 71 -10.265 -5.723 -7.507 536 HG2 GLN 71 HG2 GLN 71 -11.435 -7.581 -8.573 537 HG3 GLN 71 HG1 GLN 71 -9.955 -8.536 -8.514 538 HE21 GLN 71 HE21 GLN 71 -11.177 -6.374 -6.001 539 HE22 GLN 71 HE22 GLN 71 -11.436 -7.607 -4.827 540 H SER 72 HN SER 72 -11.047 -4.382 -8.507 541 HA SER 72 HA SER 72 -12.490 -2.907 -9.705 542 HG SER 72 HG SER 72 -10.979 -3.604 -11.671 543 HB2 SER 72 HB2 SER 72 -12.903 -5.216 -11.591 544 HB3 SER 72 HB1 SER 72 -13.771 -3.690 -11.658 545 H ASP 73 HN ASP 73 -12.572 -5.121 -7.628 546 HA ASP 73 HA ASP 73 -15.392 -4.958 -7.114 547 HB2 ASP 73 HB2 ASP 73 -15.107 -6.968 -8.648 548 HB3 ASP 73 HB1 ASP 73 -14.194 -7.721 -7.343 549 H ALA 74 HN ALA 74 -12.784 -4.203 -5.928 550 HA ALA 74 HA ALA 74 -12.016 -5.764 -3.776 551 HB1 ALA 74 HB3 ALA 74 -10.929 -3.874 -2.959 552 HB2 ALA 74 HB1 ALA 74 -12.120 -2.776 -3.644 553 HB3 ALA 74 HB2 ALA 74 -10.985 -3.604 -4.704 554 H ARG 75 HN ARG 75 -12.407 -5.482 -1.511 555 HA ARG 75 HA ARG 75 -15.184 -5.182 -0.891 556 HE ARG 75 HE ARG 75 -9.805 -6.212 0.788 557 HB2 ARG 75 HB2 ARG 75 -14.342 -5.538 1.497 558 HB3 ARG 75 HB1 ARG 75 -14.079 -6.855 0.361 559 HG2 ARG 75 HG2 ARG 75 -11.839 -5.067 0.312 560 HG3 ARG 75 HG1 ARG 75 -12.182 -5.570 1.969 561 HD2 ARG 75 HD2 ARG 75 -11.971 -7.856 1.425 562 HD3 ARG 75 HD1 ARG 75 -12.020 -7.526 -0.306 563 HH11 ARG 75 HH11 ARG 75 -10.951 -9.444 0.185 564 HH12 ARG 75 HH12 ARG 75 -9.363 -10.114 0.008 565 HH21 ARG 75 HH21 ARG 75 -7.710 -7.081 0.553 566 HH22 ARG 75 HH22 ARG 75 -7.520 -8.769 0.217 567 H GLU 76 HN GLU 76 -12.465 -3.149 -1.043 568 HA GLU 76 HA GLU 76 -12.397 -0.875 -0.980 569 HB2 GLU 76 HB2 GLU 76 -14.905 -0.894 0.690 570 HB3 GLU 76 HB1 GLU 76 -14.154 0.478 -0.102 571 HG2 GLU 76 HG2 GLU 76 -14.711 -0.320 -2.249 572 HG3 GLU 76 HG1 GLU 76 -15.182 -1.890 -1.613 573 H LEU 77 HN LEU 77 -10.935 -2.440 0.530 574 HA LEU 77 HA LEU 77 -9.849 -2.798 2.534 575 HG LEU 77 HG LEU 77 -8.722 -1.259 0.479 576 HB2 LEU 77 HB2 LEU 77 -9.906 0.169 2.111 577 HB3 LEU 77 HB1 LEU 77 -8.920 -0.583 3.336 578 HD11 LEU 77 HD11 LEU 77 -8.180 1.134 1.086 579 HD12 LEU 77 HD12 LEU 77 -6.931 0.173 0.332 580 HD13 LEU 77 HD13 LEU 77 -6.864 0.468 2.054 581 HD21 LEU 77 HD23 LEU 77 -7.271 -1.964 2.987 582 HD22 LEU 77 HD21 LEU 77 -6.426 -1.980 1.449 583 HD23 LEU 77 HD22 LEU 77 -7.827 -3.019 1.692 584 H THR 78 HN THR 78 -12.842 -2.486 2.948 585 HA THR 78 HA THR 78 -14.381 -1.798 4.540 586 HB THR 78 HB THR 78 -14.033 -2.941 6.625 587 HG1 THR 78 HG1 THR 78 -12.094 -2.867 7.460 588 HG21 THR 78 HG23 THR 78 -13.588 -5.156 5.873 589 HG22 THR 78 HG21 THR 78 -12.591 -4.570 4.542 590 HG23 THR 78 HG22 THR 78 -14.333 -4.301 4.522 591 H GLU 79 HN GLU 79 -14.297 -1.002 7.119 592 HA GLU 79 HA GLU 79 -13.409 1.654 7.010 593 HB2 GLU 79 HB2 GLU 79 -15.264 0.731 8.435 594 HB3 GLU 79 HB1 GLU 79 -14.030 -0.008 9.451 595 HG2 GLU 79 HG2 GLU 79 -13.100 2.237 9.855 596 HG3 GLU 79 HG1 GLU 79 -14.454 2.914 8.958 597 H SER 80 HN SER 80 -12.222 -1.243 8.587 598 HA SER 80 HA SER 80 -10.006 -0.065 9.896 599 HG SER 80 HG SER 80 -11.208 -3.821 9.442 600 HB2 SER 80 HB2 SER 80 -9.457 -2.291 10.578 601 HB3 SER 80 HB1 SER 80 -11.207 -2.099 10.637 602 H GLU 81 HN GLU 81 -10.051 -2.201 6.925 603 HA GLU 81 HA GLU 81 -7.336 -2.500 6.805 604 HB2 GLU 81 HB2 GLU 81 -9.420 -3.367 5.322 605 HB3 GLU 81 HB1 GLU 81 -8.680 -2.247 4.202 606 HG2 GLU 81 HG2 GLU 81 -7.476 -4.674 5.461 607 HG3 GLU 81 HG1 GLU 81 -7.729 -4.342 3.750 608 H THR 82 HN THR 82 -9.184 0.230 5.338 609 HA THR 82 HA THR 82 -7.048 1.353 3.988 610 HB THR 82 HB THR 82 -8.139 3.502 4.168 611 HG1 THR 82 HG1 THR 82 -9.892 3.806 5.552 612 HG21 THR 82 HG23 THR 82 -10.025 1.193 3.766 613 HG22 THR 82 HG21 THR 82 -9.083 2.046 2.539 614 HG23 THR 82 HG22 THR 82 -10.419 2.862 3.354 615 H LYS 83 HN LYS 83 -7.548 1.053 7.389 616 HA LYS 83 HA LYS 83 -6.110 3.220 8.384 617 HB2 LYS 83 HB2 LYS 83 -7.324 1.687 9.856 618 HB3 LYS 83 HB1 LYS 83 -6.227 0.380 9.428 619 HG2 LYS 83 HG2 LYS 83 -4.377 1.582 10.466 620 HG3 LYS 83 HG1 LYS 83 -5.472 2.896 10.896 621 HD2 LYS 83 HD2 LYS 83 -5.076 1.397 12.792 622 HD3 LYS 83 HD1 LYS 83 -6.768 1.374 12.293 623 HE2 LYS 83 HE2 LYS 83 -6.392 -0.705 11.078 624 HE3 LYS 83 HE1 LYS 83 -4.688 -0.672 11.529 625 HZ1 LYS 83 HZ3 LYS 83 -6.959 -0.864 13.433 626 HZ2 LYS 83 HZ1 LYS 83 -5.317 -0.879 13.842 627 HZ3 LYS 83 HZ2 LYS 83 -5.980 -2.154 12.948 628 H SER 84 HN SER 84 -5.025 0.072 7.223 629 HA SER 84 HA SER 84 -2.318 0.291 7.778 630 HG SER 84 HG SER 84 -1.291 -0.727 5.265 631 HB2 SER 84 HB2 SER 84 -3.308 -1.784 6.948 632 HB3 SER 84 HB1 SER 84 -3.611 -1.033 5.387 633 H LEU 85 HN LEU 85 -3.981 1.080 4.755 634 HA LEU 85 HA LEU 85 -1.811 2.254 3.477 635 HG LEU 85 HG LEU 85 -4.210 0.453 2.400 636 HB2 LEU 85 HB2 LEU 85 -4.786 2.566 3.216 637 HB3 LEU 85 HB1 LEU 85 -3.680 3.386 2.148 638 HD11 LEU 85 HD11 LEU 85 -4.138 2.346 0.059 639 HD12 LEU 85 HD12 LEU 85 -5.578 1.694 0.839 640 HD13 LEU 85 HD13 LEU 85 -4.484 0.619 -0.028 641 HD21 LEU 85 HD23 LEU 85 -1.827 0.567 2.452 642 HD22 LEU 85 HD21 LEU 85 -1.803 1.747 1.145 643 HD23 LEU 85 HD22 LEU 85 -2.316 0.089 0.829 644 H MET 86 HN MET 86 -4.323 3.658 5.522 645 HA MET 86 HA MET 86 -3.613 6.357 5.291 646 HB2 MET 86 HB2 MET 86 -4.750 4.860 7.665 647 HB3 MET 86 HB1 MET 86 -4.669 6.612 7.544 648 HG2 MET 86 HG2 MET 86 -5.957 5.369 5.253 649 HG3 MET 86 HG1 MET 86 -6.775 5.036 6.778 650 HE1 MET 86 HE3 MET 86 -4.711 8.390 6.450 651 HE2 MET 86 HE1 MET 86 -5.774 9.295 5.373 652 HE3 MET 86 HE2 MET 86 -4.991 7.816 4.806 653 H ASP 87 HN ASP 87 -2.628 3.921 7.642 654 HA ASP 87 HA ASP 87 -0.725 5.512 9.035 655 HB2 ASP 87 HB2 ASP 87 -1.015 2.515 8.874 656 HB3 ASP 87 HB1 ASP 87 -0.114 3.401 10.105 657 H ALA 88 HN ALA 88 -0.541 4.399 5.942 658 HA ALA 88 HA ALA 88 2.024 3.165 5.937 659 HB1 ALA 88 HB3 ALA 88 1.734 2.896 3.647 660 HB2 ALA 88 HB1 ALA 88 0.628 4.269 3.536 661 HB3 ALA 88 HB2 ALA 88 0.110 2.781 4.332 662 H ALA 89 HN ALA 89 0.914 6.502 5.553 663 HA ALA 89 HA ALA 89 3.684 7.338 5.611 664 HB1 ALA 89 HB3 ALA 89 3.443 6.944 3.247 665 HB2 ALA 89 HB1 ALA 89 3.550 8.679 3.545 666 HB3 ALA 89 HB2 ALA 89 1.985 7.940 3.184 667 H ASP 90 HN ASP 90 1.007 9.178 4.242 668 HA ASP 90 HA ASP 90 1.436 11.209 6.296 669 HB2 ASP 90 HB2 ASP 90 1.067 11.504 3.628 670 HB3 ASP 90 HB1 ASP 90 -0.585 11.683 4.197 671 H ASN 91 HN ASN 91 0.529 9.854 7.926 672 HA ASN 91 HA ASN 91 -2.354 9.351 7.736 673 HB2 ASN 91 HB2 ASN 91 -1.538 8.284 10.163 674 HB3 ASN 91 HB1 ASN 91 -1.797 7.393 8.675 675 HD21 ASN 91 HD21 ASN 91 0.011 6.829 7.392 676 HD22 ASN 91 HD22 ASN 91 1.605 6.815 8.062 677 H ASP 92 HN ASP 92 -0.017 10.718 10.031 678 HA ASP 92 HA ASP 92 -2.000 11.688 11.792 679 HB2 ASP 92 HB2 ASP 92 0.920 12.397 11.535 680 HB3 ASP 92 HB1 ASP 92 -0.116 12.847 12.883 681 H GLY 93 HN GLY 93 -1.125 12.984 8.749 682 HA2 GLY 93 HA2 GLY 93 -2.200 15.561 9.687 683 HA3 GLY 93 HA1 GLY 93 -0.792 15.503 8.648 684 H ASP 94 HN ASP 94 -1.067 14.789 6.460 685 HA ASP 94 HA ASP 94 -3.469 15.880 5.328 686 HB2 ASP 94 HB2 ASP 94 -1.007 14.673 4.088 687 HB3 ASP 94 HB1 ASP 94 -2.349 15.310 3.144 688 H GLY 95 HN GLY 95 -2.847 12.843 6.508 689 HA2 GLY 95 HA2 GLY 95 -3.788 10.772 6.174 690 HA3 GLY 95 HA1 GLY 95 -5.197 11.695 5.692 691 H LYS 96 HN LYS 96 -2.361 12.060 3.726 692 HA LYS 96 HA LYS 96 -3.665 10.398 1.696 693 HB2 LYS 96 HB2 LYS 96 -3.470 12.162 0.324 694 HB3 LYS 96 HB1 LYS 96 -2.678 13.067 1.599 695 HG2 LYS 96 HG2 LYS 96 -1.227 11.256 -0.322 696 HG3 LYS 96 HG1 LYS 96 -1.468 12.977 -0.584 697 HD2 LYS 96 HD2 LYS 96 0.166 11.640 1.559 698 HD3 LYS 96 HD1 LYS 96 0.696 12.768 0.316 699 HE2 LYS 96 HE2 LYS 96 -1.096 13.401 2.652 700 HE3 LYS 96 HE1 LYS 96 0.586 13.886 2.461 701 HZ1 LYS 96 HZ3 LYS 96 -0.080 15.145 0.474 702 HZ2 LYS 96 HZ1 LYS 96 -0.847 15.704 1.875 703 HZ3 LYS 96 HZ2 LYS 96 -1.697 14.746 0.770 704 H ILE 97 HN ILE 97 -2.286 9.218 0.173 705 HA ILE 97 HA ILE 97 0.373 8.551 1.229 706 HB ILE 97 HB ILE 97 -1.492 6.471 0.127 707 HG12 ILE 97 HG12 ILE 97 -2.333 7.412 2.287 708 HG13 ILE 97 HG11 ILE 97 -1.887 5.717 2.346 709 HG21 ILE 97 HG21 ILE 97 0.207 4.999 1.334 710 HG22 ILE 97 HG22 ILE 97 1.211 6.449 1.410 711 HG23 ILE 97 HG23 ILE 97 0.728 5.795 -0.153 712 HD11 ILE 97 HD13 ILE 97 0.242 6.318 3.393 713 HD12 ILE 97 HD11 ILE 97 -1.153 6.830 4.343 714 HD13 ILE 97 HD12 ILE 97 -0.260 8.005 3.384 715 H GLY 98 HN GLY 98 1.484 9.549 -0.415 716 HA2 GLY 98 HA2 GLY 98 1.016 8.610 -3.151 717 HA3 GLY 98 HA1 GLY 98 1.756 10.150 -2.725 718 H ALA 99 HN ALA 99 3.125 8.662 -4.483 719 HA ALA 99 HA ALA 99 4.813 6.657 -3.536 720 HB1 ALA 99 HB3 ALA 99 6.157 7.023 -5.419 721 HB2 ALA 99 HB1 ALA 99 5.777 8.746 -5.466 722 HB3 ALA 99 HB2 ALA 99 4.554 7.562 -5.920 723 H ASP 100 HN ASP 100 5.366 10.162 -3.576 724 HA ASP 100 HA ASP 100 7.855 10.199 -2.317 725 HB2 ASP 100 HB2 ASP 100 6.819 12.158 -3.432 726 HB3 ASP 100 HB1 ASP 100 5.679 12.293 -2.100 727 H GLU 101 HN GLU 101 4.648 10.631 -0.849 728 HA GLU 101 HA GLU 101 5.503 10.788 1.834 729 HB2 GLU 101 HB2 GLU 101 2.973 10.419 0.380 730 HB3 GLU 101 HB1 GLU 101 2.991 9.641 1.951 731 HG2 GLU 101 HG2 GLU 101 2.201 12.146 1.553 732 HG3 GLU 101 HG1 GLU 101 2.908 11.595 3.057 733 H PHE 102 HN PHE 102 4.364 8.096 -0.136 734 HA PHE 102 HA PHE 102 4.568 6.035 1.686 735 HD1 PHE 102 HD1 PHE 102 6.771 4.030 -0.016 736 HD2 PHE 102 HD2 PHE 102 2.553 3.903 -0.518 737 HE1 PHE 102 HE1 PHE 102 6.829 1.592 0.187 738 HE2 PHE 102 HE2 PHE 102 2.599 1.451 -0.309 739 HZ PHE 102 HZ PHE 102 4.744 0.292 0.043 740 HB2 PHE 102 HB2 PHE 102 3.609 5.911 -0.624 741 HB3 PHE 102 HB1 PHE 102 5.245 5.897 -1.265 742 H GLN 103 HN GLN 103 7.064 7.394 -0.466 743 HA GLN 103 HA GLN 103 9.177 5.695 0.194 744 HB2 GLN 103 HB2 GLN 103 9.262 8.654 -0.453 745 HB3 GLN 103 HB1 GLN 103 10.674 7.611 -0.398 746 HG2 GLN 103 HG2 GLN 103 8.957 6.321 -2.132 747 HG3 GLN 103 HG1 GLN 103 8.739 8.031 -2.485 748 HE21 GLN 103 HE21 GLN 103 9.951 5.983 -4.125 749 HE22 GLN 103 HE22 GLN 103 11.564 6.511 -4.446 750 H GLU 104 HN GLU 104 7.773 8.376 1.927 751 HA GLU 104 HA GLU 104 9.871 8.824 3.754 752 HB2 GLU 104 HB2 GLU 104 8.510 10.369 4.700 753 HB3 GLU 104 HB1 GLU 104 7.630 10.128 3.202 754 HG2 GLU 104 HG2 GLU 104 5.884 9.898 4.547 755 HG3 GLU 104 HG1 GLU 104 6.490 8.255 4.714 756 H MET 105 HN MET 105 7.200 6.611 3.700 757 HA MET 105 HA MET 105 7.379 5.583 6.297 758 HB2 MET 105 HB2 MET 105 5.648 5.161 4.403 759 HB3 MET 105 HB1 MET 105 6.693 3.796 4.021 760 HG2 MET 105 HG2 MET 105 5.559 4.314 6.752 761 HG3 MET 105 HG1 MET 105 4.807 3.282 5.556 762 HE1 MET 105 HE3 MET 105 5.807 2.342 8.628 763 HE2 MET 105 HE1 MET 105 6.190 0.695 8.125 764 HE3 MET 105 HE2 MET 105 4.764 1.509 7.476 765 H VAL 106 HN VAL 106 8.682 4.103 3.313 766 HA VAL 106 HA VAL 106 10.165 2.126 4.610 767 HB VAL 106 HB VAL 106 9.588 1.979 2.247 768 HG11 VAL 106 HG11 VAL 106 11.035 4.513 2.141 769 HG12 VAL 106 HG12 VAL 106 9.765 3.877 1.105 770 HG13 VAL 106 HG13 VAL 106 11.439 3.387 0.851 771 HG21 VAL 106 HG23 VAL 106 12.057 1.313 3.417 772 HG22 VAL 106 HG21 VAL 106 12.420 1.904 1.796 773 HG23 VAL 106 HG22 VAL 106 11.294 0.563 2.014 774 H HIS 107 HN HIS 107 10.901 5.450 3.875 775 HA HIS 107 HA HIS 107 13.730 5.154 4.367 776 HD1 HIS 107 HD1 HIS 107 13.741 9.308 5.228 777 HD2 HIS 107 HD2 HIS 107 15.631 6.699 2.604 778 HE1 HIS 107 HE1 HIS 107 16.111 10.130 5.054 779 HE2 HIS 107 HE2 HIS 107 17.221 8.570 3.415 780 HB2 HIS 107 HB2 HIS 107 12.734 6.812 2.751 781 HB3 HIS 107 HB1 HIS 107 12.144 7.714 4.143 782 H SER 108 HN SER 108 10.888 5.923 6.178 783 HA SER 108 HA SER 108 11.922 7.403 8.285 784 HG SER 108 HG SER 108 10.477 5.893 10.443 785 HB2 SER 108 HB2 SER 108 9.532 7.028 8.019 786 HB3 SER 108 HB1 SER 108 9.740 5.308 8.345 Start of MODEL 12 1 HA SER 1 HA SER 1 2.008 -7.396 -5.055 2 HG SER 1 HG SER 1 1.960 -10.646 -6.764 3 H1 SER 1 HT1 SER 1 0.090 -8.690 -5.732 4 H2 SER 1 HT2 SER 1 0.754 -8.907 -7.272 5 H3 SER 1 HT3 SER 1 0.320 -7.358 -6.749 6 HB2 SER 1 HB2 SER 1 3.596 -9.247 -4.926 7 HB3 SER 1 HB1 SER 1 1.955 -9.851 -4.687 8 H ILE 2 HN ILE 2 3.337 -5.865 -5.803 9 HA ILE 2 HA ILE 2 3.906 -5.290 -8.391 10 HB ILE 2 HB ILE 2 5.967 -4.757 -6.270 11 HG12 ILE 2 HG12 ILE 2 4.376 -2.584 -6.181 12 HG13 ILE 2 HG11 ILE 2 3.177 -3.842 -6.428 13 HG21 ILE 2 HG21 ILE 2 5.482 -3.874 -8.958 14 HG22 ILE 2 HG22 ILE 2 6.870 -3.577 -7.910 15 HG23 ILE 2 HG23 ILE 2 5.464 -2.513 -7.836 16 HD11 ILE 2 HD13 ILE 2 4.583 -3.110 -4.050 17 HD12 ILE 2 HD11 ILE 2 4.909 -4.797 -4.449 18 HD13 ILE 2 HD12 ILE 2 3.246 -4.243 -4.258 19 H THR 3 HN THR 3 6.596 -6.441 -6.422 20 HA THR 3 HA THR 3 8.123 -8.106 -6.733 21 HB THR 3 HB THR 3 7.992 -9.768 -8.346 22 HG1 THR 3 HG1 THR 3 7.867 -8.927 -10.306 23 HG21 THR 3 HG23 THR 3 5.094 -9.052 -8.316 24 HG22 THR 3 HG21 THR 3 5.921 -9.449 -6.809 25 HG23 THR 3 HG22 THR 3 5.861 -10.626 -8.122 26 H ASP 4 HN ASP 4 7.778 -5.248 -8.266 27 HA ASP 4 HA ASP 4 9.489 -5.189 -10.398 28 HB2 ASP 4 HB2 ASP 4 8.245 -3.222 -9.589 29 HB3 ASP 4 HB1 ASP 4 9.304 -3.123 -8.188 30 H ILE 5 HN ILE 5 10.620 -4.250 -7.113 31 HA ILE 5 HA ILE 5 13.017 -5.886 -7.632 32 HB ILE 5 HB ILE 5 12.964 -3.049 -6.590 33 HG12 ILE 5 HG12 ILE 5 14.537 -3.888 -8.978 34 HG13 ILE 5 HG11 ILE 5 12.796 -3.694 -9.154 35 HG21 ILE 5 HG21 ILE 5 14.653 -4.605 -5.519 36 HG22 ILE 5 HG22 ILE 5 15.276 -3.128 -6.255 37 HG23 ILE 5 HG23 ILE 5 15.435 -4.671 -7.101 38 HD11 ILE 5 HD13 ILE 5 13.996 -1.674 -9.775 39 HD12 ILE 5 HD11 ILE 5 14.695 -1.587 -8.158 40 HD13 ILE 5 HD12 ILE 5 12.953 -1.402 -8.378 41 H LEU 6 HN LEU 6 11.961 -7.316 -6.240 42 HA LEU 6 HA LEU 6 12.942 -7.212 -3.597 43 HG LEU 6 HG LEU 6 8.830 -6.198 -3.266 44 HB2 LEU 6 HB2 LEU 6 10.742 -7.337 -2.414 45 HB3 LEU 6 HB1 LEU 6 11.211 -5.775 -3.015 46 HD11 LEU 6 HD11 LEU 6 10.062 -6.127 -5.997 47 HD12 LEU 6 HD12 LEU 6 10.109 -4.759 -4.883 48 HD13 LEU 6 HD13 LEU 6 8.559 -5.384 -5.449 49 HD21 LEU 6 HD23 LEU 6 8.946 -8.584 -3.524 50 HD22 LEU 6 HD21 LEU 6 9.675 -8.396 -5.115 51 HD23 LEU 6 HD22 LEU 6 8.026 -7.847 -4.833 52 H SER 7 HN SER 7 12.186 -9.092 -2.224 53 HA SER 7 HA SER 7 12.381 -11.472 -3.799 54 HG SER 7 HG SER 7 13.814 -10.245 -1.506 55 HB2 SER 7 HB2 SER 7 11.811 -11.186 -0.837 56 HB3 SER 7 HB1 SER 7 12.325 -12.659 -1.659 57 H ALA 8 HN ALA 8 10.749 -12.391 -4.817 58 HA ALA 8 HA ALA 8 8.053 -11.640 -4.580 59 HB1 ALA 8 HB3 ALA 8 9.060 -12.637 -6.599 60 HB2 ALA 8 HB1 ALA 8 7.587 -13.464 -6.093 61 HB3 ALA 8 HB2 ALA 8 9.161 -14.184 -5.758 62 H GLU 9 HN GLU 9 9.840 -14.376 -3.240 63 HA GLU 9 HA GLU 9 7.623 -15.784 -2.219 64 HB2 GLU 9 HB2 GLU 9 10.509 -15.739 -1.348 65 HB3 GLU 9 HB1 GLU 9 9.320 -16.898 -0.759 66 HG2 GLU 9 HG2 GLU 9 10.144 -16.535 -3.617 67 HG3 GLU 9 HG1 GLU 9 10.744 -17.796 -2.543 68 H ASP 10 HN ASP 10 9.971 -13.708 -0.534 69 HA ASP 10 HA ASP 10 8.796 -13.535 1.891 70 HB2 ASP 10 HB2 ASP 10 10.177 -11.331 0.370 71 HB3 ASP 10 HB1 ASP 10 9.803 -11.255 2.088 72 H ILE 11 HN ILE 11 7.663 -12.052 -1.024 73 HA ILE 11 HA ILE 11 5.929 -10.175 0.222 74 HB ILE 11 HB ILE 11 6.291 -11.279 -2.498 75 HG12 ILE 11 HG12 ILE 11 5.792 -8.495 -1.419 76 HG13 ILE 11 HG11 ILE 11 7.360 -9.203 -1.808 77 HG21 ILE 11 HG21 ILE 11 3.628 -10.281 -1.578 78 HG22 ILE 11 HG22 ILE 11 4.011 -11.640 -2.637 79 HG23 ILE 11 HG23 ILE 11 4.168 -9.988 -3.231 80 HD11 ILE 11 HD13 ILE 11 6.598 -7.664 -3.530 81 HD12 ILE 11 HD11 ILE 11 5.156 -8.649 -3.776 82 HD13 ILE 11 HD12 ILE 11 6.748 -9.309 -4.152 83 H ALA 12 HN ALA 12 5.442 -13.446 -1.048 84 HA ALA 12 HA ALA 12 2.741 -13.715 -0.433 85 HB1 ALA 12 HB3 ALA 12 4.537 -15.349 -1.579 86 HB2 ALA 12 HB1 ALA 12 2.978 -15.909 -0.965 87 HB3 ALA 12 HB2 ALA 12 4.427 -16.088 0.020 88 H ALA 13 HN ALA 13 5.554 -14.645 1.540 89 HA ALA 13 HA ALA 13 4.033 -15.410 3.797 90 HB1 ALA 13 HB3 ALA 13 6.478 -15.930 3.358 91 HB2 ALA 13 HB1 ALA 13 6.080 -15.434 5.005 92 HB3 ALA 13 HB2 ALA 13 6.828 -14.285 3.895 93 H ALA 14 HN ALA 14 5.853 -12.492 3.112 94 HA ALA 14 HA ALA 14 5.212 -10.895 5.222 95 HB1 ALA 14 HB3 ALA 14 6.706 -10.048 3.591 96 HB2 ALA 14 HB1 ALA 14 5.327 -8.949 3.604 97 HB3 ALA 14 HB2 ALA 14 5.492 -10.147 2.314 98 H LEU 15 HN LEU 15 3.278 -11.341 2.288 99 HA LEU 15 HA LEU 15 1.132 -9.674 3.136 100 HG LEU 15 HG LEU 15 -1.036 -11.345 1.286 101 HB2 LEU 15 HB2 LEU 15 1.656 -10.095 0.805 102 HB3 LEU 15 HB1 LEU 15 1.280 -11.785 1.008 103 HD11 LEU 15 HD11 LEU 15 -1.924 -9.039 1.322 104 HD12 LEU 15 HD12 LEU 15 -0.270 -8.438 1.410 105 HD13 LEU 15 HD13 LEU 15 -0.921 -9.422 2.721 106 HD21 LEU 15 HD23 LEU 15 -0.136 -9.449 -0.875 107 HD22 LEU 15 HD21 LEU 15 -1.623 -10.393 -0.814 108 HD23 LEU 15 HD22 LEU 15 -0.072 -11.202 -1.042 109 H GLN 16 HN GLN 16 1.423 -13.163 2.696 110 HA GLN 16 HA GLN 16 -1.100 -13.908 3.613 111 HB2 GLN 16 HB2 GLN 16 1.489 -15.332 3.226 112 HB3 GLN 16 HB1 GLN 16 0.071 -16.157 3.847 113 HG2 GLN 16 HG2 GLN 16 0.752 -15.844 1.203 114 HG3 GLN 16 HG1 GLN 16 -0.802 -16.365 1.845 115 HE21 GLN 16 HE21 GLN 16 0.960 -13.798 0.347 116 HE22 GLN 16 HE22 GLN 16 -0.399 -12.787 0.007 117 H GLU 17 HN GLU 17 1.205 -12.554 5.636 118 HA GLU 17 HA GLU 17 1.226 -14.564 7.652 119 HB2 GLU 17 HB2 GLU 17 3.045 -13.067 7.658 120 HB3 GLU 17 HB1 GLU 17 2.005 -11.657 7.620 121 HG2 GLU 17 HG2 GLU 17 1.776 -13.478 9.911 122 HG3 GLU 17 HG1 GLU 17 3.249 -12.530 9.797 123 H CYS 18 HN CYS 18 -0.037 -11.222 8.165 124 HA CYS 18 HA CYS 18 -2.341 -12.453 9.435 125 HG CYS 18 HG CYS 18 -1.226 -10.515 12.660 126 HB2 CYS 18 HB2 CYS 18 -0.623 -10.236 10.081 127 HB3 CYS 18 HB1 CYS 18 -2.304 -9.725 10.041 128 H GLN 19 HN GLN 19 -1.761 -11.250 6.423 129 HA GLN 19 HA GLN 19 -3.376 -9.125 5.957 130 HB2 GLN 19 HB2 GLN 19 -2.120 -10.025 4.179 131 HB3 GLN 19 HB1 GLN 19 -2.958 -11.556 4.285 132 HG2 GLN 19 HG2 GLN 19 -5.043 -10.365 3.573 133 HG3 GLN 19 HG1 GLN 19 -4.039 -8.948 3.273 134 HE21 GLN 19 HE21 GLN 19 -4.496 -8.944 1.079 135 HE22 GLN 19 HE22 GLN 19 -3.841 -10.120 -0.005 136 H ASP 20 HN ASP 20 -5.436 -8.662 5.512 137 HA ASP 20 HA ASP 20 -7.623 -10.312 5.244 138 HB2 ASP 20 HB2 ASP 20 -6.748 -10.061 8.059 139 HB3 ASP 20 HB1 ASP 20 -8.465 -9.806 7.774 140 HA PRO 21 HA PRO 21 -9.567 -6.382 4.808 141 HB2 PRO 21 HB2 PRO 21 -12.127 -6.917 5.370 142 HB3 PRO 21 HB1 PRO 21 -11.363 -7.466 3.894 143 HG2 PRO 21 HG2 PRO 21 -11.927 -8.946 6.427 144 HG3 PRO 21 HG1 PRO 21 -12.098 -9.493 4.749 145 HD2 PRO 21 HD2 PRO 21 -9.984 -10.156 6.305 146 HD3 PRO 21 HD1 PRO 21 -9.879 -9.972 4.548 147 H ASP 22 HN ASP 22 -8.245 -6.235 7.130 148 HA ASP 22 HA ASP 22 -9.661 -4.381 8.635 149 HB2 ASP 22 HB2 ASP 22 -11.055 -6.246 9.353 150 HB3 ASP 22 HB1 ASP 22 -9.634 -7.110 9.925 151 H THR 23 HN THR 23 -6.791 -6.142 8.108 152 HA THR 23 HA THR 23 -5.556 -4.745 10.378 153 HB THR 23 HB THR 23 -5.620 -7.122 10.892 154 HG1 THR 23 HG1 THR 23 -3.696 -6.846 11.713 155 HG21 THR 23 HG23 THR 23 -4.036 -7.497 8.353 156 HG22 THR 23 HG21 THR 23 -5.716 -7.979 8.592 157 HG23 THR 23 HG22 THR 23 -4.434 -8.746 9.530 158 H PHE 24 HN PHE 24 -5.246 -5.713 7.021 159 HA PHE 24 HA PHE 24 -3.538 -3.785 6.169 160 HD1 PHE 24 HD1 PHE 24 -0.668 -5.243 4.615 161 HD2 PHE 24 HD2 PHE 24 -1.660 -7.519 8.074 162 HE1 PHE 24 HE1 PHE 24 0.427 -7.220 3.627 163 HE2 PHE 24 HE2 PHE 24 -0.554 -9.490 7.105 164 HZ PHE 24 HZ PHE 24 0.485 -9.343 4.883 165 HB2 PHE 24 HB2 PHE 24 -1.361 -4.190 6.790 166 HB3 PHE 24 HB1 PHE 24 -2.044 -5.206 8.037 167 H GLU 25 HN GLU 25 -3.261 -4.017 3.880 168 HA GLU 25 HA GLU 25 -3.775 -6.693 2.910 169 HB2 GLU 25 HB2 GLU 25 -4.157 -4.297 1.158 170 HB3 GLU 25 HB1 GLU 25 -4.701 -5.937 0.937 171 HG2 GLU 25 HG2 GLU 25 -5.711 -4.007 2.956 172 HG3 GLU 25 HG1 GLU 25 -6.561 -4.563 1.513 173 HA PRO 26 HA PRO 26 0.127 -5.041 0.725 174 HB2 PRO 26 HB2 PRO 26 0.397 -2.405 0.323 175 HB3 PRO 26 HB1 PRO 26 -0.758 -3.390 -0.558 176 HG2 PRO 26 HG2 PRO 26 -1.201 -1.368 1.466 177 HG3 PRO 26 HG1 PRO 26 -2.355 -2.075 0.352 178 HD2 PRO 26 HD2 PRO 26 -1.847 -2.746 3.106 179 HD3 PRO 26 HD1 PRO 26 -3.192 -3.199 2.099 180 H GLN 27 HN GLN 27 -0.198 -2.967 3.616 181 HA GLN 27 HA GLN 27 2.244 -1.781 3.768 182 HB2 GLN 27 HB2 GLN 27 0.048 -1.765 5.242 183 HB3 GLN 27 HB1 GLN 27 1.033 -2.792 6.270 184 HG2 GLN 27 HG2 GLN 27 2.786 -0.890 5.904 185 HG3 GLN 27 HG1 GLN 27 1.347 0.062 5.555 186 HE21 GLN 27 HE21 GLN 27 -0.282 -1.566 7.424 187 HE22 GLN 27 HE22 GLN 27 0.157 -1.017 9.001 188 H LYS 28 HN LYS 28 1.415 -4.884 5.287 189 HA LYS 28 HA LYS 28 4.079 -5.202 6.320 190 HB2 LYS 28 HB2 LYS 28 1.718 -7.055 6.160 191 HB3 LYS 28 HB1 LYS 28 3.231 -7.495 6.867 192 HG2 LYS 28 HG2 LYS 28 2.443 -5.058 8.029 193 HG3 LYS 28 HG1 LYS 28 1.054 -6.145 8.050 194 HD2 LYS 28 HD2 LYS 28 2.374 -6.374 10.080 195 HD3 LYS 28 HD1 LYS 28 2.423 -7.862 9.131 196 HE2 LYS 28 HE2 LYS 28 4.600 -7.091 8.182 197 HE3 LYS 28 HE1 LYS 28 4.553 -5.738 9.310 198 HZ1 LYS 28 HZ3 LYS 28 4.379 -7.461 11.112 199 HZ2 LYS 28 HZ1 LYS 28 5.867 -7.396 10.308 200 HZ3 LYS 28 HZ2 LYS 28 4.761 -8.623 9.943 201 H PHE 29 HN PHE 29 2.164 -6.272 3.608 202 HA PHE 29 HA PHE 29 3.842 -8.136 2.439 203 HD1 PHE 29 HD1 PHE 29 3.795 -5.258 -0.180 204 HD2 PHE 29 HD2 PHE 29 1.798 -8.967 -0.625 205 HE1 PHE 29 HE1 PHE 29 4.394 -5.280 -2.557 206 HE2 PHE 29 HE2 PHE 29 2.394 -9.010 -3.000 207 HZ PHE 29 HZ PHE 29 3.694 -7.164 -3.977 208 HB2 PHE 29 HB2 PHE 29 1.749 -7.932 1.423 209 HB3 PHE 29 HB1 PHE 29 1.806 -6.181 1.412 210 H PHE 30 HN PHE 30 3.877 -4.604 2.257 211 HA PHE 30 HA PHE 30 6.015 -4.389 0.379 212 HD1 PHE 30 HD1 PHE 30 4.797 -3.804 -1.000 213 HD2 PHE 30 HD2 PHE 30 3.359 -0.774 1.614 214 HE1 PHE 30 HE1 PHE 30 3.033 -3.235 -2.624 215 HE2 PHE 30 HE2 PHE 30 1.590 -0.208 0.003 216 HZ PHE 30 HZ PHE 30 1.425 -1.441 -2.121 217 HB2 PHE 30 HB2 PHE 30 4.907 -2.416 2.379 218 HB3 PHE 30 HB1 PHE 30 6.125 -2.023 1.177 219 H GLN 31 HN GLN 31 5.846 -3.670 3.800 220 HA GLN 31 HA GLN 31 8.496 -3.055 4.199 221 HB2 GLN 31 HB2 GLN 31 6.334 -2.885 5.709 222 HB3 GLN 31 HB1 GLN 31 6.976 -4.367 6.404 223 HG2 GLN 31 HG2 GLN 31 7.847 -2.709 7.765 224 HG3 GLN 31 HG1 GLN 31 9.170 -3.039 6.645 225 HE21 GLN 31 HE21 GLN 31 9.508 -1.589 4.899 226 HE22 GLN 31 HE22 GLN 31 8.989 0.054 5.001 227 H THR 32 HN THR 32 7.032 -6.063 5.357 228 HA THR 32 HA THR 32 9.353 -7.293 6.172 229 HB THR 32 HB THR 32 6.961 -8.669 4.951 230 HG1 THR 32 HG1 THR 32 7.484 -8.218 7.706 231 HG21 THR 32 HG23 THR 32 7.649 -10.586 6.314 232 HG22 THR 32 HG21 THR 32 9.077 -9.696 6.845 233 HG23 THR 32 HG22 THR 32 8.899 -10.148 5.150 234 H SER 33 HN SER 33 7.787 -7.736 3.010 235 HA SER 33 HA SER 33 9.985 -9.318 2.031 236 HG SER 33 HG SER 33 9.397 -9.198 -0.665 237 HB2 SER 33 HB2 SER 33 7.648 -9.833 1.471 238 HB3 SER 33 HB1 SER 33 7.557 -8.330 0.551 239 H GLY 34 HN GLY 34 8.534 -6.261 0.949 240 HA2 GLY 34 HA2 GLY 34 10.873 -5.973 -0.793 241 HA3 GLY 34 HA1 GLY 34 9.380 -5.094 -0.994 242 H LEU 35 HN LEU 35 8.974 -3.572 1.027 243 HA LEU 35 HA LEU 35 10.811 -1.512 0.784 244 HG LEU 35 HG LEU 35 9.315 0.433 1.128 245 HB2 LEU 35 HB2 LEU 35 8.472 -2.137 2.456 246 HB3 LEU 35 HB1 LEU 35 9.572 -0.933 3.112 247 HD11 LEU 35 HD11 LEU 35 7.753 -1.916 0.149 248 HD12 LEU 35 HD12 LEU 35 9.020 -0.998 -0.663 249 HD13 LEU 35 HD13 LEU 35 7.414 -0.297 -0.462 250 HD21 LEU 35 HD23 LEU 35 6.585 -0.393 2.073 251 HD22 LEU 35 HD21 LEU 35 7.104 1.192 1.504 252 HD23 LEU 35 HD22 LEU 35 7.697 0.567 3.043 253 H SER 36 HN SER 36 10.821 -4.217 2.935 254 HA SER 36 HA SER 36 12.166 -3.755 5.090 255 HG SER 36 HG SER 36 12.523 -5.830 2.147 256 HB2 SER 36 HB2 SER 36 13.527 -5.795 4.796 257 HB3 SER 36 HB1 SER 36 11.857 -6.018 4.277 258 H LYS 37 HN LYS 37 14.071 -3.758 2.025 259 HA LYS 37 HA LYS 37 15.811 -1.752 3.182 260 HB2 LYS 37 HB2 LYS 37 16.841 -4.511 2.541 261 HB3 LYS 37 HB1 LYS 37 17.875 -3.116 2.787 262 HG2 LYS 37 HG2 LYS 37 15.978 -4.239 4.818 263 HG3 LYS 37 HG1 LYS 37 17.716 -4.519 4.780 264 HD2 LYS 37 HD2 LYS 37 18.135 -2.154 5.101 265 HD3 LYS 37 HD1 LYS 37 16.405 -1.814 5.038 266 HE2 LYS 37 HE2 LYS 37 16.086 -3.205 7.046 267 HE3 LYS 37 HE1 LYS 37 17.828 -3.469 7.119 268 HZ1 LYS 37 HZ3 LYS 37 16.465 -0.839 7.339 269 HZ2 LYS 37 HZ1 LYS 37 18.137 -1.089 7.407 270 HZ3 LYS 37 HZ2 LYS 37 17.140 -1.711 8.622 271 H MET 38 HN MET 38 14.190 -1.540 0.948 272 HA MET 38 HA MET 38 16.042 -1.701 -1.315 273 HB2 MET 38 HB2 MET 38 13.098 -1.095 -1.381 274 HB3 MET 38 HB1 MET 38 14.141 -1.572 -2.707 275 HG2 MET 38 HG2 MET 38 13.799 -3.356 -0.360 276 HG3 MET 38 HG1 MET 38 12.580 -3.316 -1.625 277 HE1 MET 38 HE3 MET 38 14.666 -5.905 -0.662 278 HE2 MET 38 HE1 MET 38 14.553 -6.650 -2.256 279 HE3 MET 38 HE2 MET 38 13.129 -5.908 -1.524 280 H SER 39 HN SER 39 15.837 0.135 -2.957 281 HA SER 39 HA SER 39 16.335 2.610 -1.626 282 HG SER 39 HG SER 39 18.298 1.423 -4.382 283 HB2 SER 39 HB2 SER 39 16.224 1.887 -4.564 284 HB3 SER 39 HB1 SER 39 16.828 3.414 -3.911 285 H ALA 40 HN ALA 40 15.355 4.641 -2.523 286 HA ALA 40 HA ALA 40 12.550 4.646 -2.147 287 HB1 ALA 40 HB3 ALA 40 14.224 6.802 -3.427 288 HB2 ALA 40 HB1 ALA 40 14.040 6.576 -1.688 289 HB3 ALA 40 HB2 ALA 40 12.639 6.988 -2.677 290 H SER 41 HN SER 41 14.574 4.823 -5.056 291 HA SER 41 HA SER 41 12.771 5.403 -6.987 292 HG SER 41 HG SER 41 16.069 3.377 -6.749 293 HB2 SER 41 HB2 SER 41 14.203 4.122 -8.540 294 HB3 SER 41 HB1 SER 41 15.146 5.122 -7.436 295 H GLN 42 HN GLN 42 13.508 2.053 -5.920 296 HA GLN 42 HA GLN 42 11.616 0.883 -7.613 297 HB2 GLN 42 HB2 GLN 42 12.112 -1.105 -6.674 298 HB3 GLN 42 HB1 GLN 42 13.471 -0.205 -6.013 299 HG2 GLN 42 HG2 GLN 42 12.366 0.026 -3.940 300 HG3 GLN 42 HG1 GLN 42 10.864 -0.629 -4.568 301 HE21 GLN 42 HE21 GLN 42 10.609 -2.420 -3.360 302 HE22 GLN 42 HE22 GLN 42 11.737 -3.724 -3.305 303 H VAL 43 HN VAL 43 11.270 2.567 -4.680 304 HA VAL 43 HA VAL 43 8.832 1.500 -3.795 305 HB VAL 43 HB VAL 43 9.584 4.393 -3.447 306 HG11 VAL 43 HG11 VAL 43 8.297 2.652 -1.406 307 HG12 VAL 43 HG12 VAL 43 7.337 3.279 -2.746 308 HG13 VAL 43 HG13 VAL 43 8.157 4.395 -1.649 309 HG21 VAL 43 HG23 VAL 43 10.773 3.669 -1.391 310 HG22 VAL 43 HG21 VAL 43 11.554 3.142 -2.872 311 HG23 VAL 43 HG22 VAL 43 10.610 2.000 -1.931 312 H LYS 44 HN LYS 44 9.618 4.025 -6.120 313 HA LYS 44 HA LYS 44 7.062 5.039 -6.551 314 HB2 LYS 44 HB2 LYS 44 9.430 4.703 -8.393 315 HB3 LYS 44 HB1 LYS 44 7.941 5.473 -8.922 316 HG2 LYS 44 HG2 LYS 44 8.342 7.362 -7.750 317 HG3 LYS 44 HG1 LYS 44 9.125 6.501 -6.425 318 HD2 LYS 44 HD2 LYS 44 10.618 8.010 -7.792 319 HD3 LYS 44 HD1 LYS 44 11.170 6.346 -7.609 320 HE2 LYS 44 HE2 LYS 44 10.335 5.799 -9.820 321 HE3 LYS 44 HE1 LYS 44 9.693 7.431 -10.005 322 HZ1 LYS 44 HZ3 LYS 44 11.950 8.291 -9.882 323 HZ2 LYS 44 HZ1 LYS 44 11.804 7.178 -11.148 324 HZ3 LYS 44 HZ2 LYS 44 12.563 6.724 -9.706 325 H ASP 45 HN ASP 45 8.726 2.289 -8.010 326 HA ASP 45 HA ASP 45 6.582 1.535 -9.713 327 HB2 ASP 45 HB2 ASP 45 9.255 0.618 -9.087 328 HB3 ASP 45 HB1 ASP 45 8.141 -0.736 -9.178 329 H ILE 46 HN ILE 46 7.792 0.446 -6.575 330 HA ILE 46 HA ILE 46 6.027 -1.634 -6.115 331 HB ILE 46 HB ILE 46 7.728 0.126 -4.459 332 HG12 ILE 46 HG12 ILE 46 8.803 -1.920 -3.895 333 HG13 ILE 46 HG11 ILE 46 7.464 -2.858 -4.522 334 HG21 ILE 46 HG21 ILE 46 5.498 -1.511 -3.320 335 HG22 ILE 46 HG22 ILE 46 5.998 0.133 -2.914 336 HG23 ILE 46 HG23 ILE 46 6.989 -1.238 -2.415 337 HD11 ILE 46 HD13 ILE 46 8.043 -1.852 -6.787 338 HD12 ILE 46 HD11 ILE 46 9.143 -3.054 -6.122 339 HD13 ILE 46 HD12 ILE 46 9.553 -1.345 -6.033 340 H PHE 47 HN PHE 47 5.817 1.709 -4.877 341 HA PHE 47 HA PHE 47 3.433 1.796 -3.670 342 HD1 PHE 47 HD2 PHE 47 2.975 3.262 -2.276 343 HD2 PHE 47 HD1 PHE 47 2.992 5.804 -5.675 344 HE1 PHE 47 HE2 PHE 47 1.350 4.734 -1.175 345 HE2 PHE 47 HE1 PHE 47 1.359 7.286 -4.573 346 HZ PHE 47 HZ PHE 47 0.544 6.738 -2.327 347 HB2 PHE 47 HB2 PHE 47 5.028 3.682 -4.133 348 HB3 PHE 47 HB1 PHE 47 4.248 3.878 -5.696 349 H ARG 48 HN ARG 48 3.912 1.537 -7.115 350 HA ARG 48 HA ARG 48 1.409 2.224 -8.054 351 HE ARG 48 HE ARG 48 1.287 2.642 -10.579 352 HB2 ARG 48 HB2 ARG 48 3.181 0.025 -9.113 353 HB3 ARG 48 HB1 ARG 48 1.903 0.851 -10.000 354 HG2 ARG 48 HG2 ARG 48 4.482 2.015 -8.996 355 HG3 ARG 48 HG1 ARG 48 3.984 1.787 -10.673 356 HD2 ARG 48 HD2 ARG 48 2.760 3.691 -8.656 357 HD3 ARG 48 HD1 ARG 48 3.747 4.109 -10.063 358 HH11 ARG 48 HH11 ARG 48 2.915 5.739 -10.533 359 HH12 ARG 48 HH12 ARG 48 1.774 6.485 -11.596 360 HH21 ARG 48 HH21 ARG 48 -0.206 3.635 -11.972 361 HH22 ARG 48 HH22 ARG 48 0.005 5.299 -12.409 362 H PHE 49 HN PHE 49 2.319 -0.528 -6.178 363 HA PHE 49 HA PHE 49 0.419 -2.422 -6.839 364 HD1 PHE 49 HD2 PHE 49 1.091 -4.917 -5.764 365 HD2 PHE 49 HD1 PHE 49 -0.490 -2.412 -2.706 366 HE1 PHE 49 HE2 PHE 49 -0.212 -6.813 -4.892 367 HE2 PHE 49 HE1 PHE 49 -1.798 -4.309 -1.826 368 HZ PHE 49 HZ PHE 49 -1.657 -6.509 -2.923 369 HB2 PHE 49 HB2 PHE 49 2.160 -2.762 -5.115 370 HB3 PHE 49 HB1 PHE 49 1.314 -1.661 -4.044 371 H ILE 50 HN ILE 50 0.084 -0.002 -4.264 372 HA ILE 50 HA ILE 50 -2.753 -0.253 -4.217 373 HB ILE 50 HB ILE 50 -2.640 1.801 -2.718 374 HG12 ILE 50 HG12 ILE 50 0.339 1.299 -2.982 375 HG13 ILE 50 HG11 ILE 50 -0.521 2.775 -3.405 376 HG21 ILE 50 HG21 ILE 50 -1.868 -0.908 -2.260 377 HG22 ILE 50 HG22 ILE 50 -2.824 0.198 -1.274 378 HG23 ILE 50 HG23 ILE 50 -1.069 0.175 -1.117 379 HD11 ILE 50 HD13 ILE 50 -0.255 1.634 -0.630 380 HD12 ILE 50 HD11 ILE 50 -1.050 3.146 -1.063 381 HD13 ILE 50 HD12 ILE 50 0.696 2.972 -1.274 382 H ASP 51 HN ASP 51 -2.342 3.054 -4.049 383 HA ASP 51 HA ASP 51 -2.949 3.327 -6.908 384 HB2 ASP 51 HB2 ASP 51 -4.120 4.693 -4.488 385 HB3 ASP 51 HB1 ASP 51 -4.168 5.468 -6.074 386 H ASN 52 HN ASN 52 -2.099 5.213 -7.984 387 HA ASN 52 HA ASN 52 0.048 6.543 -6.477 388 HB2 ASN 52 HB2 ASN 52 0.908 4.966 -8.195 389 HB3 ASN 52 HB1 ASN 52 0.045 5.870 -9.426 390 HD21 ASN 52 HD21 ASN 52 0.831 7.762 -10.127 391 HD22 ASN 52 HD22 ASN 52 2.378 8.396 -9.693 392 H ASP 53 HN ASP 53 -2.421 6.814 -8.968 393 HA ASP 53 HA ASP 53 -2.465 9.706 -8.514 394 HB2 ASP 53 HB2 ASP 53 -2.865 10.047 -10.950 395 HB3 ASP 53 HB1 ASP 53 -1.252 9.443 -10.580 396 H GLN 54 HN GLN 54 -4.418 10.512 -8.240 397 HA GLN 54 HA GLN 54 -6.776 9.264 -9.315 398 HB2 GLN 54 HB2 GLN 54 -6.687 9.835 -6.370 399 HB3 GLN 54 HB1 GLN 54 -7.850 8.879 -7.270 400 HG2 GLN 54 HG2 GLN 54 -5.920 7.309 -7.771 401 HG3 GLN 54 HG1 GLN 54 -5.057 8.169 -6.512 402 HE21 GLN 54 HE21 GLN 54 -5.769 7.996 -4.367 403 HE22 GLN 54 HE22 GLN 54 -6.775 6.692 -3.856 404 H SER 55 HN SER 55 -5.667 11.724 -6.979 405 HA SER 55 HA SER 55 -6.880 13.814 -8.588 406 HG SER 55 HG SER 55 -9.109 13.129 -8.121 407 HB2 SER 55 HB2 SER 55 -7.665 13.373 -5.693 408 HB3 SER 55 HB1 SER 55 -8.145 14.746 -6.691 409 H GLY 56 HN GLY 56 -4.196 13.234 -8.145 410 HA2 GLY 56 HA2 GLY 56 -2.405 14.777 -7.850 411 HA3 GLY 56 HA1 GLY 56 -3.390 15.634 -6.666 412 H TYR 57 HN TYR 57 -4.134 13.038 -5.436 413 HA TYR 57 HA TYR 57 -1.778 11.859 -4.311 414 HD1 TYR 57 HD1 TYR 57 -4.899 14.357 -2.635 415 HD2 TYR 57 HD2 TYR 57 -0.865 15.333 -3.478 416 HE1 TYR 57 HE1 TYR 57 -5.560 16.706 -3.020 417 HE2 TYR 57 HE2 TYR 57 -1.491 17.685 -3.851 418 HH TYR 57 HH TYR 57 -4.519 18.938 -2.968 419 HB2 TYR 57 HB2 TYR 57 -3.136 12.893 -2.011 420 HB3 TYR 57 HB1 TYR 57 -1.481 13.197 -2.496 421 H LEU 58 HN LEU 58 -2.511 10.414 -2.443 422 HA LEU 58 HA LEU 58 -5.177 9.360 -3.139 423 HG LEU 58 HG LEU 58 -1.983 8.428 -3.527 424 HB2 LEU 58 HB2 LEU 58 -3.208 7.879 -1.441 425 HB3 LEU 58 HB1 LEU 58 -4.516 7.243 -2.417 426 HD11 LEU 58 HD11 LEU 58 -2.165 6.097 -2.181 427 HD12 LEU 58 HD12 LEU 58 -1.028 6.408 -3.486 428 HD13 LEU 58 HD13 LEU 58 -2.538 5.570 -3.821 429 HD21 LEU 58 HD23 LEU 58 -2.702 7.408 -5.618 430 HD22 LEU 58 HD21 LEU 58 -3.833 8.637 -5.055 431 HD23 LEU 58 HD22 LEU 58 -4.208 6.934 -4.848 432 H ASP 59 HN ASP 59 -6.542 8.638 -1.314 433 HA ASP 59 HA ASP 59 -5.789 9.688 1.288 434 HB2 ASP 59 HB2 ASP 59 -6.797 11.602 0.082 435 HB3 ASP 59 HB1 ASP 59 -8.277 10.662 -0.122 436 H GLY 60 HN GLY 60 -7.398 9.186 2.964 437 HA2 GLY 60 HA2 GLY 60 -7.778 6.513 3.263 438 HA3 GLY 60 HA1 GLY 60 -8.792 7.708 4.055 439 H ASP 61 HN ASP 61 -9.933 8.662 1.505 440 HA ASP 61 HA ASP 61 -12.106 6.759 1.414 441 HB2 ASP 61 HB2 ASP 61 -11.818 9.087 -0.457 442 HB3 ASP 61 HB1 ASP 61 -13.288 8.363 0.184 443 H GLU 62 HN GLU 62 -9.651 7.996 -0.747 444 HA GLU 62 HA GLU 62 -10.433 6.396 -2.973 445 HB2 GLU 62 HB2 GLU 62 -7.847 7.878 -2.572 446 HB3 GLU 62 HB1 GLU 62 -8.580 7.391 -4.098 447 HG2 GLU 62 HG2 GLU 62 -9.928 9.276 -2.212 448 HG3 GLU 62 HG1 GLU 62 -8.780 9.829 -3.429 449 H LEU 63 HN LEU 63 -8.144 6.079 -0.358 450 HA LEU 63 HA LEU 63 -6.317 4.268 -1.262 451 HG LEU 63 HG LEU 63 -6.438 6.250 1.280 452 HB2 LEU 63 HB2 LEU 63 -7.751 4.302 1.397 453 HB3 LEU 63 HB1 LEU 63 -6.387 3.263 1.066 454 HD11 LEU 63 HD11 LEU 63 -4.259 4.902 2.551 455 HD12 LEU 63 HD12 LEU 63 -5.798 4.205 3.054 456 HD13 LEU 63 HD13 LEU 63 -5.505 5.932 3.251 457 HD21 LEU 63 HD23 LEU 63 -4.306 4.539 0.034 458 HD22 LEU 63 HD21 LEU 63 -4.041 6.191 0.593 459 HD23 LEU 63 HD22 LEU 63 -5.191 5.874 -0.709 460 H LYS 64 HN LYS 64 -9.632 3.490 -0.186 461 HA LYS 64 HA LYS 64 -9.638 0.823 -0.450 462 HB2 LYS 64 HB2 LYS 64 -11.875 2.579 -1.428 463 HB3 LYS 64 HB1 LYS 64 -12.000 0.962 -0.779 464 HG2 LYS 64 HG2 LYS 64 -11.315 1.784 1.419 465 HG3 LYS 64 HG1 LYS 64 -11.208 3.415 0.759 466 HD2 LYS 64 HD2 LYS 64 -13.750 2.072 0.231 467 HD3 LYS 64 HD1 LYS 64 -13.422 2.358 1.943 468 HE2 LYS 64 HE2 LYS 64 -12.962 4.735 1.392 469 HE3 LYS 64 HE1 LYS 64 -13.435 4.400 -0.273 470 HZ1 LYS 64 HZ3 LYS 64 -15.635 3.794 0.502 471 HZ2 LYS 64 HZ1 LYS 64 -15.252 5.364 1.003 472 HZ3 LYS 64 HZ2 LYS 64 -15.184 4.084 2.107 473 H TYR 65 HN TYR 65 -9.340 3.083 -3.039 474 HA TYR 65 HA TYR 65 -10.325 1.326 -5.067 475 HD1 TYR 65 HD1 TYR 65 -11.705 2.660 -4.156 476 HD2 TYR 65 HD2 TYR 65 -9.784 5.832 -6.242 477 HE1 TYR 65 HE1 TYR 65 -13.523 4.191 -3.491 478 HE2 TYR 65 HE2 TYR 65 -11.604 7.359 -5.610 479 HH TYR 65 HH TYR 65 -13.958 7.239 -4.919 480 HB2 TYR 65 HB2 TYR 65 -8.550 3.729 -5.471 481 HB3 TYR 65 HB1 TYR 65 -9.583 2.957 -6.664 482 H PHE 66 HN PHE 66 -7.345 1.526 -3.385 483 HA PHE 66 HA PHE 66 -5.455 0.850 -5.252 484 HD1 PHE 66 HD2 PHE 66 -3.882 -1.815 -4.459 485 HD2 PHE 66 HD1 PHE 66 -5.676 -0.782 -0.748 486 HE1 PHE 66 HE2 PHE 66 -3.367 -4.053 -3.589 487 HE2 PHE 66 HE1 PHE 66 -5.156 -3.007 0.137 488 HZ PHE 66 HZ PHE 66 -3.998 -4.655 -1.285 489 HB2 PHE 66 HB2 PHE 66 -4.201 0.741 -3.365 490 HB3 PHE 66 HB1 PHE 66 -5.665 0.777 -2.411 491 H LEU 67 HN LEU 67 -7.459 -1.474 -3.436 492 HA LEU 67 HA LEU 67 -6.685 -3.753 -4.859 493 HG LEU 67 HG LEU 67 -7.047 -3.597 -2.037 494 HB2 LEU 67 HB2 LEU 67 -9.121 -2.990 -3.277 495 HB3 LEU 67 HB1 LEU 67 -9.048 -4.537 -4.093 496 HD11 LEU 67 HD11 LEU 67 -9.336 -5.533 -1.730 497 HD12 LEU 67 HD12 LEU 67 -9.284 -3.893 -1.081 498 HD13 LEU 67 HD13 LEU 67 -8.146 -5.109 -0.498 499 HD21 LEU 67 HD23 LEU 67 -7.502 -6.285 -3.326 500 HD22 LEU 67 HD21 LEU 67 -6.364 -5.954 -2.020 501 HD23 LEU 67 HD22 LEU 67 -6.132 -5.208 -3.601 502 H GLN 68 HN GLN 68 -9.139 -1.335 -5.397 503 HA GLN 68 HA GLN 68 -10.575 -2.625 -7.428 504 HB2 GLN 68 HB2 GLN 68 -10.244 0.245 -6.626 505 HB3 GLN 68 HB1 GLN 68 -11.205 -0.180 -8.019 506 HG2 GLN 68 HG2 GLN 68 -12.510 -1.720 -6.527 507 HG3 GLN 68 HG1 GLN 68 -11.646 -0.995 -5.182 508 HE21 GLN 68 HE21 GLN 68 -13.545 -0.187 -4.283 509 HE22 GLN 68 HE22 GLN 68 -14.373 1.170 -4.961 510 H LYS 69 HN LYS 69 -7.729 -0.486 -7.546 511 HA LYS 69 HA LYS 69 -7.482 -0.327 -10.277 512 HB2 LYS 69 HB2 LYS 69 -5.174 -0.714 -8.379 513 HB3 LYS 69 HB1 LYS 69 -5.155 0.155 -9.909 514 HG2 LYS 69 HG2 LYS 69 -6.341 0.969 -7.291 515 HG3 LYS 69 HG1 LYS 69 -5.158 1.820 -8.275 516 HD2 LYS 69 HD2 LYS 69 -8.081 1.433 -8.845 517 HD3 LYS 69 HD1 LYS 69 -7.279 2.940 -8.421 518 HE2 LYS 69 HE2 LYS 69 -6.755 1.334 -10.920 519 HE3 LYS 69 HE1 LYS 69 -7.747 2.788 -10.832 520 HZ1 LYS 69 HZ3 LYS 69 -4.846 2.622 -10.220 521 HZ2 LYS 69 HZ1 LYS 69 -5.791 4.020 -10.103 522 HZ3 LYS 69 HZ2 LYS 69 -5.530 3.300 -11.610 523 H PHE 70 HN PHE 70 -6.363 -2.810 -8.063 524 HA PHE 70 HA PHE 70 -5.794 -4.593 -10.336 525 HD1 PHE 70 HD1 PHE 70 -5.143 -5.337 -6.041 526 HD2 PHE 70 HD2 PHE 70 -3.487 -7.042 -9.569 527 HE1 PHE 70 HE1 PHE 70 -4.845 -7.467 -4.860 528 HE2 PHE 70 HE2 PHE 70 -3.183 -9.184 -8.395 529 HZ PHE 70 HZ PHE 70 -3.863 -9.400 -6.036 530 HB2 PHE 70 HB2 PHE 70 -3.769 -4.669 -9.350 531 HB3 PHE 70 HB1 PHE 70 -4.368 -3.946 -7.872 532 H GLN 71 HN GLN 71 -8.401 -4.385 -9.718 533 HA GLN 71 HA GLN 71 -9.266 -6.960 -9.220 534 HB2 GLN 71 HB2 GLN 71 -8.429 -6.456 -6.895 535 HB3 GLN 71 HB1 GLN 71 -9.748 -5.307 -6.772 536 HG2 GLN 71 HG2 GLN 71 -11.312 -7.196 -7.299 537 HG3 GLN 71 HG1 GLN 71 -9.936 -8.280 -7.110 538 HE21 GLN 71 HE21 GLN 71 -10.612 -5.383 -5.213 539 HE22 GLN 71 HE22 GLN 71 -10.842 -6.200 -3.730 540 H SER 72 HN SER 72 -9.984 -3.629 -9.487 541 HA SER 72 HA SER 72 -11.984 -2.447 -9.442 542 HG SER 72 HG SER 72 -11.304 -1.585 -11.670 543 HB2 SER 72 HB2 SER 72 -12.095 -4.302 -11.820 544 HB3 SER 72 HB1 SER 72 -13.124 -2.886 -11.620 545 H ASP 73 HN ASP 73 -12.443 -4.091 -7.517 546 HA ASP 73 HA ASP 73 -15.275 -4.580 -7.692 547 HB2 ASP 73 HB2 ASP 73 -13.298 -6.809 -7.239 548 HB3 ASP 73 HB1 ASP 73 -14.968 -6.911 -6.695 549 H ALA 74 HN ALA 74 -12.306 -4.718 -5.833 550 HA ALA 74 HA ALA 74 -12.222 -4.988 -3.446 551 HB1 ALA 74 HB3 ALA 74 -11.261 -3.003 -2.875 552 HB2 ALA 74 HB1 ALA 74 -12.427 -2.053 -3.792 553 HB3 ALA 74 HB2 ALA 74 -11.170 -2.965 -4.636 554 H ARG 75 HN ARG 75 -13.180 -5.169 -1.629 555 HA ARG 75 HA ARG 75 -15.936 -4.675 -1.312 556 HE ARG 75 HE ARG 75 -10.797 -5.686 0.981 557 HB2 ARG 75 HB2 ARG 75 -15.474 -5.309 1.087 558 HB3 ARG 75 HB1 ARG 75 -14.968 -6.489 -0.114 559 HG2 ARG 75 HG2 ARG 75 -12.865 -4.588 0.536 560 HG3 ARG 75 HG1 ARG 75 -13.429 -5.496 1.941 561 HD2 ARG 75 HD2 ARG 75 -12.941 -7.570 0.907 562 HD3 ARG 75 HD1 ARG 75 -12.695 -6.812 -0.663 563 HH11 ARG 75 HH11 ARG 75 -11.676 -8.917 -0.004 564 HH12 ARG 75 HH12 ARG 75 -10.060 -9.530 0.100 565 HH21 ARG 75 HH21 ARG 75 -8.655 -6.499 1.108 566 HH22 ARG 75 HH22 ARG 75 -8.348 -8.160 0.733 567 H GLU 76 HN GLU 76 -13.384 -2.519 -1.179 568 HA GLU 76 HA GLU 76 -13.488 -0.267 -0.833 569 HB2 GLU 76 HB2 GLU 76 -15.790 -0.714 1.074 570 HB3 GLU 76 HB1 GLU 76 -15.200 0.817 0.455 571 HG2 GLU 76 HG2 GLU 76 -15.905 0.269 -1.766 572 HG3 GLU 76 HG1 GLU 76 -16.361 -1.352 -1.261 573 H LEU 77 HN LEU 77 -11.897 -2.070 0.227 574 HA LEU 77 HA LEU 77 -10.668 -2.774 2.047 575 HG LEU 77 HG LEU 77 -9.510 -1.214 -0.163 576 HB2 LEU 77 HB2 LEU 77 -10.322 0.156 1.650 577 HB3 LEU 77 HB1 LEU 77 -9.328 -0.716 2.797 578 HD11 LEU 77 HD11 LEU 77 -7.025 -0.547 1.325 579 HD12 LEU 77 HD12 LEU 77 -8.166 0.725 0.895 580 HD13 LEU 77 HD13 LEU 77 -7.447 -0.265 -0.366 581 HD21 LEU 77 HD23 LEU 77 -7.589 -2.819 0.407 582 HD22 LEU 77 HD21 LEU 77 -9.249 -3.336 0.702 583 HD23 LEU 77 HD22 LEU 77 -8.262 -2.776 2.032 584 H THR 78 HN THR 78 -13.327 -2.452 2.964 585 HA THR 78 HA THR 78 -14.596 -1.944 4.839 586 HB THR 78 HB THR 78 -13.890 -3.245 6.703 587 HG1 THR 78 HG1 THR 78 -11.744 -3.794 7.042 588 HG21 THR 78 HG23 THR 78 -13.968 -5.202 5.615 589 HG22 THR 78 HG21 THR 78 -12.433 -4.905 4.794 590 HG23 THR 78 HG22 THR 78 -13.932 -4.251 4.131 591 H GLU 79 HN GLU 79 -13.946 -1.478 7.457 592 HA GLU 79 HA GLU 79 -13.366 1.304 7.441 593 HB2 GLU 79 HB2 GLU 79 -14.674 -0.410 9.136 594 HB3 GLU 79 HB1 GLU 79 -13.205 -0.041 10.028 595 HG2 GLU 79 HG2 GLU 79 -14.882 2.117 8.812 596 HG3 GLU 79 HG1 GLU 79 -15.243 1.436 10.393 597 H SER 80 HN SER 80 -11.661 -1.549 8.691 598 HA SER 80 HA SER 80 -9.369 0.031 9.508 599 HG SER 80 HG SER 80 -8.955 -1.811 12.047 600 HB2 SER 80 HB2 SER 80 -10.557 -2.018 10.670 601 HB3 SER 80 HB1 SER 80 -9.323 -2.895 9.782 602 H GLU 81 HN GLU 81 -10.198 -1.836 6.741 603 HA GLU 81 HA GLU 81 -7.674 -3.034 6.211 604 HB2 GLU 81 HB2 GLU 81 -10.078 -3.347 5.097 605 HB3 GLU 81 HB1 GLU 81 -9.358 -2.272 3.913 606 HG2 GLU 81 HG2 GLU 81 -7.560 -3.785 3.554 607 HG3 GLU 81 HG1 GLU 81 -8.182 -4.869 4.795 608 H THR 82 HN THR 82 -9.001 0.110 5.451 609 HA THR 82 HA THR 82 -6.888 0.900 3.686 610 HB THR 82 HB THR 82 -7.690 3.168 3.941 611 HG1 THR 82 HG1 THR 82 -9.727 2.291 5.692 612 HG21 THR 82 HG23 THR 82 -9.899 1.133 3.648 613 HG22 THR 82 HG21 THR 82 -8.868 1.766 2.365 614 HG23 THR 82 HG22 THR 82 -10.027 2.826 3.170 615 H LYS 83 HN LYS 83 -6.846 0.210 6.943 616 HA LYS 83 HA LYS 83 -5.423 2.280 8.132 617 HB2 LYS 83 HB2 LYS 83 -6.418 0.456 9.415 618 HB3 LYS 83 HB1 LYS 83 -5.315 -0.692 8.673 619 HG2 LYS 83 HG2 LYS 83 -3.423 0.516 9.714 620 HG3 LYS 83 HG1 LYS 83 -4.588 1.557 10.536 621 HD2 LYS 83 HD2 LYS 83 -5.558 -0.409 11.635 622 HD3 LYS 83 HD1 LYS 83 -4.381 -1.441 10.819 623 HE2 LYS 83 HE2 LYS 83 -3.772 0.755 12.794 624 HE3 LYS 83 HE1 LYS 83 -3.680 -0.979 13.100 625 HZ1 LYS 83 HZ3 LYS 83 -1.937 -1.144 11.433 626 HZ2 LYS 83 HZ1 LYS 83 -1.501 -0.049 12.648 627 HZ3 LYS 83 HZ2 LYS 83 -2.023 0.520 11.143 628 H SER 84 HN SER 84 -4.281 -0.568 6.297 629 HA SER 84 HA SER 84 -1.563 -0.294 6.692 630 HG SER 84 HG SER 84 -1.832 -3.207 4.994 631 HB2 SER 84 HB2 SER 84 -3.339 -1.454 4.609 632 HB3 SER 84 HB1 SER 84 -1.683 -1.141 4.141 633 H LEU 85 HN LEU 85 -3.529 0.874 4.013 634 HA LEU 85 HA LEU 85 -1.589 2.455 2.817 635 HG LEU 85 HG LEU 85 -4.103 0.510 2.081 636 HB2 LEU 85 HB2 LEU 85 -4.583 2.726 2.762 637 HB3 LEU 85 HB1 LEU 85 -3.477 3.389 1.588 638 HD11 LEU 85 HD11 LEU 85 -4.473 2.423 -0.195 639 HD12 LEU 85 HD12 LEU 85 -5.681 1.435 0.626 640 HD13 LEU 85 HD13 LEU 85 -4.498 0.679 -0.438 641 HD21 LEU 85 HD23 LEU 85 -1.648 0.856 1.812 642 HD22 LEU 85 HD21 LEU 85 -1.976 1.566 0.233 643 HD23 LEU 85 HD22 LEU 85 -2.379 -0.122 0.546 644 H MET 86 HN MET 86 -4.130 3.303 5.123 645 HA MET 86 HA MET 86 -3.661 6.062 5.239 646 HB2 MET 86 HB2 MET 86 -4.670 4.154 7.357 647 HB3 MET 86 HB1 MET 86 -4.652 5.900 7.560 648 HG2 MET 86 HG2 MET 86 -5.961 4.868 5.125 649 HG3 MET 86 HG1 MET 86 -6.768 4.543 6.658 650 HE1 MET 86 HE3 MET 86 -4.517 7.717 6.264 651 HE2 MET 86 HE1 MET 86 -5.603 8.840 5.445 652 HE3 MET 86 HE2 MET 86 -5.014 7.409 4.601 653 H ASP 87 HN ASP 87 -2.383 3.448 7.254 654 HA ASP 87 HA ASP 87 -0.555 5.102 8.712 655 HB2 ASP 87 HB2 ASP 87 -0.854 2.117 8.446 656 HB3 ASP 87 HB1 ASP 87 0.304 2.890 9.526 657 H ALA 88 HN ALA 88 -0.502 4.101 5.572 658 HA ALA 88 HA ALA 88 2.108 3.044 5.269 659 HB1 ALA 88 HB3 ALA 88 1.642 2.935 3.031 660 HB2 ALA 88 HB1 ALA 88 0.645 4.392 3.058 661 HB3 ALA 88 HB2 ALA 88 0.036 2.894 3.754 662 H ALA 89 HN ALA 89 0.889 6.331 5.395 663 HA ALA 89 HA ALA 89 3.598 7.306 5.320 664 HB1 ALA 89 HB3 ALA 89 3.179 7.101 2.940 665 HB2 ALA 89 HB1 ALA 89 3.319 8.796 3.399 666 HB3 ALA 89 HB2 ALA 89 1.729 8.096 3.079 667 H ASP 90 HN ASP 90 0.684 9.056 4.335 668 HA ASP 90 HA ASP 90 1.167 10.899 6.548 669 HB2 ASP 90 HB2 ASP 90 0.524 11.413 3.926 670 HB3 ASP 90 HB1 ASP 90 -1.032 11.586 4.738 671 H ASN 91 HN ASN 91 0.474 9.475 8.113 672 HA ASN 91 HA ASN 91 -2.358 8.713 8.096 673 HB2 ASN 91 HB2 ASN 91 -1.277 7.522 10.346 674 HB3 ASN 91 HB1 ASN 91 -1.555 6.745 8.795 675 HD21 ASN 91 HD21 ASN 91 0.197 6.507 7.342 676 HD22 ASN 91 HD22 ASN 91 1.830 6.567 7.907 677 H ASP 92 HN ASP 92 0.074 10.190 10.213 678 HA ASP 92 HA ASP 92 -2.126 11.377 11.764 679 HB2 ASP 92 HB2 ASP 92 -0.640 9.868 13.037 680 HB3 ASP 92 HB1 ASP 92 0.731 10.895 12.628 681 H GLY 93 HN GLY 93 -0.909 12.463 9.236 682 HA2 GLY 93 HA2 GLY 93 -0.267 15.097 10.344 683 HA3 GLY 93 HA1 GLY 93 0.858 14.385 9.202 684 H ASP 94 HN ASP 94 -2.259 13.444 8.383 685 HA ASP 94 HA ASP 94 -3.358 15.610 7.105 686 HB2 ASP 94 HB2 ASP 94 -1.196 15.600 5.796 687 HB3 ASP 94 HB1 ASP 94 -1.688 14.048 5.130 688 H GLY 95 HN GLY 95 -2.526 12.401 5.814 689 HA2 GLY 95 HA2 GLY 95 -4.204 10.591 6.295 690 HA3 GLY 95 HA1 GLY 95 -5.411 11.769 5.802 691 H LYS 96 HN LYS 96 -2.740 12.236 3.871 692 HA LYS 96 HA LYS 96 -3.953 10.622 1.756 693 HB2 LYS 96 HB2 LYS 96 -3.830 12.552 0.615 694 HB3 LYS 96 HB1 LYS 96 -2.872 13.298 1.876 695 HG2 LYS 96 HG2 LYS 96 -1.689 11.561 -0.283 696 HG3 LYS 96 HG1 LYS 96 -1.893 13.297 -0.443 697 HD2 LYS 96 HD2 LYS 96 -0.073 11.798 1.412 698 HD3 LYS 96 HD1 LYS 96 0.320 13.035 0.223 699 HE2 LYS 96 HE2 LYS 96 -1.120 14.604 1.657 700 HE3 LYS 96 HE1 LYS 96 -0.964 13.374 2.911 701 HZ1 LYS 96 HZ3 LYS 96 1.428 13.587 2.789 702 HZ2 LYS 96 HZ1 LYS 96 0.731 15.096 3.102 703 HZ3 LYS 96 HZ2 LYS 96 1.301 14.733 1.552 704 H ILE 97 HN ILE 97 -2.645 9.428 0.292 705 HA ILE 97 HA ILE 97 0.055 8.811 1.284 706 HB ILE 97 HB ILE 97 -1.760 6.814 -0.040 707 HG12 ILE 97 HG12 ILE 97 -2.694 7.413 2.147 708 HG13 ILE 97 HG11 ILE 97 -2.025 5.787 2.150 709 HG21 ILE 97 HG21 ILE 97 -0.037 5.247 0.976 710 HG22 ILE 97 HG22 ILE 97 0.944 6.690 1.260 711 HG23 ILE 97 HG23 ILE 97 0.486 6.244 -0.381 712 HD11 ILE 97 HD13 ILE 97 -0.034 6.597 3.287 713 HD12 ILE 97 HD11 ILE 97 -1.492 6.973 4.203 714 HD13 ILE 97 HD12 ILE 97 -0.689 8.231 3.268 715 H GLY 98 HN GLY 98 1.085 10.059 -0.292 716 HA2 GLY 98 HA2 GLY 98 0.663 9.341 -3.070 717 HA3 GLY 98 HA1 GLY 98 1.565 10.736 -2.479 718 H ALA 99 HN ALA 99 2.706 9.208 -4.390 719 HA ALA 99 HA ALA 99 4.189 6.980 -3.559 720 HB1 ALA 99 HB3 ALA 99 4.251 7.371 -5.851 721 HB2 ALA 99 HB1 ALA 99 5.880 7.806 -5.334 722 HB3 ALA 99 HB2 ALA 99 4.686 9.067 -5.645 723 H ASP 100 HN ASP 100 5.261 10.395 -3.544 724 HA ASP 100 HA ASP 100 7.691 9.876 -2.246 725 HB2 ASP 100 HB2 ASP 100 5.993 12.391 -2.215 726 HB3 ASP 100 HB1 ASP 100 7.651 12.302 -1.628 727 H GLU 101 HN GLU 101 4.490 10.682 -0.918 728 HA GLU 101 HA GLU 101 5.219 10.820 1.784 729 HB2 GLU 101 HB2 GLU 101 2.755 10.471 0.232 730 HB3 GLU 101 HB1 GLU 101 2.682 9.714 1.809 731 HG2 GLU 101 HG2 GLU 101 1.892 12.174 1.424 732 HG3 GLU 101 HG1 GLU 101 2.706 11.713 2.904 733 H PHE 102 HN PHE 102 3.953 8.112 -0.120 734 HA PHE 102 HA PHE 102 4.219 6.053 1.701 735 HD1 PHE 102 HD1 PHE 102 6.464 4.253 -0.691 736 HD2 PHE 102 HD2 PHE 102 2.354 3.730 0.248 737 HE1 PHE 102 HE1 PHE 102 6.829 1.850 -0.437 738 HE2 PHE 102 HE2 PHE 102 2.712 1.307 0.497 739 HZ PHE 102 HZ PHE 102 4.962 0.362 0.153 740 HB2 PHE 102 HB2 PHE 102 3.129 5.809 -0.448 741 HB3 PHE 102 HB1 PHE 102 4.673 5.958 -1.289 742 H GLN 103 HN GLN 103 6.634 7.459 -0.461 743 HA GLN 103 HA GLN 103 8.768 5.710 0.090 744 HB2 GLN 103 HB2 GLN 103 8.632 8.567 -0.846 745 HB3 GLN 103 HB1 GLN 103 10.180 7.782 -0.572 746 HG2 GLN 103 HG2 GLN 103 9.442 6.041 -2.186 747 HG3 GLN 103 HG1 GLN 103 8.036 7.024 -2.497 748 HE21 GLN 103 HE21 GLN 103 8.663 7.109 -4.658 749 HE22 GLN 103 HE22 GLN 103 9.905 8.181 -5.182 750 H GLU 104 HN GLU 104 7.396 8.311 1.919 751 HA GLU 104 HA GLU 104 9.650 8.940 3.540 752 HB2 GLU 104 HB2 GLU 104 6.702 9.219 4.165 753 HB3 GLU 104 HB1 GLU 104 8.002 9.903 5.126 754 HG2 GLU 104 HG2 GLU 104 7.446 10.590 2.255 755 HG3 GLU 104 HG1 GLU 104 6.930 11.540 3.643 756 H MET 105 HN MET 105 7.054 6.599 3.770 757 HA MET 105 HA MET 105 7.518 5.690 6.373 758 HB2 MET 105 HB2 MET 105 5.700 5.162 4.435 759 HB3 MET 105 HB1 MET 105 6.627 3.671 4.432 760 HG2 MET 105 HG2 MET 105 5.471 4.885 6.919 761 HG3 MET 105 HG1 MET 105 4.597 3.732 5.918 762 HE1 MET 105 HE3 MET 105 5.152 3.306 9.029 763 HE2 MET 105 HE1 MET 105 5.621 1.606 9.059 764 HE3 MET 105 HE2 MET 105 4.284 2.134 8.037 765 H VAL 106 HN VAL 106 8.568 4.174 3.295 766 HA VAL 106 HA VAL 106 10.221 2.273 4.532 767 HB VAL 106 HB VAL 106 9.379 2.020 2.236 768 HG11 VAL 106 HG11 VAL 106 11.107 4.399 1.734 769 HG12 VAL 106 HG12 VAL 106 9.441 4.093 1.238 770 HG13 VAL 106 HG13 VAL 106 10.769 3.241 0.454 771 HG21 VAL 106 HG23 VAL 106 12.196 1.703 2.996 772 HG22 VAL 106 HG21 VAL 106 11.895 1.664 1.260 773 HG23 VAL 106 HG22 VAL 106 11.069 0.526 2.323 774 H HIS 107 HN HIS 107 10.753 5.538 3.452 775 HA HIS 107 HA HIS 107 13.614 5.436 3.667 776 HD1 HIS 107 HD1 HIS 107 14.697 7.716 1.299 777 HD2 HIS 107 HD2 HIS 107 13.827 9.163 5.095 778 HE1 HIS 107 HE1 HIS 107 16.549 9.326 1.845 779 HE2 HIS 107 HE2 HIS 107 16.057 10.110 4.187 780 HB2 HIS 107 HB2 HIS 107 12.459 6.968 2.111 781 HB3 HIS 107 HB1 HIS 107 11.784 7.837 3.485 782 H SER 108 HN SER 108 10.993 6.159 5.832 783 HA SER 108 HA SER 108 12.240 7.794 7.688 784 HG SER 108 HG SER 108 9.279 5.208 8.728 785 HB2 SER 108 HB2 SER 108 10.620 6.988 9.311 786 HB3 SER 108 HB1 SER 108 9.843 7.197 7.743 Start of MODEL 13 1 HA SER 1 HA SER 1 3.778 -6.147 -9.669 2 HG SER 1 HG SER 1 1.697 -4.978 -10.645 3 H1 SER 1 HT1 SER 1 2.119 -7.824 -7.880 4 H2 SER 1 HT2 SER 1 3.448 -8.350 -8.783 5 H3 SER 1 HT3 SER 1 2.052 -7.814 -9.572 6 HB2 SER 1 HB2 SER 1 1.448 -5.436 -7.869 7 HB3 SER 1 HB1 SER 1 2.468 -4.265 -8.704 8 H ILE 2 HN ILE 2 4.573 -4.226 -8.268 9 HA ILE 2 HA ILE 2 5.720 -3.366 -6.507 10 HB ILE 2 HB ILE 2 4.578 -5.712 -5.062 11 HG12 ILE 2 HG12 ILE 2 4.708 -2.941 -4.019 12 HG13 ILE 2 HG11 ILE 2 3.677 -3.244 -5.404 13 HG21 ILE 2 HG21 ILE 2 7.053 -4.264 -4.263 14 HG22 ILE 2 HG22 ILE 2 6.593 -5.944 -3.995 15 HG23 ILE 2 HG23 ILE 2 5.872 -4.666 -3.015 16 HD11 ILE 2 HD13 ILE 2 3.520 -4.521 -2.708 17 HD12 ILE 2 HD11 ILE 2 2.581 -5.049 -4.105 18 HD13 ILE 2 HD12 ILE 2 2.377 -3.425 -3.465 19 H THR 3 HN THR 3 6.309 -6.826 -7.078 20 HA THR 3 HA THR 3 8.948 -6.719 -6.137 21 HB THR 3 HB THR 3 8.032 -8.836 -6.038 22 HG1 THR 3 HG1 THR 3 9.379 -10.053 -7.570 23 HG21 THR 3 HG23 THR 3 6.748 -8.094 -8.470 24 HG22 THR 3 HG21 THR 3 6.401 -9.443 -7.390 25 HG23 THR 3 HG22 THR 3 7.563 -9.641 -8.700 26 H ASP 4 HN ASP 4 9.145 -4.600 -7.646 27 HA ASP 4 HA ASP 4 10.250 -5.255 -10.208 28 HB2 ASP 4 HB2 ASP 4 10.213 -2.709 -8.561 29 HB3 ASP 4 HB1 ASP 4 10.976 -2.825 -10.144 30 H ILE 5 HN ILE 5 11.368 -4.329 -6.979 31 HA ILE 5 HA ILE 5 13.887 -5.746 -7.491 32 HB ILE 5 HB ILE 5 13.810 -3.022 -6.218 33 HG12 ILE 5 HG12 ILE 5 15.025 -2.436 -8.483 34 HG13 ILE 5 HG11 ILE 5 14.047 -3.774 -9.055 35 HG21 ILE 5 HG21 ILE 5 15.705 -4.793 -5.881 36 HG22 ILE 5 HG22 ILE 5 16.070 -3.079 -6.087 37 HG23 ILE 5 HG23 ILE 5 16.236 -4.187 -7.453 38 HD11 ILE 5 HD13 ILE 5 12.637 -2.050 -9.492 39 HD12 ILE 5 HD11 ILE 5 13.207 -1.096 -8.125 40 HD13 ILE 5 HD12 ILE 5 12.111 -2.454 -7.856 41 H LEU 6 HN LEU 6 12.815 -7.221 -6.092 42 HA LEU 6 HA LEU 6 13.779 -7.173 -3.491 43 HG LEU 6 HG LEU 6 9.771 -5.918 -2.926 44 HB2 LEU 6 HB2 LEU 6 11.686 -7.063 -2.187 45 HB3 LEU 6 HB1 LEU 6 12.204 -5.559 -2.888 46 HD11 LEU 6 HD11 LEU 6 10.737 -5.838 -5.754 47 HD12 LEU 6 HD12 LEU 6 11.094 -4.510 -4.645 48 HD13 LEU 6 HD13 LEU 6 9.422 -4.944 -4.997 49 HD21 LEU 6 HD23 LEU 6 9.885 -8.337 -3.281 50 HD22 LEU 6 HD21 LEU 6 10.416 -8.043 -4.935 51 HD23 LEU 6 HD22 LEU 6 8.821 -7.521 -4.420 52 H SER 7 HN SER 7 12.808 -8.951 -2.055 53 HA SER 7 HA SER 7 12.841 -11.375 -3.563 54 HG SER 7 HG SER 7 14.452 -11.759 -0.703 55 HB2 SER 7 HB2 SER 7 11.944 -11.120 -0.687 56 HB3 SER 7 HB1 SER 7 12.655 -12.526 -1.478 57 H ALA 8 HN ALA 8 11.198 -11.998 -4.785 58 HA ALA 8 HA ALA 8 8.529 -11.007 -4.597 59 HB1 ALA 8 HB3 ALA 8 9.690 -11.764 -6.688 60 HB2 ALA 8 HB1 ALA 8 8.072 -12.431 -6.453 61 HB3 ALA 8 HB2 ALA 8 9.492 -13.423 -6.119 62 H GLU 9 HN GLU 9 10.146 -13.959 -3.470 63 HA GLU 9 HA GLU 9 7.820 -15.461 -2.939 64 HB2 GLU 9 HB2 GLU 9 10.579 -15.532 -1.725 65 HB3 GLU 9 HB1 GLU 9 9.341 -16.745 -1.406 66 HG2 GLU 9 HG2 GLU 9 10.482 -16.068 -4.093 67 HG3 GLU 9 HG1 GLU 9 10.962 -17.447 -3.106 68 H ASP 10 HN ASP 10 9.922 -13.651 -0.736 69 HA ASP 10 HA ASP 10 8.479 -13.717 1.533 70 HB2 ASP 10 HB2 ASP 10 10.183 -11.534 0.392 71 HB3 ASP 10 HB1 ASP 10 9.444 -11.381 1.983 72 H ILE 11 HN ILE 11 7.553 -12.092 -1.321 73 HA ILE 11 HA ILE 11 5.868 -10.119 -0.149 74 HB ILE 11 HB ILE 11 6.202 -11.302 -2.846 75 HG12 ILE 11 HG12 ILE 11 5.845 -8.453 -1.947 76 HG13 ILE 11 HG11 ILE 11 7.399 -9.274 -2.107 77 HG21 ILE 11 HG21 ILE 11 3.690 -9.823 -2.105 78 HG22 ILE 11 HG22 ILE 11 3.809 -11.473 -2.717 79 HG23 ILE 11 HG23 ILE 11 4.232 -10.115 -3.759 80 HD11 ILE 11 HD13 ILE 11 5.452 -8.547 -4.264 81 HD12 ILE 11 HD11 ILE 11 6.761 -9.699 -4.516 82 HD13 ILE 11 HD12 ILE 11 7.122 -8.044 -4.067 83 H ALA 12 HN ALA 12 5.251 -13.374 -1.454 84 HA ALA 12 HA ALA 12 2.509 -13.451 -0.885 85 HB1 ALA 12 HB3 ALA 12 4.119 -15.129 -2.172 86 HB2 ALA 12 HB1 ALA 12 2.580 -15.654 -1.481 87 HB3 ALA 12 HB2 ALA 12 4.083 -15.950 -0.609 88 H ALA 13 HN ALA 13 5.260 -14.702 1.056 89 HA ALA 13 HA ALA 13 3.627 -15.416 3.232 90 HB1 ALA 13 HB3 ALA 13 6.054 -16.066 2.867 91 HB2 ALA 13 HB1 ALA 13 5.628 -15.600 4.514 92 HB3 ALA 13 HB2 ALA 13 6.479 -14.463 3.468 93 H ALA 14 HN ALA 14 5.654 -12.599 2.746 94 HA ALA 14 HA ALA 14 5.030 -11.022 4.850 95 HB1 ALA 14 HB3 ALA 14 6.590 -10.177 3.292 96 HB2 ALA 14 HB1 ALA 14 5.254 -9.026 3.301 97 HB3 ALA 14 HB2 ALA 14 5.407 -10.188 1.979 98 H LEU 15 HN LEU 15 3.082 -11.259 1.884 99 HA LEU 15 HA LEU 15 1.084 -9.457 2.911 100 HG LEU 15 HG LEU 15 -0.001 -8.365 0.532 101 HB2 LEU 15 HB2 LEU 15 1.788 -9.814 0.455 102 HB3 LEU 15 HB1 LEU 15 0.776 -11.246 0.522 103 HD11 LEU 15 HD11 LEU 15 -1.316 -10.779 -0.695 104 HD12 LEU 15 HD12 LEU 15 -0.075 -9.818 -1.496 105 HD13 LEU 15 HD13 LEU 15 -1.619 -9.082 -1.068 106 HD21 LEU 15 HD23 LEU 15 -0.943 -9.335 2.628 107 HD22 LEU 15 HD21 LEU 15 -1.825 -10.484 1.626 108 HD23 LEU 15 HD22 LEU 15 -2.139 -8.754 1.474 109 H GLN 16 HN GLN 16 1.241 -12.905 2.068 110 HA GLN 16 HA GLN 16 -1.434 -13.451 2.793 111 HB2 GLN 16 HB2 GLN 16 0.844 -15.332 2.243 112 HB3 GLN 16 HB1 GLN 16 -0.884 -15.703 2.181 113 HG2 GLN 16 HG2 GLN 16 0.489 -13.686 0.461 114 HG3 GLN 16 HG1 GLN 16 0.153 -15.338 -0.038 115 HE21 GLN 16 HE21 GLN 16 -1.109 -12.215 0.661 116 HE22 GLN 16 HE22 GLN 16 -2.676 -12.457 -0.006 117 H GLU 17 HN GLU 17 1.231 -12.888 4.719 118 HA GLU 17 HA GLU 17 1.166 -15.122 6.443 119 HB2 GLU 17 HB2 GLU 17 3.107 -13.811 6.551 120 HB3 GLU 17 HB1 GLU 17 2.201 -12.316 6.705 121 HG2 GLU 17 HG2 GLU 17 1.567 -12.927 8.972 122 HG3 GLU 17 HG1 GLU 17 2.429 -14.453 8.803 123 H CYS 18 HN CYS 18 0.194 -11.818 7.396 124 HA CYS 18 HA CYS 18 -1.920 -13.010 9.017 125 HG CYS 18 HG CYS 18 -1.162 -12.210 12.057 126 HB2 CYS 18 HB2 CYS 18 0.077 -11.499 9.898 127 HB3 CYS 18 HB1 CYS 18 -1.003 -10.204 9.405 128 H GLN 19 HN GLN 19 -1.747 -11.781 6.049 129 HA GLN 19 HA GLN 19 -3.101 -9.432 5.854 130 HB2 GLN 19 HB2 GLN 19 -2.577 -9.993 3.758 131 HB3 GLN 19 HB1 GLN 19 -2.633 -11.701 4.123 132 HG2 GLN 19 HG2 GLN 19 -4.933 -11.843 3.603 133 HG3 GLN 19 HG1 GLN 19 -5.119 -10.094 3.606 134 HE21 GLN 19 HE21 GLN 19 -4.352 -8.899 1.837 135 HE22 GLN 19 HE22 GLN 19 -4.009 -9.630 0.313 136 H ASP 20 HN ASP 20 -5.057 -8.692 5.763 137 HA ASP 20 HA ASP 20 -7.505 -9.979 5.741 138 HB2 ASP 20 HB2 ASP 20 -6.255 -9.828 8.438 139 HB3 ASP 20 HB1 ASP 20 -7.958 -9.400 8.329 140 HA PRO 21 HA PRO 21 -8.736 -5.729 5.563 141 HB2 PRO 21 HB2 PRO 21 -11.256 -5.788 6.426 142 HB3 PRO 21 HB1 PRO 21 -10.802 -6.517 4.895 143 HG2 PRO 21 HG2 PRO 21 -11.234 -7.802 7.566 144 HG3 PRO 21 HG1 PRO 21 -11.820 -8.318 5.970 145 HD2 PRO 21 HD2 PRO 21 -9.643 -9.404 7.123 146 HD3 PRO 21 HD1 PRO 21 -9.790 -9.196 5.370 147 H ASP 22 HN ASP 22 -7.084 -5.907 7.642 148 HA ASP 22 HA ASP 22 -7.806 -3.975 9.479 149 HB2 ASP 22 HB2 ASP 22 -9.483 -5.670 10.230 150 HB3 ASP 22 HB1 ASP 22 -8.162 -6.739 10.652 151 H THR 23 HN THR 23 -5.690 -6.541 8.550 152 HA THR 23 HA THR 23 -3.884 -6.032 10.789 153 HB THR 23 HB THR 23 -4.451 -8.359 10.214 154 HG1 THR 23 HG1 THR 23 -1.702 -7.901 9.668 155 HG21 THR 23 HG23 THR 23 -3.649 -7.449 7.575 156 HG22 THR 23 HG21 THR 23 -4.570 -8.874 8.045 157 HG23 THR 23 HG22 THR 23 -2.808 -8.922 8.055 158 H PHE 24 HN PHE 24 -4.214 -5.220 7.498 159 HA PHE 24 HA PHE 24 -2.945 -3.467 6.514 160 HD1 PHE 24 HD2 PHE 24 -2.242 -3.560 9.961 161 HD2 PHE 24 HD1 PHE 24 -0.098 -1.381 6.998 162 HE1 PHE 24 HE2 PHE 24 -2.316 -1.570 11.378 163 HE2 PHE 24 HE1 PHE 24 -0.161 0.614 8.425 164 HZ PHE 24 HZ PHE 24 -1.271 0.522 10.619 165 HB2 PHE 24 HB2 PHE 24 -0.641 -4.650 8.053 166 HB3 PHE 24 HB1 PHE 24 -0.387 -3.615 6.679 167 H GLU 25 HN GLU 25 -3.764 -4.618 4.730 168 HA GLU 25 HA GLU 25 -2.525 -6.910 3.650 169 HB2 GLU 25 HB2 GLU 25 -4.139 -4.870 2.130 170 HB3 GLU 25 HB1 GLU 25 -3.905 -6.557 1.719 171 HG2 GLU 25 HG2 GLU 25 -5.306 -5.628 4.190 172 HG3 GLU 25 HG1 GLU 25 -6.130 -5.961 2.672 173 HA PRO 26 HA PRO 26 -0.317 -3.947 0.617 174 HB2 PRO 26 HB2 PRO 26 -0.226 -1.285 1.303 175 HB3 PRO 26 HB1 PRO 26 -1.407 -2.020 0.229 176 HG2 PRO 26 HG2 PRO 26 -1.787 -0.975 2.890 177 HG3 PRO 26 HG1 PRO 26 -2.987 -1.491 1.708 178 HD2 PRO 26 HD2 PRO 26 -2.038 -2.879 4.043 179 HD3 PRO 26 HD1 PRO 26 -3.357 -3.308 2.941 180 H GLN 27 HN GLN 27 0.109 -2.264 3.736 181 HA GLN 27 HA GLN 27 2.830 -1.727 3.419 182 HB2 GLN 27 HB2 GLN 27 1.277 -2.162 5.959 183 HB3 GLN 27 HB1 GLN 27 2.886 -1.467 5.885 184 HG2 GLN 27 HG2 GLN 27 0.427 -0.308 4.601 185 HG3 GLN 27 HG1 GLN 27 1.155 0.239 6.112 186 HE21 GLN 27 HE21 GLN 27 3.219 1.217 6.048 187 HE22 GLN 27 HE22 GLN 27 3.807 1.962 4.603 188 H LYS 28 HN LYS 28 1.280 -4.568 4.867 189 HA LYS 28 HA LYS 28 3.627 -5.706 5.900 190 HB2 LYS 28 HB2 LYS 28 0.919 -6.742 5.148 191 HB3 LYS 28 HB1 LYS 28 2.179 -7.815 5.687 192 HG2 LYS 28 HG2 LYS 28 2.316 -6.008 7.640 193 HG3 LYS 28 HG1 LYS 28 0.612 -5.859 7.198 194 HD2 LYS 28 HD2 LYS 28 0.298 -8.251 7.519 195 HD3 LYS 28 HD1 LYS 28 2.011 -8.439 7.902 196 HE2 LYS 28 HE2 LYS 28 0.083 -6.729 9.453 197 HE3 LYS 28 HE1 LYS 28 0.546 -8.369 9.903 198 HZ1 LYS 28 HZ3 LYS 28 1.819 -6.649 11.085 199 HZ2 LYS 28 HZ1 LYS 28 2.440 -6.099 9.611 200 HZ3 LYS 28 HZ2 LYS 28 2.812 -7.656 10.157 201 H PHE 29 HN PHE 29 1.893 -6.092 2.868 202 HA PHE 29 HA PHE 29 3.397 -8.010 1.590 203 HD1 PHE 29 HD1 PHE 29 4.502 -6.029 -1.091 204 HD2 PHE 29 HD2 PHE 29 0.808 -8.126 -1.152 205 HE1 PHE 29 HE1 PHE 29 4.975 -6.829 -3.363 206 HE2 PHE 29 HE2 PHE 29 1.277 -8.918 -3.421 207 HZ PHE 29 HZ PHE 29 3.367 -8.261 -4.536 208 HB2 PHE 29 HB2 PHE 29 1.326 -6.957 0.703 209 HB3 PHE 29 HB1 PHE 29 2.215 -5.475 0.410 210 H PHE 30 HN PHE 30 3.853 -4.541 1.681 211 HA PHE 30 HA PHE 30 6.229 -4.499 0.110 212 HD1 PHE 30 HD1 PHE 30 4.044 -4.144 -0.876 213 HD2 PHE 30 HD2 PHE 30 3.764 -0.720 1.643 214 HE1 PHE 30 HE1 PHE 30 1.760 -3.713 -1.690 215 HE2 PHE 30 HE2 PHE 30 1.488 -0.291 0.821 216 HZ PHE 30 HZ PHE 30 0.483 -1.792 -0.849 217 HB2 PHE 30 HB2 PHE 30 5.485 -2.286 1.956 218 HB3 PHE 30 HB1 PHE 30 6.143 -2.195 0.326 219 H GLN 31 HN GLN 31 5.651 -3.722 3.535 220 HA GLN 31 HA GLN 31 8.258 -3.227 4.263 221 HB2 GLN 31 HB2 GLN 31 6.149 -2.761 5.561 222 HB3 GLN 31 HB1 GLN 31 6.216 -4.435 6.100 223 HG2 GLN 31 HG2 GLN 31 7.177 -2.778 7.694 224 HG3 GLN 31 HG1 GLN 31 8.275 -4.079 7.224 225 HE21 GLN 31 HE21 GLN 31 9.915 -3.633 5.703 226 HE22 GLN 31 HE22 GLN 31 10.504 -2.030 5.460 227 H THR 32 HN THR 32 6.555 -6.170 5.222 228 HA THR 32 HA THR 32 8.705 -7.479 6.306 229 HB THR 32 HB THR 32 6.358 -8.682 4.850 230 HG1 THR 32 HG1 THR 32 5.802 -7.463 6.686 231 HG21 THR 32 HG23 THR 32 8.343 -9.998 6.708 232 HG22 THR 32 HG21 THR 32 8.134 -10.343 4.990 233 HG23 THR 32 HG22 THR 32 6.848 -10.736 6.132 234 H SER 33 HN SER 33 7.606 -7.818 2.919 235 HA SER 33 HA SER 33 9.872 -9.495 2.285 236 HG SER 33 HG SER 33 9.552 -9.113 -0.664 237 HB2 SER 33 HB2 SER 33 7.684 -9.944 1.300 238 HB3 SER 33 HB1 SER 33 7.731 -8.392 0.472 239 H GLY 34 HN GLY 34 8.711 -6.362 1.124 240 HA2 GLY 34 HA2 GLY 34 11.310 -6.027 -0.178 241 HA3 GLY 34 HA1 GLY 34 9.881 -5.107 -0.566 242 H LEU 35 HN LEU 35 9.196 -3.723 1.560 243 HA LEU 35 HA LEU 35 10.999 -1.636 1.510 244 HG LEU 35 HG LEU 35 9.813 0.468 2.563 245 HB2 LEU 35 HB2 LEU 35 8.459 -2.222 2.635 246 HB3 LEU 35 HB1 LEU 35 9.448 -1.500 3.894 247 HD11 LEU 35 HD11 LEU 35 8.257 -0.968 0.415 248 HD12 LEU 35 HD12 LEU 35 9.958 -0.510 0.352 249 HD13 LEU 35 HD13 LEU 35 8.710 0.735 0.364 250 HD21 LEU 35 HD23 LEU 35 6.892 -0.192 2.343 251 HD22 LEU 35 HD21 LEU 35 7.640 1.380 2.626 252 HD23 LEU 35 HD22 LEU 35 7.683 0.142 3.883 253 H SER 36 HN SER 36 10.698 -4.223 3.904 254 HA SER 36 HA SER 36 12.034 -3.596 6.039 255 HG SER 36 HG SER 36 13.066 -5.449 7.155 256 HB2 SER 36 HB2 SER 36 11.469 -5.908 5.507 257 HB3 SER 36 HB1 SER 36 12.824 -5.994 4.381 258 H LYS 37 HN LYS 37 13.855 -4.047 3.005 259 HA LYS 37 HA LYS 37 16.012 -2.441 4.194 260 HB2 LYS 37 HB2 LYS 37 16.436 -5.059 2.746 261 HB3 LYS 37 HB1 LYS 37 17.713 -3.963 3.244 262 HG2 LYS 37 HG2 LYS 37 17.184 -4.309 5.561 263 HG3 LYS 37 HG1 LYS 37 15.792 -5.295 5.121 264 HD2 LYS 37 HD2 LYS 37 17.268 -6.940 4.085 265 HD3 LYS 37 HD1 LYS 37 18.668 -5.946 4.493 266 HE2 LYS 37 HE2 LYS 37 18.216 -6.232 6.858 267 HE3 LYS 37 HE1 LYS 37 16.751 -7.143 6.492 268 HZ1 LYS 37 HZ3 LYS 37 18.609 -8.593 7.057 269 HZ2 LYS 37 HZ1 LYS 37 19.510 -7.973 5.766 270 HZ3 LYS 37 HZ2 LYS 37 18.097 -8.853 5.467 271 H MET 38 HN MET 38 14.183 -3.335 1.451 272 HA MET 38 HA MET 38 15.551 -2.710 -0.760 273 HB2 MET 38 HB2 MET 38 12.742 -2.303 0.124 274 HB3 MET 38 HB1 MET 38 13.236 -1.817 -1.477 275 HG2 MET 38 HG2 MET 38 12.220 -4.170 -1.006 276 HG3 MET 38 HG1 MET 38 13.481 -3.943 -2.189 277 HE1 MET 38 HE3 MET 38 16.380 -6.003 -1.077 278 HE2 MET 38 HE1 MET 38 16.117 -4.337 -1.589 279 HE3 MET 38 HE2 MET 38 15.297 -5.653 -2.422 280 H SER 39 HN SER 39 15.525 -0.886 -2.198 281 HA SER 39 HA SER 39 16.338 1.540 -0.919 282 HG SER 39 HG SER 39 17.775 -0.315 -3.389 283 HB2 SER 39 HB2 SER 39 16.069 0.826 -3.847 284 HB3 SER 39 HB1 SER 39 16.874 2.263 -3.209 285 H ALA 40 HN ALA 40 15.570 3.659 -1.746 286 HA ALA 40 HA ALA 40 12.776 3.946 -1.360 287 HB1 ALA 40 HB3 ALA 40 14.786 5.935 -2.408 288 HB2 ALA 40 HB1 ALA 40 14.304 5.715 -0.725 289 HB3 ALA 40 HB2 ALA 40 13.136 6.316 -1.906 290 H SER 41 HN SER 41 14.822 4.241 -4.261 291 HA SER 41 HA SER 41 13.021 5.106 -6.098 292 HG SER 41 HG SER 41 15.809 2.408 -7.160 293 HB2 SER 41 HB2 SER 41 14.382 3.850 -7.787 294 HB3 SER 41 HB1 SER 41 15.331 4.845 -6.683 295 H GLN 42 HN GLN 42 13.732 1.661 -5.530 296 HA GLN 42 HA GLN 42 11.820 0.633 -7.259 297 HB2 GLN 42 HB2 GLN 42 11.950 -1.447 -5.944 298 HB3 GLN 42 HB1 GLN 42 13.544 -0.750 -6.259 299 HG2 GLN 42 HG2 GLN 42 13.841 -0.104 -4.079 300 HG3 GLN 42 HG1 GLN 42 12.111 -0.160 -3.723 301 HE21 GLN 42 HE21 GLN 42 11.094 -2.178 -3.536 302 HE22 GLN 42 HE22 GLN 42 11.982 -3.604 -3.171 303 H VAL 43 HN VAL 43 11.468 1.975 -4.135 304 HA VAL 43 HA VAL 43 8.961 0.911 -3.432 305 HB VAL 43 HB VAL 43 9.897 3.675 -2.706 306 HG11 VAL 43 HG11 VAL 43 7.839 1.843 -1.517 307 HG12 VAL 43 HG12 VAL 43 7.544 3.377 -2.330 308 HG13 VAL 43 HG13 VAL 43 8.384 3.349 -0.778 309 HG21 VAL 43 HG23 VAL 43 10.302 2.150 -0.509 310 HG22 VAL 43 HG21 VAL 43 11.555 2.518 -1.692 311 HG23 VAL 43 HG22 VAL 43 10.676 0.999 -1.782 312 H LYS 44 HN LYS 44 9.835 3.546 -5.569 313 HA LYS 44 HA LYS 44 7.376 4.778 -5.924 314 HB2 LYS 44 HB2 LYS 44 9.672 4.272 -7.792 315 HB3 LYS 44 HB1 LYS 44 8.206 5.044 -8.381 316 HG2 LYS 44 HG2 LYS 44 8.711 6.989 -7.422 317 HG3 LYS 44 HG1 LYS 44 9.218 6.216 -5.921 318 HD2 LYS 44 HD2 LYS 44 11.047 7.422 -7.058 319 HD3 LYS 44 HD1 LYS 44 11.374 5.704 -6.866 320 HE2 LYS 44 HE2 LYS 44 10.664 5.331 -9.168 321 HE3 LYS 44 HE1 LYS 44 10.372 7.056 -9.363 322 HZ1 LYS 44 HZ3 LYS 44 12.512 6.448 -10.271 323 HZ2 LYS 44 HZ1 LYS 44 12.994 5.780 -8.793 324 HZ3 LYS 44 HZ2 LYS 44 12.729 7.446 -8.923 325 H ASP 45 HN ASP 45 8.663 1.851 -7.431 326 HA ASP 45 HA ASP 45 6.427 1.331 -9.075 327 HB2 ASP 45 HB2 ASP 45 8.899 -0.001 -8.297 328 HB3 ASP 45 HB1 ASP 45 7.564 -1.127 -8.465 329 H ILE 46 HN ILE 46 7.401 0.334 -5.833 330 HA ILE 46 HA ILE 46 5.357 -1.414 -5.227 331 HB ILE 46 HB ILE 46 7.137 0.358 -3.641 332 HG12 ILE 46 HG12 ILE 46 7.919 -1.733 -2.771 333 HG13 ILE 46 HG11 ILE 46 6.560 -2.582 -3.487 334 HG21 ILE 46 HG21 ILE 46 4.703 -0.981 -2.513 335 HG22 ILE 46 HG22 ILE 46 5.265 0.675 -2.287 336 HG23 ILE 46 HG23 ILE 46 6.135 -0.660 -1.534 337 HD11 ILE 46 HD13 ILE 46 7.444 -1.931 -5.724 338 HD12 ILE 46 HD11 ILE 46 8.486 -3.016 -4.803 339 HD13 ILE 46 HD12 ILE 46 8.872 -1.302 -4.904 340 H PHE 47 HN PHE 47 5.509 2.073 -4.485 341 HA PHE 47 HA PHE 47 3.099 2.681 -3.500 342 HD1 PHE 47 HD1 PHE 47 1.888 5.219 -3.519 343 HD2 PHE 47 HD2 PHE 47 4.017 5.297 -7.204 344 HE1 PHE 47 HE1 PHE 47 0.280 6.856 -4.418 345 HE2 PHE 47 HE2 PHE 47 2.416 6.933 -8.102 346 HZ PHE 47 HZ PHE 47 0.544 7.714 -6.707 347 HB2 PHE 47 HB2 PHE 47 4.451 4.523 -3.850 348 HB3 PHE 47 HB1 PHE 47 4.858 4.058 -5.482 349 H ARG 48 HN ARG 48 3.757 2.036 -6.866 350 HA ARG 48 HA ARG 48 1.318 2.692 -8.000 351 HE ARG 48 HE ARG 48 1.326 3.974 -10.260 352 HB2 ARG 48 HB2 ARG 48 3.059 0.394 -8.868 353 HB3 ARG 48 HB1 ARG 48 1.935 1.317 -9.862 354 HG2 ARG 48 HG2 ARG 48 4.510 2.253 -8.649 355 HG3 ARG 48 HG1 ARG 48 4.125 2.081 -10.361 356 HD2 ARG 48 HD2 ARG 48 2.767 4.005 -8.464 357 HD3 ARG 48 HD1 ARG 48 4.086 4.432 -9.557 358 HH11 ARG 48 HH11 ARG 48 4.614 4.126 -11.402 359 HH12 ARG 48 HH12 ARG 48 4.164 4.471 -13.038 360 HH21 ARG 48 HH21 ARG 48 0.728 4.419 -12.412 361 HH22 ARG 48 HH22 ARG 48 1.956 4.638 -13.612 362 H PHE 49 HN PHE 49 2.101 0.021 -5.955 363 HA PHE 49 HA PHE 49 0.166 -1.831 -6.735 364 HD1 PHE 49 HD2 PHE 49 0.792 -4.375 -5.909 365 HD2 PHE 49 HD1 PHE 49 -0.737 -2.133 -2.626 366 HE1 PHE 49 HE2 PHE 49 -0.567 -6.307 -5.221 367 HE2 PHE 49 HE1 PHE 49 -2.093 -4.060 -1.933 368 HZ PHE 49 HZ PHE 49 -2.012 -6.150 -3.233 369 HB2 PHE 49 HB2 PHE 49 1.929 -2.312 -5.049 370 HB3 PHE 49 HB1 PHE 49 1.077 -1.287 -3.898 371 H ILE 50 HN ILE 50 -0.078 0.564 -4.083 372 HA ILE 50 HA ILE 50 -2.811 0.190 -3.698 373 HB ILE 50 HB ILE 50 -2.760 2.440 -2.556 374 HG12 ILE 50 HG12 ILE 50 0.184 2.305 -3.251 375 HG13 ILE 50 HG11 ILE 50 -0.953 3.520 -3.835 376 HG21 ILE 50 HG21 ILE 50 -0.906 0.212 -1.874 377 HG22 ILE 50 HG22 ILE 50 -2.496 0.597 -1.220 378 HG23 ILE 50 HG23 ILE 50 -1.110 1.604 -0.809 379 HD11 ILE 50 HD13 ILE 50 -0.368 3.088 -0.916 380 HD12 ILE 50 HD11 ILE 50 -1.207 4.444 -1.661 381 HD13 ILE 50 HD12 ILE 50 0.529 4.234 -1.909 382 H ASP 51 HN ASP 51 -3.585 3.160 -3.952 383 HA ASP 51 HA ASP 51 -4.892 2.836 -6.415 384 HB2 ASP 51 HB2 ASP 51 -4.586 5.105 -4.482 385 HB3 ASP 51 HB1 ASP 51 -5.415 5.347 -6.023 386 H ASN 52 HN ASN 52 -4.773 4.450 -8.223 387 HA ASN 52 HA ASN 52 -1.993 4.609 -9.097 388 HB2 ASN 52 HB2 ASN 52 -3.602 3.397 -10.507 389 HB3 ASN 52 HB1 ASN 52 -4.552 4.868 -10.683 390 HD21 ASN 52 HD21 ASN 52 -1.584 3.252 -11.518 391 HD22 ASN 52 HD22 ASN 52 -1.160 4.285 -12.836 392 H ASP 53 HN ASP 53 -2.548 6.602 -7.298 393 HA ASP 53 HA ASP 53 -2.002 8.827 -7.110 394 HB2 ASP 53 HB2 ASP 53 -2.520 9.209 -10.060 395 HB3 ASP 53 HB1 ASP 53 -1.584 10.235 -8.979 396 H GLN 54 HN GLN 54 -4.640 8.232 -9.424 397 HA GLN 54 HA GLN 54 -6.820 8.799 -9.397 398 HB2 GLN 54 HB2 GLN 54 -6.428 9.849 -6.615 399 HB3 GLN 54 HB1 GLN 54 -7.875 9.184 -7.346 400 HG2 GLN 54 HG2 GLN 54 -6.956 6.982 -7.367 401 HG3 GLN 54 HG1 GLN 54 -5.389 7.580 -6.828 402 HE21 GLN 54 HE21 GLN 54 -6.270 9.328 -4.808 403 HE22 GLN 54 HE22 GLN 54 -6.884 8.358 -3.521 404 H SER 55 HN SER 55 -5.043 11.330 -7.614 405 HA SER 55 HA SER 55 -5.781 13.295 -9.589 406 HG SER 55 HG SER 55 -8.044 12.791 -9.078 407 HB2 SER 55 HB2 SER 55 -6.748 13.678 -6.746 408 HB3 SER 55 HB1 SER 55 -6.983 14.784 -8.099 409 H GLY 56 HN GLY 56 -3.321 12.216 -8.623 410 HA2 GLY 56 HA2 GLY 56 -1.278 13.496 -8.527 411 HA3 GLY 56 HA1 GLY 56 -2.137 14.706 -7.578 412 H TYR 57 HN TYR 57 -3.392 12.354 -6.068 413 HA TYR 57 HA TYR 57 -1.233 11.160 -4.625 414 HD1 TYR 57 HD2 TYR 57 0.174 14.251 -4.144 415 HD2 TYR 57 HD1 TYR 57 -4.017 14.399 -3.556 416 HE1 TYR 57 HE2 TYR 57 0.168 16.596 -4.896 417 HE2 TYR 57 HE1 TYR 57 -4.057 16.744 -4.317 418 HH TYR 57 HH TYR 57 -1.442 18.206 -5.881 419 HB2 TYR 57 HB2 TYR 57 -2.776 12.638 -2.656 420 HB3 TYR 57 HB1 TYR 57 -1.038 12.535 -2.840 421 H LEU 58 HN LEU 58 -2.098 9.890 -2.763 422 HA LEU 58 HA LEU 58 -4.762 8.893 -3.451 423 HG LEU 58 HG LEU 58 -1.733 7.857 -3.969 424 HB2 LEU 58 HB2 LEU 58 -2.723 7.511 -1.725 425 HB3 LEU 58 HB1 LEU 58 -4.140 6.806 -2.482 426 HD11 LEU 58 HD11 LEU 58 -2.463 5.161 -2.962 427 HD12 LEU 58 HD12 LEU 58 -0.876 5.921 -3.115 428 HD13 LEU 58 HD13 LEU 58 -1.694 5.282 -4.543 429 HD21 LEU 58 HD23 LEU 58 -3.256 6.138 -5.558 430 HD22 LEU 58 HD21 LEU 58 -3.047 7.878 -5.738 431 HD23 LEU 58 HD22 LEU 58 -4.397 7.247 -4.800 432 H ASP 59 HN ASP 59 -6.347 8.529 -1.733 433 HA ASP 59 HA ASP 59 -5.626 9.783 0.818 434 HB2 ASP 59 HB2 ASP 59 -7.810 11.019 0.763 435 HB3 ASP 59 HB1 ASP 59 -6.611 11.567 -0.409 436 H GLY 60 HN GLY 60 -6.828 9.202 2.561 437 HA2 GLY 60 HA2 GLY 60 -7.302 6.539 2.934 438 HA3 GLY 60 HA1 GLY 60 -8.040 7.800 3.912 439 H ASP 61 HN ASP 61 -9.524 8.843 1.566 440 HA ASP 61 HA ASP 61 -11.880 7.253 1.919 441 HB2 ASP 61 HB2 ASP 61 -11.329 9.439 -0.104 442 HB3 ASP 61 HB1 ASP 61 -12.916 8.830 0.371 443 H GLU 62 HN GLU 62 -9.727 7.999 -0.712 444 HA GLU 62 HA GLU 62 -10.900 6.183 -2.563 445 HB2 GLU 62 HB2 GLU 62 -8.304 7.645 -2.715 446 HB3 GLU 62 HB1 GLU 62 -9.201 6.957 -4.063 447 HG2 GLU 62 HG2 GLU 62 -10.247 9.134 -2.289 448 HG3 GLU 62 HG1 GLU 62 -9.402 9.431 -3.808 449 H LEU 63 HN LEU 63 -8.298 6.040 -0.276 450 HA LEU 63 HA LEU 63 -6.533 4.242 -1.282 451 HG LEU 63 HG LEU 63 -6.314 6.404 0.979 452 HB2 LEU 63 HB2 LEU 63 -7.630 4.554 1.496 453 HB3 LEU 63 HB1 LEU 63 -6.338 3.430 1.148 454 HD11 LEU 63 HD11 LEU 63 -4.005 5.216 2.146 455 HD12 LEU 63 HD12 LEU 63 -5.478 4.627 2.920 456 HD13 LEU 63 HD13 LEU 63 -5.157 6.357 2.836 457 HD21 LEU 63 HD23 LEU 63 -4.511 4.506 -0.436 458 HD22 LEU 63 HD21 LEU 63 -3.927 6.085 0.093 459 HD23 LEU 63 HD22 LEU 63 -5.278 5.983 -1.046 460 H LYS 64 HN LYS 64 -9.627 3.336 0.303 461 HA LYS 64 HA LYS 64 -9.299 0.616 0.134 462 HB2 LYS 64 HB2 LYS 64 -11.890 0.665 0.014 463 HB3 LYS 64 HB1 LYS 64 -11.090 1.281 1.438 464 HG2 LYS 64 HG2 LYS 64 -11.446 3.538 0.743 465 HG3 LYS 64 HG1 LYS 64 -12.036 3.009 -0.834 466 HD2 LYS 64 HD2 LYS 64 -13.506 1.778 1.327 467 HD3 LYS 64 HD1 LYS 64 -13.557 3.537 1.434 468 HE2 LYS 64 HE2 LYS 64 -14.321 3.636 -0.883 469 HE3 LYS 64 HE1 LYS 64 -14.263 1.876 -0.973 470 HZ1 LYS 64 HZ3 LYS 64 -16.002 3.462 0.838 471 HZ2 LYS 64 HZ1 LYS 64 -15.945 1.773 0.762 472 HZ3 LYS 64 HZ2 LYS 64 -16.506 2.661 -0.564 473 H TYR 65 HN TYR 65 -9.859 2.817 -2.433 474 HA TYR 65 HA TYR 65 -11.083 0.949 -4.226 475 HD1 TYR 65 HD1 TYR 65 -12.557 1.925 -3.372 476 HD2 TYR 65 HD2 TYR 65 -11.389 5.405 -5.518 477 HE1 TYR 65 HE1 TYR 65 -14.639 3.031 -2.690 478 HE2 TYR 65 HE2 TYR 65 -13.471 6.525 -4.841 479 HH TYR 65 HH TYR 65 -15.522 5.294 -2.418 480 HB2 TYR 65 HB2 TYR 65 -9.727 3.596 -4.757 481 HB3 TYR 65 HB1 TYR 65 -10.606 2.661 -5.961 482 H PHE 66 HN PHE 66 -7.911 1.313 -3.114 483 HA PHE 66 HA PHE 66 -6.243 1.038 -5.207 484 HD1 PHE 66 HD2 PHE 66 -8.041 -0.690 -2.312 485 HD2 PHE 66 HD1 PHE 66 -3.875 -1.447 -2.254 486 HE1 PHE 66 HE2 PHE 66 -8.415 -2.654 -0.894 487 HE2 PHE 66 HE1 PHE 66 -4.256 -3.402 -0.821 488 HZ PHE 66 HZ PHE 66 -6.509 -4.007 -0.135 489 HB2 PHE 66 HB2 PHE 66 -4.705 0.139 -3.683 490 HB3 PHE 66 HB1 PHE 66 -5.748 1.121 -2.700 491 H LEU 67 HN LEU 67 -8.370 -1.441 -3.973 492 HA LEU 67 HA LEU 67 -7.219 -3.509 -5.586 493 HG LEU 67 HG LEU 67 -6.891 -3.913 -2.963 494 HB2 LEU 67 HB2 LEU 67 -9.276 -3.327 -3.440 495 HB3 LEU 67 HB1 LEU 67 -9.332 -4.705 -4.516 496 HD11 LEU 67 HD11 LEU 67 -9.014 -5.946 -2.297 497 HD12 LEU 67 HD12 LEU 67 -8.615 -4.492 -1.374 498 HD13 LEU 67 HD13 LEU 67 -7.452 -5.817 -1.488 499 HD21 LEU 67 HD23 LEU 67 -7.592 -6.477 -4.355 500 HD22 LEU 67 HD21 LEU 67 -6.054 -6.053 -3.594 501 HD23 LEU 67 HD22 LEU 67 -6.597 -5.187 -5.036 502 H GLN 68 HN GLN 68 -9.881 -1.309 -5.570 503 HA GLN 68 HA GLN 68 -11.420 -2.686 -7.553 504 HB2 GLN 68 HB2 GLN 68 -11.764 -0.332 -5.863 505 HB3 GLN 68 HB1 GLN 68 -12.363 -0.093 -7.499 506 HG2 GLN 68 HG2 GLN 68 -13.547 -2.356 -7.152 507 HG3 GLN 68 HG1 GLN 68 -13.242 -2.076 -5.447 508 HE21 GLN 68 HE21 GLN 68 -15.415 -1.918 -4.968 509 HE22 GLN 68 HE22 GLN 68 -16.359 -0.537 -5.407 510 H LYS 69 HN LYS 69 -8.526 -1.147 -7.788 511 HA LYS 69 HA LYS 69 -9.047 0.502 -10.076 512 HB2 LYS 69 HB2 LYS 69 -6.446 -0.550 -8.923 513 HB3 LYS 69 HB1 LYS 69 -6.610 0.750 -10.098 514 HG2 LYS 69 HG2 LYS 69 -7.506 0.770 -7.228 515 HG3 LYS 69 HG1 LYS 69 -6.159 1.652 -7.920 516 HD2 LYS 69 HD2 LYS 69 -9.096 2.088 -8.353 517 HD3 LYS 69 HD1 LYS 69 -7.914 3.214 -7.689 518 HE2 LYS 69 HE2 LYS 69 -6.823 3.378 -9.861 519 HE3 LYS 69 HE1 LYS 69 -7.963 2.211 -10.532 520 HZ1 LYS 69 HZ3 LYS 69 -8.573 4.492 -11.075 521 HZ2 LYS 69 HZ1 LYS 69 -8.682 4.875 -9.431 522 HZ3 LYS 69 HZ2 LYS 69 -9.757 3.761 -10.113 523 H PHE 70 HN PHE 70 -7.356 -2.486 -9.285 524 HA PHE 70 HA PHE 70 -7.466 -3.344 -12.061 525 HD1 PHE 70 HD1 PHE 70 -6.485 -4.951 -8.146 526 HD2 PHE 70 HD2 PHE 70 -4.098 -2.397 -10.581 527 HE1 PHE 70 HE1 PHE 70 -5.358 -4.095 -6.139 528 HE2 PHE 70 HE2 PHE 70 -2.969 -1.537 -8.570 529 HZ PHE 70 HZ PHE 70 -3.600 -2.389 -6.347 530 HB2 PHE 70 HB2 PHE 70 -6.169 -5.316 -10.598 531 HB3 PHE 70 HB1 PHE 70 -5.412 -4.077 -11.581 532 H GLN 71 HN GLN 71 -8.443 -4.570 -8.845 533 HA GLN 71 HA GLN 71 -9.729 -6.842 -10.149 534 HB2 GLN 71 HB2 GLN 71 -10.054 -7.825 -8.035 535 HB3 GLN 71 HB1 GLN 71 -8.443 -7.128 -8.012 536 HG2 GLN 71 HG2 GLN 71 -8.955 -5.666 -6.401 537 HG3 GLN 71 HG1 GLN 71 -10.583 -5.391 -7.016 538 HE21 GLN 71 HE21 GLN 71 -12.211 -6.885 -6.490 539 HE22 GLN 71 HE22 GLN 71 -12.103 -7.855 -5.068 540 H SER 72 HN SER 72 -10.588 -3.759 -9.768 541 HA SER 72 HA SER 72 -12.559 -2.667 -9.184 542 HG SER 72 HG SER 72 -14.007 -1.637 -10.788 543 HB2 SER 72 HB2 SER 72 -12.239 -2.843 -11.635 544 HB3 SER 72 HB1 SER 72 -13.291 -4.251 -11.611 545 H ASP 73 HN ASP 73 -12.805 -4.267 -7.317 546 HA ASP 73 HA ASP 73 -15.612 -4.871 -7.173 547 HB2 ASP 73 HB2 ASP 73 -14.009 -6.989 -7.908 548 HB3 ASP 73 HB1 ASP 73 -14.074 -7.159 -6.155 549 H ALA 74 HN ALA 74 -12.446 -5.144 -5.699 550 HA ALA 74 HA ALA 74 -11.900 -5.201 -3.415 551 HB1 ALA 74 HB3 ALA 74 -11.115 -3.101 -2.986 552 HB2 ALA 74 HB1 ALA 74 -12.532 -2.310 -3.671 553 HB3 ALA 74 HB2 ALA 74 -11.347 -3.062 -4.728 554 H ARG 75 HN ARG 75 -12.663 -5.650 -1.528 555 HA ARG 75 HA ARG 75 -15.335 -5.354 -0.814 556 HE ARG 75 HE ARG 75 -10.028 -5.225 1.428 557 HB2 ARG 75 HB2 ARG 75 -14.627 -5.964 1.461 558 HB3 ARG 75 HB1 ARG 75 -13.861 -6.992 0.259 559 HG2 ARG 75 HG2 ARG 75 -12.277 -4.639 0.903 560 HG3 ARG 75 HG1 ARG 75 -12.591 -5.665 2.303 561 HD2 ARG 75 HD2 ARG 75 -11.620 -7.556 1.240 562 HD3 ARG 75 HD1 ARG 75 -11.557 -6.731 -0.315 563 HH11 ARG 75 HH11 ARG 75 -10.013 -8.469 0.157 564 HH12 ARG 75 HH12 ARG 75 -8.288 -8.627 0.226 565 HH21 ARG 75 HH21 ARG 75 -7.756 -5.422 1.519 566 HH22 ARG 75 HH22 ARG 75 -7.007 -6.895 1.000 567 H GLU 76 HN GLU 76 -12.760 -3.122 -0.791 568 HA GLU 76 HA GLU 76 -12.885 -0.863 -0.610 569 HB2 GLU 76 HB2 GLU 76 -15.324 -1.179 1.147 570 HB3 GLU 76 HB1 GLU 76 -14.687 0.309 0.469 571 HG2 GLU 76 HG2 GLU 76 -15.222 -0.402 -1.758 572 HG3 GLU 76 HG1 GLU 76 -15.724 -1.983 -1.169 573 H LEU 77 HN LEU 77 -11.369 -2.542 0.676 574 HA LEU 77 HA LEU 77 -10.266 -3.099 2.600 575 HG LEU 77 HG LEU 77 -9.037 -1.593 0.410 576 HB2 LEU 77 HB2 LEU 77 -9.989 -0.187 2.050 577 HB3 LEU 77 HB1 LEU 77 -9.022 -0.927 3.296 578 HD11 LEU 77 HD11 LEU 77 -7.750 0.390 1.713 579 HD12 LEU 77 HD12 LEU 77 -7.186 -0.400 0.253 580 HD13 LEU 77 HD13 LEU 77 -6.568 -0.918 1.811 581 HD21 LEU 77 HD23 LEU 77 -8.084 -3.563 0.834 582 HD22 LEU 77 HD21 LEU 77 -8.569 -3.354 2.499 583 HD23 LEU 77 HD22 LEU 77 -6.994 -2.830 2.002 584 H THR 78 HN THR 78 -13.005 -2.703 3.300 585 HA THR 78 HA THR 78 -14.417 -2.057 5.016 586 HB THR 78 HB THR 78 -13.926 -3.264 7.010 587 HG1 THR 78 HG1 THR 78 -11.233 -3.630 6.212 588 HG21 THR 78 HG23 THR 78 -13.217 -5.447 6.149 589 HG22 THR 78 HG21 THR 78 -12.604 -4.672 4.687 590 HG23 THR 78 HG22 THR 78 -14.334 -4.657 5.036 591 H GLU 79 HN GLU 79 -14.076 -1.388 7.601 592 HA GLU 79 HA GLU 79 -13.296 1.320 7.496 593 HB2 GLU 79 HB2 GLU 79 -15.031 0.276 9.024 594 HB3 GLU 79 HB1 GLU 79 -13.694 -0.376 9.963 595 HG2 GLU 79 HG2 GLU 79 -12.875 1.910 10.305 596 HG3 GLU 79 HG1 GLU 79 -14.295 2.513 9.459 597 H SER 80 HN SER 80 -11.916 -1.626 8.797 598 HA SER 80 HA SER 80 -9.642 -0.429 9.988 599 HG SER 80 HG SER 80 -8.904 -2.113 11.676 600 HB2 SER 80 HB2 SER 80 -10.792 -2.575 10.658 601 HB3 SER 80 HB1 SER 80 -9.904 -3.338 9.343 602 H GLU 81 HN GLU 81 -9.771 -2.546 6.970 603 HA GLU 81 HA GLU 81 -7.058 -2.599 6.654 604 HB2 GLU 81 HB2 GLU 81 -9.148 -3.626 5.251 605 HB3 GLU 81 HB1 GLU 81 -8.545 -2.427 4.143 606 HG2 GLU 81 HG2 GLU 81 -7.106 -4.792 5.233 607 HG3 GLU 81 HG1 GLU 81 -7.399 -4.371 3.545 608 H THR 82 HN THR 82 -9.230 -0.051 5.273 609 HA THR 82 HA THR 82 -7.296 1.294 3.844 610 HB THR 82 HB THR 82 -8.568 3.413 4.488 611 HG1 THR 82 HG1 THR 82 -10.519 1.622 5.475 612 HG21 THR 82 HG23 THR 82 -10.251 1.212 3.329 613 HG22 THR 82 HG21 THR 82 -8.923 1.980 2.453 614 HG23 THR 82 HG22 THR 82 -10.317 2.936 2.963 615 H LYS 83 HN LYS 83 -7.561 0.908 7.266 616 HA LYS 83 HA LYS 83 -6.158 3.143 8.190 617 HB2 LYS 83 HB2 LYS 83 -7.316 1.461 9.620 618 HB3 LYS 83 HB1 LYS 83 -6.012 0.331 9.273 619 HG2 LYS 83 HG2 LYS 83 -5.787 1.464 11.432 620 HG3 LYS 83 HG1 LYS 83 -4.417 1.744 10.365 621 HD2 LYS 83 HD2 LYS 83 -5.336 3.929 9.769 622 HD3 LYS 83 HD1 LYS 83 -6.722 3.640 10.823 623 HE2 LYS 83 HE2 LYS 83 -5.245 3.530 12.755 624 HE3 LYS 83 HE1 LYS 83 -3.843 3.770 11.713 625 HZ1 LYS 83 HZ3 LYS 83 -4.723 5.946 11.110 626 HZ2 LYS 83 HZ1 LYS 83 -4.493 5.827 12.782 627 HZ3 LYS 83 HZ2 LYS 83 -6.050 5.714 12.131 628 H SER 84 HN SER 84 -5.107 0.050 6.854 629 HA SER 84 HA SER 84 -2.390 0.185 7.270 630 HG SER 84 HG SER 84 -4.043 -1.696 4.072 631 HB2 SER 84 HB2 SER 84 -2.243 -1.400 5.475 632 HB3 SER 84 HB1 SER 84 -3.732 -1.731 6.335 633 H LEU 85 HN LEU 85 -4.195 1.078 4.374 634 HA LEU 85 HA LEU 85 -2.119 2.322 3.017 635 HG LEU 85 HG LEU 85 -4.571 0.471 2.347 636 HB2 LEU 85 HB2 LEU 85 -5.104 2.749 2.908 637 HB3 LEU 85 HB1 LEU 85 -3.979 3.343 1.712 638 HD11 LEU 85 HD11 LEU 85 -4.999 2.131 -0.132 639 HD12 LEU 85 HD12 LEU 85 -6.249 1.535 0.958 640 HD13 LEU 85 HD13 LEU 85 -5.298 0.399 0.004 641 HD21 LEU 85 HD23 LEU 85 -2.224 0.655 1.950 642 HD22 LEU 85 HD21 LEU 85 -2.494 1.690 0.551 643 HD23 LEU 85 HD22 LEU 85 -2.980 -0.002 0.499 644 H MET 86 HN MET 86 -4.549 3.623 5.183 645 HA MET 86 HA MET 86 -3.885 6.342 5.033 646 HB2 MET 86 HB2 MET 86 -4.973 4.713 7.339 647 HB3 MET 86 HB1 MET 86 -4.836 6.466 7.375 648 HG2 MET 86 HG2 MET 86 -6.196 5.545 4.999 649 HG3 MET 86 HG1 MET 86 -6.989 4.987 6.469 650 HE1 MET 86 HE3 MET 86 -5.058 8.648 6.402 651 HE2 MET 86 HE1 MET 86 -6.168 9.282 5.188 652 HE3 MET 86 HE2 MET 86 -5.213 7.836 4.844 653 H ASP 87 HN ASP 87 -2.747 3.811 7.207 654 HA ASP 87 HA ASP 87 -0.778 5.391 8.548 655 HB2 ASP 87 HB2 ASP 87 -1.901 3.413 9.550 656 HB3 ASP 87 HB1 ASP 87 -1.059 2.397 8.380 657 H ALA 88 HN ALA 88 -0.824 4.326 5.443 658 HA ALA 88 HA ALA 88 1.672 3.030 5.156 659 HB1 ALA 88 HB3 ALA 88 1.180 2.902 2.923 660 HB2 ALA 88 HB1 ALA 88 0.315 4.440 2.920 661 HB3 ALA 88 HB2 ALA 88 -0.419 3.020 3.659 662 H ALA 89 HN ALA 89 0.751 6.411 5.206 663 HA ALA 89 HA ALA 89 3.526 7.153 5.156 664 HB1 ALA 89 HB3 ALA 89 3.171 6.887 2.771 665 HB2 ALA 89 HB1 ALA 89 3.437 8.583 3.171 666 HB3 ALA 89 HB2 ALA 89 1.806 8.004 2.821 667 H ASP 90 HN ASP 90 0.782 9.071 4.013 668 HA ASP 90 HA ASP 90 1.362 11.038 6.086 669 HB2 ASP 90 HB2 ASP 90 0.751 11.407 3.481 670 HB3 ASP 90 HB1 ASP 90 -0.856 11.518 4.188 671 H ASN 91 HN ASN 91 0.625 9.601 7.751 672 HA ASN 91 HA ASN 91 -2.272 9.157 7.833 673 HB2 ASN 91 HB2 ASN 91 -1.319 7.847 10.040 674 HB3 ASN 91 HB1 ASN 91 -1.627 7.109 8.477 675 HD21 ASN 91 HD21 ASN 91 0.125 6.710 7.075 676 HD22 ASN 91 HD22 ASN 91 1.745 6.639 7.672 677 H ASP 92 HN ASP 92 0.356 10.294 9.925 678 HA ASP 92 HA ASP 92 -1.387 11.166 11.980 679 HB2 ASP 92 HB2 ASP 92 1.509 11.819 11.453 680 HB3 ASP 92 HB1 ASP 92 0.643 12.174 12.940 681 H GLY 93 HN GLY 93 -0.673 12.677 8.967 682 HA2 GLY 93 HA2 GLY 93 -1.472 15.237 10.195 683 HA3 GLY 93 HA1 GLY 93 -0.294 15.140 8.903 684 H ASP 94 HN ASP 94 -1.024 14.571 6.781 685 HA ASP 94 HA ASP 94 -3.485 15.877 6.151 686 HB2 ASP 94 HB2 ASP 94 -1.605 14.371 4.327 687 HB3 ASP 94 HB1 ASP 94 -2.882 15.472 3.825 688 H GLY 95 HN GLY 95 -2.358 12.530 5.493 689 HA2 GLY 95 HA2 GLY 95 -3.885 10.692 5.987 690 HA3 GLY 95 HA1 GLY 95 -5.204 11.750 5.521 691 H LYS 96 HN LYS 96 -2.530 12.078 3.456 692 HA LYS 96 HA LYS 96 -3.869 10.382 1.472 693 HB2 LYS 96 HB2 LYS 96 -3.694 12.086 -0.011 694 HB3 LYS 96 HB1 LYS 96 -3.265 13.082 1.364 695 HG2 LYS 96 HG2 LYS 96 -1.337 11.693 -0.481 696 HG3 LYS 96 HG1 LYS 96 -1.736 13.406 -0.487 697 HD2 LYS 96 HD2 LYS 96 -1.006 13.029 2.110 698 HD3 LYS 96 HD1 LYS 96 0.062 11.898 1.267 699 HE2 LYS 96 HE2 LYS 96 1.083 13.579 0.036 700 HE3 LYS 96 HE1 LYS 96 -0.261 14.698 0.262 701 HZ1 LYS 96 HZ3 LYS 96 1.599 13.835 2.411 702 HZ2 LYS 96 HZ1 LYS 96 0.371 14.990 2.548 703 HZ3 LYS 96 HZ2 LYS 96 1.713 15.296 1.566 704 H ILE 97 HN ILE 97 -2.502 9.228 -0.096 705 HA ILE 97 HA ILE 97 0.213 8.675 0.917 706 HB ILE 97 HB ILE 97 -1.587 6.608 -0.324 707 HG12 ILE 97 HG12 ILE 97 -2.463 7.239 1.868 708 HG13 ILE 97 HG11 ILE 97 -1.755 5.631 1.895 709 HG21 ILE 97 HG21 ILE 97 0.186 5.090 0.703 710 HG22 ILE 97 HG22 ILE 97 1.166 6.549 0.868 711 HG23 ILE 97 HG23 ILE 97 0.641 6.016 -0.729 712 HD11 ILE 97 HD13 ILE 97 0.321 6.674 2.846 713 HD12 ILE 97 HD11 ILE 97 -1.098 6.702 3.892 714 HD13 ILE 97 HD12 ILE 97 -0.614 8.156 3.028 715 H GLY 98 HN GLY 98 1.314 9.844 -0.652 716 HA2 GLY 98 HA2 GLY 98 0.945 9.007 -3.435 717 HA3 GLY 98 HA1 GLY 98 1.697 10.507 -2.910 718 H ALA 99 HN ALA 99 3.080 9.105 -4.714 719 HA ALA 99 HA ALA 99 4.733 7.012 -3.815 720 HB1 ALA 99 HB3 ALA 99 4.754 7.456 -6.131 721 HB2 ALA 99 HB1 ALA 99 6.363 7.908 -5.566 722 HB3 ALA 99 HB2 ALA 99 5.152 9.152 -5.881 723 H ASP 100 HN ASP 100 5.275 10.520 -3.763 724 HA ASP 100 HA ASP 100 7.759 10.517 -2.488 725 HB2 ASP 100 HB2 ASP 100 5.544 12.574 -2.366 726 HB3 ASP 100 HB1 ASP 100 7.189 12.847 -1.799 727 H GLU 101 HN GLU 101 4.522 10.864 -1.064 728 HA GLU 101 HA GLU 101 5.302 10.946 1.626 729 HB2 GLU 101 HB2 GLU 101 2.832 10.607 0.095 730 HB3 GLU 101 HB1 GLU 101 2.800 9.749 1.623 731 HG2 GLU 101 HG2 GLU 101 1.961 12.231 1.370 732 HG3 GLU 101 HG1 GLU 101 2.732 11.657 2.839 733 H PHE 102 HN PHE 102 4.130 8.250 -0.359 734 HA PHE 102 HA PHE 102 4.398 6.182 1.438 735 HD1 PHE 102 HD1 PHE 102 6.666 4.206 -0.339 736 HD2 PHE 102 HD2 PHE 102 2.417 3.952 -0.536 737 HE1 PHE 102 HE1 PHE 102 6.796 1.794 0.053 738 HE2 PHE 102 HE2 PHE 102 2.547 1.523 -0.170 739 HZ PHE 102 HZ PHE 102 4.739 0.441 0.125 740 HB2 PHE 102 HB2 PHE 102 3.398 5.984 -0.841 741 HB3 PHE 102 HB1 PHE 102 5.022 6.006 -1.529 742 H GLN 103 HN GLN 103 6.808 7.568 -0.759 743 HA GLN 103 HA GLN 103 8.938 5.860 -0.253 744 HB2 GLN 103 HB2 GLN 103 8.885 8.796 -0.920 745 HB3 GLN 103 HB1 GLN 103 10.381 7.881 -0.788 746 HG2 GLN 103 HG2 GLN 103 8.306 6.743 -2.531 747 HG3 GLN 103 HG1 GLN 103 9.040 8.252 -3.053 748 HE21 GLN 103 HE21 GLN 103 10.130 7.428 -4.759 749 HE22 GLN 103 HE22 GLN 103 11.458 6.331 -4.606 750 H GLU 104 HN GLU 104 7.558 8.384 1.681 751 HA GLU 104 HA GLU 104 9.743 8.857 3.417 752 HB2 GLU 104 HB2 GLU 104 6.810 9.043 4.119 753 HB3 GLU 104 HB1 GLU 104 8.142 9.863 4.920 754 HG2 GLU 104 HG2 GLU 104 8.574 11.111 2.832 755 HG3 GLU 104 HG1 GLU 104 7.153 10.347 2.123 756 H MET 105 HN MET 105 7.128 6.508 3.435 757 HA MET 105 HA MET 105 7.543 5.465 5.997 758 HB2 MET 105 HB2 MET 105 5.759 5.036 3.968 759 HB3 MET 105 HB1 MET 105 6.631 3.511 4.033 760 HG2 MET 105 HG2 MET 105 5.329 4.845 6.395 761 HG3 MET 105 HG1 MET 105 4.593 3.566 5.433 762 HE1 MET 105 HE3 MET 105 7.065 0.583 6.101 763 HE2 MET 105 HE1 MET 105 7.085 1.749 4.778 764 HE3 MET 105 HE2 MET 105 5.555 1.059 5.323 765 H VAL 106 HN VAL 106 8.710 4.168 2.843 766 HA VAL 106 HA VAL 106 10.206 2.084 3.933 767 HB VAL 106 HB VAL 106 9.679 2.124 1.577 768 HG11 VAL 106 HG11 VAL 106 11.168 4.701 1.630 769 HG12 VAL 106 HG12 VAL 106 9.615 4.300 0.897 770 HG13 VAL 106 HG13 VAL 106 11.113 3.753 0.145 771 HG21 VAL 106 HG23 VAL 106 12.296 1.653 2.610 772 HG22 VAL 106 HG21 VAL 106 12.442 2.291 0.972 773 HG23 VAL 106 HG22 VAL 106 11.480 0.838 1.269 774 H HIS 107 HN HIS 107 10.958 5.455 3.407 775 HA HIS 107 HA HIS 107 13.756 5.162 4.034 776 HD1 HIS 107 HD1 HIS 107 13.390 9.316 5.206 777 HD2 HIS 107 HD2 HIS 107 15.828 6.964 2.801 778 HE1 HIS 107 HE1 HIS 107 15.701 10.283 5.441 779 HE2 HIS 107 HE2 HIS 107 17.171 8.799 4.033 780 HB2 HIS 107 HB2 HIS 107 12.926 6.922 2.497 781 HB3 HIS 107 HB1 HIS 107 12.085 7.678 3.845 782 H SER 108 HN SER 108 10.823 5.892 5.753 783 HA SER 108 HA SER 108 11.940 7.099 8.038 784 HG SER 108 HG SER 108 9.965 7.391 9.741 785 HB2 SER 108 HB2 SER 108 9.557 7.230 7.579 786 HB3 SER 108 HB1 SER 108 9.401 5.480 7.738 Start of MODEL 14 1 HA SER 1 HA SER 1 1.790 -8.685 -6.025 2 HG SER 1 HG SER 1 0.220 -7.635 -3.146 3 H1 SER 1 HT1 SER 1 3.380 -9.551 -4.435 4 H2 SER 1 HT2 SER 1 1.827 -9.466 -3.777 5 H3 SER 1 HT3 SER 1 2.987 -8.316 -3.348 6 HB2 SER 1 HB2 SER 1 1.552 -6.333 -4.149 7 HB3 SER 1 HB1 SER 1 0.681 -6.590 -5.658 8 H ILE 2 HN ILE 2 2.137 -6.375 -7.113 9 HA ILE 2 HA ILE 2 3.631 -5.064 -8.268 10 HB ILE 2 HB ILE 2 5.262 -5.239 -5.724 11 HG12 ILE 2 HG12 ILE 2 4.098 -2.695 -6.176 12 HG13 ILE 2 HG11 ILE 2 2.832 -3.908 -6.225 13 HG21 ILE 2 HG21 ILE 2 6.016 -4.293 -8.243 14 HG22 ILE 2 HG22 ILE 2 6.862 -4.076 -6.712 15 HG23 ILE 2 HG23 ILE 2 5.699 -2.867 -7.256 16 HD11 ILE 2 HD13 ILE 2 3.783 -2.701 -4.011 17 HD12 ILE 2 HD11 ILE 2 4.749 -4.176 -4.038 18 HD13 ILE 2 HD12 ILE 2 2.989 -4.273 -4.038 19 H THR 3 HN THR 3 6.219 -6.610 -6.468 20 HA THR 3 HA THR 3 7.598 -8.346 -6.871 21 HB THR 3 HB THR 3 7.232 -10.006 -8.462 22 HG1 THR 3 HG1 THR 3 5.675 -9.608 -10.223 23 HG21 THR 3 HG23 THR 3 4.453 -8.974 -7.953 24 HG22 THR 3 HG21 THR 3 5.463 -9.676 -6.685 25 HG23 THR 3 HG22 THR 3 4.991 -10.650 -8.082 26 H ASP 4 HN ASP 4 7.542 -5.483 -8.396 27 HA ASP 4 HA ASP 4 9.241 -5.790 -10.587 28 HB2 ASP 4 HB2 ASP 4 9.034 -3.538 -8.573 29 HB3 ASP 4 HB1 ASP 4 10.023 -3.446 -10.026 30 H ILE 5 HN ILE 5 10.681 -4.217 -7.758 31 HA ILE 5 HA ILE 5 12.869 -6.163 -7.907 32 HB ILE 5 HB ILE 5 12.701 -3.441 -6.618 33 HG12 ILE 5 HG12 ILE 5 14.363 -2.895 -8.393 34 HG13 ILE 5 HG11 ILE 5 14.054 -4.454 -9.120 35 HG21 ILE 5 HG21 ILE 5 14.203 -4.953 -5.395 36 HG22 ILE 5 HG22 ILE 5 15.078 -3.646 -6.194 37 HG23 ILE 5 HG23 ILE 5 15.086 -5.267 -6.890 38 HD11 ILE 5 HD13 ILE 5 11.907 -3.845 -9.763 39 HD12 ILE 5 HD11 ILE 5 12.869 -2.401 -10.072 40 HD13 ILE 5 HD12 ILE 5 11.850 -2.490 -8.635 41 H LEU 6 HN LEU 6 12.018 -7.818 -6.700 42 HA LEU 6 HA LEU 6 12.170 -7.636 -3.874 43 HG LEU 6 HG LEU 6 10.979 -5.974 -3.111 44 HB2 LEU 6 HB2 LEU 6 9.563 -7.205 -5.131 45 HB3 LEU 6 HB1 LEU 6 9.557 -8.402 -3.853 46 HD11 LEU 6 HD11 LEU 6 8.039 -5.791 -3.743 47 HD12 LEU 6 HD12 LEU 6 9.339 -4.942 -4.576 48 HD13 LEU 6 HD13 LEU 6 8.990 -4.577 -2.886 49 HD21 LEU 6 HD23 LEU 6 9.162 -7.974 -1.992 50 HD22 LEU 6 HD21 LEU 6 8.935 -6.348 -1.354 51 HD23 LEU 6 HD22 LEU 6 10.513 -7.129 -1.249 52 H SER 7 HN SER 7 11.497 -9.609 -2.737 53 HA SER 7 HA SER 7 11.943 -11.983 -4.362 54 HG SER 7 HG SER 7 13.567 -10.846 -1.736 55 HB2 SER 7 HB2 SER 7 11.625 -11.670 -1.359 56 HB3 SER 7 HB1 SER 7 12.071 -13.159 -2.188 57 H ALA 8 HN ALA 8 10.248 -13.114 -5.139 58 HA ALA 8 HA ALA 8 7.599 -12.259 -4.845 59 HB1 ALA 8 HB3 ALA 8 8.446 -13.539 -6.770 60 HB2 ALA 8 HB1 ALA 8 6.986 -14.245 -6.078 61 HB3 ALA 8 HB2 ALA 8 8.557 -14.972 -5.748 62 H GLU 9 HN GLU 9 9.272 -15.011 -3.321 63 HA GLU 9 HA GLU 9 7.011 -16.044 -2.003 64 HB2 GLU 9 HB2 GLU 9 9.952 -16.261 -1.377 65 HB3 GLU 9 HB1 GLU 9 8.704 -17.208 -0.570 66 HG2 GLU 9 HG2 GLU 9 9.276 -17.219 -3.513 67 HG3 GLU 9 HG1 GLU 9 9.850 -18.430 -2.368 68 H ASP 10 HN ASP 10 9.715 -14.132 -0.708 69 HA ASP 10 HA ASP 10 8.791 -13.604 1.768 70 HB2 ASP 10 HB2 ASP 10 10.205 -11.687 -0.074 71 HB3 ASP 10 HB1 ASP 10 10.026 -11.438 1.658 72 H ILE 11 HN ILE 11 7.714 -12.090 -1.185 73 HA ILE 11 HA ILE 11 6.092 -10.142 0.173 74 HB ILE 11 HB ILE 11 6.338 -11.055 -2.669 75 HG12 ILE 11 HG12 ILE 11 6.744 -8.386 -1.308 76 HG13 ILE 11 HG11 ILE 11 8.017 -9.508 -1.784 77 HG21 ILE 11 HG21 ILE 11 4.174 -9.335 -1.518 78 HG22 ILE 11 HG22 ILE 11 4.052 -10.634 -2.705 79 HG23 ILE 11 HG23 ILE 11 4.746 -9.079 -3.166 80 HD11 ILE 11 HD13 ILE 11 7.818 -7.675 -3.361 81 HD12 ILE 11 HD11 ILE 11 6.127 -8.080 -3.640 82 HD13 ILE 11 HD12 ILE 11 7.394 -9.204 -4.129 83 H ALA 12 HN ALA 12 5.579 -13.281 -1.358 84 HA ALA 12 HA ALA 12 2.785 -13.361 -1.128 85 HB1 ALA 12 HB3 ALA 12 4.590 -15.041 -2.198 86 HB2 ALA 12 HB1 ALA 12 2.928 -15.513 -1.828 87 HB3 ALA 12 HB2 ALA 12 4.225 -15.893 -0.697 88 H ALA 13 HN ALA 13 5.265 -14.665 1.069 89 HA ALA 13 HA ALA 13 3.413 -15.418 3.064 90 HB1 ALA 13 HB3 ALA 13 5.838 -16.157 2.877 91 HB2 ALA 13 HB1 ALA 13 5.279 -15.738 4.498 92 HB3 ALA 13 HB2 ALA 13 6.266 -14.597 3.584 93 H ALA 14 HN ALA 14 5.593 -12.662 2.839 94 HA ALA 14 HA ALA 14 4.826 -11.152 4.967 95 HB1 ALA 14 HB3 ALA 14 6.592 -10.344 3.631 96 HB2 ALA 14 HB1 ALA 14 5.324 -9.125 3.531 97 HB3 ALA 14 HB2 ALA 14 5.569 -10.250 2.197 98 H LEU 15 HN LEU 15 3.237 -11.233 1.801 99 HA LEU 15 HA LEU 15 1.174 -9.396 2.571 100 HG LEU 15 HG LEU 15 0.433 -8.283 0.331 101 HB2 LEU 15 HB2 LEU 15 2.167 -9.911 0.223 102 HB3 LEU 15 HB1 LEU 15 1.017 -11.235 0.213 103 HD11 LEU 15 HD11 LEU 15 -0.305 -10.452 -1.627 104 HD12 LEU 15 HD12 LEU 15 0.866 -9.156 -1.882 105 HD13 LEU 15 HD13 LEU 15 -0.847 -8.775 -1.707 106 HD21 LEU 15 HD23 LEU 15 -1.512 -10.564 0.637 107 HD22 LEU 15 HD21 LEU 15 -1.919 -8.855 0.503 108 HD23 LEU 15 HD22 LEU 15 -1.032 -9.441 1.908 109 H GLN 16 HN GLN 16 1.202 -12.843 1.723 110 HA GLN 16 HA GLN 16 -1.507 -13.314 2.341 111 HB2 GLN 16 HB2 GLN 16 0.785 -15.251 1.988 112 HB3 GLN 16 HB1 GLN 16 -0.938 -15.614 1.845 113 HG2 GLN 16 HG2 GLN 16 0.377 -13.563 0.123 114 HG3 GLN 16 HG1 GLN 16 0.436 -15.274 -0.291 115 HE21 GLN 16 HE21 GLN 16 -1.550 -12.462 0.053 116 HE22 GLN 16 HE22 GLN 16 -2.939 -13.079 -0.763 117 H GLU 17 HN GLU 17 1.019 -12.762 4.479 118 HA GLU 17 HA GLU 17 0.779 -14.968 6.220 119 HB2 GLU 17 HB2 GLU 17 2.719 -13.638 6.414 120 HB3 GLU 17 HB1 GLU 17 1.778 -12.191 6.618 121 HG2 GLU 17 HG2 GLU 17 1.077 -12.921 8.808 122 HG3 GLU 17 HG1 GLU 17 1.945 -14.441 8.599 123 H CYS 18 HN CYS 18 -0.110 -11.649 7.100 124 HA CYS 18 HA CYS 18 -2.282 -12.708 8.697 125 HG CYS 18 HG CYS 18 -1.021 -11.750 11.686 126 HB2 CYS 18 HB2 CYS 18 -0.165 -11.168 9.328 127 HB3 CYS 18 HB1 CYS 18 -1.368 -9.920 8.980 128 H GLN 19 HN GLN 19 -2.097 -11.582 5.670 129 HA GLN 19 HA GLN 19 -3.476 -9.245 5.381 130 HB2 GLN 19 HB2 GLN 19 -2.665 -10.366 3.441 131 HB3 GLN 19 HB1 GLN 19 -3.668 -11.765 3.764 132 HG2 GLN 19 HG2 GLN 19 -5.671 -10.358 3.348 133 HG3 GLN 19 HG1 GLN 19 -4.593 -9.053 2.873 134 HE21 GLN 19 HE21 GLN 19 -3.794 -9.016 0.873 135 HE22 GLN 19 HE22 GLN 19 -4.088 -10.224 -0.322 136 H ASP 20 HN ASP 20 -5.501 -8.559 5.284 137 HA ASP 20 HA ASP 20 -7.895 -9.890 5.345 138 HB2 ASP 20 HB2 ASP 20 -6.520 -10.058 7.892 139 HB3 ASP 20 HB1 ASP 20 -8.067 -9.242 8.066 140 HA PRO 21 HA PRO 21 -9.344 -5.696 5.507 141 HB2 PRO 21 HB2 PRO 21 -11.734 -5.818 6.622 142 HB3 PRO 21 HB1 PRO 21 -11.423 -6.641 5.102 143 HG2 PRO 21 HG2 PRO 21 -11.508 -7.736 7.887 144 HG3 PRO 21 HG1 PRO 21 -12.236 -8.392 6.408 145 HD2 PRO 21 HD2 PRO 21 -9.872 -9.263 7.424 146 HD3 PRO 21 HD1 PRO 21 -10.271 -9.304 5.703 147 H ASP 22 HN ASP 22 -7.464 -5.915 7.453 148 HA ASP 22 HA ASP 22 -7.774 -3.848 9.175 149 HB2 ASP 22 HB2 ASP 22 -9.674 -4.795 10.250 150 HB3 ASP 22 HB1 ASP 22 -8.898 -6.361 10.415 151 H THR 23 HN THR 23 -6.057 -6.593 8.241 152 HA THR 23 HA THR 23 -4.215 -6.535 10.481 153 HB THR 23 HB THR 23 -3.061 -8.343 9.134 154 HG1 THR 23 HG1 THR 23 -3.820 -8.732 7.207 155 HG21 THR 23 HG23 THR 23 -4.220 -9.472 10.695 156 HG22 THR 23 HG21 THR 23 -5.401 -9.772 9.421 157 HG23 THR 23 HG22 THR 23 -5.625 -8.419 10.530 158 H PHE 24 HN PHE 24 -4.354 -5.572 7.142 159 HA PHE 24 HA PHE 24 -3.022 -3.743 6.309 160 HD1 PHE 24 HD2 PHE 24 -2.746 -3.635 9.554 161 HD2 PHE 24 HD1 PHE 24 0.151 -1.951 6.934 162 HE1 PHE 24 HE2 PHE 24 -2.798 -1.556 10.850 163 HE2 PHE 24 HE1 PHE 24 0.106 0.140 8.233 164 HZ PHE 24 HZ PHE 24 -1.370 0.338 10.195 165 HB2 PHE 24 HB2 PHE 24 -0.887 -5.005 7.998 166 HB3 PHE 24 HB1 PHE 24 -0.457 -4.077 6.597 167 H GLU 25 HN GLU 25 -3.783 -4.858 4.469 168 HA GLU 25 HA GLU 25 -2.414 -7.141 3.492 169 HB2 GLU 25 HB2 GLU 25 -4.145 -5.356 1.822 170 HB3 GLU 25 HB1 GLU 25 -3.870 -7.083 1.657 171 HG2 GLU 25 HG2 GLU 25 -5.040 -7.437 3.791 172 HG3 GLU 25 HG1 GLU 25 -5.378 -5.719 3.849 173 HA PRO 26 HA PRO 26 -0.420 -4.197 0.358 174 HB2 PRO 26 HB2 PRO 26 -0.614 -1.527 0.672 175 HB3 PRO 26 HB1 PRO 26 -1.839 -2.488 -0.144 176 HG2 PRO 26 HG2 PRO 26 -1.889 -1.264 2.518 177 HG3 PRO 26 HG1 PRO 26 -3.223 -1.642 1.429 178 HD2 PRO 26 HD2 PRO 26 -2.396 -3.127 3.693 179 HD3 PRO 26 HD1 PRO 26 -3.584 -3.617 2.473 180 H GLN 27 HN GLN 27 -0.237 -2.022 3.170 181 HA GLN 27 HA GLN 27 2.443 -1.358 2.795 182 HB2 GLN 27 HB2 GLN 27 0.375 -0.415 4.259 183 HB3 GLN 27 HB1 GLN 27 1.367 -1.142 5.513 184 HG2 GLN 27 HG2 GLN 27 2.547 0.698 3.491 185 HG3 GLN 27 HG1 GLN 27 1.719 1.314 4.913 186 HE21 GLN 27 HE21 GLN 27 2.629 1.021 6.943 187 HE22 GLN 27 HE22 GLN 27 4.274 0.544 7.157 188 H LYS 28 HN LYS 28 1.014 -3.895 4.793 189 HA LYS 28 HA LYS 28 3.374 -4.315 6.348 190 HB2 LYS 28 HB2 LYS 28 1.149 -5.017 7.131 191 HB3 LYS 28 HB1 LYS 28 1.081 -6.214 5.845 192 HG2 LYS 28 HG2 LYS 28 2.829 -7.477 6.794 193 HG3 LYS 28 HG1 LYS 28 3.242 -6.183 7.916 194 HD2 LYS 28 HD2 LYS 28 0.587 -7.596 7.942 195 HD3 LYS 28 HD1 LYS 28 1.969 -8.106 8.893 196 HE2 LYS 28 HE2 LYS 28 0.695 -5.416 9.041 197 HE3 LYS 28 HE1 LYS 28 0.415 -6.720 10.180 198 HZ1 LYS 28 HZ3 LYS 28 3.014 -5.376 9.668 199 HZ2 LYS 28 HZ1 LYS 28 2.774 -6.662 10.742 200 HZ3 LYS 28 HZ2 LYS 28 2.040 -5.166 11.035 201 H PHE 29 HN PHE 29 2.024 -5.833 3.479 202 HA PHE 29 HA PHE 29 3.887 -7.893 3.218 203 HD1 PHE 29 HD1 PHE 29 4.979 -7.703 0.237 204 HD2 PHE 29 HD2 PHE 29 1.118 -5.986 -0.218 205 HE1 PHE 29 HE1 PHE 29 5.539 -7.076 -2.072 206 HE2 PHE 29 HE2 PHE 29 1.679 -5.331 -2.519 207 HZ PHE 29 HZ PHE 29 3.891 -5.894 -3.449 208 HB2 PHE 29 HB2 PHE 29 2.512 -8.389 1.535 209 HB3 PHE 29 HB1 PHE 29 1.677 -6.871 1.798 210 H PHE 30 HN PHE 30 3.901 -4.605 2.089 211 HA PHE 30 HA PHE 30 6.166 -4.571 0.473 212 HD1 PHE 30 HD1 PHE 30 4.668 -4.102 -0.801 213 HD2 PHE 30 HD2 PHE 30 3.839 -0.664 1.552 214 HE1 PHE 30 HE1 PHE 30 2.813 -3.501 -2.280 215 HE2 PHE 30 HE2 PHE 30 1.977 -0.074 0.064 216 HZ PHE 30 HZ PHE 30 1.462 -1.502 -1.866 217 HB2 PHE 30 HB2 PHE 30 5.207 -2.439 2.360 218 HB3 PHE 30 HB1 PHE 30 6.363 -2.183 1.071 219 H GLN 31 HN GLN 31 5.931 -3.659 3.878 220 HA GLN 31 HA GLN 31 8.573 -3.254 4.395 221 HB2 GLN 31 HB2 GLN 31 6.315 -4.165 6.159 222 HB3 GLN 31 HB1 GLN 31 7.884 -3.703 6.769 223 HG2 GLN 31 HG2 GLN 31 5.885 -1.983 5.374 224 HG3 GLN 31 HG1 GLN 31 6.520 -1.810 7.011 225 HE21 GLN 31 HE21 GLN 31 9.265 -2.375 6.191 226 HE22 GLN 31 HE22 GLN 31 9.821 -1.016 5.291 227 H THR 32 HN THR 32 6.772 -6.103 5.496 228 HA THR 32 HA THR 32 8.801 -7.540 6.565 229 HB THR 32 HB THR 32 6.493 -8.625 4.957 230 HG1 THR 32 HG1 THR 32 5.540 -8.816 7.029 231 HG21 THR 32 HG23 THR 32 6.821 -10.713 6.200 232 HG22 THR 32 HG21 THR 32 8.262 -10.035 6.959 233 HG23 THR 32 HG22 THR 32 8.236 -10.329 5.220 234 H SER 33 HN SER 33 7.803 -7.737 3.142 235 HA SER 33 HA SER 33 10.093 -9.398 2.539 236 HG SER 33 HG SER 33 9.888 -9.027 -0.351 237 HB2 SER 33 HB2 SER 33 7.941 -9.914 1.508 238 HB3 SER 33 HB1 SER 33 7.943 -8.360 0.692 239 H GLY 34 HN GLY 34 8.860 -6.286 1.274 240 HA2 GLY 34 HA2 GLY 34 11.548 -5.924 0.161 241 HA3 GLY 34 HA1 GLY 34 10.128 -5.116 -0.431 242 H LEU 35 HN LEU 35 9.176 -3.582 1.494 243 HA LEU 35 HA LEU 35 10.812 -1.389 1.288 244 HG LEU 35 HG LEU 35 9.163 0.654 1.890 245 HB2 LEU 35 HB2 LEU 35 8.311 -2.129 2.524 246 HB3 LEU 35 HB1 LEU 35 9.200 -0.988 3.506 247 HD11 LEU 35 HD11 LEU 35 8.038 -0.065 -0.434 248 HD12 LEU 35 HD12 LEU 35 8.860 -1.572 -0.021 249 HD13 LEU 35 HD13 LEU 35 9.776 -0.073 -0.152 250 HD21 LEU 35 HD23 LEU 35 6.532 -0.287 1.087 251 HD22 LEU 35 HD21 LEU 35 7.004 1.168 1.961 252 HD23 LEU 35 HD22 LEU 35 6.838 -0.360 2.821 253 H SER 36 HN SER 36 10.491 -3.634 4.033 254 HA SER 36 HA SER 36 11.892 -2.519 5.989 255 HG SER 36 HG SER 36 12.938 -6.289 5.143 256 HB2 SER 36 HB2 SER 36 12.813 -4.746 6.577 257 HB3 SER 36 HB1 SER 36 11.106 -4.807 6.139 258 H LYS 37 HN LYS 37 13.364 -3.395 2.915 259 HA LYS 37 HA LYS 37 15.845 -2.158 3.879 260 HB2 LYS 37 HB2 LYS 37 15.702 -4.771 2.377 261 HB3 LYS 37 HB1 LYS 37 17.180 -3.891 2.726 262 HG2 LYS 37 HG2 LYS 37 15.316 -4.860 4.857 263 HG3 LYS 37 HG1 LYS 37 16.668 -5.812 4.250 264 HD2 LYS 37 HD2 LYS 37 18.190 -3.959 4.880 265 HD3 LYS 37 HD1 LYS 37 16.814 -3.109 5.586 266 HE2 LYS 37 HE2 LYS 37 16.473 -4.910 7.168 267 HE3 LYS 37 HE1 LYS 37 17.765 -5.847 6.421 268 HZ1 LYS 37 HZ3 LYS 37 19.335 -4.126 7.078 269 HZ2 LYS 37 HZ1 LYS 37 18.527 -4.751 8.427 270 HZ3 LYS 37 HZ2 LYS 37 18.092 -3.238 7.805 271 H MET 38 HN MET 38 13.782 -2.920 1.133 272 HA MET 38 HA MET 38 15.324 -2.191 -1.010 273 HB2 MET 38 HB2 MET 38 12.402 -1.600 -0.579 274 HB3 MET 38 HB1 MET 38 13.230 -1.582 -2.122 275 HG2 MET 38 HG2 MET 38 12.923 -3.948 -0.328 276 HG3 MET 38 HG1 MET 38 12.006 -3.659 -1.788 277 HE1 MET 38 HE3 MET 38 14.481 -6.697 -2.551 278 HE2 MET 38 HE1 MET 38 12.787 -6.220 -2.484 279 HE3 MET 38 HE2 MET 38 13.736 -6.305 -1.002 280 H SER 39 HN SER 39 15.679 -0.333 -2.208 281 HA SER 39 HA SER 39 16.011 2.055 -0.689 282 HG SER 39 HG SER 39 17.965 0.341 -2.642 283 HB2 SER 39 HB2 SER 39 16.456 1.511 -3.630 284 HB3 SER 39 HB1 SER 39 16.984 2.956 -2.767 285 H ALA 40 HN ALA 40 15.448 4.168 -2.018 286 HA ALA 40 HA ALA 40 12.615 4.422 -1.859 287 HB1 ALA 40 HB3 ALA 40 14.546 6.411 -3.028 288 HB2 ALA 40 HB1 ALA 40 14.241 6.224 -1.302 289 HB3 ALA 40 HB2 ALA 40 12.936 6.726 -2.378 290 H SER 41 HN SER 41 14.888 4.417 -4.599 291 HA SER 41 HA SER 41 13.297 5.169 -6.653 292 HG SER 41 HG SER 41 15.660 2.091 -6.937 293 HB2 SER 41 HB2 SER 41 14.735 3.601 -8.057 294 HB3 SER 41 HB1 SER 41 15.580 4.813 -7.094 295 H GLN 42 HN GLN 42 13.770 1.727 -5.782 296 HA GLN 42 HA GLN 42 11.861 0.835 -7.646 297 HB2 GLN 42 HB2 GLN 42 11.980 -1.310 -6.650 298 HB3 GLN 42 HB1 GLN 42 13.595 -0.613 -6.606 299 HG2 GLN 42 HG2 GLN 42 13.407 -0.114 -4.321 300 HG3 GLN 42 HG1 GLN 42 11.693 -0.503 -4.299 301 HE21 GLN 42 HE21 GLN 42 11.077 -2.494 -3.817 302 HE22 GLN 42 HE22 GLN 42 12.125 -3.867 -3.712 303 H VAL 43 HN VAL 43 11.578 2.024 -4.463 304 HA VAL 43 HA VAL 43 9.078 1.000 -3.745 305 HB VAL 43 HB VAL 43 10.123 3.738 -3.031 306 HG11 VAL 43 HG11 VAL 43 8.061 2.038 -1.659 307 HG12 VAL 43 HG12 VAL 43 7.687 3.398 -2.716 308 HG13 VAL 43 HG13 VAL 43 8.559 3.669 -1.203 309 HG21 VAL 43 HG23 VAL 43 11.263 1.324 -2.430 310 HG22 VAL 43 HG21 VAL 43 10.206 1.584 -1.046 311 HG23 VAL 43 HG22 VAL 43 11.429 2.781 -1.454 312 H LYS 44 HN LYS 44 9.988 3.479 -5.963 313 HA LYS 44 HA LYS 44 7.591 4.840 -6.353 314 HB2 LYS 44 HB2 LYS 44 9.743 4.052 -8.327 315 HB3 LYS 44 HB1 LYS 44 8.399 5.098 -8.749 316 HG2 LYS 44 HG2 LYS 44 9.147 6.807 -7.307 317 HG3 LYS 44 HG1 LYS 44 10.288 5.728 -6.511 318 HD2 LYS 44 HD2 LYS 44 11.264 7.380 -8.172 319 HD3 LYS 44 HD1 LYS 44 11.725 5.690 -8.371 320 HE2 LYS 44 HE2 LYS 44 10.088 5.430 -10.147 321 HE3 LYS 44 HE1 LYS 44 9.553 7.097 -9.924 322 HZ1 LYS 44 HZ3 LYS 44 11.752 7.853 -10.582 323 HZ2 LYS 44 HZ1 LYS 44 11.069 6.889 -11.796 324 HZ3 LYS 44 HZ2 LYS 44 12.270 6.256 -10.787 325 H ASP 45 HN ASP 45 8.805 1.906 -7.897 326 HA ASP 45 HA ASP 45 6.507 1.395 -9.467 327 HB2 ASP 45 HB2 ASP 45 9.074 0.228 -9.072 328 HB3 ASP 45 HB1 ASP 45 7.877 -1.039 -8.835 329 H ILE 46 HN ILE 46 7.625 0.288 -6.308 330 HA ILE 46 HA ILE 46 5.647 -1.593 -5.788 331 HB ILE 46 HB ILE 46 7.501 0.030 -4.146 332 HG12 ILE 46 HG12 ILE 46 8.429 -2.092 -3.605 333 HG13 ILE 46 HG11 ILE 46 7.014 -2.932 -4.226 334 HG21 ILE 46 HG21 ILE 46 5.108 -1.384 -3.063 335 HG22 ILE 46 HG22 ILE 46 5.826 0.152 -2.574 336 HG23 ILE 46 HG23 ILE 46 6.612 -1.365 -2.140 337 HD11 ILE 46 HD13 ILE 46 7.602 -2.156 -6.490 338 HD12 ILE 46 HD11 ILE 46 8.845 -3.171 -5.760 339 HD13 ILE 46 HD12 ILE 46 9.063 -1.425 -5.829 340 H PHE 47 HN PHE 47 5.790 1.824 -4.727 341 HA PHE 47 HA PHE 47 3.423 2.148 -3.519 342 HD1 PHE 47 HD2 PHE 47 3.170 3.741 -2.161 343 HD2 PHE 47 HD1 PHE 47 3.044 5.973 -5.766 344 HE1 PHE 47 HE2 PHE 47 1.549 5.259 -1.152 345 HE2 PHE 47 HE1 PHE 47 1.395 7.509 -4.752 346 HZ PHE 47 HZ PHE 47 0.651 7.144 -2.446 347 HB2 PHE 47 HB2 PHE 47 5.123 3.913 -4.051 348 HB3 PHE 47 HB1 PHE 47 4.372 4.079 -5.633 349 H ARG 48 HN ARG 48 3.861 1.628 -6.922 350 HA ARG 48 HA ARG 48 1.411 2.482 -7.899 351 HE ARG 48 HE ARG 48 4.544 4.931 -9.624 352 HB2 ARG 48 HB2 ARG 48 3.023 0.116 -8.851 353 HB3 ARG 48 HB1 ARG 48 1.779 0.955 -9.768 354 HG2 ARG 48 HG2 ARG 48 4.440 2.032 -8.884 355 HG3 ARG 48 HG1 ARG 48 3.888 1.734 -10.534 356 HD2 ARG 48 HD2 ARG 48 2.132 3.458 -10.200 357 HD3 ARG 48 HD1 ARG 48 2.814 3.804 -8.608 358 HH11 ARG 48 HH11 ARG 48 2.756 3.137 -12.015 359 HH12 ARG 48 HH12 ARG 48 3.542 3.893 -13.360 360 HH21 ARG 48 HH21 ARG 48 5.586 5.934 -11.389 361 HH22 ARG 48 HH22 ARG 48 5.151 5.483 -13.005 362 H PHE 49 HN PHE 49 2.138 -0.295 -5.933 363 HA PHE 49 HA PHE 49 0.072 -2.018 -6.522 364 HD1 PHE 49 HD2 PHE 49 0.111 -4.278 -5.811 365 HD2 PHE 49 HD1 PHE 49 -0.314 -2.227 -2.103 366 HE1 PHE 49 HE2 PHE 49 -1.312 -6.098 -4.972 367 HE2 PHE 49 HE1 PHE 49 -1.734 -4.054 -1.260 368 HZ PHE 49 HZ PHE 49 -2.234 -5.988 -2.692 369 HB2 PHE 49 HB2 PHE 49 1.824 -2.454 -4.820 370 HB3 PHE 49 HB1 PHE 49 1.030 -1.314 -3.741 371 H ILE 50 HN ILE 50 -0.076 0.434 -3.914 372 HA ILE 50 HA ILE 50 -2.862 0.299 -3.694 373 HB ILE 50 HB ILE 50 -2.655 2.538 -2.506 374 HG12 ILE 50 HG12 ILE 50 0.304 2.009 -2.859 375 HG13 ILE 50 HG11 ILE 50 -0.581 3.319 -3.634 376 HG21 ILE 50 HG21 ILE 50 -1.352 -0.003 -1.744 377 HG22 ILE 50 HG22 ILE 50 -2.745 0.821 -1.040 378 HG23 ILE 50 HG23 ILE 50 -1.114 1.399 -0.704 379 HD11 ILE 50 HD13 ILE 50 -0.920 3.220 -0.740 380 HD12 ILE 50 HD11 ILE 50 -0.558 4.578 -1.799 381 HD13 ILE 50 HD12 ILE 50 0.740 3.513 -1.259 382 H ASP 51 HN ASP 51 -3.368 3.332 -3.953 383 HA ASP 51 HA ASP 51 -4.227 3.127 -6.673 384 HB2 ASP 51 HB2 ASP 51 -4.646 5.034 -4.435 385 HB3 ASP 51 HB1 ASP 51 -4.864 5.654 -6.078 386 H ASN 52 HN ASN 52 -3.846 4.980 -8.218 387 HA ASN 52 HA ASN 52 -1.006 5.745 -8.092 388 HB2 ASN 52 HB2 ASN 52 -1.346 3.959 -9.690 389 HB3 ASN 52 HB1 ASN 52 -2.583 4.897 -10.516 390 HD21 ASN 52 HD21 ASN 52 0.427 6.207 -9.256 391 HD22 ASN 52 HD22 ASN 52 1.109 6.600 -10.791 392 H ASP 53 HN ASP 53 -4.152 6.786 -9.508 393 HA ASP 53 HA ASP 53 -3.194 9.516 -9.247 394 HB2 ASP 53 HB2 ASP 53 -4.066 8.428 -11.926 395 HB3 ASP 53 HB1 ASP 53 -3.704 10.116 -11.578 396 H GLN 54 HN GLN 54 -5.108 8.504 -7.754 397 HA GLN 54 HA GLN 54 -7.726 8.784 -8.639 398 HB2 GLN 54 HB2 GLN 54 -6.904 9.575 -5.860 399 HB3 GLN 54 HB1 GLN 54 -8.383 8.780 -6.384 400 HG2 GLN 54 HG2 GLN 54 -6.719 6.903 -7.151 401 HG3 GLN 54 HG1 GLN 54 -5.674 7.654 -5.956 402 HE21 GLN 54 HE21 GLN 54 -6.242 7.580 -3.777 403 HE22 GLN 54 HE22 GLN 54 -7.426 6.479 -3.173 404 H SER 55 HN SER 55 -5.940 11.270 -6.745 405 HA SER 55 HA SER 55 -7.035 13.340 -8.450 406 HG SER 55 HG SER 55 -9.342 13.064 -7.863 407 HB2 SER 55 HB2 SER 55 -7.760 13.232 -5.513 408 HB3 SER 55 HB1 SER 55 -8.104 14.577 -6.600 409 H GLY 56 HN GLY 56 -4.388 12.623 -8.113 410 HA2 GLY 56 HA2 GLY 56 -2.479 14.049 -8.015 411 HA3 GLY 56 HA1 GLY 56 -3.342 15.066 -6.862 412 H TYR 57 HN TYR 57 -4.207 12.764 -5.339 413 HA TYR 57 HA TYR 57 -1.834 11.506 -4.246 414 HD1 TYR 57 HD1 TYR 57 -4.925 14.143 -2.812 415 HD2 TYR 57 HD2 TYR 57 -0.817 14.928 -3.460 416 HE1 TYR 57 HE1 TYR 57 -5.473 16.493 -3.338 417 HE2 TYR 57 HE2 TYR 57 -1.328 17.282 -3.974 418 HH TYR 57 HH TYR 57 -4.408 18.661 -3.377 419 HB2 TYR 57 HB2 TYR 57 -3.256 12.648 -2.013 420 HB3 TYR 57 HB1 TYR 57 -1.571 12.859 -2.436 421 H LEU 58 HN LEU 58 -2.499 10.017 -2.433 422 HA LEU 58 HA LEU 58 -5.177 8.971 -3.032 423 HG LEU 58 HG LEU 58 -2.051 8.167 -3.650 424 HB2 LEU 58 HB2 LEU 58 -3.045 7.573 -1.440 425 HB3 LEU 58 HB1 LEU 58 -4.404 6.862 -2.287 426 HD11 LEU 58 HD11 LEU 58 -2.632 5.286 -3.027 427 HD12 LEU 58 HD12 LEU 58 -1.193 6.224 -2.617 428 HD13 LEU 58 HD13 LEU 58 -1.514 5.789 -4.295 429 HD21 LEU 58 HD23 LEU 58 -3.134 6.614 -5.501 430 HD22 LEU 58 HD21 LEU 58 -3.629 8.287 -5.247 431 HD23 LEU 58 HD22 LEU 58 -4.571 6.976 -4.554 432 H ASP 59 HN ASP 59 -6.667 8.584 -1.278 433 HA ASP 59 HA ASP 59 -5.766 9.497 1.346 434 HB2 ASP 59 HB2 ASP 59 -6.584 11.508 0.154 435 HB3 ASP 59 HB1 ASP 59 -8.159 10.729 -0.021 436 H GLY 60 HN GLY 60 -7.198 9.087 3.031 437 HA2 GLY 60 HA2 GLY 60 -7.827 6.490 3.397 438 HA3 GLY 60 HA1 GLY 60 -8.634 7.786 4.262 439 H ASP 61 HN ASP 61 -9.887 8.802 1.795 440 HA ASP 61 HA ASP 61 -12.275 7.210 1.962 441 HB2 ASP 61 HB2 ASP 61 -11.704 9.323 -0.100 442 HB3 ASP 61 HB1 ASP 61 -13.266 8.854 0.580 443 H GLU 62 HN GLU 62 -9.932 8.037 -0.482 444 HA GLU 62 HA GLU 62 -11.076 6.345 -2.482 445 HB2 GLU 62 HB2 GLU 62 -8.501 7.900 -2.489 446 HB3 GLU 62 HB1 GLU 62 -9.341 7.233 -3.889 447 HG2 GLU 62 HG2 GLU 62 -11.115 8.758 -3.692 448 HG3 GLU 62 HG1 GLU 62 -10.606 9.251 -2.079 449 H LEU 63 HN LEU 63 -8.527 6.085 -0.150 450 HA LEU 63 HA LEU 63 -6.714 4.365 -1.182 451 HG LEU 63 HG LEU 63 -6.638 6.326 1.240 452 HB2 LEU 63 HB2 LEU 63 -7.970 4.424 1.550 453 HB3 LEU 63 HB1 LEU 63 -6.647 3.346 1.171 454 HD11 LEU 63 HD11 LEU 63 -4.417 5.209 2.532 455 HD12 LEU 63 HD12 LEU 63 -5.844 4.317 3.062 456 HD13 LEU 63 HD13 LEU 63 -5.782 6.067 3.241 457 HD21 LEU 63 HD23 LEU 63 -4.670 4.505 -0.069 458 HD22 LEU 63 HD21 LEU 63 -4.226 6.114 0.507 459 HD23 LEU 63 HD22 LEU 63 -5.471 5.935 -0.735 460 H LYS 64 HN LYS 64 -9.958 3.368 -0.006 461 HA LYS 64 HA LYS 64 -9.622 0.653 -0.143 462 HB2 LYS 64 HB2 LYS 64 -12.106 2.218 -0.835 463 HB3 LYS 64 HB1 LYS 64 -12.046 0.552 -0.301 464 HG2 LYS 64 HG2 LYS 64 -11.581 1.116 1.876 465 HG3 LYS 64 HG1 LYS 64 -10.892 2.674 1.424 466 HD2 LYS 64 HD2 LYS 64 -13.025 3.015 2.511 467 HD3 LYS 64 HD1 LYS 64 -13.140 3.468 0.809 468 HE2 LYS 64 HE2 LYS 64 -14.247 1.408 0.277 469 HE3 LYS 64 HE1 LYS 64 -13.993 0.796 1.912 470 HZ1 LYS 64 HZ3 LYS 64 -15.417 2.587 2.738 471 HZ2 LYS 64 HZ1 LYS 64 -16.242 1.593 1.643 472 HZ3 LYS 64 HZ2 LYS 64 -15.690 3.115 1.154 473 H TYR 65 HN TYR 65 -9.937 2.884 -2.782 474 HA TYR 65 HA TYR 65 -10.898 0.961 -4.675 475 HD1 TYR 65 HD1 TYR 65 -12.616 2.066 -4.119 476 HD2 TYR 65 HD2 TYR 65 -10.614 5.612 -5.358 477 HE1 TYR 65 HE1 TYR 65 -14.466 3.431 -3.219 478 HE2 TYR 65 HE2 TYR 65 -12.457 6.976 -4.472 479 HH TYR 65 HH TYR 65 -14.834 6.730 -3.926 480 HB2 TYR 65 HB2 TYR 65 -9.465 3.522 -5.350 481 HB3 TYR 65 HB1 TYR 65 -10.603 2.626 -6.347 482 H PHE 66 HN PHE 66 -7.809 1.536 -3.337 483 HA PHE 66 HA PHE 66 -6.036 1.093 -5.373 484 HD1 PHE 66 HD2 PHE 66 -3.965 -1.343 -4.634 485 HD2 PHE 66 HD1 PHE 66 -5.953 -0.597 -0.961 486 HE1 PHE 66 HE2 PHE 66 -3.218 -3.527 -3.796 487 HE2 PHE 66 HE1 PHE 66 -5.212 -2.781 -0.105 488 HZ PHE 66 HZ PHE 66 -3.840 -4.252 -1.525 489 HB2 PHE 66 HB2 PHE 66 -4.608 1.088 -3.625 490 HB3 PHE 66 HB1 PHE 66 -5.980 1.023 -2.547 491 H LEU 67 HN LEU 67 -7.665 -1.402 -3.474 492 HA LEU 67 HA LEU 67 -6.623 -3.649 -4.806 493 HG LEU 67 HG LEU 67 -7.322 -2.774 -2.075 494 HB2 LEU 67 HB2 LEU 67 -9.360 -3.328 -3.598 495 HB3 LEU 67 HB1 LEU 67 -8.533 -4.841 -3.864 496 HD11 LEU 67 HD11 LEU 67 -8.625 -3.292 -0.314 497 HD12 LEU 67 HD12 LEU 67 -8.945 -4.898 -0.915 498 HD13 LEU 67 HD13 LEU 67 -9.815 -3.537 -1.590 499 HD21 LEU 67 HD23 LEU 67 -7.218 -5.767 -1.914 500 HD22 LEU 67 HD21 LEU 67 -6.124 -4.590 -1.187 501 HD23 LEU 67 HD22 LEU 67 -6.112 -4.845 -2.936 502 H GLN 68 HN GLN 68 -9.337 -1.557 -5.375 503 HA GLN 68 HA GLN 68 -10.460 -3.036 -7.498 504 HB2 GLN 68 HB2 GLN 68 -10.816 -0.288 -6.382 505 HB3 GLN 68 HB1 GLN 68 -11.565 -0.703 -7.909 506 HG2 GLN 68 HG2 GLN 68 -12.592 -2.684 -6.769 507 HG3 GLN 68 HG1 GLN 68 -11.997 -2.016 -5.251 508 HE21 GLN 68 HE21 GLN 68 -14.121 -1.871 -4.503 509 HE22 GLN 68 HE22 GLN 68 -15.179 -0.605 -5.021 510 H LYS 69 HN LYS 69 -8.234 -0.201 -7.430 511 HA LYS 69 HA LYS 69 -7.986 0.198 -10.118 512 HB2 LYS 69 HB2 LYS 69 -5.695 0.213 -8.157 513 HB3 LYS 69 HB1 LYS 69 -5.806 1.135 -9.644 514 HG2 LYS 69 HG2 LYS 69 -7.210 1.551 -7.047 515 HG3 LYS 69 HG1 LYS 69 -6.248 2.690 -7.974 516 HD2 LYS 69 HD2 LYS 69 -8.985 1.652 -8.652 517 HD3 LYS 69 HD1 LYS 69 -8.584 3.282 -8.117 518 HE2 LYS 69 HE2 LYS 69 -7.561 2.018 -10.655 519 HE3 LYS 69 HE1 LYS 69 -8.953 3.095 -10.570 520 HZ1 LYS 69 HZ3 LYS 69 -6.935 4.268 -11.216 521 HZ2 LYS 69 HZ1 LYS 69 -6.180 3.805 -9.774 522 HZ3 LYS 69 HZ2 LYS 69 -7.517 4.839 -9.735 523 H PHE 70 HN PHE 70 -5.898 -1.794 -8.099 524 HA PHE 70 HA PHE 70 -4.487 -2.973 -10.229 525 HD1 PHE 70 HD2 PHE 70 -3.151 -5.759 -9.433 526 HD2 PHE 70 HD1 PHE 70 -5.181 -4.563 -5.886 527 HE1 PHE 70 HE2 PHE 70 -3.144 -8.091 -8.646 528 HE2 PHE 70 HE1 PHE 70 -5.178 -6.889 -5.092 529 HZ PHE 70 HZ PHE 70 -4.158 -8.659 -6.474 530 HB2 PHE 70 HB2 PHE 70 -3.163 -3.312 -8.468 531 HB3 PHE 70 HB1 PHE 70 -4.467 -2.952 -7.357 532 H GLN 71 HN GLN 71 -7.187 -4.143 -8.233 533 HA GLN 71 HA GLN 71 -7.339 -6.594 -9.787 534 HB2 GLN 71 HB2 GLN 71 -7.766 -6.568 -7.315 535 HB3 GLN 71 HB1 GLN 71 -9.241 -5.669 -7.639 536 HG2 GLN 71 HG2 GLN 71 -10.049 -7.524 -9.030 537 HG3 GLN 71 HG1 GLN 71 -8.586 -8.428 -8.645 538 HE21 GLN 71 HE21 GLN 71 -10.514 -6.417 -6.461 539 HE22 GLN 71 HE22 GLN 71 -10.973 -7.707 -5.419 540 H SER 72 HN SER 72 -9.855 -4.305 -8.821 541 HA SER 72 HA SER 72 -11.179 -3.000 -10.295 542 HG SER 72 HG SER 72 -12.828 -4.349 -12.805 543 HB2 SER 72 HB2 SER 72 -10.136 -3.821 -12.371 544 HB3 SER 72 HB1 SER 72 -11.035 -5.323 -12.202 545 H ASP 73 HN ASP 73 -11.505 -5.266 -8.277 546 HA ASP 73 HA ASP 73 -14.364 -5.251 -8.342 547 HB2 ASP 73 HB2 ASP 73 -13.883 -7.097 -9.913 548 HB3 ASP 73 HB1 ASP 73 -12.967 -7.917 -8.651 549 H ALA 74 HN ALA 74 -12.029 -4.564 -6.519 550 HA ALA 74 HA ALA 74 -11.876 -6.390 -4.413 551 HB1 ALA 74 HB3 ALA 74 -10.566 -4.855 -3.482 552 HB2 ALA 74 HB1 ALA 74 -11.741 -3.563 -3.714 553 HB3 ALA 74 HB2 ALA 74 -10.691 -4.046 -5.049 554 H ARG 75 HN ARG 75 -12.704 -6.132 -2.263 555 HA ARG 75 HA ARG 75 -15.518 -5.388 -2.265 556 HE ARG 75 HE ARG 75 -10.638 -6.380 0.857 557 HB2 ARG 75 HB2 ARG 75 -15.393 -6.400 0.102 558 HB3 ARG 75 HB1 ARG 75 -15.257 -7.491 -1.266 559 HG2 ARG 75 HG2 ARG 75 -13.672 -8.067 0.473 560 HG3 ARG 75 HG1 ARG 75 -12.829 -7.543 -0.983 561 HD2 ARG 75 HD2 ARG 75 -12.474 -5.346 0.004 562 HD3 ARG 75 HD1 ARG 75 -13.364 -5.829 1.444 563 HH11 ARG 75 HH11 ARG 75 -13.468 -7.703 2.393 564 HH12 ARG 75 HH12 ARG 75 -12.568 -8.668 3.515 565 HH21 ARG 75 HH21 ARG 75 -9.441 -7.649 2.329 566 HH22 ARG 75 HH22 ARG 75 -10.279 -8.638 3.479 567 H GLU 76 HN GLU 76 -12.640 -3.913 -1.732 568 HA GLU 76 HA GLU 76 -12.267 -1.741 -1.119 569 HB2 GLU 76 HB2 GLU 76 -14.710 -1.907 0.652 570 HB3 GLU 76 HB1 GLU 76 -13.765 -0.475 0.283 571 HG2 GLU 76 HG2 GLU 76 -14.423 -0.527 -1.997 572 HG3 GLU 76 HG1 GLU 76 -15.198 -2.086 -1.782 573 H LEU 77 HN LEU 77 -11.079 -0.916 0.532 574 HA LEU 77 HA LEU 77 -9.986 -2.828 2.335 575 HG LEU 77 HG LEU 77 -8.390 -1.472 0.252 576 HB2 LEU 77 HB2 LEU 77 -9.476 0.070 1.805 577 HB3 LEU 77 HB1 LEU 77 -8.710 -0.736 3.148 578 HD11 LEU 77 HD11 LEU 77 -6.781 0.096 2.213 579 HD12 LEU 77 HD12 LEU 77 -7.122 0.426 0.513 580 HD13 LEU 77 HD13 LEU 77 -5.965 -0.831 0.954 581 HD21 LEU 77 HD23 LEU 77 -7.025 -2.604 2.689 582 HD22 LEU 77 HD21 LEU 77 -6.762 -3.085 1.014 583 HD23 LEU 77 HD22 LEU 77 -8.305 -3.410 1.792 584 H THR 78 HN THR 78 -12.824 -2.034 2.861 585 HA THR 78 HA THR 78 -14.215 -1.252 4.483 586 HB THR 78 HB THR 78 -13.978 -2.504 6.513 587 HG1 THR 78 HG1 THR 78 -11.317 -3.126 5.707 588 HG21 THR 78 HG23 THR 78 -13.843 -4.713 5.663 589 HG22 THR 78 HG21 THR 78 -12.758 -4.225 4.361 590 HG23 THR 78 HG22 THR 78 -14.449 -3.720 4.337 591 H GLU 79 HN GLU 79 -14.125 -0.625 6.975 592 HA GLU 79 HA GLU 79 -13.032 1.967 7.098 593 HB2 GLU 79 HB2 GLU 79 -15.062 1.119 8.332 594 HB3 GLU 79 HB1 GLU 79 -13.968 0.239 9.394 595 HG2 GLU 79 HG2 GLU 79 -12.907 2.376 9.986 596 HG3 GLU 79 HG1 GLU 79 -14.124 3.204 9.019 597 H SER 80 HN SER 80 -12.186 -1.140 8.475 598 HA SER 80 HA SER 80 -9.975 -0.245 10.007 599 HG SER 80 HG SER 80 -8.549 -2.398 10.266 600 HB2 SER 80 HB2 SER 80 -11.340 -2.241 10.540 601 HB3 SER 80 HB1 SER 80 -10.631 -3.058 9.149 602 H GLU 81 HN GLU 81 -10.007 -2.265 6.967 603 HA GLU 81 HA GLU 81 -7.279 -2.539 6.839 604 HB2 GLU 81 HB2 GLU 81 -9.435 -3.295 5.275 605 HB3 GLU 81 HB1 GLU 81 -8.482 -2.285 4.213 606 HG2 GLU 81 HG2 GLU 81 -7.660 -4.807 5.582 607 HG3 GLU 81 HG1 GLU 81 -7.704 -4.459 3.853 608 H THR 82 HN THR 82 -9.226 0.100 5.355 609 HA THR 82 HA THR 82 -7.126 1.295 3.991 610 HB THR 82 HB THR 82 -8.339 3.384 4.101 611 HG1 THR 82 HG1 THR 82 -9.749 2.058 6.169 612 HG21 THR 82 HG23 THR 82 -9.968 0.905 3.653 613 HG22 THR 82 HG21 THR 82 -9.195 1.951 2.458 614 HG23 THR 82 HG22 THR 82 -10.618 2.515 3.341 615 H LYS 83 HN LYS 83 -7.706 1.058 7.385 616 HA LYS 83 HA LYS 83 -6.310 3.318 8.301 617 HB2 LYS 83 HB2 LYS 83 -7.671 1.743 9.726 618 HB3 LYS 83 HB1 LYS 83 -6.352 0.585 9.607 619 HG2 LYS 83 HG2 LYS 83 -4.867 2.072 10.764 620 HG3 LYS 83 HG1 LYS 83 -6.076 3.357 10.750 621 HD2 LYS 83 HD2 LYS 83 -7.559 1.888 12.108 622 HD3 LYS 83 HD1 LYS 83 -6.235 0.724 12.216 623 HE2 LYS 83 HE2 LYS 83 -4.843 2.405 13.315 624 HE3 LYS 83 HE1 LYS 83 -6.151 3.580 13.189 625 HZ1 LYS 83 HZ3 LYS 83 -7.512 2.123 14.587 626 HZ2 LYS 83 HZ1 LYS 83 -6.102 2.617 15.381 627 HZ3 LYS 83 HZ2 LYS 83 -6.212 1.053 14.748 628 H SER 84 HN SER 84 -5.327 0.197 7.100 629 HA SER 84 HA SER 84 -2.636 0.211 7.753 630 HG SER 84 HG SER 84 -4.916 -1.872 7.209 631 HB2 SER 84 HB2 SER 84 -4.091 -0.978 5.388 632 HB3 SER 84 HB1 SER 84 -2.475 -1.411 5.902 633 H LEU 85 HN LEU 85 -4.205 1.113 4.685 634 HA LEU 85 HA LEU 85 -1.959 2.205 3.460 635 HG LEU 85 HG LEU 85 -4.364 0.511 2.289 636 HB2 LEU 85 HB2 LEU 85 -4.919 2.624 3.149 637 HB3 LEU 85 HB1 LEU 85 -3.776 3.442 2.122 638 HD11 LEU 85 HD11 LEU 85 -4.324 2.508 0.038 639 HD12 LEU 85 HD12 LEU 85 -5.735 1.739 0.760 640 HD13 LEU 85 HD13 LEU 85 -4.586 0.776 -0.162 641 HD21 LEU 85 HD23 LEU 85 -1.956 0.658 2.340 642 HD22 LEU 85 HD21 LEU 85 -1.968 1.794 0.991 643 HD23 LEU 85 HD22 LEU 85 -2.489 0.128 0.750 644 H MET 86 HN MET 86 -4.449 3.635 5.458 645 HA MET 86 HA MET 86 -3.659 6.322 5.372 646 HB2 MET 86 HB2 MET 86 -4.965 4.760 7.615 647 HB3 MET 86 HB1 MET 86 -4.827 6.513 7.577 648 HG2 MET 86 HG2 MET 86 -6.035 5.358 5.182 649 HG3 MET 86 HG1 MET 86 -6.950 5.080 6.661 650 HE1 MET 86 HE3 MET 86 -4.643 8.263 5.946 651 HE2 MET 86 HE1 MET 86 -5.792 9.222 5.013 652 HE3 MET 86 HE2 MET 86 -5.225 7.670 4.390 653 H ASP 87 HN ASP 87 -2.831 3.717 7.596 654 HA ASP 87 HA ASP 87 -0.921 5.173 9.129 655 HB2 ASP 87 HB2 ASP 87 -1.468 2.228 8.826 656 HB3 ASP 87 HB1 ASP 87 -0.324 2.895 9.987 657 H ALA 88 HN ALA 88 -0.755 4.201 5.992 658 HA ALA 88 HA ALA 88 1.810 2.965 5.885 659 HB1 ALA 88 HB3 ALA 88 1.453 2.756 3.636 660 HB2 ALA 88 HB1 ALA 88 0.545 4.268 3.533 661 HB3 ALA 88 HB2 ALA 88 -0.196 2.843 4.252 662 H ALA 89 HN ALA 89 0.624 6.271 5.721 663 HA ALA 89 HA ALA 89 3.357 7.223 5.820 664 HB1 ALA 89 HB3 ALA 89 2.959 6.924 3.408 665 HB2 ALA 89 HB1 ALA 89 3.218 8.613 3.841 666 HB3 ALA 89 HB2 ALA 89 1.582 8.030 3.504 667 H ASP 90 HN ASP 90 0.314 8.726 4.785 668 HA ASP 90 HA ASP 90 0.579 11.062 6.215 669 HB2 ASP 90 HB2 ASP 90 -1.794 11.292 5.649 670 HB3 ASP 90 HB1 ASP 90 -0.810 10.852 4.308 671 H ASN 91 HN ASN 91 0.945 9.151 8.249 672 HA ASN 91 HA ASN 91 -1.456 9.067 9.827 673 HB2 ASN 91 HB2 ASN 91 1.041 8.367 11.195 674 HB3 ASN 91 HB1 ASN 91 -0.422 7.426 11.016 675 HD21 ASN 91 HD21 ASN 91 -0.490 7.277 8.267 676 HD22 ASN 91 HD22 ASN 91 0.853 6.357 7.754 677 H ASP 92 HN ASP 92 1.719 10.538 9.828 678 HA ASP 92 HA ASP 92 0.860 12.483 11.853 679 HB2 ASP 92 HB2 ASP 92 2.939 11.277 12.368 680 HB3 ASP 92 HB1 ASP 92 3.638 11.811 10.843 681 H GLY 93 HN GLY 93 0.128 12.436 8.968 682 HA2 GLY 93 HA2 GLY 93 1.229 15.070 8.215 683 HA3 GLY 93 HA1 GLY 93 0.946 13.803 7.028 684 H ASP 94 HN ASP 94 -0.970 13.863 5.970 685 HA ASP 94 HA ASP 94 -3.306 14.887 7.391 686 HB2 ASP 94 HB2 ASP 94 -2.073 15.997 4.900 687 HB3 ASP 94 HB1 ASP 94 -3.804 16.135 5.166 688 H GLY 95 HN GLY 95 -2.943 12.239 6.930 689 HA2 GLY 95 HA2 GLY 95 -3.983 10.406 6.051 690 HA3 GLY 95 HA1 GLY 95 -5.329 11.482 5.761 691 H LYS 96 HN LYS 96 -2.413 12.196 3.935 692 HA LYS 96 HA LYS 96 -3.724 10.910 1.658 693 HB2 LYS 96 HB2 LYS 96 -3.673 13.038 0.922 694 HB3 LYS 96 HB1 LYS 96 -2.348 13.478 1.983 695 HG2 LYS 96 HG2 LYS 96 -1.901 11.841 -0.485 696 HG3 LYS 96 HG1 LYS 96 -1.987 13.596 -0.527 697 HD2 LYS 96 HD2 LYS 96 -0.228 13.359 1.445 698 HD3 LYS 96 HD1 LYS 96 0.097 11.831 0.623 699 HE2 LYS 96 HE2 LYS 96 0.591 12.961 -1.425 700 HE3 LYS 96 HE1 LYS 96 0.066 14.506 -0.759 701 HZ1 LYS 96 HZ3 LYS 96 2.384 12.929 0.221 702 HZ2 LYS 96 HZ1 LYS 96 1.902 14.451 0.783 703 HZ3 LYS 96 HZ2 LYS 96 2.487 14.279 -0.795 704 H ILE 97 HN ILE 97 -2.720 9.416 0.490 705 HA ILE 97 HA ILE 97 0.027 8.711 1.254 706 HB ILE 97 HB ILE 97 -2.105 6.915 0.078 707 HG12 ILE 97 HG12 ILE 97 -2.617 7.227 2.381 708 HG13 ILE 97 HG11 ILE 97 -1.800 5.670 2.238 709 HG21 ILE 97 HG21 ILE 97 -0.372 5.130 0.636 710 HG22 ILE 97 HG22 ILE 97 0.785 6.465 0.711 711 HG23 ILE 97 HG23 ILE 97 -0.094 6.140 -0.783 712 HD11 ILE 97 HD13 ILE 97 0.274 6.684 2.999 713 HD12 ILE 97 HD11 ILE 97 -1.024 6.901 4.176 714 HD13 ILE 97 HD12 ILE 97 -0.543 8.241 3.136 715 H GLY 98 HN GLY 98 1.149 9.914 -0.281 716 HA2 GLY 98 HA2 GLY 98 0.668 9.219 -3.074 717 HA3 GLY 98 HA1 GLY 98 1.398 10.720 -2.514 718 H ALA 99 HN ALA 99 2.745 9.378 -4.383 719 HA ALA 99 HA ALA 99 4.466 7.315 -3.559 720 HB1 ALA 99 HB3 ALA 99 5.810 7.809 -5.441 721 HB2 ALA 99 HB1 ALA 99 5.313 9.502 -5.452 722 HB3 ALA 99 HB2 ALA 99 4.166 8.243 -5.906 723 H ASP 100 HN ASP 100 4.906 10.835 -3.408 724 HA ASP 100 HA ASP 100 7.434 10.798 -2.198 725 HB2 ASP 100 HB2 ASP 100 7.057 13.121 -1.646 726 HB3 ASP 100 HB1 ASP 100 6.367 12.806 -3.232 727 H GLU 101 HN GLU 101 4.200 11.091 -0.713 728 HA GLU 101 HA GLU 101 5.032 11.131 1.953 729 HB2 GLU 101 HB2 GLU 101 2.578 11.007 0.573 730 HB3 GLU 101 HB1 GLU 101 2.583 9.656 1.692 731 HG2 GLU 101 HG2 GLU 101 2.721 12.575 2.274 732 HG3 GLU 101 HG1 GLU 101 1.637 11.357 2.907 733 H PHE 102 HN PHE 102 3.874 8.413 0.008 734 HA PHE 102 HA PHE 102 4.348 6.358 1.794 735 HD1 PHE 102 HD1 PHE 102 6.407 4.550 -0.607 736 HD2 PHE 102 HD2 PHE 102 2.304 4.060 0.396 737 HE1 PHE 102 HE1 PHE 102 6.763 2.145 -0.315 738 HE2 PHE 102 HE2 PHE 102 2.658 1.641 0.678 739 HZ PHE 102 HZ PHE 102 4.902 0.685 0.319 740 HB2 PHE 102 HB2 PHE 102 3.070 6.128 -0.262 741 HB3 PHE 102 HB1 PHE 102 4.549 6.253 -1.225 742 H GLN 103 HN GLN 103 6.510 7.703 -0.687 743 HA GLN 103 HA GLN 103 8.664 5.976 -0.318 744 HB2 GLN 103 HB2 GLN 103 8.497 8.822 -1.260 745 HB3 GLN 103 HB1 GLN 103 10.035 7.970 -1.161 746 HG2 GLN 103 HG2 GLN 103 7.744 6.737 -2.592 747 HG3 GLN 103 HG1 GLN 103 8.673 8.015 -3.350 748 HE21 GLN 103 HE21 GLN 103 9.289 6.464 -4.929 749 HE22 GLN 103 HE22 GLN 103 10.567 5.347 -4.598 750 H GLU 104 HN GLU 104 7.634 8.764 1.503 751 HA GLU 104 HA GLU 104 9.992 9.218 2.952 752 HB2 GLU 104 HB2 GLU 104 8.822 10.840 3.995 753 HB3 GLU 104 HB1 GLU 104 7.650 10.498 2.735 754 HG2 GLU 104 HG2 GLU 104 6.299 10.469 4.547 755 HG3 GLU 104 HG1 GLU 104 6.761 8.774 4.464 756 H MET 105 HN MET 105 7.314 7.055 3.449 757 HA MET 105 HA MET 105 7.924 6.210 6.053 758 HB2 MET 105 HB2 MET 105 5.885 5.744 4.385 759 HB3 MET 105 HB1 MET 105 6.750 4.223 4.205 760 HG2 MET 105 HG2 MET 105 5.642 5.422 6.726 761 HG3 MET 105 HG1 MET 105 5.131 3.944 5.917 762 HE1 MET 105 HE3 MET 105 8.204 1.591 6.509 763 HE2 MET 105 HE1 MET 105 7.944 2.654 5.126 764 HE3 MET 105 HE2 MET 105 6.595 1.738 5.800 765 H VAL 106 HN VAL 106 8.752 4.628 2.934 766 HA VAL 106 HA VAL 106 10.240 2.549 4.057 767 HB VAL 106 HB VAL 106 9.495 2.448 1.756 768 HG11 VAL 106 HG11 VAL 106 11.146 4.901 1.480 769 HG12 VAL 106 HG12 VAL 106 9.524 4.548 0.882 770 HG13 VAL 106 HG13 VAL 106 10.930 3.838 0.090 771 HG21 VAL 106 HG23 VAL 106 12.154 1.868 2.616 772 HG22 VAL 106 HG21 VAL 106 12.201 2.361 0.924 773 HG23 VAL 106 HG22 VAL 106 11.179 1.007 1.420 774 H HIS 107 HN HIS 107 11.052 5.843 3.295 775 HA HIS 107 HA HIS 107 13.895 5.455 3.580 776 HD1 HIS 107 HD1 HIS 107 15.062 8.075 1.237 777 HD2 HIS 107 HD2 HIS 107 14.645 8.674 5.328 778 HE1 HIS 107 HE1 HIS 107 17.119 9.336 1.945 779 HE2 HIS 107 HE2 HIS 107 16.891 9.601 4.440 780 HB2 HIS 107 HB2 HIS 107 12.924 7.183 2.075 781 HB3 HIS 107 HB1 HIS 107 12.318 8.035 3.493 782 H SER 108 HN SER 108 11.229 6.607 5.558 783 HA SER 108 HA SER 108 12.651 7.782 7.641 784 HG SER 108 HG SER 108 8.925 6.220 7.734 785 HB2 SER 108 HB2 SER 108 10.667 7.394 9.016 786 HB3 SER 108 HB1 SER 108 10.207 7.931 7.401 Start of MODEL 15 1 HA SER 1 HA SER 1 3.030 -3.508 -9.530 2 HG SER 1 HG SER 1 3.433 -5.885 -10.230 3 H1 SER 1 HT1 SER 1 3.652 -1.223 -9.892 4 H2 SER 1 HT2 SER 1 3.134 -1.926 -11.339 5 H3 SER 1 HT3 SER 1 4.784 -1.679 -11.062 6 HB2 SER 1 HB2 SER 1 3.512 -4.299 -11.823 7 HB3 SER 1 HB1 SER 1 5.239 -4.118 -11.516 8 H ILE 2 HN ILE 2 4.157 -4.822 -7.994 9 HA ILE 2 HA ILE 2 6.310 -3.372 -6.698 10 HB ILE 2 HB ILE 2 4.598 -5.651 -5.818 11 HG12 ILE 2 HG12 ILE 2 4.960 -2.842 -4.907 12 HG13 ILE 2 HG11 ILE 2 3.560 -3.509 -5.707 13 HG21 ILE 2 HG21 ILE 2 7.026 -4.513 -4.473 14 HG22 ILE 2 HG22 ILE 2 6.717 -6.188 -4.937 15 HG23 ILE 2 HG23 ILE 2 5.796 -5.448 -3.620 16 HD11 ILE 2 HD13 ILE 2 3.778 -3.151 -3.073 17 HD12 ILE 2 HD11 ILE 2 4.342 -4.815 -3.205 18 HD13 ILE 2 HD12 ILE 2 2.772 -4.363 -3.841 19 H THR 3 HN THR 3 5.734 -6.434 -8.266 20 HA THR 3 HA THR 3 7.997 -7.836 -7.532 21 HB THR 3 HB THR 3 7.712 -9.140 -9.606 22 HG1 THR 3 HG1 THR 3 5.600 -7.333 -10.223 23 HG21 THR 3 HG23 THR 3 5.021 -8.518 -8.402 24 HG22 THR 3 HG21 THR 3 6.265 -9.433 -7.547 25 HG23 THR 3 HG22 THR 3 5.592 -10.053 -9.056 26 H ASP 4 HN ASP 4 7.833 -5.019 -9.474 27 HA ASP 4 HA ASP 4 9.864 -5.207 -11.283 28 HB2 ASP 4 HB2 ASP 4 9.205 -2.945 -9.392 29 HB3 ASP 4 HB1 ASP 4 10.448 -2.794 -10.631 30 H ILE 5 HN ILE 5 10.288 -4.353 -7.848 31 HA ILE 5 HA ILE 5 12.828 -5.827 -7.845 32 HB ILE 5 HB ILE 5 12.498 -3.109 -6.560 33 HG12 ILE 5 HG12 ILE 5 14.255 -3.669 -8.936 34 HG13 ILE 5 HG11 ILE 5 12.569 -3.217 -9.149 35 HG21 ILE 5 HG21 ILE 5 14.073 -4.615 -5.445 36 HG22 ILE 5 HG22 ILE 5 14.897 -3.242 -6.184 37 HG23 ILE 5 HG23 ILE 5 14.945 -4.825 -6.964 38 HD11 ILE 5 HD13 ILE 5 14.115 -1.318 -9.329 39 HD12 ILE 5 HD11 ILE 5 14.594 -1.582 -7.652 40 HD13 ILE 5 HD12 ILE 5 12.931 -1.131 -8.035 41 H LEU 6 HN LEU 6 11.886 -7.429 -6.676 42 HA LEU 6 HA LEU 6 11.792 -7.135 -3.864 43 HG LEU 6 HG LEU 6 10.372 -6.441 -2.474 44 HB2 LEU 6 HB2 LEU 6 9.364 -6.551 -5.220 45 HB3 LEU 6 HB1 LEU 6 9.138 -8.032 -4.315 46 HD11 LEU 6 HD11 LEU 6 9.049 -4.714 -4.448 47 HD12 LEU 6 HD12 LEU 6 10.324 -4.346 -3.283 48 HD13 LEU 6 HD13 LEU 6 8.639 -4.396 -2.764 49 HD21 LEU 6 HD23 LEU 6 8.417 -7.874 -2.128 50 HD22 LEU 6 HD21 LEU 6 7.409 -6.693 -2.961 51 HD23 LEU 6 HD22 LEU 6 8.180 -6.271 -1.434 52 H SER 7 HN SER 7 11.082 -9.081 -2.717 53 HA SER 7 HA SER 7 11.890 -11.471 -4.155 54 HG SER 7 HG SER 7 13.188 -10.934 -0.812 55 HB2 SER 7 HB2 SER 7 11.060 -11.142 -1.259 56 HB3 SER 7 HB1 SER 7 11.807 -12.572 -1.964 57 H ALA 8 HN ALA 8 10.440 -12.697 -5.184 58 HA ALA 8 HA ALA 8 7.692 -12.097 -5.237 59 HB1 ALA 8 HB3 ALA 8 8.890 -13.156 -7.098 60 HB2 ALA 8 HB1 ALA 8 7.458 -14.069 -6.623 61 HB3 ALA 8 HB2 ALA 8 9.061 -14.627 -6.141 62 H GLU 9 HN GLU 9 9.461 -14.711 -3.603 63 HA GLU 9 HA GLU 9 7.167 -16.061 -2.659 64 HB2 GLU 9 HB2 GLU 9 10.006 -16.019 -1.645 65 HB3 GLU 9 HB1 GLU 9 8.773 -17.146 -1.085 66 HG2 GLU 9 HG2 GLU 9 8.583 -18.076 -3.305 67 HG3 GLU 9 HG1 GLU 9 9.727 -16.881 -3.914 68 H ASP 10 HN ASP 10 9.468 -13.978 -0.925 69 HA ASP 10 HA ASP 10 8.156 -13.727 1.423 70 HB2 ASP 10 HB2 ASP 10 9.676 -11.575 -0.025 71 HB3 ASP 10 HB1 ASP 10 9.257 -11.523 1.682 72 H ILE 11 HN ILE 11 7.291 -12.212 -1.575 73 HA ILE 11 HA ILE 11 5.616 -10.210 -0.459 74 HB ILE 11 HB ILE 11 6.027 -11.416 -3.129 75 HG12 ILE 11 HG12 ILE 11 5.627 -8.563 -2.185 76 HG13 ILE 11 HG11 ILE 11 7.180 -9.379 -2.390 77 HG21 ILE 11 HG21 ILE 11 3.416 -10.128 -2.398 78 HG22 ILE 11 HG22 ILE 11 3.696 -11.640 -3.261 79 HG23 ILE 11 HG23 ILE 11 4.043 -10.099 -4.047 80 HD11 ILE 11 HD13 ILE 11 6.850 -8.003 -4.281 81 HD12 ILE 11 HD11 ILE 11 5.213 -8.608 -4.522 82 HD13 ILE 11 HD12 ILE 11 6.594 -9.663 -4.810 83 H ALA 12 HN ALA 12 4.930 -13.458 -1.706 84 HA ALA 12 HA ALA 12 2.188 -13.519 -1.160 85 HB1 ALA 12 HB3 ALA 12 3.852 -15.266 -2.305 86 HB2 ALA 12 HB1 ALA 12 2.269 -15.734 -1.678 87 HB3 ALA 12 HB2 ALA 12 3.715 -16.007 -0.710 88 H ALA 13 HN ALA 13 4.874 -14.664 0.888 89 HA ALA 13 HA ALA 13 3.191 -15.323 3.069 90 HB1 ALA 13 HB3 ALA 13 5.602 -16.058 2.715 91 HB2 ALA 13 HB1 ALA 13 5.170 -15.571 4.355 92 HB3 ALA 13 HB2 ALA 13 6.069 -14.465 3.316 93 H ALA 14 HN ALA 14 5.262 -12.563 2.443 94 HA ALA 14 HA ALA 14 4.737 -10.913 4.533 95 HB1 ALA 14 HB3 ALA 14 6.277 -10.153 2.906 96 HB2 ALA 14 HB1 ALA 14 4.962 -8.978 2.901 97 HB3 ALA 14 HB2 ALA 14 5.064 -10.194 1.623 98 H LEU 15 HN LEU 15 2.761 -11.218 1.601 99 HA LEU 15 HA LEU 15 0.753 -9.409 2.567 100 HG LEU 15 HG LEU 15 -0.645 -8.602 0.426 101 HB2 LEU 15 HB2 LEU 15 1.338 -9.890 0.134 102 HB3 LEU 15 HB1 LEU 15 0.476 -11.396 0.327 103 HD11 LEU 15 HD11 LEU 15 -1.362 -10.974 -1.284 104 HD12 LEU 15 HD12 LEU 15 -0.295 -9.661 -1.780 105 HD13 LEU 15 HD13 LEU 15 -1.992 -9.333 -1.426 106 HD21 LEU 15 HD23 LEU 15 -1.833 -9.599 2.164 107 HD22 LEU 15 HD21 LEU 15 -1.875 -11.168 1.363 108 HD23 LEU 15 HD22 LEU 15 -2.863 -9.843 0.753 109 H GLN 16 HN GLN 16 0.860 -12.937 1.964 110 HA GLN 16 HA GLN 16 -1.720 -13.501 2.940 111 HB2 GLN 16 HB2 GLN 16 0.719 -15.170 2.386 112 HB3 GLN 16 HB1 GLN 16 -0.801 -15.848 2.931 113 HG2 GLN 16 HG2 GLN 16 -0.088 -15.651 0.378 114 HG3 GLN 16 HG1 GLN 16 -1.761 -15.666 0.929 115 HE21 GLN 16 HE21 GLN 16 -2.904 -13.698 0.965 116 HE22 GLN 16 HE22 GLN 16 -2.412 -12.375 -0.027 117 H GLU 17 HN GLU 17 0.947 -12.542 4.773 118 HA GLU 17 HA GLU 17 1.010 -14.628 6.681 119 HB2 GLU 17 HB2 GLU 17 2.926 -13.312 6.630 120 HB3 GLU 17 HB1 GLU 17 2.021 -11.810 6.618 121 HG2 GLU 17 HG2 GLU 17 1.508 -12.033 8.937 122 HG3 GLU 17 HG1 GLU 17 2.164 -13.665 8.969 123 H CYS 18 HN CYS 18 0.000 -11.270 7.447 124 HA CYS 18 HA CYS 18 -2.016 -12.413 9.200 125 HG CYS 18 HG CYS 18 -1.864 -10.207 12.136 126 HB2 CYS 18 HB2 CYS 18 -0.007 -10.460 9.561 127 HB3 CYS 18 HB1 CYS 18 -1.554 -9.633 9.660 128 H GLN 19 HN GLN 19 -2.062 -11.387 6.155 129 HA GLN 19 HA GLN 19 -3.517 -9.094 5.885 130 HB2 GLN 19 HB2 GLN 19 -2.735 -10.479 4.003 131 HB3 GLN 19 HB1 GLN 19 -4.017 -11.626 4.329 132 HG2 GLN 19 HG2 GLN 19 -5.609 -9.664 3.990 133 HG3 GLN 19 HG1 GLN 19 -4.220 -8.827 3.299 134 HE21 GLN 19 HE21 GLN 19 -5.086 -8.698 1.256 135 HE22 GLN 19 HE22 GLN 19 -5.281 -10.078 0.234 136 H ASP 20 HN ASP 20 -5.536 -8.436 5.920 137 HA ASP 20 HA ASP 20 -7.899 -9.820 6.176 138 HB2 ASP 20 HB2 ASP 20 -6.351 -9.799 8.631 139 HB3 ASP 20 HB1 ASP 20 -7.907 -9.017 8.861 140 HA PRO 21 HA PRO 21 -9.375 -5.653 6.151 141 HB2 PRO 21 HB2 PRO 21 -11.668 -5.673 7.467 142 HB3 PRO 21 HB1 PRO 21 -11.472 -6.600 5.989 143 HG2 PRO 21 HG2 PRO 21 -11.366 -7.503 8.840 144 HG3 PRO 21 HG1 PRO 21 -12.175 -8.260 7.455 145 HD2 PRO 21 HD2 PRO 21 -9.743 -9.039 8.392 146 HD3 PRO 21 HD1 PRO 21 -10.259 -9.228 6.712 147 H ASP 22 HN ASP 22 -7.337 -5.670 7.959 148 HA ASP 22 HA ASP 22 -7.459 -3.412 9.400 149 HB2 ASP 22 HB2 ASP 22 -9.359 -4.071 10.676 150 HB3 ASP 22 HB1 ASP 22 -8.645 -5.622 11.085 151 H THR 23 HN THR 23 -5.793 -6.199 8.693 152 HA THR 23 HA THR 23 -3.956 -6.010 10.933 153 HB THR 23 HB THR 23 -2.830 -7.944 9.842 154 HG1 THR 23 HG1 THR 23 -4.370 -8.925 8.183 155 HG21 THR 23 HG23 THR 23 -4.208 -8.804 11.417 156 HG22 THR 23 HG21 THR 23 -5.108 -9.369 10.012 157 HG23 THR 23 HG22 THR 23 -5.604 -7.894 10.838 158 H PHE 24 HN PHE 24 -3.892 -5.573 7.423 159 HA PHE 24 HA PHE 24 -2.386 -3.653 6.715 160 HD1 PHE 24 HD1 PHE 24 -0.929 -1.968 6.764 161 HD2 PHE 24 HD2 PHE 24 0.148 -4.203 10.219 162 HE1 PHE 24 HE1 PHE 24 -0.548 0.126 7.993 163 HE2 PHE 24 HE2 PHE 24 0.526 -2.112 11.456 164 HZ PHE 24 HZ PHE 24 0.179 0.057 10.345 165 HB2 PHE 24 HB2 PHE 24 -0.497 -5.333 8.325 166 HB3 PHE 24 HB1 PHE 24 0.121 -4.568 6.874 167 H GLU 25 HN GLU 25 -3.624 -4.860 4.999 168 HA GLU 25 HA GLU 25 -2.422 -7.133 3.812 169 HB2 GLU 25 HB2 GLU 25 -4.305 -5.257 2.421 170 HB3 GLU 25 HB1 GLU 25 -4.072 -6.974 2.143 171 HG2 GLU 25 HG2 GLU 25 -4.998 -7.441 4.362 172 HG3 GLU 25 HG1 GLU 25 -5.286 -5.723 4.570 173 HA PRO 26 HA PRO 26 -0.664 -4.098 0.614 174 HB2 PRO 26 HB2 PRO 26 -0.756 -1.441 1.069 175 HB3 PRO 26 HB1 PRO 26 -2.069 -2.334 0.311 176 HG2 PRO 26 HG2 PRO 26 -1.876 -1.234 3.017 177 HG3 PRO 26 HG1 PRO 26 -3.301 -1.551 2.035 178 HD2 PRO 26 HD2 PRO 26 -2.307 -3.139 4.152 179 HD3 PRO 26 HD1 PRO 26 -3.613 -3.548 3.026 180 H GLN 27 HN GLN 27 -0.203 -2.204 3.621 181 HA GLN 27 HA GLN 27 2.435 -1.551 3.179 182 HB2 GLN 27 HB2 GLN 27 1.477 -0.227 4.749 183 HB3 GLN 27 HB1 GLN 27 0.521 -1.528 5.427 184 HG2 GLN 27 HG2 GLN 27 2.256 -2.270 6.768 185 HG3 GLN 27 HG1 GLN 27 3.459 -1.371 5.858 186 HE21 GLN 27 HE21 GLN 27 2.249 1.136 5.759 187 HE22 GLN 27 HE22 GLN 27 2.154 1.780 7.354 188 H LYS 28 HN LYS 28 1.078 -4.433 4.713 189 HA LYS 28 HA LYS 28 3.558 -5.339 5.803 190 HB2 LYS 28 HB2 LYS 28 1.287 -6.106 6.559 191 HB3 LYS 28 HB1 LYS 28 1.164 -7.033 5.072 192 HG2 LYS 28 HG2 LYS 28 3.130 -8.322 5.703 193 HG3 LYS 28 HG1 LYS 28 3.260 -7.386 7.187 194 HD2 LYS 28 HD2 LYS 28 0.951 -9.155 6.411 195 HD3 LYS 28 HD1 LYS 28 2.196 -9.529 7.601 196 HE2 LYS 28 HE2 LYS 28 0.676 -8.715 9.053 197 HE3 LYS 28 HE1 LYS 28 1.346 -7.163 8.550 198 HZ1 LYS 28 HZ3 LYS 28 -1.078 -7.181 8.483 199 HZ2 LYS 28 HZ1 LYS 28 -1.053 -8.454 7.369 200 HZ3 LYS 28 HZ2 LYS 28 -0.423 -6.946 6.943 201 H PHE 29 HN PHE 29 1.783 -5.948 2.849 202 HA PHE 29 HA PHE 29 3.243 -7.911 1.621 203 HD1 PHE 29 HD1 PHE 29 4.280 -6.026 -1.192 204 HD2 PHE 29 HD2 PHE 29 0.603 -8.151 -0.975 205 HE1 PHE 29 HE1 PHE 29 4.650 -6.922 -3.455 206 HE2 PHE 29 HE2 PHE 29 0.973 -9.045 -3.230 207 HZ PHE 29 HZ PHE 29 3.000 -8.425 -4.477 208 HB2 PHE 29 HB2 PHE 29 1.175 -6.835 0.755 209 HB3 PHE 29 HB1 PHE 29 2.104 -5.402 0.360 210 H PHE 30 HN PHE 30 3.886 -4.469 1.768 211 HA PHE 30 HA PHE 30 6.183 -4.517 0.059 212 HD1 PHE 30 HD1 PHE 30 4.143 -4.116 -0.899 213 HD2 PHE 30 HD2 PHE 30 3.954 -0.597 1.501 214 HE1 PHE 30 HE1 PHE 30 1.956 -3.552 -1.875 215 HE2 PHE 30 HE2 PHE 30 1.772 -0.035 0.522 216 HZ PHE 30 HZ PHE 30 0.769 -1.514 -1.166 217 HB2 PHE 30 HB2 PHE 30 5.504 -2.344 1.994 218 HB3 PHE 30 HB1 PHE 30 6.286 -2.205 0.426 219 H GLN 31 HN GLN 31 5.709 -3.894 3.506 220 HA GLN 31 HA GLN 31 8.305 -3.460 4.244 221 HB2 GLN 31 HB2 GLN 31 6.038 -3.292 5.534 222 HB3 GLN 31 HB1 GLN 31 6.467 -4.899 6.104 223 HG2 GLN 31 HG2 GLN 31 7.274 -3.478 7.752 224 HG3 GLN 31 HG1 GLN 31 8.701 -3.850 6.782 225 HE21 GLN 31 HE21 GLN 31 9.427 -2.290 5.266 226 HE22 GLN 31 HE22 GLN 31 9.067 -0.615 5.484 227 H THR 32 HN THR 32 6.641 -6.492 4.953 228 HA THR 32 HA THR 32 8.850 -7.850 5.895 229 HB THR 32 HB THR 32 6.457 -8.980 4.456 230 HG1 THR 32 HG1 THR 32 6.238 -7.758 6.515 231 HG21 THR 32 HG23 THR 32 7.001 -11.109 5.520 232 HG22 THR 32 HG21 THR 32 8.460 -10.400 6.214 233 HG23 THR 32 HG22 THR 32 8.317 -10.592 4.465 234 H SER 33 HN SER 33 7.598 -7.948 2.551 235 HA SER 33 HA SER 33 9.842 -9.559 1.706 236 HG SER 33 HG SER 33 8.376 -10.360 -1.208 237 HB2 SER 33 HB2 SER 33 7.657 -10.041 0.799 238 HB3 SER 33 HB1 SER 33 7.555 -8.433 0.106 239 H GLY 34 HN GLY 34 8.601 -6.356 0.738 240 HA2 GLY 34 HA2 GLY 34 11.115 -6.022 -0.723 241 HA3 GLY 34 HA1 GLY 34 9.667 -5.098 -1.020 242 H LEU 35 HN LEU 35 9.071 -3.761 1.128 243 HA LEU 35 HA LEU 35 10.816 -1.634 1.090 244 HG LEU 35 HG LEU 35 9.370 0.351 2.032 245 HB2 LEU 35 HB2 LEU 35 8.461 -2.464 2.587 246 HB3 LEU 35 HB1 LEU 35 9.554 -1.471 3.539 247 HD11 LEU 35 HD11 LEU 35 7.843 0.074 -0.008 248 HD12 LEU 35 HD12 LEU 35 8.120 -1.655 0.200 249 HD13 LEU 35 HD13 LEU 35 9.480 -0.575 -0.097 250 HD21 LEU 35 HD23 LEU 35 6.587 -0.757 2.182 251 HD22 LEU 35 HD21 LEU 35 7.098 0.928 2.237 252 HD23 LEU 35 HD22 LEU 35 7.442 -0.143 3.595 253 H SER 36 HN SER 36 10.730 -4.373 3.296 254 HA SER 36 HA SER 36 12.263 -3.863 5.346 255 HG SER 36 HG SER 36 13.227 -6.968 5.878 256 HB2 SER 36 HB2 SER 36 11.600 -6.127 4.824 257 HB3 SER 36 HB1 SER 36 12.753 -6.194 3.491 258 H LYS 37 HN LYS 37 13.785 -4.210 2.112 259 HA LYS 37 HA LYS 37 15.990 -2.570 3.074 260 HB2 LYS 37 HB2 LYS 37 16.523 -5.259 1.837 261 HB3 LYS 37 HB1 LYS 37 17.698 -4.159 2.528 262 HG2 LYS 37 HG2 LYS 37 16.744 -4.501 4.736 263 HG3 LYS 37 HG1 LYS 37 15.556 -5.603 4.041 264 HD2 LYS 37 HD2 LYS 37 17.721 -6.740 3.074 265 HD3 LYS 37 HD1 LYS 37 18.463 -5.973 4.478 266 HE2 LYS 37 HE2 LYS 37 17.798 -8.195 5.097 267 HE3 LYS 37 HE1 LYS 37 16.735 -7.045 5.907 268 HZ1 LYS 37 HZ3 LYS 37 15.518 -8.925 4.967 269 HZ2 LYS 37 HZ1 LYS 37 16.068 -8.524 3.418 270 HZ3 LYS 37 HZ2 LYS 37 15.045 -7.467 4.253 271 H MET 38 HN MET 38 14.249 -1.655 1.247 272 HA MET 38 HA MET 38 15.688 -1.904 -1.304 273 HB2 MET 38 HB2 MET 38 12.783 -1.258 -0.824 274 HB3 MET 38 HB1 MET 38 13.575 -1.337 -2.382 275 HG2 MET 38 HG2 MET 38 13.678 -3.686 -0.581 276 HG3 MET 38 HG1 MET 38 12.212 -3.359 -1.499 277 HE1 MET 38 HE3 MET 38 13.875 -6.317 -3.470 278 HE2 MET 38 HE1 MET 38 12.418 -5.746 -2.657 279 HE3 MET 38 HE2 MET 38 13.878 -6.071 -1.724 280 H SER 39 HN SER 39 15.996 -0.048 -2.580 281 HA SER 39 HA SER 39 16.503 2.340 -1.128 282 HG SER 39 HG SER 39 18.128 0.575 -3.367 283 HB2 SER 39 HB2 SER 39 16.569 1.851 -4.114 284 HB3 SER 39 HB1 SER 39 17.274 3.233 -3.277 285 H ALA 40 HN ALA 40 15.801 4.503 -2.191 286 HA ALA 40 HA ALA 40 13.011 4.787 -1.778 287 HB1 ALA 40 HB3 ALA 40 14.768 6.817 -3.124 288 HB2 ALA 40 HB1 ALA 40 14.792 6.528 -1.384 289 HB3 ALA 40 HB2 ALA 40 13.311 7.087 -2.163 290 H SER 41 HN SER 41 14.953 4.840 -4.772 291 HA SER 41 HA SER 41 13.078 5.641 -6.584 292 HG SER 41 HG SER 41 15.816 2.856 -7.565 293 HB2 SER 41 HB2 SER 41 14.349 4.233 -8.242 294 HB3 SER 41 HB1 SER 41 15.343 5.321 -7.273 295 H GLN 42 HN GLN 42 13.753 2.222 -5.823 296 HA GLN 42 HA GLN 42 11.742 1.142 -7.423 297 HB2 GLN 42 HB2 GLN 42 11.973 -0.886 -6.138 298 HB3 GLN 42 HB1 GLN 42 13.556 -0.165 -6.393 299 HG2 GLN 42 HG2 GLN 42 13.703 -0.714 -4.200 300 HG3 GLN 42 HG1 GLN 42 13.093 0.936 -4.094 301 HE21 GLN 42 HE21 GLN 42 12.227 -2.441 -3.906 302 HE22 GLN 42 HE22 GLN 42 10.792 -2.227 -2.974 303 H VAL 43 HN VAL 43 11.572 2.686 -4.392 304 HA VAL 43 HA VAL 43 9.172 1.637 -3.377 305 HB VAL 43 HB VAL 43 9.897 4.542 -3.094 306 HG11 VAL 43 HG11 VAL 43 8.732 2.796 -0.981 307 HG12 VAL 43 HG12 VAL 43 7.702 3.436 -2.261 308 HG13 VAL 43 HG13 VAL 43 8.584 4.540 -1.204 309 HG21 VAL 43 HG23 VAL 43 11.219 3.895 -1.123 310 HG22 VAL 43 HG21 VAL 43 11.896 3.283 -2.617 311 HG23 VAL 43 HG22 VAL 43 11.011 2.201 -1.561 312 H LYS 44 HN LYS 44 9.780 4.280 -5.644 313 HA LYS 44 HA LYS 44 7.187 5.181 -6.008 314 HB2 LYS 44 HB2 LYS 44 9.556 5.009 -7.847 315 HB3 LYS 44 HB1 LYS 44 8.010 5.579 -8.459 316 HG2 LYS 44 HG2 LYS 44 8.182 7.558 -7.420 317 HG3 LYS 44 HG1 LYS 44 8.907 6.854 -5.975 318 HD2 LYS 44 HD2 LYS 44 10.411 8.396 -7.252 319 HD3 LYS 44 HD1 LYS 44 11.061 6.774 -7.003 320 HE2 LYS 44 HE2 LYS 44 10.391 6.149 -9.265 321 HE3 LYS 44 HE1 LYS 44 9.702 7.754 -9.514 322 HZ1 LYS 44 HZ3 LYS 44 11.893 7.582 -10.502 323 HZ2 LYS 44 HZ1 LYS 44 12.568 7.154 -9.010 324 HZ3 LYS 44 HZ2 LYS 44 11.915 8.698 -9.231 325 H ASP 45 HN ASP 45 8.858 2.462 -7.518 326 HA ASP 45 HA ASP 45 6.689 1.669 -9.173 327 HB2 ASP 45 HB2 ASP 45 9.378 0.778 -8.581 328 HB3 ASP 45 HB1 ASP 45 8.272 -0.585 -8.650 329 H ILE 46 HN ILE 46 7.950 0.575 -6.047 330 HA ILE 46 HA ILE 46 6.153 -1.474 -5.546 331 HB ILE 46 HB ILE 46 7.898 0.271 -3.898 332 HG12 ILE 46 HG12 ILE 46 8.976 -1.770 -3.372 333 HG13 ILE 46 HG11 ILE 46 7.627 -2.718 -3.955 334 HG21 ILE 46 HG21 ILE 46 5.693 -1.401 -2.744 335 HG22 ILE 46 HG22 ILE 46 6.142 0.265 -2.372 336 HG23 ILE 46 HG23 ILE 46 7.179 -1.063 -1.852 337 HD11 ILE 46 HD13 ILE 46 8.135 -1.757 -6.243 338 HD12 ILE 46 HD11 ILE 46 9.296 -2.908 -5.584 339 HD13 ILE 46 HD12 ILE 46 9.648 -1.183 -5.543 340 H PHE 47 HN PHE 47 6.011 1.873 -4.354 341 HA PHE 47 HA PHE 47 3.636 1.972 -3.092 342 HD1 PHE 47 HD2 PHE 47 2.340 3.327 -2.303 343 HD2 PHE 47 HD1 PHE 47 3.943 6.211 -4.982 344 HE1 PHE 47 HE2 PHE 47 0.528 4.894 -1.729 345 HE2 PHE 47 HE1 PHE 47 2.108 7.755 -4.408 346 HZ PHE 47 HZ PHE 47 0.422 7.076 -2.796 347 HB2 PHE 47 HB2 PHE 47 5.166 3.856 -3.350 348 HB3 PHE 47 HB1 PHE 47 4.718 4.010 -5.036 349 H ARG 48 HN ARG 48 4.122 1.713 -6.519 350 HA ARG 48 HA ARG 48 1.672 2.537 -7.518 351 HE ARG 48 HE ARG 48 5.187 4.299 -9.706 352 HB2 ARG 48 HB2 ARG 48 3.333 0.218 -8.512 353 HB3 ARG 48 HB1 ARG 48 2.068 1.035 -9.418 354 HG2 ARG 48 HG2 ARG 48 4.702 2.157 -8.534 355 HG3 ARG 48 HG1 ARG 48 4.154 1.863 -10.181 356 HD2 ARG 48 HD2 ARG 48 2.403 3.557 -9.888 357 HD3 ARG 48 HD1 ARG 48 2.979 3.865 -8.248 358 HH11 ARG 48 HH11 ARG 48 1.910 5.424 -10.072 359 HH12 ARG 48 HH12 ARG 48 2.370 6.909 -10.834 360 HH21 ARG 48 HH21 ARG 48 5.800 6.253 -10.706 361 HH22 ARG 48 HH22 ARG 48 4.580 7.381 -11.195 362 H PHE 49 HN PHE 49 2.461 -0.377 -5.778 363 HA PHE 49 HA PHE 49 0.499 -2.137 -6.456 364 HD1 PHE 49 HD2 PHE 49 1.168 -4.640 -5.583 365 HD2 PHE 49 HD1 PHE 49 -0.457 -2.390 -2.353 366 HE1 PHE 49 HE2 PHE 49 -0.126 -6.604 -4.867 367 HE2 PHE 49 HE1 PHE 49 -1.745 -4.354 -1.628 368 HZ PHE 49 HZ PHE 49 -1.584 -6.463 -2.888 369 HB2 PHE 49 HB2 PHE 49 2.236 -2.518 -4.728 370 HB3 PHE 49 HB1 PHE 49 1.322 -1.504 -3.618 371 H ILE 50 HN ILE 50 0.105 0.308 -3.879 372 HA ILE 50 HA ILE 50 -2.670 -0.164 -3.683 373 HB ILE 50 HB ILE 50 -2.650 2.095 -2.392 374 HG12 ILE 50 HG12 ILE 50 0.319 1.509 -2.547 375 HG13 ILE 50 HG11 ILE 50 -0.483 2.969 -3.112 376 HG21 ILE 50 HG21 ILE 50 -1.779 -0.589 -1.746 377 HG22 ILE 50 HG22 ILE 50 -2.950 0.464 -0.953 378 HG23 ILE 50 HG23 ILE 50 -1.233 0.630 -0.595 379 HD11 ILE 50 HD13 ILE 50 -0.489 2.066 -0.244 380 HD12 ILE 50 HD11 ILE 50 -0.988 3.630 -0.885 381 HD13 ILE 50 HD12 ILE 50 0.719 3.168 -0.916 382 H ASP 51 HN ASP 51 -3.112 3.043 -3.765 383 HA ASP 51 HA ASP 51 -3.944 2.835 -6.553 384 HB2 ASP 51 HB2 ASP 51 -4.927 4.724 -4.424 385 HB3 ASP 51 HB1 ASP 51 -5.542 4.610 -6.067 386 H ASN 52 HN ASN 52 -1.344 4.025 -5.268 387 HA ASN 52 HA ASN 52 -0.756 6.492 -5.869 388 HB2 ASN 52 HB2 ASN 52 0.984 4.955 -5.242 389 HB3 ASN 52 HB1 ASN 52 0.950 4.208 -6.834 390 HD21 ASN 52 HD21 ASN 52 0.663 7.670 -6.367 391 HD22 ASN 52 HD22 ASN 52 2.199 8.077 -7.036 392 H ASP 53 HN ASP 53 -2.687 6.559 -7.633 393 HA ASP 53 HA ASP 53 -1.836 7.891 -9.834 394 HB2 ASP 53 HB2 ASP 53 -0.871 5.737 -10.618 395 HB3 ASP 53 HB1 ASP 53 -2.477 5.023 -10.542 396 H GLN 54 HN GLN 54 -3.714 8.987 -8.887 397 HA GLN 54 HA GLN 54 -6.107 8.201 -10.212 398 HB2 GLN 54 HB2 GLN 54 -7.372 8.482 -7.928 399 HB3 GLN 54 HB1 GLN 54 -6.797 6.928 -8.502 400 HG2 GLN 54 HG2 GLN 54 -4.737 7.302 -7.137 401 HG3 GLN 54 HG1 GLN 54 -5.542 8.711 -6.443 402 HE21 GLN 54 HE21 GLN 54 -5.511 7.781 -4.407 403 HE22 GLN 54 HE22 GLN 54 -6.536 6.477 -3.943 404 H SER 55 HN SER 55 -4.889 10.460 -7.692 405 HA SER 55 HA SER 55 -5.952 12.647 -9.282 406 HG SER 55 HG SER 55 -8.039 11.632 -6.023 407 HB2 SER 55 HB2 SER 55 -7.116 13.563 -7.149 408 HB3 SER 55 HB1 SER 55 -7.936 12.323 -8.102 409 H GLY 56 HN GLY 56 -3.259 12.131 -8.682 410 HA2 GLY 56 HA2 GLY 56 -1.524 13.667 -8.214 411 HA3 GLY 56 HA1 GLY 56 -2.659 14.601 -7.244 412 H TYR 57 HN TYR 57 -3.554 12.353 -5.703 413 HA TYR 57 HA TYR 57 -1.309 11.258 -4.284 414 HD1 TYR 57 HD1 TYR 57 -4.579 13.795 -3.276 415 HD2 TYR 57 HD2 TYR 57 -0.514 14.887 -3.693 416 HE1 TYR 57 HE1 TYR 57 -5.278 16.049 -4.017 417 HE2 TYR 57 HE2 TYR 57 -1.171 17.151 -4.407 418 HH TYR 57 HH TYR 57 -4.324 18.338 -4.071 419 HB2 TYR 57 HB2 TYR 57 -2.845 12.527 -2.241 420 HB3 TYR 57 HB1 TYR 57 -1.165 12.819 -2.628 421 H LEU 58 HN LEU 58 -2.132 9.940 -2.446 422 HA LEU 58 HA LEU 58 -4.779 8.920 -3.161 423 HG LEU 58 HG LEU 58 -1.587 7.784 -3.519 424 HB2 LEU 58 HB2 LEU 58 -2.772 7.517 -1.430 425 HB3 LEU 58 HB1 LEU 58 -4.155 6.829 -2.256 426 HD11 LEU 58 HD11 LEU 58 -2.103 5.447 -2.298 427 HD12 LEU 58 HD12 LEU 58 -0.972 5.642 -3.629 428 HD13 LEU 58 HD13 LEU 58 -2.612 5.072 -3.939 429 HD21 LEU 58 HD23 LEU 58 -2.474 7.294 -5.652 430 HD22 LEU 58 HD21 LEU 58 -3.617 8.367 -4.860 431 HD23 LEU 58 HD22 LEU 58 -3.958 6.647 -4.978 432 H ASP 59 HN ASP 59 -6.318 8.516 -1.518 433 HA ASP 59 HA ASP 59 -5.687 9.632 1.108 434 HB2 ASP 59 HB2 ASP 59 -7.733 11.035 1.037 435 HB3 ASP 59 HB1 ASP 59 -6.521 11.517 -0.155 436 H GLY 60 HN GLY 60 -7.226 9.152 2.752 437 HA2 GLY 60 HA2 GLY 60 -7.815 6.541 3.107 438 HA3 GLY 60 HA1 GLY 60 -8.760 7.819 3.854 439 H ASP 61 HN ASP 61 -9.777 8.729 1.195 440 HA ASP 61 HA ASP 61 -12.081 6.979 1.179 441 HB2 ASP 61 HB2 ASP 61 -11.610 9.124 -0.854 442 HB3 ASP 61 HB1 ASP 61 -13.132 8.576 -0.156 443 H GLU 62 HN GLU 62 -9.443 7.875 -0.941 444 HA GLU 62 HA GLU 62 -10.297 6.211 -3.103 445 HB2 GLU 62 HB2 GLU 62 -7.645 7.571 -2.735 446 HB3 GLU 62 HB1 GLU 62 -8.377 7.038 -4.245 447 HG2 GLU 62 HG2 GLU 62 -9.534 9.145 -2.457 448 HG3 GLU 62 HG1 GLU 62 -8.491 9.488 -3.838 449 H LEU 63 HN LEU 63 -8.160 5.909 -0.379 450 HA LEU 63 HA LEU 63 -6.317 4.040 -1.136 451 HG LEU 63 HG LEU 63 -6.416 6.224 1.105 452 HB2 LEU 63 HB2 LEU 63 -7.826 4.361 1.446 453 HB3 LEU 63 HB1 LEU 63 -6.499 3.233 1.274 454 HD11 LEU 63 HD11 LEU 63 -4.376 5.101 2.701 455 HD12 LEU 63 HD12 LEU 63 -5.912 4.368 3.166 456 HD13 LEU 63 HD13 LEU 63 -5.727 6.121 3.190 457 HD21 LEU 63 HD23 LEU 63 -4.350 4.245 0.208 458 HD22 LEU 63 HD21 LEU 63 -3.965 5.916 0.626 459 HD23 LEU 63 HD22 LEU 63 -5.067 5.574 -0.712 460 H LYS 64 HN LYS 64 -9.597 3.326 0.078 461 HA LYS 64 HA LYS 64 -9.573 0.631 -0.057 462 HB2 LYS 64 HB2 LYS 64 -12.081 0.981 -0.576 463 HB3 LYS 64 HB1 LYS 64 -11.423 1.577 0.934 464 HG2 LYS 64 HG2 LYS 64 -11.494 3.781 0.234 465 HG3 LYS 64 HG1 LYS 64 -11.575 3.343 -1.475 466 HD2 LYS 64 HD2 LYS 64 -13.736 4.126 -0.816 467 HD3 LYS 64 HD1 LYS 64 -13.831 2.375 -1.037 468 HE2 LYS 64 HE2 LYS 64 -13.618 2.049 1.353 469 HE3 LYS 64 HE1 LYS 64 -13.486 3.788 1.601 470 HZ1 LYS 64 HZ3 LYS 64 -15.848 2.383 0.473 471 HZ2 LYS 64 HZ1 LYS 64 -15.720 4.051 0.732 472 HZ3 LYS 64 HZ2 LYS 64 -15.725 2.989 2.048 473 H TYR 65 HN TYR 65 -9.630 2.754 -2.817 474 HA TYR 65 HA TYR 65 -10.793 0.802 -4.571 475 HD1 TYR 65 HD1 TYR 65 -12.218 2.145 -3.679 476 HD2 TYR 65 HD2 TYR 65 -10.393 5.330 -5.842 477 HE1 TYR 65 HE1 TYR 65 -13.891 3.727 -2.777 478 HE2 TYR 65 HE2 TYR 65 -12.071 6.898 -4.969 479 HH TYR 65 HH TYR 65 -14.318 6.865 -4.033 480 HB2 TYR 65 HB2 TYR 65 -9.205 3.211 -5.428 481 HB3 TYR 65 HB1 TYR 65 -10.446 2.354 -6.332 482 H PHE 66 HN PHE 66 -7.658 1.199 -3.286 483 HA PHE 66 HA PHE 66 -5.962 0.545 -5.336 484 HD1 PHE 66 HD2 PHE 66 -3.981 -1.886 -4.616 485 HD2 PHE 66 HD1 PHE 66 -5.739 -0.989 -0.853 486 HE1 PHE 66 HE2 PHE 66 -3.246 -4.071 -3.752 487 HE2 PHE 66 HE1 PHE 66 -5.016 -3.166 0.018 488 HZ PHE 66 HZ PHE 66 -3.765 -4.713 -1.433 489 HB2 PHE 66 HB2 PHE 66 -4.503 0.586 -3.643 490 HB3 PHE 66 HB1 PHE 66 -5.830 0.591 -2.502 491 H LEU 67 HN LEU 67 -7.652 -1.813 -3.271 492 HA LEU 67 HA LEU 67 -6.780 -4.109 -4.661 493 HG LEU 67 HG LEU 67 -7.065 -3.854 -1.721 494 HB2 LEU 67 HB2 LEU 67 -9.179 -3.533 -2.942 495 HB3 LEU 67 HB1 LEU 67 -8.982 -5.097 -3.705 496 HD11 LEU 67 HD11 LEU 67 -9.032 -6.121 -1.455 497 HD12 LEU 67 HD12 LEU 67 -9.111 -4.556 -0.647 498 HD13 LEU 67 HD13 LEU 67 -7.816 -5.687 -0.254 499 HD21 LEU 67 HD23 LEU 67 -7.041 -6.570 -3.036 500 HD22 LEU 67 HD21 LEU 67 -5.938 -6.022 -1.774 501 HD23 LEU 67 HD22 LEU 67 -5.913 -5.255 -3.362 502 H GLN 68 HN GLN 68 -9.400 -1.904 -5.088 503 HA GLN 68 HA GLN 68 -10.810 -3.326 -7.064 504 HB2 GLN 68 HB2 GLN 68 -10.826 -0.481 -6.106 505 HB3 GLN 68 HB1 GLN 68 -11.807 -0.969 -7.467 506 HG2 GLN 68 HG2 GLN 68 -12.938 -2.626 -6.101 507 HG3 GLN 68 HG1 GLN 68 -11.929 -2.183 -4.732 508 HE21 GLN 68 HE21 GLN 68 -14.783 -2.113 -4.846 509 HE22 GLN 68 HE22 GLN 68 -15.266 -0.473 -4.606 510 H LYS 69 HN LYS 69 -8.283 -0.774 -7.269 511 HA LYS 69 HA LYS 69 -8.223 -0.335 -9.942 512 HB2 LYS 69 HB2 LYS 69 -5.796 -0.774 -8.193 513 HB3 LYS 69 HB1 LYS 69 -5.837 0.139 -9.690 514 HG2 LYS 69 HG2 LYS 69 -7.044 0.840 -7.038 515 HG3 LYS 69 HG1 LYS 69 -5.823 1.715 -7.951 516 HD2 LYS 69 HD2 LYS 69 -8.730 1.397 -8.640 517 HD3 LYS 69 HD1 LYS 69 -7.910 2.880 -8.154 518 HE2 LYS 69 HE2 LYS 69 -7.436 1.309 -10.685 519 HE3 LYS 69 HE1 LYS 69 -8.246 2.870 -10.554 520 HZ1 LYS 69 HZ3 LYS 69 -5.915 3.037 -11.286 521 HZ2 LYS 69 HZ1 LYS 69 -5.413 2.381 -9.808 522 HZ3 LYS 69 HZ2 LYS 69 -6.204 3.876 -9.846 523 H PHE 70 HN PHE 70 -6.109 -2.688 -8.327 524 HA PHE 70 HA PHE 70 -5.333 -3.916 -10.766 525 HD1 PHE 70 HD2 PHE 70 -4.569 -7.062 -10.155 526 HD2 PHE 70 HD1 PHE 70 -5.133 -5.347 -6.302 527 HE1 PHE 70 HE2 PHE 70 -4.887 -9.310 -9.206 528 HE2 PHE 70 HE1 PHE 70 -5.451 -7.589 -5.343 529 HZ PHE 70 HZ PHE 70 -5.329 -9.575 -6.796 530 HB2 PHE 70 HB2 PHE 70 -3.711 -4.674 -9.425 531 HB3 PHE 70 HB1 PHE 70 -4.537 -3.980 -8.047 532 H GLN 71 HN GLN 71 -7.576 -4.775 -8.188 533 HA GLN 71 HA GLN 71 -8.580 -7.023 -9.768 534 HB2 GLN 71 HB2 GLN 71 -8.106 -7.003 -7.186 535 HB3 GLN 71 HB1 GLN 71 -9.677 -6.226 -7.095 536 HG2 GLN 71 HG2 GLN 71 -10.465 -8.232 -8.546 537 HG3 GLN 71 HG1 GLN 71 -8.979 -8.992 -7.982 538 HE21 GLN 71 HE21 GLN 71 -11.266 -6.853 -6.347 539 HE22 GLN 71 HE22 GLN 71 -11.647 -7.938 -5.065 540 H SER 72 HN SER 72 -11.266 -6.316 -8.201 541 HA SER 72 HA SER 72 -12.316 -3.932 -8.997 542 HG SER 72 HG SER 72 -14.114 -4.791 -12.090 543 HB2 SER 72 HB2 SER 72 -11.919 -4.340 -11.305 544 HB3 SER 72 HB1 SER 72 -12.490 -5.998 -11.167 545 H ASP 73 HN ASP 73 -12.618 -5.482 -6.921 546 HA ASP 73 HA ASP 73 -15.466 -5.940 -6.868 547 HB2 ASP 73 HB2 ASP 73 -13.471 -8.122 -6.242 548 HB3 ASP 73 HB1 ASP 73 -15.167 -8.179 -5.778 549 H ALA 74 HN ALA 74 -12.378 -5.922 -5.170 550 HA ALA 74 HA ALA 74 -12.330 -6.015 -2.722 551 HB1 ALA 74 HB3 ALA 74 -10.843 -4.400 -2.653 552 HB2 ALA 74 HB1 ALA 74 -12.041 -3.162 -3.013 553 HB3 ALA 74 HB2 ALA 74 -11.265 -4.045 -4.330 554 H ARG 75 HN ARG 75 -13.189 -5.580 -0.817 555 HA ARG 75 HA ARG 75 -15.905 -4.667 -0.742 556 HE ARG 75 HE ARG 75 -11.101 -5.735 1.761 557 HB2 ARG 75 HB2 ARG 75 -15.730 -5.145 1.678 558 HB3 ARG 75 HB1 ARG 75 -15.219 -6.501 0.685 559 HG2 ARG 75 HG2 ARG 75 -13.049 -4.690 1.432 560 HG3 ARG 75 HG1 ARG 75 -13.838 -5.477 2.800 561 HD2 ARG 75 HD2 ARG 75 -13.227 -7.588 2.112 562 HD3 ARG 75 HD1 ARG 75 -13.065 -7.109 0.424 563 HH11 ARG 75 HH11 ARG 75 -11.979 -9.082 1.364 564 HH12 ARG 75 HH12 ARG 75 -10.350 -9.658 1.485 565 HH21 ARG 75 HH21 ARG 75 -8.951 -6.483 1.919 566 HH22 ARG 75 HH22 ARG 75 -8.627 -8.180 1.797 567 H GLU 76 HN GLU 76 -13.235 -2.867 -1.077 568 HA GLU 76 HA GLU 76 -12.900 -0.663 -0.870 569 HB2 GLU 76 HB2 GLU 76 -15.203 -0.514 1.065 570 HB3 GLU 76 HB1 GLU 76 -14.461 0.795 0.161 571 HG2 GLU 76 HG2 GLU 76 -15.178 -0.457 -1.927 572 HG3 GLU 76 HG1 GLU 76 -16.214 -1.402 -0.861 573 H LEU 77 HN LEU 77 -11.444 -2.385 0.356 574 HA LEU 77 HA LEU 77 -10.304 -3.073 2.275 575 HG LEU 77 HG LEU 77 -9.122 -1.725 0.058 576 HB2 LEU 77 HB2 LEU 77 -9.826 -0.137 1.887 577 HB3 LEU 77 HB1 LEU 77 -8.874 -1.103 2.998 578 HD11 LEU 77 HD11 LEU 77 -6.585 -0.672 1.054 579 HD12 LEU 77 HD12 LEU 77 -7.915 0.487 1.079 580 HD13 LEU 77 HD13 LEU 77 -7.471 -0.306 -0.429 581 HD21 LEU 77 HD23 LEU 77 -6.815 -2.580 1.685 582 HD22 LEU 77 HD21 LEU 77 -7.686 -3.433 0.411 583 HD23 LEU 77 HD22 LEU 77 -8.352 -3.369 2.044 584 H THR 78 HN THR 78 -13.015 -2.545 2.977 585 HA THR 78 HA THR 78 -14.411 -1.936 4.690 586 HB THR 78 HB THR 78 -13.863 -2.979 6.773 587 HG1 THR 78 HG1 THR 78 -11.801 -3.393 7.397 588 HG21 THR 78 HG23 THR 78 -13.389 -5.190 6.082 589 HG22 THR 78 HG21 THR 78 -12.446 -4.633 4.701 590 HG23 THR 78 HG22 THR 78 -14.198 -4.426 4.713 591 H GLU 79 HN GLU 79 -14.292 -1.048 7.118 592 HA GLU 79 HA GLU 79 -13.438 1.660 6.894 593 HB2 GLU 79 HB2 GLU 79 -14.336 0.096 9.326 594 HB3 GLU 79 HB1 GLU 79 -14.127 1.840 9.271 595 HG2 GLU 79 HG2 GLU 79 -15.885 2.006 7.591 596 HG3 GLU 79 HG1 GLU 79 -16.088 0.255 7.627 597 H SER 80 HN SER 80 -12.334 -1.158 8.664 598 HA SER 80 HA SER 80 -10.147 0.137 9.962 599 HG SER 80 HG SER 80 -9.483 -1.032 11.670 600 HB2 SER 80 HB2 SER 80 -11.536 -1.848 10.749 601 HB3 SER 80 HB1 SER 80 -10.493 -2.820 9.724 602 H GLU 81 HN GLU 81 -10.356 -1.858 7.002 603 HA GLU 81 HA GLU 81 -7.598 -2.551 7.016 604 HB2 GLU 81 HB2 GLU 81 -9.719 -3.414 5.538 605 HB3 GLU 81 HB1 GLU 81 -8.868 -2.412 4.378 606 HG2 GLU 81 HG2 GLU 81 -7.715 -4.719 5.897 607 HG3 GLU 81 HG1 GLU 81 -8.126 -4.680 4.181 608 H THR 82 HN THR 82 -9.387 0.142 5.523 609 HA THR 82 HA THR 82 -7.278 1.159 4.004 610 HB THR 82 HB THR 82 -8.413 3.346 4.168 611 HG1 THR 82 HG1 THR 82 -10.259 1.993 5.866 612 HG21 THR 82 HG23 THR 82 -10.117 0.928 3.604 613 HG22 THR 82 HG21 THR 82 -9.186 1.892 2.456 614 HG23 THR 82 HG22 THR 82 -10.621 2.575 3.223 615 H LYS 83 HN LYS 83 -7.640 0.966 7.404 616 HA LYS 83 HA LYS 83 -6.261 3.238 8.275 617 HB2 LYS 83 HB2 LYS 83 -7.473 1.499 9.698 618 HB3 LYS 83 HB1 LYS 83 -6.035 0.501 9.531 619 HG2 LYS 83 HG2 LYS 83 -4.699 2.268 10.582 620 HG3 LYS 83 HG1 LYS 83 -6.160 3.238 10.776 621 HD2 LYS 83 HD2 LYS 83 -7.132 1.389 12.130 622 HD3 LYS 83 HD1 LYS 83 -5.576 0.560 12.033 623 HE2 LYS 83 HE2 LYS 83 -5.714 1.743 14.127 624 HE3 LYS 83 HE1 LYS 83 -4.509 2.517 13.098 625 HZ1 LYS 83 HZ3 LYS 83 -5.923 4.144 14.191 626 HZ2 LYS 83 HZ1 LYS 83 -7.301 3.455 13.489 627 HZ3 LYS 83 HZ2 LYS 83 -6.138 4.202 12.514 628 H SER 84 HN SER 84 -5.170 0.099 7.105 629 HA SER 84 HA SER 84 -2.440 0.301 7.596 630 HG SER 84 HG SER 84 -1.329 -0.644 5.426 631 HB2 SER 84 HB2 SER 84 -3.078 -1.794 6.784 632 HB3 SER 84 HB1 SER 84 -4.085 -1.106 5.518 633 H LEU 85 HN LEU 85 -4.212 1.120 4.638 634 HA LEU 85 HA LEU 85 -2.105 2.331 3.292 635 HG LEU 85 HG LEU 85 -4.547 0.453 2.421 636 HB2 LEU 85 HB2 LEU 85 -5.090 2.629 3.110 637 HB3 LEU 85 HB1 LEU 85 -3.996 3.359 1.965 638 HD11 LEU 85 HD11 LEU 85 -4.721 2.299 0.057 639 HD12 LEU 85 HD12 LEU 85 -6.026 1.427 0.859 640 HD13 LEU 85 HD13 LEU 85 -4.826 0.544 -0.080 641 HD21 LEU 85 HD23 LEU 85 -2.127 0.673 2.333 642 HD22 LEU 85 HD21 LEU 85 -2.255 1.607 0.841 643 HD23 LEU 85 HD22 LEU 85 -2.745 -0.088 0.869 644 H MET 86 HN MET 86 -4.503 3.607 5.487 645 HA MET 86 HA MET 86 -3.929 6.355 5.224 646 HB2 MET 86 HB2 MET 86 -4.922 4.852 7.659 647 HB3 MET 86 HB1 MET 86 -5.000 6.594 7.437 648 HG2 MET 86 HG2 MET 86 -6.223 5.122 5.251 649 HG3 MET 86 HG1 MET 86 -6.967 4.783 6.811 650 HE1 MET 86 HE3 MET 86 -5.280 8.333 6.296 651 HE2 MET 86 HE1 MET 86 -6.452 9.065 5.202 652 HE3 MET 86 HE2 MET 86 -5.514 7.662 4.683 653 H ASP 87 HN ASP 87 -2.817 3.945 7.541 654 HA ASP 87 HA ASP 87 -0.913 5.602 8.867 655 HB2 ASP 87 HB2 ASP 87 -1.391 2.632 8.843 656 HB3 ASP 87 HB1 ASP 87 -0.204 3.418 9.881 657 H ALA 88 HN ALA 88 -0.830 4.375 5.827 658 HA ALA 88 HA ALA 88 1.704 3.101 5.703 659 HB1 ALA 88 HB3 ALA 88 1.279 2.817 3.464 660 HB2 ALA 88 HB1 ALA 88 0.353 4.317 3.344 661 HB3 ALA 88 HB2 ALA 88 -0.340 2.917 4.160 662 H ALA 89 HN ALA 89 0.711 6.449 5.588 663 HA ALA 89 HA ALA 89 3.459 7.254 5.507 664 HB1 ALA 89 HB3 ALA 89 3.172 6.856 3.148 665 HB2 ALA 89 HB1 ALA 89 3.344 8.584 3.447 666 HB3 ALA 89 HB2 ALA 89 1.751 7.903 3.103 667 H ASP 90 HN ASP 90 0.810 9.163 4.173 668 HA ASP 90 HA ASP 90 1.320 11.180 6.217 669 HB2 ASP 90 HB2 ASP 90 0.608 11.324 3.499 670 HB3 ASP 90 HB1 ASP 90 -0.788 11.919 4.394 671 H ASN 91 HN ASN 91 0.472 9.935 7.910 672 HA ASN 91 HA ASN 91 -2.446 9.612 7.919 673 HB2 ASN 91 HB2 ASN 91 -1.628 8.221 10.126 674 HB3 ASN 91 HB1 ASN 91 -1.913 7.503 8.549 675 HD21 ASN 91 HD21 ASN 91 -0.156 6.950 7.243 676 HD22 ASN 91 HD22 ASN 91 1.444 6.836 7.878 677 H ASP 92 HN ASP 92 0.290 10.801 9.812 678 HA ASP 92 HA ASP 92 -1.267 11.714 11.968 679 HB2 ASP 92 HB2 ASP 92 0.701 13.002 12.600 680 HB3 ASP 92 HB1 ASP 92 1.186 11.398 12.072 681 H GLY 93 HN GLY 93 -0.706 12.973 8.773 682 HA2 GLY 93 HA2 GLY 93 -2.731 14.965 9.254 683 HA3 GLY 93 HA1 GLY 93 -1.124 15.594 8.905 684 H ASP 94 HN ASP 94 -3.845 15.350 7.438 685 HA ASP 94 HA ASP 94 -4.397 15.590 5.267 686 HB2 ASP 94 HB2 ASP 94 -1.873 15.954 4.917 687 HB3 ASP 94 HB1 ASP 94 -1.857 14.273 4.402 688 H GLY 95 HN GLY 95 -3.339 12.628 6.686 689 HA2 GLY 95 HA2 GLY 95 -3.928 10.438 6.295 690 HA3 GLY 95 HA1 GLY 95 -5.497 11.131 5.926 691 H LYS 96 HN LYS 96 -2.717 11.933 3.983 692 HA LYS 96 HA LYS 96 -3.940 10.384 1.802 693 HB2 LYS 96 HB2 LYS 96 -3.689 12.153 0.433 694 HB3 LYS 96 HB1 LYS 96 -3.278 13.089 1.858 695 HG2 LYS 96 HG2 LYS 96 -1.360 11.741 -0.034 696 HG3 LYS 96 HG1 LYS 96 -1.680 13.462 0.084 697 HD2 LYS 96 HD2 LYS 96 -0.999 12.801 2.661 698 HD3 LYS 96 HD1 LYS 96 0.070 11.782 1.689 699 HE2 LYS 96 HE2 LYS 96 1.162 13.885 2.134 700 HE3 LYS 96 HE1 LYS 96 0.764 13.789 0.421 701 HZ1 LYS 96 HZ3 LYS 96 0.184 15.940 1.118 702 HZ2 LYS 96 HZ1 LYS 96 -0.583 15.384 2.519 703 HZ3 LYS 96 HZ2 LYS 96 -1.283 15.108 1.006 704 H ILE 97 HN ILE 97 -2.424 9.519 0.177 705 HA ILE 97 HA ILE 97 0.207 8.853 1.291 706 HB ILE 97 HB ILE 97 -1.442 6.833 -0.214 707 HG12 ILE 97 HG12 ILE 97 -2.494 7.406 1.986 708 HG13 ILE 97 HG11 ILE 97 -1.904 5.754 1.887 709 HG21 ILE 97 HG21 ILE 97 0.264 5.303 0.850 710 HG22 ILE 97 HG22 ILE 97 1.152 6.760 1.302 711 HG23 ILE 97 HG23 ILE 97 0.866 6.394 -0.397 712 HD11 ILE 97 HD13 ILE 97 -0.011 6.262 3.230 713 HD12 ILE 97 HD11 ILE 97 -1.449 6.870 4.048 714 HD13 ILE 97 HD12 ILE 97 -0.388 7.980 3.193 715 H GLY 98 HN GLY 98 1.352 10.173 -0.157 716 HA2 GLY 98 HA2 GLY 98 1.071 9.535 -2.985 717 HA3 GLY 98 HA1 GLY 98 1.848 10.964 -2.314 718 H ALA 99 HN ALA 99 3.217 9.644 -4.201 719 HA ALA 99 HA ALA 99 4.824 7.471 -3.434 720 HB1 ALA 99 HB3 ALA 99 6.217 7.972 -5.254 721 HB2 ALA 99 HB1 ALA 99 5.868 9.698 -5.159 722 HB3 ALA 99 HB2 ALA 99 4.633 8.580 -5.734 723 H ASP 100 HN ASP 100 5.480 10.948 -3.137 724 HA ASP 100 HA ASP 100 7.927 10.742 -1.816 725 HB2 ASP 100 HB2 ASP 100 7.647 13.039 -1.174 726 HB3 ASP 100 HB1 ASP 100 6.940 12.844 -2.772 727 H GLU 101 HN GLU 101 4.663 11.050 -0.475 728 HA GLU 101 HA GLU 101 5.322 10.943 2.236 729 HB2 GLU 101 HB2 GLU 101 2.958 10.722 0.557 730 HB3 GLU 101 HB1 GLU 101 2.837 9.699 1.973 731 HG2 GLU 101 HG2 GLU 101 1.949 12.138 1.986 732 HG3 GLU 101 HG1 GLU 101 2.740 11.478 3.403 733 H PHE 102 HN PHE 102 4.194 8.369 0.074 734 HA PHE 102 HA PHE 102 4.456 6.193 1.735 735 HD1 PHE 102 HD1 PHE 102 6.814 4.496 -0.369 736 HD2 PHE 102 HD2 PHE 102 2.594 3.990 -0.245 737 HE1 PHE 102 HE1 PHE 102 7.119 2.077 -0.199 738 HE2 PHE 102 HE2 PHE 102 2.891 1.551 -0.094 739 HZ PHE 102 HZ PHE 102 5.159 0.588 -0.070 740 HB2 PHE 102 HB2 PHE 102 3.453 6.100 -0.515 741 HB3 PHE 102 HB1 PHE 102 5.051 6.273 -1.243 742 H GLN 103 HN GLN 103 6.918 7.710 -0.336 743 HA GLN 103 HA GLN 103 9.028 5.937 0.150 744 HB2 GLN 103 HB2 GLN 103 9.075 8.895 -0.439 745 HB3 GLN 103 HB1 GLN 103 10.510 7.874 -0.421 746 HG2 GLN 103 HG2 GLN 103 8.374 6.811 -2.073 747 HG3 GLN 103 HG1 GLN 103 8.914 8.410 -2.569 748 HE21 GLN 103 HE21 GLN 103 9.812 7.616 -4.461 749 HE22 GLN 103 HE22 GLN 103 11.282 6.707 -4.473 750 H GLU 104 HN GLU 104 7.687 8.468 2.131 751 HA GLU 104 HA GLU 104 9.923 8.834 3.855 752 HB2 GLU 104 HB2 GLU 104 6.983 9.342 4.320 753 HB3 GLU 104 HB1 GLU 104 8.247 9.796 5.449 754 HG2 GLU 104 HG2 GLU 104 8.102 10.766 2.610 755 HG3 GLU 104 HG1 GLU 104 7.456 11.644 3.994 756 H MET 105 HN MET 105 7.117 6.697 3.962 757 HA MET 105 HA MET 105 7.476 5.669 6.534 758 HB2 MET 105 HB2 MET 105 5.601 5.353 4.661 759 HB3 MET 105 HB1 MET 105 6.470 3.842 4.425 760 HG2 MET 105 HG2 MET 105 5.403 4.786 7.072 761 HG3 MET 105 HG1 MET 105 4.542 3.702 5.986 762 HE1 MET 105 HE3 MET 105 5.319 3.035 9.117 763 HE2 MET 105 HE1 MET 105 5.653 1.320 8.884 764 HE3 MET 105 HE2 MET 105 4.301 2.078 8.042 765 H VAL 106 HN VAL 106 8.631 4.366 3.424 766 HA VAL 106 HA VAL 106 9.984 2.159 4.485 767 HB VAL 106 HB VAL 106 9.554 2.254 2.122 768 HG11 VAL 106 HG11 VAL 106 11.185 4.748 2.235 769 HG12 VAL 106 HG12 VAL 106 9.601 4.471 1.509 770 HG13 VAL 106 HG13 VAL 106 11.049 3.824 0.746 771 HG21 VAL 106 HG23 VAL 106 12.067 1.614 3.245 772 HG22 VAL 106 HG21 VAL 106 12.375 2.368 1.681 773 HG23 VAL 106 HG22 VAL 106 11.332 0.949 1.785 774 H HIS 107 HN HIS 107 10.966 5.486 4.003 775 HA HIS 107 HA HIS 107 13.698 5.016 4.788 776 HD1 HIS 107 HD1 HIS 107 15.569 6.760 3.054 777 HD2 HIS 107 HD2 HIS 107 14.073 8.953 6.251 778 HE1 HIS 107 HE1 HIS 107 17.518 8.086 3.931 779 HE2 HIS 107 HE2 HIS 107 16.606 9.351 5.911 780 HB2 HIS 107 HB2 HIS 107 12.979 6.821 3.190 781 HB3 HIS 107 HB1 HIS 107 12.262 7.664 4.559 782 H SER 108 HN SER 108 10.729 5.798 6.369 783 HA SER 108 HA SER 108 11.690 7.078 8.667 784 HG SER 108 HG SER 108 8.721 5.813 10.291 785 HB2 SER 108 HB2 SER 108 9.321 7.048 8.135 786 HB3 SER 108 HB1 SER 108 9.271 5.295 8.317 Start of MODEL 16 1 HA SER 1 HA SER 1 3.021 -3.538 -10.536 2 HG SER 1 HG SER 1 0.260 -1.523 -10.922 3 H1 SER 1 HT1 SER 1 0.668 -4.042 -10.474 4 H2 SER 1 HT2 SER 1 0.634 -3.793 -8.802 5 H3 SER 1 HT3 SER 1 1.538 -5.068 -9.447 6 HB2 SER 1 HB2 SER 1 1.381 -1.397 -9.154 7 HB3 SER 1 HB1 SER 1 2.835 -1.129 -10.114 8 H ILE 2 HN ILE 2 4.529 -4.520 -9.286 9 HA ILE 2 HA ILE 2 5.711 -3.208 -7.178 10 HB ILE 2 HB ILE 2 3.354 -4.499 -6.302 11 HG12 ILE 2 HG12 ILE 2 5.600 -3.146 -4.864 12 HG13 ILE 2 HG11 ILE 2 4.108 -2.438 -5.374 13 HG21 ILE 2 HG21 ILE 2 5.620 -5.729 -4.792 14 HG22 ILE 2 HG22 ILE 2 4.880 -6.556 -6.164 15 HG23 ILE 2 HG23 ILE 2 3.905 -6.123 -4.769 16 HD11 ILE 2 HD13 ILE 2 3.841 -2.702 -3.111 17 HD12 ILE 2 HD11 ILE 2 4.661 -4.264 -3.095 18 HD13 ILE 2 HD12 ILE 2 3.052 -4.121 -3.782 19 H THR 3 HN THR 3 4.925 -6.356 -8.517 20 HA THR 3 HA THR 3 7.121 -7.809 -7.629 21 HB THR 3 HB THR 3 6.778 -9.243 -9.643 22 HG1 THR 3 HG1 THR 3 5.701 -8.459 -11.284 23 HG21 THR 3 HG23 THR 3 4.120 -8.566 -8.417 24 HG22 THR 3 HG21 THR 3 5.408 -9.320 -7.473 25 HG23 THR 3 HG22 THR 3 4.751 -10.145 -8.889 26 H ASP 4 HN ASP 4 6.995 -5.212 -9.869 27 HA ASP 4 HA ASP 4 8.962 -5.555 -11.684 28 HB2 ASP 4 HB2 ASP 4 8.658 -3.123 -9.904 29 HB3 ASP 4 HB1 ASP 4 9.545 -3.159 -11.426 30 H ILE 5 HN ILE 5 9.519 -4.674 -8.278 31 HA ILE 5 HA ILE 5 12.093 -6.083 -8.399 32 HB ILE 5 HB ILE 5 11.811 -3.436 -6.984 33 HG12 ILE 5 HG12 ILE 5 13.112 -3.780 -9.683 34 HG13 ILE 5 HG11 ILE 5 11.431 -3.279 -9.505 35 HG21 ILE 5 HG21 ILE 5 13.617 -4.942 -6.269 36 HG22 ILE 5 HG22 ILE 5 14.226 -3.445 -6.981 37 HG23 ILE 5 HG23 ILE 5 14.247 -4.942 -7.917 38 HD11 ILE 5 HD13 ILE 5 13.092 -1.437 -9.828 39 HD12 ILE 5 HD11 ILE 5 13.710 -1.816 -8.219 40 HD13 ILE 5 HD12 ILE 5 12.038 -1.288 -8.421 41 H LEU 6 HN LEU 6 11.250 -7.728 -7.172 42 HA LEU 6 HA LEU 6 11.289 -7.413 -4.358 43 HG LEU 6 HG LEU 6 10.010 -5.922 -3.553 44 HB2 LEU 6 HB2 LEU 6 8.682 -7.194 -5.682 45 HB3 LEU 6 HB1 LEU 6 8.727 -8.351 -4.368 46 HD11 LEU 6 HD11 LEU 6 7.615 -5.621 -5.182 47 HD12 LEU 6 HD12 LEU 6 8.809 -4.425 -4.664 48 HD13 LEU 6 HD13 LEU 6 7.488 -4.883 -3.587 49 HD21 LEU 6 HD23 LEU 6 9.119 -7.592 -2.032 50 HD22 LEU 6 HD21 LEU 6 7.493 -7.311 -2.650 51 HD23 LEU 6 HD22 LEU 6 8.328 -6.037 -1.769 52 H SER 7 HN SER 7 10.707 -9.365 -3.170 53 HA SER 7 HA SER 7 11.393 -11.772 -4.629 54 HG SER 7 HG SER 7 13.184 -12.210 -2.170 55 HB2 SER 7 HB2 SER 7 10.724 -11.282 -1.716 56 HB3 SER 7 HB1 SER 7 11.203 -12.846 -2.369 57 H ALA 8 HN ALA 8 9.830 -12.922 -5.634 58 HA ALA 8 HA ALA 8 7.122 -12.141 -5.536 59 HB1 ALA 8 HB3 ALA 8 8.004 -13.128 -7.522 60 HB2 ALA 8 HB1 ALA 8 6.721 -14.169 -6.903 61 HB3 ALA 8 HB2 ALA 8 8.410 -14.617 -6.664 62 H GLU 9 HN GLU 9 8.756 -15.015 -4.134 63 HA GLU 9 HA GLU 9 6.392 -16.119 -3.061 64 HB2 GLU 9 HB2 GLU 9 9.275 -16.465 -2.248 65 HB3 GLU 9 HB1 GLU 9 7.952 -17.459 -1.649 66 HG2 GLU 9 HG2 GLU 9 8.743 -17.181 -4.526 67 HG3 GLU 9 HG1 GLU 9 9.236 -18.506 -3.473 68 H ASP 10 HN ASP 10 9.050 -14.409 -1.402 69 HA ASP 10 HA ASP 10 7.913 -14.102 1.033 70 HB2 ASP 10 HB2 ASP 10 9.637 -12.152 -0.463 71 HB3 ASP 10 HB1 ASP 10 9.238 -11.975 1.237 72 H ILE 11 HN ILE 11 7.076 -12.398 -1.860 73 HA ILE 11 HA ILE 11 5.614 -10.301 -0.613 74 HB ILE 11 HB ILE 11 5.922 -11.389 -3.336 75 HG12 ILE 11 HG12 ILE 11 5.668 -8.579 -2.246 76 HG13 ILE 11 HG11 ILE 11 7.175 -9.449 -2.528 77 HG21 ILE 11 HG21 ILE 11 3.329 -10.210 -2.477 78 HG22 ILE 11 HG22 ILE 11 3.659 -11.461 -3.676 79 HG23 ILE 11 HG23 ILE 11 3.971 -9.767 -4.059 80 HD11 ILE 11 HD13 ILE 11 6.613 -7.797 -4.289 81 HD12 ILE 11 HD11 ILE 11 5.188 -8.757 -4.680 82 HD13 ILE 11 HD12 ILE 11 6.798 -9.442 -4.895 83 H ALA 12 HN ALA 12 4.681 -13.448 -1.963 84 HA ALA 12 HA ALA 12 1.946 -13.351 -1.409 85 HB1 ALA 12 HB3 ALA 12 3.541 -15.176 -2.569 86 HB2 ALA 12 HB1 ALA 12 1.898 -15.528 -2.027 87 HB3 ALA 12 HB2 ALA 12 3.273 -15.945 -1.006 88 H ALA 13 HN ALA 13 4.563 -14.727 0.576 89 HA ALA 13 HA ALA 13 2.908 -15.317 2.789 90 HB1 ALA 13 HB3 ALA 13 5.257 -16.187 2.355 91 HB2 ALA 13 HB1 ALA 13 4.906 -15.699 4.015 92 HB3 ALA 13 HB2 ALA 13 5.838 -14.634 2.962 93 H ALA 14 HN ALA 14 5.156 -12.688 2.196 94 HA ALA 14 HA ALA 14 4.746 -11.052 4.324 95 HB1 ALA 14 HB3 ALA 14 6.332 -10.386 2.688 96 HB2 ALA 14 HB1 ALA 14 5.121 -9.110 2.743 97 HB3 ALA 14 HB2 ALA 14 5.099 -10.285 1.430 98 H LEU 15 HN LEU 15 2.734 -11.243 1.422 99 HA LEU 15 HA LEU 15 0.815 -9.330 2.327 100 HG LEU 15 HG LEU 15 -0.716 -8.679 0.443 101 HB2 LEU 15 HB2 LEU 15 1.297 -10.039 -0.076 102 HB3 LEU 15 HB1 LEU 15 0.383 -11.485 0.274 103 HD11 LEU 15 HD11 LEU 15 -2.079 -9.529 -1.549 104 HD12 LEU 15 HD12 LEU 15 -0.826 -10.760 -1.713 105 HD13 LEU 15 HD13 LEU 15 -0.407 -9.053 -1.836 106 HD21 LEU 15 HD23 LEU 15 -1.795 -11.353 1.114 107 HD22 LEU 15 HD21 LEU 15 -2.878 -10.216 0.312 108 HD23 LEU 15 HD22 LEU 15 -2.117 -9.782 1.843 109 H GLN 16 HN GLN 16 0.715 -12.868 1.917 110 HA GLN 16 HA GLN 16 -1.821 -13.288 3.036 111 HB2 GLN 16 HB2 GLN 16 0.500 -14.990 2.280 112 HB3 GLN 16 HB1 GLN 16 -0.895 -15.673 3.096 113 HG2 GLN 16 HG2 GLN 16 -0.575 -15.362 0.395 114 HG3 GLN 16 HG1 GLN 16 -2.073 -15.719 1.243 115 HE21 GLN 16 HE21 GLN 16 -0.286 -13.405 -0.555 116 HE22 GLN 16 HE22 GLN 16 -1.530 -12.212 -0.665 117 H GLU 17 HN GLU 17 0.893 -12.340 4.761 118 HA GLU 17 HA GLU 17 1.073 -14.392 6.697 119 HB2 GLU 17 HB2 GLU 17 2.898 -12.873 6.453 120 HB3 GLU 17 HB1 GLU 17 1.864 -11.486 6.758 121 HG2 GLU 17 HG2 GLU 17 1.530 -12.298 9.065 122 HG3 GLU 17 HG1 GLU 17 2.658 -13.609 8.732 123 H CYS 18 HN CYS 18 0.002 -11.066 7.497 124 HA CYS 18 HA CYS 18 -1.999 -12.239 9.259 125 HG CYS 18 HG CYS 18 -2.889 -11.243 11.378 126 HB2 CYS 18 HB2 CYS 18 -0.105 -10.817 10.176 127 HB3 CYS 18 HB1 CYS 18 -0.869 -9.450 9.376 128 H GLN 19 HN GLN 19 -2.031 -11.153 6.238 129 HA GLN 19 HA GLN 19 -3.432 -8.811 6.040 130 HB2 GLN 19 HB2 GLN 19 -2.603 -10.015 4.125 131 HB3 GLN 19 HB1 GLN 19 -3.818 -11.247 4.359 132 HG2 GLN 19 HG2 GLN 19 -5.551 -9.492 3.996 133 HG3 GLN 19 HG1 GLN 19 -4.243 -8.392 3.569 134 HE21 GLN 19 HE21 GLN 19 -4.663 -8.070 1.455 135 HE22 GLN 19 HE22 GLN 19 -4.664 -9.324 0.265 136 H ASP 20 HN ASP 20 -5.436 -8.133 6.002 137 HA ASP 20 HA ASP 20 -7.827 -9.459 6.152 138 HB2 ASP 20 HB2 ASP 20 -6.370 -9.667 8.638 139 HB3 ASP 20 HB1 ASP 20 -7.851 -8.745 8.883 140 HA PRO 21 HA PRO 21 -9.208 -5.240 6.302 141 HB2 PRO 21 HB2 PRO 21 -11.631 -5.371 7.319 142 HB3 PRO 21 HB1 PRO 21 -11.263 -6.206 5.818 143 HG2 PRO 21 HG2 PRO 21 -11.437 -7.286 8.608 144 HG3 PRO 21 HG1 PRO 21 -12.128 -7.945 7.112 145 HD2 PRO 21 HD2 PRO 21 -9.787 -8.812 8.192 146 HD3 PRO 21 HD1 PRO 21 -10.151 -8.863 6.461 147 H ASP 22 HN ASP 22 -7.368 -5.295 8.268 148 HA ASP 22 HA ASP 22 -7.912 -3.273 9.994 149 HB2 ASP 22 HB2 ASP 22 -9.718 -4.447 11.033 150 HB3 ASP 22 HB1 ASP 22 -8.745 -5.889 11.256 151 H THR 23 HN THR 23 -5.890 -5.883 9.153 152 HA THR 23 HA THR 23 -4.138 -5.502 11.451 153 HB THR 23 HB THR 23 -4.496 -7.778 10.780 154 HG1 THR 23 HG1 THR 23 -2.437 -7.455 11.554 155 HG21 THR 23 HG23 THR 23 -4.096 -6.681 8.122 156 HG22 THR 23 HG21 THR 23 -4.886 -8.178 8.614 157 HG23 THR 23 HG22 THR 23 -3.135 -8.131 8.398 158 H PHE 24 HN PHE 24 -4.201 -4.761 8.033 159 HA PHE 24 HA PHE 24 -2.966 -2.991 7.073 160 HD1 PHE 24 HD2 PHE 24 -0.156 -2.731 5.979 161 HD2 PHE 24 HD1 PHE 24 -1.373 -0.523 9.345 162 HE1 PHE 24 HE2 PHE 24 0.644 -0.645 4.910 163 HE2 PHE 24 HE1 PHE 24 -0.577 1.557 8.329 164 HZ PHE 24 HZ PHE 24 0.438 1.491 6.092 165 HB2 PHE 24 HB2 PHE 24 -1.728 -2.705 9.377 166 HB3 PHE 24 HB1 PHE 24 -0.477 -3.658 8.582 167 H GLU 25 HN GLU 25 -3.266 -4.292 5.430 168 HA GLU 25 HA GLU 25 -1.702 -6.582 4.879 169 HB2 GLU 25 HB2 GLU 25 -3.264 -5.102 2.803 170 HB3 GLU 25 HB1 GLU 25 -2.970 -6.824 2.950 171 HG2 GLU 25 HG2 GLU 25 -4.405 -6.895 4.927 172 HG3 GLU 25 HG1 GLU 25 -4.731 -5.184 4.721 173 HA PRO 26 HA PRO 26 0.146 -3.633 1.383 174 HB2 PRO 26 HB2 PRO 26 0.472 -1.170 2.922 175 HB3 PRO 26 HB1 PRO 26 -0.162 -1.413 1.311 176 HG2 PRO 26 HG2 PRO 26 -1.646 -0.790 3.471 177 HG3 PRO 26 HG1 PRO 26 -2.266 -1.499 1.993 178 HD2 PRO 26 HD2 PRO 26 -1.960 -2.703 4.619 179 HD3 PRO 26 HD1 PRO 26 -2.879 -3.248 3.210 180 H GLN 27 HN GLN 27 1.088 -2.410 4.586 181 HA GLN 27 HA GLN 27 3.811 -2.221 4.051 182 HB2 GLN 27 HB2 GLN 27 2.166 -2.265 6.535 183 HB3 GLN 27 HB1 GLN 27 3.908 -2.430 6.690 184 HG2 GLN 27 HG2 GLN 27 4.244 -0.316 5.585 185 HG3 GLN 27 HG1 GLN 27 2.510 -0.165 5.299 186 HE21 GLN 27 HE21 GLN 27 2.396 1.764 6.451 187 HE22 GLN 27 HE22 GLN 27 2.478 1.806 8.177 188 H LYS 28 HN LYS 28 2.017 -4.944 5.470 189 HA LYS 28 HA LYS 28 4.296 -6.349 6.290 190 HB2 LYS 28 HB2 LYS 28 1.513 -7.234 5.515 191 HB3 LYS 28 HB1 LYS 28 2.709 -8.288 6.211 192 HG2 LYS 28 HG2 LYS 28 2.545 -6.040 7.881 193 HG3 LYS 28 HG1 LYS 28 0.900 -6.560 7.518 194 HD2 LYS 28 HD2 LYS 28 1.830 -8.932 8.054 195 HD3 LYS 28 HD1 LYS 28 3.098 -8.039 8.900 196 HE2 LYS 28 HE2 LYS 28 0.193 -7.492 9.340 197 HE3 LYS 28 HE1 LYS 28 1.046 -8.739 10.251 198 HZ1 LYS 28 HZ3 LYS 28 2.552 -7.074 11.089 199 HZ2 LYS 28 HZ1 LYS 28 0.962 -6.596 11.417 200 HZ3 LYS 28 HZ2 LYS 28 1.820 -5.872 10.152 201 H PHE 29 HN PHE 29 2.300 -6.425 3.418 202 HA PHE 29 HA PHE 29 3.562 -8.342 1.906 203 HD1 PHE 29 HD1 PHE 29 4.445 -5.927 -0.647 204 HD2 PHE 29 HD2 PHE 29 0.920 -8.286 -0.654 205 HE1 PHE 29 HE1 PHE 29 4.817 -6.469 -3.010 206 HE2 PHE 29 HE2 PHE 29 1.278 -8.841 -3.019 207 HZ PHE 29 HZ PHE 29 3.232 -7.931 -4.200 208 HB2 PHE 29 HB2 PHE 29 1.485 -7.237 1.248 209 HB3 PHE 29 HB1 PHE 29 2.323 -5.706 1.070 210 H PHE 30 HN PHE 30 4.168 -4.876 1.967 211 HA PHE 30 HA PHE 30 6.405 -4.891 0.221 212 HD1 PHE 30 HD1 PHE 30 4.618 -4.072 -0.944 213 HD2 PHE 30 HD2 PHE 30 4.089 -1.315 2.251 214 HE1 PHE 30 HE1 PHE 30 2.408 -3.456 -1.836 215 HE2 PHE 30 HE2 PHE 30 1.881 -0.694 1.363 216 HZ PHE 30 HZ PHE 30 1.037 -1.765 -0.685 217 HB2 PHE 30 HB2 PHE 30 5.877 -2.776 2.285 218 HB3 PHE 30 HB1 PHE 30 6.594 -2.592 0.687 219 H GLN 31 HN GLN 31 6.196 -4.281 3.689 220 HA GLN 31 HA GLN 31 8.891 -4.045 4.228 221 HB2 GLN 31 HB2 GLN 31 6.884 -3.545 5.719 222 HB3 GLN 31 HB1 GLN 31 6.934 -5.245 6.163 223 HG2 GLN 31 HG2 GLN 31 8.183 -4.407 7.848 224 HG3 GLN 31 HG1 GLN 31 9.464 -4.662 6.664 225 HE21 GLN 31 HE21 GLN 31 8.544 -2.392 5.017 226 HE22 GLN 31 HE22 GLN 31 9.054 -0.975 5.854 227 H THR 32 HN THR 32 6.995 -6.916 5.050 228 HA THR 32 HA THR 32 9.053 -8.516 5.889 229 HB THR 32 HB THR 32 6.599 -9.370 4.353 230 HG1 THR 32 HG1 THR 32 7.171 -8.902 7.080 231 HG21 THR 32 HG23 THR 32 8.247 -11.156 4.316 232 HG22 THR 32 HG21 THR 32 6.941 -11.570 5.426 233 HG23 THR 32 HG22 THR 32 8.487 -11.001 6.057 234 H SER 33 HN SER 33 7.771 -8.413 2.555 235 HA SER 33 HA SER 33 9.929 -10.079 1.620 236 HG SER 33 HG SER 33 9.717 -9.572 -1.048 237 HB2 SER 33 HB2 SER 33 7.669 -10.346 0.732 238 HB3 SER 33 HB1 SER 33 7.738 -8.735 0.042 239 H GLY 34 HN GLY 34 8.836 -6.799 0.691 240 HA2 GLY 34 HA2 GLY 34 11.454 -6.506 -0.579 241 HA3 GLY 34 HA1 GLY 34 10.046 -5.577 -0.995 242 H LEU 35 HN LEU 35 9.317 -4.138 1.080 243 HA LEU 35 HA LEU 35 10.852 -1.919 1.034 244 HG LEU 35 HG LEU 35 9.628 -0.039 2.511 245 HB2 LEU 35 HB2 LEU 35 8.683 -2.904 2.584 246 HB3 LEU 35 HB1 LEU 35 9.812 -2.121 3.671 247 HD11 LEU 35 HD11 LEU 35 8.283 -1.676 0.407 248 HD12 LEU 35 HD12 LEU 35 9.582 -0.490 0.243 249 HD13 LEU 35 HD13 LEU 35 7.930 0.043 0.558 250 HD21 LEU 35 HD23 LEU 35 6.833 -1.128 2.629 251 HD22 LEU 35 HD21 LEU 35 7.375 0.522 2.925 252 HD23 LEU 35 HD22 LEU 35 7.779 -0.758 4.069 253 H SER 36 HN SER 36 11.284 -4.564 3.366 254 HA SER 36 HA SER 36 12.957 -3.726 5.208 255 HG SER 36 HG SER 36 12.790 -6.145 2.638 256 HB2 SER 36 HB2 SER 36 14.231 -5.854 5.066 257 HB3 SER 36 HB1 SER 36 12.487 -6.081 4.943 258 H LYS 37 HN LYS 37 13.982 -3.893 1.816 259 HA LYS 37 HA LYS 37 16.360 -2.351 2.597 260 HB2 LYS 37 HB2 LYS 37 17.598 -3.653 0.776 261 HB3 LYS 37 HB1 LYS 37 17.332 -4.416 2.330 262 HG2 LYS 37 HG2 LYS 37 15.527 -5.705 1.447 263 HG3 LYS 37 HG1 LYS 37 15.624 -4.858 -0.099 264 HD2 LYS 37 HD2 LYS 37 17.769 -5.784 -0.551 265 HD3 LYS 37 HD1 LYS 37 17.900 -6.429 1.084 266 HE2 LYS 37 HE2 LYS 37 16.086 -7.980 0.649 267 HE3 LYS 37 HE1 LYS 37 15.853 -7.290 -0.959 268 HZ1 LYS 37 HZ3 LYS 37 18.381 -8.571 -0.078 269 HZ2 LYS 37 HZ1 LYS 37 17.955 -8.112 -1.649 270 HZ3 LYS 37 HZ2 LYS 37 17.154 -9.398 -0.898 271 H MET 38 HN MET 38 13.832 -2.795 0.344 272 HA MET 38 HA MET 38 14.512 -1.850 -2.050 273 HB2 MET 38 HB2 MET 38 12.217 -0.561 -0.600 274 HB3 MET 38 HB1 MET 38 12.364 -0.886 -2.312 275 HG2 MET 38 HG2 MET 38 12.245 -3.299 -1.839 276 HG3 MET 38 HG1 MET 38 12.044 -2.884 -0.146 277 HE1 MET 38 HE3 MET 38 9.827 -3.333 -3.542 278 HE2 MET 38 HE1 MET 38 8.888 -4.194 -2.324 279 HE3 MET 38 HE2 MET 38 10.630 -4.456 -2.447 280 H SER 39 HN SER 39 15.423 -0.143 -2.952 281 HA SER 39 HA SER 39 16.264 2.090 -1.410 282 HG SER 39 HG SER 39 17.281 3.871 -3.310 283 HB2 SER 39 HB2 SER 39 17.679 1.704 -3.220 284 HB3 SER 39 HB1 SER 39 16.344 1.408 -4.333 285 H ALA 40 HN ALA 40 15.682 4.365 -2.141 286 HA ALA 40 HA ALA 40 12.922 4.743 -1.709 287 HB1 ALA 40 HB3 ALA 40 14.724 6.777 -3.012 288 HB2 ALA 40 HB1 ALA 40 14.760 6.432 -1.281 289 HB3 ALA 40 HB2 ALA 40 13.289 7.063 -2.024 290 H SER 41 HN SER 41 14.880 4.836 -4.646 291 HA SER 41 HA SER 41 12.992 5.622 -6.484 292 HG SER 41 HG SER 41 16.386 5.603 -7.198 293 HB2 SER 41 HB2 SER 41 15.376 3.804 -6.736 294 HB3 SER 41 HB1 SER 41 14.406 4.285 -8.125 295 H GLN 42 HN GLN 42 13.837 2.224 -5.685 296 HA GLN 42 HA GLN 42 11.878 1.159 -7.421 297 HB2 GLN 42 HB2 GLN 42 12.344 -0.966 -6.527 298 HB3 GLN 42 HB1 GLN 42 13.868 -0.095 -6.512 299 HG2 GLN 42 HG2 GLN 42 13.972 -0.038 -4.248 300 HG3 GLN 42 HG1 GLN 42 12.219 -0.028 -4.052 301 HE21 GLN 42 HE21 GLN 42 11.158 -1.925 -3.734 302 HE22 GLN 42 HE22 GLN 42 11.927 -3.473 -3.746 303 H VAL 43 HN VAL 43 11.779 2.293 -4.184 304 HA VAL 43 HA VAL 43 9.403 1.069 -3.347 305 HB VAL 43 HB VAL 43 10.520 3.753 -2.558 306 HG11 VAL 43 HG11 VAL 43 8.422 2.203 -1.068 307 HG12 VAL 43 HG12 VAL 43 8.015 3.485 -2.205 308 HG13 VAL 43 HG13 VAL 43 8.975 3.850 -0.770 309 HG21 VAL 43 HG23 VAL 43 11.480 1.247 -2.088 310 HG22 VAL 43 HG21 VAL 43 10.465 1.508 -0.671 311 HG23 VAL 43 HG22 VAL 43 11.765 2.633 -1.045 312 H LYS 44 HN LYS 44 9.954 4.035 -5.211 313 HA LYS 44 HA LYS 44 7.404 5.002 -5.463 314 HB2 LYS 44 HB2 LYS 44 9.464 4.740 -7.660 315 HB3 LYS 44 HB1 LYS 44 8.056 5.789 -7.719 316 HG2 LYS 44 HG2 LYS 44 8.917 7.000 -5.769 317 HG3 LYS 44 HG1 LYS 44 10.340 5.970 -5.776 318 HD2 LYS 44 HD2 LYS 44 9.470 7.904 -7.911 319 HD3 LYS 44 HD1 LYS 44 10.868 8.033 -6.841 320 HE2 LYS 44 HE2 LYS 44 11.556 5.776 -7.854 321 HE3 LYS 44 HE1 LYS 44 10.419 6.176 -9.138 322 HZ1 LYS 44 HZ3 LYS 44 12.757 7.812 -8.312 323 HZ2 LYS 44 HZ1 LYS 44 11.644 8.242 -9.510 324 HZ3 LYS 44 HZ2 LYS 44 12.638 6.890 -9.725 325 H ASP 45 HN ASP 45 8.914 2.497 -7.477 326 HA ASP 45 HA ASP 45 6.690 1.947 -9.073 327 HB2 ASP 45 HB2 ASP 45 9.297 0.948 -8.818 328 HB3 ASP 45 HB1 ASP 45 8.254 -0.438 -8.522 329 H ILE 46 HN ILE 46 7.772 0.630 -5.992 330 HA ILE 46 HA ILE 46 5.872 -1.359 -5.642 331 HB ILE 46 HB ILE 46 7.625 0.249 -3.871 332 HG12 ILE 46 HG12 ILE 46 8.645 -1.805 -3.443 333 HG13 ILE 46 HG11 ILE 46 7.230 -2.713 -3.910 334 HG21 ILE 46 HG21 ILE 46 5.270 -1.308 -2.872 335 HG22 ILE 46 HG22 ILE 46 5.835 0.296 -2.402 336 HG23 ILE 46 HG23 ILE 46 6.737 -1.133 -1.905 337 HD11 ILE 46 HD13 ILE 46 7.674 -2.481 -6.164 338 HD12 ILE 46 HD11 ILE 46 9.268 -2.716 -5.450 339 HD13 ILE 46 HD12 ILE 46 8.730 -1.105 -5.896 340 H PHE 47 HN PHE 47 5.782 2.036 -4.515 341 HA PHE 47 HA PHE 47 3.353 2.218 -3.373 342 HD1 PHE 47 HD2 PHE 47 2.418 3.700 -2.323 343 HD2 PHE 47 HD1 PHE 47 3.282 6.188 -5.659 344 HE1 PHE 47 HE2 PHE 47 0.581 5.193 -1.682 345 HE2 PHE 47 HE1 PHE 47 1.431 7.683 -5.024 346 HZ PHE 47 HZ PHE 47 0.092 7.192 -3.027 347 HB2 PHE 47 HB2 PHE 47 4.924 4.106 -3.764 348 HB3 PHE 47 HB1 PHE 47 4.382 4.174 -5.432 349 H ARG 48 HN ARG 48 3.999 1.745 -6.744 350 HA ARG 48 HA ARG 48 1.530 2.449 -7.852 351 HE ARG 48 HE ARG 48 4.691 5.104 -9.391 352 HB2 ARG 48 HB2 ARG 48 3.322 0.203 -8.785 353 HB3 ARG 48 HB1 ARG 48 2.132 1.069 -9.745 354 HG2 ARG 48 HG2 ARG 48 4.639 2.245 -8.565 355 HG3 ARG 48 HG1 ARG 48 4.385 1.815 -10.257 356 HD2 ARG 48 HD2 ARG 48 2.543 3.446 -10.369 357 HD3 ARG 48 HD1 ARG 48 2.860 3.900 -8.694 358 HH11 ARG 48 HH11 ARG 48 3.554 3.092 -11.996 359 HH12 ARG 48 HH12 ARG 48 4.550 3.852 -13.192 360 HH21 ARG 48 HH21 ARG 48 6.005 6.116 -10.960 361 HH22 ARG 48 HH22 ARG 48 5.942 5.572 -12.603 362 H PHE 49 HN PHE 49 2.497 -0.328 -6.000 363 HA PHE 49 HA PHE 49 0.601 -2.201 -6.690 364 HD1 PHE 49 HD2 PHE 49 0.879 -4.799 -5.480 365 HD2 PHE 49 HD1 PHE 49 0.133 -1.975 -2.384 366 HE1 PHE 49 HE2 PHE 49 -0.516 -6.452 -4.310 367 HE2 PHE 49 HE1 PHE 49 -1.257 -3.624 -1.209 368 HZ PHE 49 HZ PHE 49 -1.585 -5.866 -2.172 369 HB2 PHE 49 HB2 PHE 49 2.295 -2.822 -5.161 370 HB3 PHE 49 HB1 PHE 49 1.853 -1.573 -4.012 371 H ILE 50 HN ILE 50 0.223 0.118 -3.955 372 HA ILE 50 HA ILE 50 -2.563 -0.336 -3.819 373 HB ILE 50 HB ILE 50 -2.596 1.842 -2.477 374 HG12 ILE 50 HG12 ILE 50 0.404 1.502 -2.639 375 HG13 ILE 50 HG11 ILE 50 -0.502 2.785 -3.439 376 HG21 ILE 50 HG21 ILE 50 -2.124 -0.686 -1.755 377 HG22 ILE 50 HG22 ILE 50 -2.295 0.677 -0.644 378 HG23 ILE 50 HG23 ILE 50 -0.685 0.115 -1.113 379 HD11 ILE 50 HD13 ILE 50 -0.651 2.367 -0.478 380 HD12 ILE 50 HD11 ILE 50 -1.055 3.805 -1.413 381 HD13 ILE 50 HD12 ILE 50 0.632 3.325 -1.214 382 H ASP 51 HN ASP 51 -2.809 2.918 -3.817 383 HA ASP 51 HA ASP 51 -3.952 2.894 -6.445 384 HB2 ASP 51 HB2 ASP 51 -3.892 4.881 -4.181 385 HB3 ASP 51 HB1 ASP 51 -4.495 5.335 -5.779 386 H ASN 52 HN ASN 52 -3.313 4.061 -8.189 387 HA ASN 52 HA ASN 52 -0.492 4.424 -8.483 388 HB2 ASN 52 HB2 ASN 52 -0.968 4.975 -10.785 389 HB3 ASN 52 HB1 ASN 52 -1.971 3.614 -10.313 390 HD21 ASN 52 HD21 ASN 52 -1.886 6.764 -11.489 391 HD22 ASN 52 HD22 ASN 52 -3.588 7.045 -11.588 392 H ASP 53 HN ASP 53 -3.255 6.595 -8.350 393 HA ASP 53 HA ASP 53 -1.841 8.708 -7.158 394 HB2 ASP 53 HB2 ASP 53 -2.016 8.736 -10.137 395 HB3 ASP 53 HB1 ASP 53 -2.301 10.250 -9.285 396 H GLN 54 HN GLN 54 -4.451 7.857 -9.344 397 HA GLN 54 HA GLN 54 -6.658 8.240 -9.364 398 HB2 GLN 54 HB2 GLN 54 -6.472 9.120 -6.503 399 HB3 GLN 54 HB1 GLN 54 -7.758 8.239 -7.317 400 HG2 GLN 54 HG2 GLN 54 -6.052 6.370 -7.628 401 HG3 GLN 54 HG1 GLN 54 -5.081 7.226 -6.432 402 HE21 GLN 54 HE21 GLN 54 -5.734 7.244 -4.305 403 HE22 GLN 54 HE22 GLN 54 -6.951 6.188 -3.696 404 H SER 55 HN SER 55 -5.229 10.812 -7.353 405 HA SER 55 HA SER 55 -6.117 12.801 -9.243 406 HG SER 55 HG SER 55 -8.164 12.476 -5.809 407 HB2 SER 55 HB2 SER 55 -7.267 14.134 -7.413 408 HB3 SER 55 HB1 SER 55 -8.128 12.692 -7.952 409 H GLY 56 HN GLY 56 -3.551 11.972 -8.501 410 HA2 GLY 56 HA2 GLY 56 -1.612 13.348 -8.282 411 HA3 GLY 56 HA1 GLY 56 -2.569 14.477 -7.323 412 H TYR 57 HN TYR 57 -3.672 12.110 -5.834 413 HA TYR 57 HA TYR 57 -1.487 10.980 -4.360 414 HD1 TYR 57 HD1 TYR 57 -4.662 13.670 -3.436 415 HD2 TYR 57 HD2 TYR 57 -0.535 14.552 -3.735 416 HE1 TYR 57 HE1 TYR 57 -5.221 15.959 -4.187 417 HE2 TYR 57 HE2 TYR 57 -1.055 16.847 -4.464 418 HH TYR 57 HH TYR 57 -2.917 18.060 -5.525 419 HB2 TYR 57 HB2 TYR 57 -3.006 12.312 -2.339 420 HB3 TYR 57 HB1 TYR 57 -1.307 12.521 -2.705 421 H LEU 58 HN LEU 58 -2.371 9.665 -2.502 422 HA LEU 58 HA LEU 58 -5.051 8.703 -3.263 423 HG LEU 58 HG LEU 58 -1.730 7.776 -3.022 424 HB2 LEU 58 HB2 LEU 58 -3.439 7.200 -1.285 425 HB3 LEU 58 HB1 LEU 58 -4.472 6.608 -2.564 426 HD11 LEU 58 HD11 LEU 58 -1.334 5.765 -1.877 427 HD12 LEU 58 HD12 LEU 58 -1.182 5.355 -3.584 428 HD13 LEU 58 HD13 LEU 58 -2.652 4.939 -2.702 429 HD21 LEU 58 HD23 LEU 58 -2.297 6.276 -5.184 430 HD22 LEU 58 HD21 LEU 58 -2.595 8.011 -5.073 431 HD23 LEU 58 HD22 LEU 58 -3.897 6.873 -4.762 432 H ASP 59 HN ASP 59 -6.657 8.398 -1.597 433 HA ASP 59 HA ASP 59 -6.013 9.623 0.975 434 HB2 ASP 59 HB2 ASP 59 -8.026 11.081 0.827 435 HB3 ASP 59 HB1 ASP 59 -6.765 11.493 -0.341 436 H GLY 60 HN GLY 60 -7.589 9.279 2.624 437 HA2 GLY 60 HA2 GLY 60 -8.193 6.721 3.162 438 HA3 GLY 60 HA1 GLY 60 -9.177 8.043 3.764 439 H ASP 61 HN ASP 61 -10.150 8.744 1.064 440 HA ASP 61 HA ASP 61 -12.398 6.922 1.082 441 HB2 ASP 61 HB2 ASP 61 -11.960 9.011 -1.017 442 HB3 ASP 61 HB1 ASP 61 -13.474 8.445 -0.316 443 H GLU 62 HN GLU 62 -9.777 7.849 -1.049 444 HA GLU 62 HA GLU 62 -10.580 6.108 -3.173 445 HB2 GLU 62 HB2 GLU 62 -7.995 7.602 -2.875 446 HB3 GLU 62 HB1 GLU 62 -8.751 7.032 -4.359 447 HG2 GLU 62 HG2 GLU 62 -9.961 9.082 -2.549 448 HG3 GLU 62 HG1 GLU 62 -8.955 9.478 -3.944 449 H LEU 63 HN LEU 63 -8.366 5.980 -0.487 450 HA LEU 63 HA LEU 63 -6.424 4.210 -1.201 451 HG LEU 63 HG LEU 63 -6.724 6.343 1.092 452 HB2 LEU 63 HB2 LEU 63 -8.020 4.389 1.355 453 HB3 LEU 63 HB1 LEU 63 -6.620 3.356 1.196 454 HD11 LEU 63 HD11 LEU 63 -4.682 5.284 2.751 455 HD12 LEU 63 HD12 LEU 63 -6.212 4.503 3.149 456 HD13 LEU 63 HD13 LEU 63 -6.081 6.258 3.195 457 HD21 LEU 63 HD23 LEU 63 -4.504 4.519 0.249 458 HD22 LEU 63 HD21 LEU 63 -4.248 6.204 0.701 459 HD23 LEU 63 HD22 LEU 63 -5.275 5.808 -0.678 460 H LYS 64 HN LYS 64 -9.755 3.293 -0.200 461 HA LYS 64 HA LYS 64 -9.510 0.586 -0.248 462 HB2 LYS 64 HB2 LYS 64 -11.868 2.231 -1.157 463 HB3 LYS 64 HB1 LYS 64 -11.932 0.572 -0.613 464 HG2 LYS 64 HG2 LYS 64 -11.507 1.152 1.603 465 HG3 LYS 64 HG1 LYS 64 -10.873 2.732 1.147 466 HD2 LYS 64 HD2 LYS 64 -13.068 2.977 2.140 467 HD3 LYS 64 HD1 LYS 64 -13.124 3.412 0.432 468 HE2 LYS 64 HE2 LYS 64 -14.057 1.235 -0.111 469 HE3 LYS 64 HE1 LYS 64 -13.943 0.745 1.580 470 HZ1 LYS 64 HZ3 LYS 64 -16.177 1.421 1.091 471 HZ2 LYS 64 HZ1 LYS 64 -15.654 2.907 0.477 472 HZ3 LYS 64 HZ2 LYS 64 -15.486 2.568 2.124 473 H TYR 65 HN TYR 65 -9.487 2.703 -2.959 474 HA TYR 65 HA TYR 65 -10.409 0.779 -4.868 475 HD1 TYR 65 HD1 TYR 65 -11.926 2.027 -4.085 476 HD2 TYR 65 HD2 TYR 65 -10.082 5.305 -6.093 477 HE1 TYR 65 HE1 TYR 65 -13.799 3.500 -3.425 478 HE2 TYR 65 HE2 TYR 65 -11.953 6.763 -5.452 479 HH TYR 65 HH TYR 65 -14.233 5.904 -3.108 480 HB2 TYR 65 HB2 TYR 65 -8.801 3.268 -5.441 481 HB3 TYR 65 HB1 TYR 65 -9.844 2.388 -6.555 482 H PHE 66 HN PHE 66 -7.412 1.249 -3.302 483 HA PHE 66 HA PHE 66 -5.533 0.633 -5.198 484 HD1 PHE 66 HD2 PHE 66 -3.676 -1.913 -4.024 485 HD2 PHE 66 HD1 PHE 66 -5.776 -0.468 -0.639 486 HE1 PHE 66 HE2 PHE 66 -3.122 -3.977 -2.808 487 HE2 PHE 66 HE1 PHE 66 -5.222 -2.515 0.602 488 HZ PHE 66 HZ PHE 66 -3.893 -4.282 -0.488 489 HB2 PHE 66 HB2 PHE 66 -4.188 0.700 -3.424 490 HB3 PHE 66 HB1 PHE 66 -5.609 0.887 -2.430 491 H LEU 67 HN LEU 67 -7.256 -1.773 -3.190 492 HA LEU 67 HA LEU 67 -6.095 -3.985 -4.530 493 HG LEU 67 HG LEU 67 -6.448 -3.913 -1.598 494 HB2 LEU 67 HB2 LEU 67 -8.564 -3.707 -2.853 495 HB3 LEU 67 HB1 LEU 67 -8.234 -5.210 -3.700 496 HD11 LEU 67 HD11 LEU 67 -7.965 -6.516 -1.482 497 HD12 LEU 67 HD12 LEU 67 -8.394 -5.057 -0.572 498 HD13 LEU 67 HD13 LEU 67 -6.876 -5.896 -0.253 499 HD21 LEU 67 HD23 LEU 67 -6.056 -6.429 -3.205 500 HD22 LEU 67 HD21 LEU 67 -5.082 -5.959 -1.814 501 HD23 LEU 67 HD22 LEU 67 -5.073 -4.971 -3.271 502 H GLN 68 HN GLN 68 -8.812 -1.953 -5.103 503 HA GLN 68 HA GLN 68 -10.017 -3.472 -7.122 504 HB2 GLN 68 HB2 GLN 68 -10.247 -0.707 -6.093 505 HB3 GLN 68 HB1 GLN 68 -10.918 -1.036 -7.678 506 HG2 GLN 68 HG2 GLN 68 -12.397 -2.652 -6.848 507 HG3 GLN 68 HG1 GLN 68 -11.535 -2.761 -5.318 508 HE21 GLN 68 HE21 GLN 68 -13.362 -2.407 -4.143 509 HE22 GLN 68 HE22 GLN 68 -14.119 -0.855 -4.027 510 H LYS 69 HN LYS 69 -7.533 -0.892 -7.201 511 HA LYS 69 HA LYS 69 -7.240 -0.661 -9.919 512 HB2 LYS 69 HB2 LYS 69 -4.998 -0.684 -7.899 513 HB3 LYS 69 HB1 LYS 69 -4.982 0.109 -9.464 514 HG2 LYS 69 HG2 LYS 69 -6.444 0.869 -6.974 515 HG3 LYS 69 HG1 LYS 69 -5.323 1.824 -7.931 516 HD2 LYS 69 HD2 LYS 69 -8.117 1.017 -8.706 517 HD3 LYS 69 HD1 LYS 69 -7.573 2.637 -8.267 518 HE2 LYS 69 HE2 LYS 69 -6.684 1.040 -10.669 519 HE3 LYS 69 HE1 LYS 69 -7.774 2.426 -10.683 520 HZ1 LYS 69 HZ3 LYS 69 -4.915 2.456 -9.878 521 HZ2 LYS 69 HZ1 LYS 69 -5.955 3.790 -9.819 522 HZ3 LYS 69 HZ2 LYS 69 -5.557 3.092 -11.308 523 H PHE 70 HN PHE 70 -5.271 -2.685 -7.769 524 HA PHE 70 HA PHE 70 -3.932 -4.026 -9.860 525 HD1 PHE 70 HD2 PHE 70 -2.947 -6.884 -9.091 526 HD2 PHE 70 HD1 PHE 70 -4.583 -5.470 -5.427 527 HE1 PHE 70 HE2 PHE 70 -3.108 -9.200 -8.273 528 HE2 PHE 70 HE1 PHE 70 -4.749 -7.777 -4.600 529 HZ PHE 70 HZ PHE 70 -4.011 -9.650 -6.025 530 HB2 PHE 70 HB2 PHE 70 -2.636 -4.415 -8.081 531 HB3 PHE 70 HB1 PHE 70 -3.916 -3.951 -6.980 532 H GLN 71 HN GLN 71 -6.814 -4.728 -7.973 533 HA GLN 71 HA GLN 71 -7.604 -6.683 -10.011 534 HB2 GLN 71 HB2 GLN 71 -6.736 -7.980 -8.143 535 HB3 GLN 71 HB1 GLN 71 -7.712 -7.062 -7.010 536 HG2 GLN 71 HG2 GLN 71 -9.429 -8.162 -8.987 537 HG3 GLN 71 HG1 GLN 71 -8.371 -9.438 -8.387 538 HE21 GLN 71 HE21 GLN 71 -9.556 -6.629 -6.587 539 HE22 GLN 71 HE22 GLN 71 -10.468 -7.542 -5.440 540 H SER 72 HN SER 72 -9.316 -5.732 -10.854 541 HA SER 72 HA SER 72 -10.875 -3.721 -9.566 542 HG SER 72 HG SER 72 -12.093 -5.637 -12.760 543 HB2 SER 72 HB2 SER 72 -12.313 -3.913 -11.606 544 HB3 SER 72 HB1 SER 72 -10.620 -3.546 -11.931 545 H ASP 73 HN ASP 73 -11.119 -5.750 -7.833 546 HA ASP 73 HA ASP 73 -13.921 -6.291 -7.897 547 HB2 ASP 73 HB2 ASP 73 -13.089 -8.127 -9.300 548 HB3 ASP 73 HB1 ASP 73 -11.996 -8.622 -8.011 549 H ALA 74 HN ALA 74 -11.574 -5.145 -6.138 550 HA ALA 74 HA ALA 74 -11.365 -6.793 -3.890 551 HB1 ALA 74 HB3 ALA 74 -10.003 -5.213 -3.248 552 HB2 ALA 74 HB1 ALA 74 -11.294 -4.028 -3.166 553 HB3 ALA 74 HB2 ALA 74 -10.412 -4.268 -4.677 554 H ARG 75 HN ARG 75 -12.279 -6.509 -1.852 555 HA ARG 75 HA ARG 75 -15.117 -6.033 -1.887 556 HE ARG 75 HE ARG 75 -11.677 -4.784 1.165 557 HB2 ARG 75 HB2 ARG 75 -14.761 -6.691 0.659 558 HB3 ARG 75 HB1 ARG 75 -14.882 -7.885 -0.617 559 HG2 ARG 75 HG2 ARG 75 -13.103 -8.635 0.618 560 HG3 ARG 75 HG1 ARG 75 -12.301 -7.760 -0.662 561 HD2 ARG 75 HD2 ARG 75 -13.003 -6.439 1.914 562 HD3 ARG 75 HD1 ARG 75 -11.542 -7.415 1.802 563 HH11 ARG 75 HH11 ARG 75 -10.491 -7.610 -0.452 564 HH12 ARG 75 HH12 ARG 75 -9.761 -6.698 -1.723 565 HH21 ARG 75 HH21 ARG 75 -10.687 -3.593 -0.393 566 HH22 ARG 75 HH22 ARG 75 -9.802 -4.385 -1.629 567 H GLU 76 HN GLU 76 -12.526 -4.121 -1.467 568 HA GLU 76 HA GLU 76 -12.515 -1.832 -1.065 569 HB2 GLU 76 HB2 GLU 76 -14.948 -2.178 0.694 570 HB3 GLU 76 HB1 GLU 76 -14.299 -0.686 0.023 571 HG2 GLU 76 HG2 GLU 76 -14.775 -1.762 -2.262 572 HG3 GLU 76 HG1 GLU 76 -15.802 -2.866 -1.356 573 H LEU 77 HN LEU 77 -11.343 -0.831 0.570 574 HA LEU 77 HA LEU 77 -10.256 -2.590 2.524 575 HG LEU 77 HG LEU 77 -8.643 -1.361 0.361 576 HB2 LEU 77 HB2 LEU 77 -9.803 0.250 1.760 577 HB3 LEU 77 HB1 LEU 77 -9.041 -0.394 3.193 578 HD11 LEU 77 HD11 LEU 77 -7.236 0.502 2.171 579 HD12 LEU 77 HD12 LEU 77 -7.380 0.513 0.415 580 HD13 LEU 77 HD13 LEU 77 -6.241 -0.580 1.201 581 HD21 LEU 77 HD23 LEU 77 -6.964 -2.214 2.677 582 HD22 LEU 77 HD21 LEU 77 -7.198 -2.997 1.118 583 HD23 LEU 77 HD22 LEU 77 -8.464 -3.071 2.338 584 H THR 78 HN THR 78 -13.131 -1.835 2.955 585 HA THR 78 HA THR 78 -14.545 -0.927 4.520 586 HB THR 78 HB THR 78 -14.473 -2.214 6.480 587 HG1 THR 78 HG1 THR 78 -12.604 -2.899 7.429 588 HG21 THR 78 HG23 THR 78 -14.308 -4.349 5.654 589 HG22 THR 78 HG21 THR 78 -12.791 -4.023 4.816 590 HG23 THR 78 HG22 THR 78 -14.312 -3.441 4.142 591 H GLU 79 HN GLU 79 -14.280 -0.409 7.155 592 HA GLU 79 HA GLU 79 -13.202 2.239 7.180 593 HB2 GLU 79 HB2 GLU 79 -14.261 0.530 9.442 594 HB3 GLU 79 HB1 GLU 79 -13.882 2.242 9.564 595 HG2 GLU 79 HG2 GLU 79 -15.601 2.747 7.909 596 HG3 GLU 79 HG1 GLU 79 -15.975 1.030 7.772 597 H SER 80 HN SER 80 -12.322 -0.855 8.598 598 HA SER 80 HA SER 80 -10.067 0.126 10.067 599 HG SER 80 HG SER 80 -9.215 -1.418 11.390 600 HB2 SER 80 HB2 SER 80 -11.541 -1.773 10.733 601 HB3 SER 80 HB1 SER 80 -10.795 -2.722 9.460 602 H GLU 81 HN GLU 81 -10.449 -1.487 6.927 603 HA GLU 81 HA GLU 81 -7.718 -2.364 6.813 604 HB2 GLU 81 HB2 GLU 81 -9.942 -3.033 5.382 605 HB3 GLU 81 HB1 GLU 81 -9.092 -2.010 4.243 606 HG2 GLU 81 HG2 GLU 81 -7.279 -3.447 4.094 607 HG3 GLU 81 HG1 GLU 81 -7.675 -4.250 5.615 608 H THR 82 HN THR 82 -9.492 0.389 5.331 609 HA THR 82 HA THR 82 -7.281 1.452 3.985 610 HB THR 82 HB THR 82 -8.424 3.568 3.928 611 HG1 THR 82 HG1 THR 82 -9.927 2.431 6.032 612 HG21 THR 82 HG23 THR 82 -10.229 1.191 3.584 613 HG22 THR 82 HG21 THR 82 -9.266 2.016 2.355 614 HG23 THR 82 HG22 THR 82 -10.667 2.820 3.070 615 H LYS 83 HN LYS 83 -8.025 1.322 7.334 616 HA LYS 83 HA LYS 83 -6.749 3.619 8.300 617 HB2 LYS 83 HB2 LYS 83 -8.089 1.928 9.647 618 HB3 LYS 83 HB1 LYS 83 -6.668 0.892 9.612 619 HG2 LYS 83 HG2 LYS 83 -5.383 2.585 10.793 620 HG3 LYS 83 HG1 LYS 83 -6.786 3.657 10.800 621 HD2 LYS 83 HD2 LYS 83 -8.024 1.872 12.055 622 HD3 LYS 83 HD1 LYS 83 -6.498 0.998 12.193 623 HE2 LYS 83 HE2 LYS 83 -7.076 3.764 13.248 624 HE3 LYS 83 HE1 LYS 83 -6.938 2.292 14.206 625 HZ1 LYS 83 HZ3 LYS 83 -4.757 3.480 12.579 626 HZ2 LYS 83 HZ1 LYS 83 -4.633 2.107 13.560 627 HZ3 LYS 83 HZ2 LYS 83 -4.908 3.622 14.257 628 H SER 84 HN SER 84 -5.607 0.516 7.211 629 HA SER 84 HA SER 84 -2.942 0.643 7.917 630 HG SER 84 HG SER 84 -5.308 -1.650 6.546 631 HB2 SER 84 HB2 SER 84 -4.012 -0.522 5.349 632 HB3 SER 84 HB1 SER 84 -2.667 -1.095 6.317 633 H LEU 85 HN LEU 85 -4.454 1.451 4.801 634 HA LEU 85 HA LEU 85 -2.194 2.595 3.643 635 HG LEU 85 HG LEU 85 -4.528 0.729 2.475 636 HB2 LEU 85 HB2 LEU 85 -5.141 2.891 3.133 637 HB3 LEU 85 HB1 LEU 85 -3.939 3.637 2.118 638 HD11 LEU 85 HD11 LEU 85 -4.356 2.588 0.120 639 HD12 LEU 85 HD12 LEU 85 -5.775 1.745 0.735 640 HD13 LEU 85 HD13 LEU 85 -4.476 0.838 -0.032 641 HD21 LEU 85 HD23 LEU 85 -2.114 0.937 2.703 642 HD22 LEU 85 HD21 LEU 85 -2.046 1.882 1.215 643 HD23 LEU 85 HD22 LEU 85 -2.547 0.192 1.169 644 H MET 86 HN MET 86 -4.735 3.901 5.624 645 HA MET 86 HA MET 86 -4.151 6.647 5.355 646 HB2 MET 86 HB2 MET 86 -5.308 5.165 7.730 647 HB3 MET 86 HB1 MET 86 -5.351 6.908 7.507 648 HG2 MET 86 HG2 MET 86 -6.440 5.427 5.249 649 HG3 MET 86 HG1 MET 86 -7.302 5.143 6.759 650 HE1 MET 86 HE3 MET 86 -5.464 8.607 6.217 651 HE2 MET 86 HE1 MET 86 -6.574 9.368 5.077 652 HE3 MET 86 HE2 MET 86 -5.677 7.923 4.605 653 H ASP 87 HN ASP 87 -3.192 4.282 7.795 654 HA ASP 87 HA ASP 87 -1.350 5.977 9.175 655 HB2 ASP 87 HB2 ASP 87 -1.944 3.032 9.263 656 HB3 ASP 87 HB1 ASP 87 -0.725 3.787 10.287 657 H ALA 88 HN ALA 88 -1.129 4.594 6.203 658 HA ALA 88 HA ALA 88 1.516 3.475 6.360 659 HB1 ALA 88 HB3 ALA 88 1.216 2.789 4.175 660 HB2 ALA 88 HB1 ALA 88 0.068 4.085 3.824 661 HB3 ALA 88 HB2 ALA 88 -0.409 2.741 4.860 662 H ALA 89 HN ALA 89 0.044 6.501 5.277 663 HA ALA 89 HA ALA 89 2.570 7.821 5.263 664 HB1 ALA 89 HB3 ALA 89 1.623 6.706 2.836 665 HB2 ALA 89 HB1 ALA 89 3.028 7.741 3.096 666 HB3 ALA 89 HB2 ALA 89 1.457 8.459 2.739 667 H ASP 90 HN ASP 90 2.290 9.886 5.623 668 HA ASP 90 HA ASP 90 1.276 11.722 6.537 669 HB2 ASP 90 HB2 ASP 90 1.280 11.951 3.978 670 HB3 ASP 90 HB1 ASP 90 -0.430 11.605 4.089 671 H ASN 91 HN ASN 91 0.389 10.172 8.076 672 HA ASN 91 HA ASN 91 -2.512 9.743 7.932 673 HB2 ASN 91 HB2 ASN 91 -1.490 8.548 10.275 674 HB3 ASN 91 HB1 ASN 91 -2.056 7.738 8.836 675 HD21 ASN 91 HD21 ASN 91 -0.469 7.277 7.193 676 HD22 ASN 91 HD22 ASN 91 1.163 7.045 7.677 677 H ASP 92 HN ASP 92 0.014 10.949 10.079 678 HA ASP 92 HA ASP 92 -1.979 12.276 11.744 679 HB2 ASP 92 HB2 ASP 92 0.958 11.704 12.135 680 HB3 ASP 92 HB1 ASP 92 -0.012 12.641 13.259 681 H GLY 93 HN GLY 93 -1.239 13.291 9.032 682 HA2 GLY 93 HA2 GLY 93 -0.616 15.985 9.849 683 HA3 GLY 93 HA1 GLY 93 0.610 15.245 8.839 684 H ASP 94 HN ASP 94 -2.499 14.096 8.012 685 HA ASP 94 HA ASP 94 -3.517 16.126 6.443 686 HB2 ASP 94 HB2 ASP 94 -1.177 15.605 5.317 687 HB3 ASP 94 HB1 ASP 94 -2.092 14.297 4.572 688 H GLY 95 HN GLY 95 -2.759 12.736 5.610 689 HA2 GLY 95 HA2 GLY 95 -4.503 11.048 6.146 690 HA3 GLY 95 HA1 GLY 95 -5.669 12.220 5.556 691 H LYS 96 HN LYS 96 -2.906 12.356 3.661 692 HA LYS 96 HA LYS 96 -4.172 10.658 1.624 693 HB2 LYS 96 HB2 LYS 96 -3.909 12.388 0.225 694 HB3 LYS 96 HB1 LYS 96 -3.181 13.326 1.515 695 HG2 LYS 96 HG2 LYS 96 -1.656 11.524 -0.409 696 HG3 LYS 96 HG1 LYS 96 -1.805 13.282 -0.533 697 HD2 LYS 96 HD2 LYS 96 -0.905 12.813 2.068 698 HD3 LYS 96 HD1 LYS 96 0.000 11.669 1.056 699 HE2 LYS 96 HE2 LYS 96 1.206 13.772 1.246 700 HE3 LYS 96 HE1 LYS 96 0.654 13.535 -0.413 701 HZ1 LYS 96 HZ3 LYS 96 -0.687 15.247 1.610 702 HZ2 LYS 96 HZ1 LYS 96 -1.171 15.047 0.002 703 HZ3 LYS 96 HZ2 LYS 96 0.297 15.808 0.354 704 H ILE 97 HN ILE 97 -2.719 9.707 0.054 705 HA ILE 97 HA ILE 97 -0.109 8.986 1.158 706 HB ILE 97 HB ILE 97 -1.720 7.128 -0.575 707 HG12 ILE 97 HG12 ILE 97 -2.931 7.422 1.535 708 HG13 ILE 97 HG11 ILE 97 -2.177 5.834 1.461 709 HG21 ILE 97 HG21 ILE 97 -0.087 5.479 0.245 710 HG22 ILE 97 HG22 ILE 97 0.733 6.765 1.131 711 HG23 ILE 97 HG23 ILE 97 0.672 6.811 -0.628 712 HD11 ILE 97 HD13 ILE 97 -0.606 6.353 3.059 713 HD12 ILE 97 HD11 ILE 97 -2.038 7.200 3.640 714 HD13 ILE 97 HD12 ILE 97 -0.769 8.087 2.800 715 H GLY 98 HN GLY 98 1.442 8.638 -0.440 716 HA2 GLY 98 HA2 GLY 98 1.042 9.141 -3.201 717 HA3 GLY 98 HA1 GLY 98 1.778 10.515 -2.376 718 H ALA 99 HN ALA 99 3.200 9.161 -4.361 719 HA ALA 99 HA ALA 99 4.799 7.035 -3.481 720 HB1 ALA 99 HB3 ALA 99 6.244 7.512 -5.274 721 HB2 ALA 99 HB1 ALA 99 5.856 9.233 -5.243 722 HB3 ALA 99 HB2 ALA 99 4.660 8.071 -5.814 723 H ASP 100 HN ASP 100 5.423 10.514 -3.297 724 HA ASP 100 HA ASP 100 7.823 10.440 -1.905 725 HB2 ASP 100 HB2 ASP 100 6.825 12.481 -2.922 726 HB3 ASP 100 HB1 ASP 100 5.649 12.525 -1.614 727 H GLU 101 HN GLU 101 4.525 10.680 -0.632 728 HA GLU 101 HA GLU 101 5.196 10.675 2.095 729 HB2 GLU 101 HB2 GLU 101 2.708 9.955 0.566 730 HB3 GLU 101 HB1 GLU 101 2.779 9.756 2.311 731 HG2 GLU 101 HG2 GLU 101 1.843 11.932 1.221 732 HG3 GLU 101 HG1 GLU 101 2.759 11.981 2.713 733 H PHE 102 HN PHE 102 4.168 8.052 -0.054 734 HA PHE 102 HA PHE 102 4.359 5.928 1.700 735 HD1 PHE 102 HD1 PHE 102 6.760 4.096 -0.194 736 HD2 PHE 102 HD2 PHE 102 2.525 3.707 -0.294 737 HE1 PHE 102 HE1 PHE 102 6.978 1.671 0.086 738 HE2 PHE 102 HE2 PHE 102 2.738 1.272 -0.025 739 HZ PHE 102 HZ PHE 102 4.970 0.248 0.166 740 HB2 PHE 102 HB2 PHE 102 3.453 5.775 -0.608 741 HB3 PHE 102 HB1 PHE 102 5.094 5.876 -1.248 742 H GLN 103 HN GLN 103 6.868 7.410 -0.327 743 HA GLN 103 HA GLN 103 8.990 5.715 0.310 744 HB2 GLN 103 HB2 GLN 103 9.008 8.667 -0.321 745 HB3 GLN 103 HB1 GLN 103 10.451 7.662 -0.251 746 HG2 GLN 103 HG2 GLN 103 8.453 6.501 -1.962 747 HG3 GLN 103 HG1 GLN 103 8.836 8.153 -2.435 748 HE21 GLN 103 HE21 GLN 103 9.934 7.634 -4.273 749 HE22 GLN 103 HE22 GLN 103 11.455 6.816 -4.277 750 H GLU 104 HN GLU 104 7.518 8.296 2.136 751 HA GLU 104 HA GLU 104 9.648 8.762 3.954 752 HB2 GLU 104 HB2 GLU 104 6.673 9.147 4.347 753 HB3 GLU 104 HB1 GLU 104 7.916 9.747 5.433 754 HG2 GLU 104 HG2 GLU 104 8.841 11.047 3.499 755 HG3 GLU 104 HG1 GLU 104 7.396 10.589 2.601 756 H MET 105 HN MET 105 6.945 6.510 3.928 757 HA MET 105 HA MET 105 7.219 5.523 6.528 758 HB2 MET 105 HB2 MET 105 5.568 5.037 4.383 759 HB3 MET 105 HB1 MET 105 6.358 3.491 4.681 760 HG2 MET 105 HG2 MET 105 4.769 5.151 6.614 761 HG3 MET 105 HG1 MET 105 4.372 3.570 5.969 762 HE1 MET 105 HE3 MET 105 5.111 3.123 9.868 763 HE2 MET 105 HE1 MET 105 3.850 3.100 8.636 764 HE3 MET 105 HE2 MET 105 4.564 4.632 9.139 765 H VAL 106 HN VAL 106 8.493 4.138 3.476 766 HA VAL 106 HA VAL 106 9.912 2.056 4.691 767 HB VAL 106 HB VAL 106 9.443 1.967 2.329 768 HG11 VAL 106 HG11 VAL 106 11.044 4.497 2.197 769 HG12 VAL 106 HG12 VAL 106 9.392 4.198 1.652 770 HG13 VAL 106 HG13 VAL 106 10.751 3.491 0.779 771 HG21 VAL 106 HG23 VAL 106 12.419 2.226 2.788 772 HG22 VAL 106 HG21 VAL 106 11.659 1.404 1.426 773 HG23 VAL 106 HG22 VAL 106 11.453 0.776 3.062 774 H HIS 107 HN HIS 107 10.798 5.367 3.921 775 HA HIS 107 HA HIS 107 13.556 5.026 4.662 776 HD1 HIS 107 HD1 HIS 107 15.401 6.832 2.903 777 HD2 HIS 107 HD2 HIS 107 13.637 9.094 5.910 778 HE1 HIS 107 HE1 HIS 107 17.211 8.362 3.745 779 HE2 HIS 107 HE2 HIS 107 16.091 9.792 5.490 780 HB2 HIS 107 HB2 HIS 107 12.825 6.683 2.966 781 HB3 HIS 107 HB1 HIS 107 11.989 7.576 4.230 782 H SER 108 HN SER 108 10.615 5.829 6.281 783 HA SER 108 HA SER 108 11.707 7.245 8.473 784 HG SER 108 HG SER 108 9.025 5.992 10.305 785 HB2 SER 108 HB2 SER 108 9.337 7.381 7.987 786 HB3 SER 108 HB1 SER 108 9.147 5.646 8.239 Start of MODEL 17 1 HA SER 1 HA SER 1 1.966 -8.106 -7.520 2 HG SER 1 HG SER 1 0.623 -5.640 -9.659 3 H1 SER 1 HT1 SER 1 1.321 -6.205 -5.345 4 H2 SER 1 HT2 SER 1 2.261 -7.606 -5.219 5 H3 SER 1 HT3 SER 1 0.606 -7.725 -5.546 6 HB2 SER 1 HB2 SER 1 -0.315 -7.222 -7.759 7 HB3 SER 1 HB1 SER 1 0.299 -5.577 -7.595 8 H ILE 2 HN ILE 2 3.975 -7.131 -6.004 9 HA ILE 2 HA ILE 2 5.231 -5.319 -7.887 10 HB ILE 2 HB ILE 2 5.864 -5.041 -4.994 11 HG12 ILE 2 HG12 ILE 2 4.541 -2.964 -4.940 12 HG13 ILE 2 HG11 ILE 2 3.946 -3.295 -6.566 13 HG21 ILE 2 HG21 ILE 2 6.289 -2.723 -6.596 14 HG22 ILE 2 HG22 ILE 2 6.982 -4.126 -7.406 15 HG23 ILE 2 HG23 ILE 2 7.471 -3.729 -5.760 16 HD11 ILE 2 HD13 ILE 2 3.464 -5.485 -4.731 17 HD12 ILE 2 HD11 ILE 2 2.352 -4.626 -5.794 18 HD13 ILE 2 HD12 ILE 2 2.747 -3.977 -4.221 19 H THR 3 HN THR 3 6.886 -6.332 -8.623 20 HA THR 3 HA THR 3 8.645 -7.850 -6.873 21 HB THR 3 HB THR 3 8.812 -9.691 -8.426 22 HG1 THR 3 HG1 THR 3 6.735 -8.554 -9.987 23 HG21 THR 3 HG23 THR 3 5.886 -9.512 -8.377 24 HG22 THR 3 HG21 THR 3 6.673 -9.173 -6.836 25 HG23 THR 3 HG22 THR 3 6.963 -10.709 -7.653 26 H ASP 4 HN ASP 4 8.526 -5.259 -8.796 27 HA ASP 4 HA ASP 4 10.509 -5.535 -10.719 28 HB2 ASP 4 HB2 ASP 4 9.952 -3.154 -8.922 29 HB3 ASP 4 HB1 ASP 4 10.922 -3.101 -10.392 30 H ILE 5 HN ILE 5 10.795 -4.552 -7.335 31 HA ILE 5 HA ILE 5 13.399 -5.890 -7.180 32 HB ILE 5 HB ILE 5 12.861 -3.136 -6.076 33 HG12 ILE 5 HG12 ILE 5 14.903 -2.793 -7.815 34 HG13 ILE 5 HG11 ILE 5 13.952 -4.027 -8.625 35 HG21 ILE 5 HG21 ILE 5 14.631 -4.999 -5.164 36 HG22 ILE 5 HG22 ILE 5 14.760 -3.255 -4.925 37 HG23 ILE 5 HG23 ILE 5 15.622 -4.029 -6.258 38 HD11 ILE 5 HD13 ILE 5 13.114 -2.035 -9.468 39 HD12 ILE 5 HD11 ILE 5 13.153 -1.249 -7.889 40 HD13 ILE 5 HD12 ILE 5 11.948 -2.494 -8.223 41 H LEU 6 HN LEU 6 12.403 -7.481 -6.011 42 HA LEU 6 HA LEU 6 12.090 -7.031 -3.214 43 HG LEU 6 HG LEU 6 10.611 -5.369 -2.875 44 HB2 LEU 6 HB2 LEU 6 9.647 -7.191 -4.912 45 HB3 LEU 6 HB1 LEU 6 9.617 -7.934 -3.327 46 HD11 LEU 6 HD11 LEU 6 9.131 -5.377 -5.313 47 HD12 LEU 6 HD12 LEU 6 9.839 -4.019 -4.451 48 HD13 LEU 6 HD13 LEU 6 8.198 -4.529 -4.079 49 HD21 LEU 6 HD23 LEU 6 7.743 -6.228 -2.625 50 HD22 LEU 6 HD21 LEU 6 8.616 -5.070 -1.631 51 HD23 LEU 6 HD22 LEU 6 9.009 -6.788 -1.539 52 H SER 7 HN SER 7 11.481 -8.950 -2.010 53 HA SER 7 HA SER 7 12.406 -11.379 -3.273 54 HG SER 7 HG SER 7 13.507 -10.709 0.033 55 HB2 SER 7 HB2 SER 7 11.425 -10.750 -0.483 56 HB3 SER 7 HB1 SER 7 11.944 -12.358 -0.983 57 H ALA 8 HN ALA 8 11.029 -12.601 -4.434 58 HA ALA 8 HA ALA 8 8.277 -12.008 -4.656 59 HB1 ALA 8 HB3 ALA 8 9.557 -13.060 -6.456 60 HB2 ALA 8 HB1 ALA 8 8.144 -14.024 -6.025 61 HB3 ALA 8 HB2 ALA 8 9.748 -14.518 -5.481 62 H GLU 9 HN GLU 9 9.964 -14.728 -3.034 63 HA GLU 9 HA GLU 9 7.614 -15.981 -2.112 64 HB2 GLU 9 HB2 GLU 9 10.440 -16.078 -1.067 65 HB3 GLU 9 HB1 GLU 9 9.153 -17.153 -0.534 66 HG2 GLU 9 HG2 GLU 9 10.142 -16.902 -3.351 67 HG3 GLU 9 HG1 GLU 9 10.651 -18.150 -2.217 68 H ASP 10 HN ASP 10 9.980 -14.015 -0.281 69 HA ASP 10 HA ASP 10 8.567 -13.749 2.024 70 HB2 ASP 10 HB2 ASP 10 10.384 -11.797 0.660 71 HB3 ASP 10 HB1 ASP 10 9.721 -11.492 2.258 72 H ILE 11 HN ILE 11 7.940 -12.195 -0.995 73 HA ILE 11 HA ILE 11 6.220 -10.163 0.029 74 HB ILE 11 HB ILE 11 6.941 -11.264 -2.609 75 HG12 ILE 11 HG12 ILE 11 6.148 -8.437 -1.927 76 HG13 ILE 11 HG11 ILE 11 7.740 -9.099 -1.550 77 HG21 ILE 11 HG21 ILE 11 4.147 -10.402 -2.122 78 HG22 ILE 11 HG22 ILE 11 4.785 -11.602 -3.245 79 HG23 ILE 11 HG23 ILE 11 4.930 -9.883 -3.614 80 HD11 ILE 11 HD13 ILE 11 8.339 -9.283 -3.757 81 HD12 ILE 11 HD11 ILE 11 7.389 -7.796 -3.748 82 HD13 ILE 11 HD12 ILE 11 6.670 -9.309 -4.308 83 H ALA 12 HN ALA 12 5.686 -13.389 -1.349 84 HA ALA 12 HA ALA 12 2.905 -13.477 -1.103 85 HB1 ALA 12 HB3 ALA 12 4.703 -15.182 -2.114 86 HB2 ALA 12 HB1 ALA 12 3.060 -15.668 -1.685 87 HB3 ALA 12 HB2 ALA 12 4.387 -15.972 -0.568 88 H ALA 13 HN ALA 13 5.393 -14.654 1.155 89 HA ALA 13 HA ALA 13 3.552 -15.357 3.175 90 HB1 ALA 13 HB3 ALA 13 5.993 -16.053 3.013 91 HB2 ALA 13 HB1 ALA 13 5.421 -15.592 4.618 92 HB3 ALA 13 HB2 ALA 13 6.386 -14.462 3.668 93 H ALA 14 HN ALA 14 5.687 -12.566 2.869 94 HA ALA 14 HA ALA 14 4.872 -10.997 4.928 95 HB1 ALA 14 HB3 ALA 14 6.618 -10.183 3.552 96 HB2 ALA 14 HB1 ALA 14 5.319 -8.998 3.433 97 HB3 ALA 14 HB2 ALA 14 5.584 -10.153 2.118 98 H LEU 15 HN LEU 15 3.277 -11.292 1.786 99 HA LEU 15 HA LEU 15 1.167 -9.466 2.469 100 HG LEU 15 HG LEU 15 0.322 -8.566 0.053 101 HB2 LEU 15 HB2 LEU 15 2.119 -10.084 0.137 102 HB3 LEU 15 HB1 LEU 15 1.058 -11.471 0.246 103 HD11 LEU 15 HD11 LEU 15 -0.601 -11.005 -1.459 104 HD12 LEU 15 HD12 LEU 15 0.633 -9.874 -2.008 105 HD13 LEU 15 HD13 LEU 15 -1.031 -9.329 -1.801 106 HD21 LEU 15 HD23 LEU 15 -1.427 -10.827 1.003 107 HD22 LEU 15 HD21 LEU 15 -2.038 -9.279 0.423 108 HD23 LEU 15 HD22 LEU 15 -1.028 -9.343 1.866 109 H GLN 16 HN GLN 16 1.288 -12.946 1.775 110 HA GLN 16 HA GLN 16 -1.409 -13.458 2.413 111 HB2 GLN 16 HB2 GLN 16 0.924 -15.338 2.060 112 HB3 GLN 16 HB1 GLN 16 -0.792 -15.744 1.928 113 HG2 GLN 16 HG2 GLN 16 0.473 -13.678 0.184 114 HG3 GLN 16 HG1 GLN 16 0.558 -15.389 -0.220 115 HE21 GLN 16 HE21 GLN 16 -1.477 -12.611 0.135 116 HE22 GLN 16 HE22 GLN 16 -2.859 -13.251 -0.670 117 H GLU 17 HN GLU 17 1.130 -12.844 4.526 118 HA GLU 17 HA GLU 17 0.939 -15.068 6.259 119 HB2 GLU 17 HB2 GLU 17 2.877 -13.717 6.415 120 HB3 GLU 17 HB1 GLU 17 1.932 -12.257 6.664 121 HG2 GLU 17 HG2 GLU 17 1.238 -13.115 8.858 122 HG3 GLU 17 HG1 GLU 17 2.230 -14.544 8.590 123 H CYS 18 HN CYS 18 -0.067 -11.763 7.181 124 HA CYS 18 HA CYS 18 -2.228 -12.957 8.735 125 HG CYS 18 HG CYS 18 -2.824 -12.225 11.203 126 HB2 CYS 18 HB2 CYS 18 -0.381 -11.596 9.846 127 HB3 CYS 18 HB1 CYS 18 -1.097 -10.194 9.062 128 H GLN 19 HN GLN 19 -2.023 -11.757 5.772 129 HA GLN 19 HA GLN 19 -3.364 -9.384 5.553 130 HB2 GLN 19 HB2 GLN 19 -2.467 -10.539 3.640 131 HB3 GLN 19 HB1 GLN 19 -3.690 -11.775 3.793 132 HG2 GLN 19 HG2 GLN 19 -5.419 -10.119 3.300 133 HG3 GLN 19 HG1 GLN 19 -4.169 -8.886 3.135 134 HE21 GLN 19 HE21 GLN 19 -4.587 -8.432 0.998 135 HE22 GLN 19 HE22 GLN 19 -4.260 -9.545 -0.280 136 H ASP 20 HN ASP 20 -5.332 -8.659 5.467 137 HA ASP 20 HA ASP 20 -7.756 -9.950 5.484 138 HB2 ASP 20 HB2 ASP 20 -8.330 -10.469 7.666 139 HB3 ASP 20 HB1 ASP 20 -6.602 -10.777 7.742 140 HA PRO 21 HA PRO 21 -9.015 -5.696 5.677 141 HB2 PRO 21 HB2 PRO 21 -11.481 -5.746 6.594 142 HB3 PRO 21 HB1 PRO 21 -11.087 -6.591 5.105 143 HG2 PRO 21 HG2 PRO 21 -11.427 -7.663 7.879 144 HG3 PRO 21 HG1 PRO 21 -12.049 -8.310 6.347 145 HD2 PRO 21 HD2 PRO 21 -9.777 -9.209 7.582 146 HD3 PRO 21 HD1 PRO 21 -10.082 -9.319 5.842 147 H ASP 22 HN ASP 22 -7.280 -6.036 7.762 148 HA ASP 22 HA ASP 22 -7.937 -4.008 9.561 149 HB2 ASP 22 HB2 ASP 22 -9.549 -5.943 10.245 150 HB3 ASP 22 HB1 ASP 22 -8.123 -6.622 11.007 151 H THR 23 HN THR 23 -5.774 -6.527 8.610 152 HA THR 23 HA THR 23 -4.012 -5.992 10.869 153 HB THR 23 HB THR 23 -4.403 -8.319 10.298 154 HG1 THR 23 HG1 THR 23 -2.434 -8.083 11.207 155 HG21 THR 23 HG23 THR 23 -3.660 -7.387 7.613 156 HG22 THR 23 HG21 THR 23 -4.676 -8.739 8.102 157 HG23 THR 23 HG22 THR 23 -2.919 -8.907 8.095 158 H PHE 24 HN PHE 24 -4.097 -5.504 7.395 159 HA PHE 24 HA PHE 24 -2.863 -3.607 6.474 160 HD1 PHE 24 HD2 PHE 24 -2.955 -3.088 9.350 161 HD2 PHE 24 HD1 PHE 24 0.562 -1.868 7.326 162 HE1 PHE 24 HE2 PHE 24 -3.068 -0.918 10.489 163 HE2 PHE 24 HE1 PHE 24 0.475 0.317 8.466 164 HZ PHE 24 HZ PHE 24 -1.351 0.792 10.052 165 HB2 PHE 24 HB2 PHE 24 -0.690 -4.678 8.248 166 HB3 PHE 24 HB1 PHE 24 -0.290 -3.821 6.785 167 H GLU 25 HN GLU 25 -3.511 -4.838 4.703 168 HA GLU 25 HA GLU 25 -2.063 -7.122 3.891 169 HB2 GLU 25 HB2 GLU 25 -3.764 -5.529 2.025 170 HB3 GLU 25 HB1 GLU 25 -3.476 -7.258 2.067 171 HG2 GLU 25 HG2 GLU 25 -4.697 -7.363 4.208 172 HG3 GLU 25 HG1 GLU 25 -5.086 -5.664 4.005 173 HA PRO 26 HA PRO 26 -0.116 -4.356 0.541 174 HB2 PRO 26 HB2 PRO 26 -0.221 -1.649 0.872 175 HB3 PRO 26 HB1 PRO 26 -1.390 -2.584 -0.048 176 HG2 PRO 26 HG2 PRO 26 -1.659 -1.336 2.581 177 HG3 PRO 26 HG1 PRO 26 -2.905 -1.775 1.411 178 HD2 PRO 26 HD2 PRO 26 -2.215 -3.164 3.775 179 HD3 PRO 26 HD1 PRO 26 -3.307 -3.714 2.494 180 H GLN 27 HN GLN 27 0.080 -2.363 3.473 181 HA GLN 27 HA GLN 27 2.751 -1.655 3.271 182 HB2 GLN 27 HB2 GLN 27 0.748 -1.752 5.443 183 HB3 GLN 27 HB1 GLN 27 2.429 -1.560 5.919 184 HG2 GLN 27 HG2 GLN 27 1.040 0.203 3.923 185 HG3 GLN 27 HG1 GLN 27 1.144 0.561 5.646 186 HE21 GLN 27 HE21 GLN 27 3.133 1.095 6.546 187 HE22 GLN 27 HE22 GLN 27 4.476 1.589 5.578 188 H LYS 28 HN LYS 28 1.342 -4.536 4.734 189 HA LYS 28 HA LYS 28 3.722 -5.378 6.024 190 HB2 LYS 28 HB2 LYS 28 1.114 -6.663 5.310 191 HB3 LYS 28 HB1 LYS 28 2.427 -7.582 5.977 192 HG2 LYS 28 HG2 LYS 28 1.590 -5.131 7.360 193 HG3 LYS 28 HG1 LYS 28 0.622 -6.594 7.544 194 HD2 LYS 28 HD2 LYS 28 2.574 -7.795 8.347 195 HD3 LYS 28 HD1 LYS 28 3.581 -6.372 8.078 196 HE2 LYS 28 HE2 LYS 28 2.140 -5.144 9.695 197 HE3 LYS 28 HE1 LYS 28 1.331 -6.667 10.055 198 HZ1 LYS 28 HZ3 LYS 28 3.434 -7.579 10.794 199 HZ2 LYS 28 HZ1 LYS 28 3.075 -6.170 11.660 200 HZ3 LYS 28 HZ2 LYS 28 4.229 -6.133 10.424 201 H PHE 29 HN PHE 29 2.116 -6.137 2.990 202 HA PHE 29 HA PHE 29 3.773 -8.088 1.968 203 HD1 PHE 29 HD1 PHE 29 4.573 -5.441 -0.661 204 HD2 PHE 29 HD2 PHE 29 1.923 -8.711 -1.166 205 HE1 PHE 29 HE1 PHE 29 5.468 -5.803 -2.914 206 HE2 PHE 29 HE2 PHE 29 2.813 -9.091 -3.420 207 HZ PHE 29 HZ PHE 29 4.594 -7.639 -4.293 208 HB2 PHE 29 HB2 PHE 29 1.801 -7.515 0.766 209 HB3 PHE 29 HB1 PHE 29 2.246 -5.819 0.685 210 H PHE 30 HN PHE 30 4.094 -4.588 1.827 211 HA PHE 30 HA PHE 30 6.487 -4.540 0.292 212 HD1 PHE 30 HD1 PHE 30 5.159 -3.754 -1.276 213 HD2 PHE 30 HD2 PHE 30 3.610 -1.129 1.678 214 HE1 PHE 30 HE1 PHE 30 3.232 -3.290 -2.696 215 HE2 PHE 30 HE2 PHE 30 1.652 -0.673 0.261 216 HZ PHE 30 HZ PHE 30 1.462 -1.757 -1.942 217 HB2 PHE 30 HB2 PHE 30 5.481 -2.385 2.145 218 HB3 PHE 30 HB1 PHE 30 6.536 -2.191 0.755 219 H GLN 31 HN GLN 31 5.875 -3.713 3.656 220 HA GLN 31 HA GLN 31 8.503 -3.233 4.395 221 HB2 GLN 31 HB2 GLN 31 6.343 -2.665 5.622 222 HB3 GLN 31 HB1 GLN 31 6.433 -4.289 6.288 223 HG2 GLN 31 HG2 GLN 31 7.493 -3.186 7.945 224 HG3 GLN 31 HG1 GLN 31 8.883 -3.490 6.905 225 HE21 GLN 31 HE21 GLN 31 8.043 -1.501 4.920 226 HE22 GLN 31 HE22 GLN 31 8.373 0.038 5.624 227 H THR 32 HN THR 32 6.689 -6.093 5.471 228 HA THR 32 HA THR 32 8.745 -7.428 6.651 229 HB THR 32 HB THR 32 6.562 -8.702 5.000 230 HG1 THR 32 HG1 THR 32 5.515 -7.594 6.548 231 HG21 THR 32 HG23 THR 32 8.227 -9.833 7.252 232 HG22 THR 32 HG21 THR 32 8.367 -10.270 5.548 233 HG23 THR 32 HG22 THR 32 6.894 -10.652 6.439 234 H SER 33 HN SER 33 7.794 -7.847 3.248 235 HA SER 33 HA SER 33 10.102 -9.504 2.726 236 HG SER 33 HG SER 33 9.573 -9.298 -0.433 237 HB2 SER 33 HB2 SER 33 7.927 -10.007 1.714 238 HB3 SER 33 HB1 SER 33 8.004 -8.502 0.809 239 H GLY 34 HN GLY 34 8.924 -6.455 1.333 240 HA2 GLY 34 HA2 GLY 34 11.594 -6.161 0.158 241 HA3 GLY 34 HA1 GLY 34 10.179 -5.342 -0.427 242 H LEU 35 HN LEU 35 9.289 -3.744 1.430 243 HA LEU 35 HA LEU 35 10.921 -1.558 1.271 244 HG LEU 35 HG LEU 35 9.367 0.419 1.749 245 HB2 LEU 35 HB2 LEU 35 8.505 -2.312 2.698 246 HB3 LEU 35 HB1 LEU 35 9.466 -1.140 3.585 247 HD11 LEU 35 HD11 LEU 35 7.723 -0.375 -0.173 248 HD12 LEU 35 HD12 LEU 35 8.384 -1.950 0.272 249 HD13 LEU 35 HD13 LEU 35 9.462 -0.654 -0.244 250 HD21 LEU 35 HD23 LEU 35 6.602 -0.711 2.098 251 HD22 LEU 35 HD21 LEU 35 7.058 0.963 1.786 252 HD23 LEU 35 HD22 LEU 35 7.433 0.221 3.341 253 H SER 36 HN SER 36 10.777 -3.941 3.873 254 HA SER 36 HA SER 36 12.177 -2.969 5.889 255 HG SER 36 HG SER 36 13.379 -4.605 7.142 256 HB2 SER 36 HB2 SER 36 11.554 -5.315 5.782 257 HB3 SER 36 HB1 SER 36 12.792 -5.616 4.564 258 H LYS 37 HN LYS 37 13.692 -3.683 2.754 259 HA LYS 37 HA LYS 37 15.927 -1.993 3.519 260 HB2 LYS 37 HB2 LYS 37 16.365 -4.845 2.643 261 HB3 LYS 37 HB1 LYS 37 17.621 -3.653 2.923 262 HG2 LYS 37 HG2 LYS 37 17.094 -3.568 5.264 263 HG3 LYS 37 HG1 LYS 37 15.725 -4.648 5.019 264 HD2 LYS 37 HD2 LYS 37 17.202 -6.429 4.328 265 HD3 LYS 37 HD1 LYS 37 18.597 -5.359 4.476 266 HE2 LYS 37 HE2 LYS 37 16.783 -6.275 6.702 267 HE3 LYS 37 HE1 LYS 37 18.446 -6.789 6.424 268 HZ1 LYS 37 HZ3 LYS 37 19.139 -4.472 6.775 269 HZ2 LYS 37 HZ1 LYS 37 18.387 -5.131 8.140 270 HZ3 LYS 37 HZ2 LYS 37 17.543 -4.055 7.145 271 H MET 38 HN MET 38 14.003 -1.427 1.579 272 HA MET 38 HA MET 38 15.432 -1.881 -0.942 273 HB2 MET 38 HB2 MET 38 12.558 -1.151 -0.393 274 HB3 MET 38 HB1 MET 38 13.268 -1.328 -1.986 275 HG2 MET 38 HG2 MET 38 13.571 -3.559 -0.101 276 HG3 MET 38 HG1 MET 38 11.981 -3.279 -0.795 277 HE1 MET 38 HE3 MET 38 14.691 -5.627 -1.155 278 HE2 MET 38 HE1 MET 38 14.038 -6.300 -2.647 279 HE3 MET 38 HE2 MET 38 12.968 -5.974 -1.286 280 H SER 39 HN SER 39 15.618 -0.102 -2.444 281 HA SER 39 HA SER 39 16.248 2.357 -1.146 282 HG SER 39 HG SER 39 17.518 3.711 -3.913 283 HB2 SER 39 HB2 SER 39 17.691 1.880 -2.910 284 HB3 SER 39 HB1 SER 39 16.378 1.377 -3.979 285 H ALA 40 HN ALA 40 15.495 4.436 -2.040 286 HA ALA 40 HA ALA 40 12.709 4.690 -1.687 287 HB1 ALA 40 HB3 ALA 40 14.502 6.718 -3.008 288 HB2 ALA 40 HB1 ALA 40 14.393 6.486 -1.261 289 HB3 ALA 40 HB2 ALA 40 12.974 7.010 -2.171 290 H SER 41 HN SER 41 14.715 4.731 -4.613 291 HA SER 41 HA SER 41 12.855 5.440 -6.490 292 HG SER 41 HG SER 41 16.027 3.028 -7.296 293 HB2 SER 41 HB2 SER 41 14.232 4.145 -8.110 294 HB3 SER 41 HB1 SER 41 15.189 5.188 -7.058 295 H GLN 42 HN GLN 42 13.688 2.073 -5.651 296 HA GLN 42 HA GLN 42 11.790 0.844 -7.245 297 HB2 GLN 42 HB2 GLN 42 12.233 -1.128 -6.100 298 HB3 GLN 42 HB1 GLN 42 13.699 -0.187 -5.852 299 HG2 GLN 42 HG2 GLN 42 13.477 -0.592 -3.699 300 HG3 GLN 42 HG1 GLN 42 12.071 0.476 -3.707 301 HE21 GLN 42 HE21 GLN 42 11.235 -0.900 -1.961 302 HE22 GLN 42 HE22 GLN 42 10.479 -2.395 -2.356 303 H VAL 43 HN VAL 43 11.387 2.493 -4.276 304 HA VAL 43 HA VAL 43 8.914 1.442 -3.421 305 HB VAL 43 HB VAL 43 9.717 4.326 -3.118 306 HG11 VAL 43 HG11 VAL 43 8.225 2.815 -1.067 307 HG12 VAL 43 HG12 VAL 43 7.375 3.306 -2.531 308 HG13 VAL 43 HG13 VAL 43 8.143 4.519 -1.513 309 HG21 VAL 43 HG23 VAL 43 10.576 3.477 -0.847 310 HG22 VAL 43 HG21 VAL 43 11.581 3.231 -2.272 311 HG23 VAL 43 HG22 VAL 43 10.627 1.897 -1.630 312 H LYS 44 HN LYS 44 9.760 3.948 -5.725 313 HA LYS 44 HA LYS 44 7.311 5.078 -6.280 314 HB2 LYS 44 HB2 LYS 44 9.644 4.438 -8.072 315 HB3 LYS 44 HB1 LYS 44 8.216 5.266 -8.679 316 HG2 LYS 44 HG2 LYS 44 8.669 7.187 -7.529 317 HG3 LYS 44 HG1 LYS 44 9.544 6.345 -6.250 318 HD2 LYS 44 HD2 LYS 44 10.965 7.759 -7.765 319 HD3 LYS 44 HD1 LYS 44 11.458 6.074 -7.628 320 HE2 LYS 44 HE2 LYS 44 11.569 6.814 -9.939 321 HE3 LYS 44 HE1 LYS 44 10.335 5.568 -9.738 322 HZ1 LYS 44 HZ3 LYS 44 9.875 8.496 -9.952 323 HZ2 LYS 44 HZ1 LYS 44 8.666 7.355 -9.642 324 HZ3 LYS 44 HZ2 LYS 44 9.495 7.329 -11.116 325 H ASP 45 HN ASP 45 8.700 2.107 -7.630 326 HA ASP 45 HA ASP 45 6.505 1.472 -9.289 327 HB2 ASP 45 HB2 ASP 45 9.023 0.298 -8.583 328 HB3 ASP 45 HB1 ASP 45 7.770 -0.924 -8.408 329 H ILE 46 HN ILE 46 7.461 0.383 -6.040 330 HA ILE 46 HA ILE 46 5.367 -1.281 -5.452 331 HB ILE 46 HB ILE 46 7.145 0.466 -3.832 332 HG12 ILE 46 HG12 ILE 46 7.317 -2.072 -2.909 333 HG13 ILE 46 HG11 ILE 46 6.814 -2.356 -4.550 334 HG21 ILE 46 HG21 ILE 46 4.658 -0.827 -2.815 335 HG22 ILE 46 HG22 ILE 46 5.387 0.727 -2.403 336 HG23 ILE 46 HG23 ILE 46 6.098 -0.767 -1.795 337 HD11 ILE 46 HD13 ILE 46 9.309 -2.268 -3.995 338 HD12 ILE 46 HD11 ILE 46 9.085 -0.523 -3.963 339 HD13 ILE 46 HD12 ILE 46 8.727 -1.435 -5.430 340 H PHE 47 HN PHE 47 5.561 2.181 -4.645 341 HA PHE 47 HA PHE 47 3.172 2.840 -3.693 342 HD1 PHE 47 HD1 PHE 47 2.071 5.378 -3.631 343 HD2 PHE 47 HD2 PHE 47 3.986 5.403 -7.430 344 HE1 PHE 47 HE1 PHE 47 0.436 7.021 -4.449 345 HE2 PHE 47 HE2 PHE 47 2.356 7.053 -8.249 346 HZ PHE 47 HZ PHE 47 0.576 7.865 -6.755 347 HB2 PHE 47 HB2 PHE 47 4.581 4.640 -4.090 348 HB3 PHE 47 HB1 PHE 47 4.905 4.167 -5.742 349 H ARG 48 HN ARG 48 3.798 2.104 -7.049 350 HA ARG 48 HA ARG 48 1.353 2.790 -8.162 351 HE ARG 48 HE ARG 48 5.071 4.603 -10.061 352 HB2 ARG 48 HB2 ARG 48 3.117 0.515 -9.045 353 HB3 ARG 48 HB1 ARG 48 1.929 1.368 -10.022 354 HG2 ARG 48 HG2 ARG 48 4.510 2.421 -8.925 355 HG3 ARG 48 HG1 ARG 48 4.045 2.238 -10.615 356 HD2 ARG 48 HD2 ARG 48 2.280 3.939 -10.267 357 HD3 ARG 48 HD1 ARG 48 2.843 4.157 -8.606 358 HH11 ARG 48 HH11 ARG 48 1.826 5.848 -10.258 359 HH12 ARG 48 HH12 ARG 48 2.314 7.380 -10.904 360 HH21 ARG 48 HH21 ARG 48 5.726 6.614 -10.913 361 HH22 ARG 48 HH22 ARG 48 4.533 7.814 -11.278 362 H PHE 49 HN PHE 49 2.236 -0.085 -6.335 363 HA PHE 49 HA PHE 49 0.190 -1.812 -6.993 364 HD1 PHE 49 HD2 PHE 49 0.451 -4.349 -6.092 365 HD2 PHE 49 HD1 PHE 49 -0.320 -1.904 -2.692 366 HE1 PHE 49 HE2 PHE 49 -0.996 -6.106 -5.157 367 HE2 PHE 49 HE1 PHE 49 -1.764 -3.656 -1.755 368 HZ PHE 49 HZ PHE 49 -2.106 -5.761 -2.987 369 HB2 PHE 49 HB2 PHE 49 1.953 -2.416 -5.401 370 HB3 PHE 49 HB1 PHE 49 1.323 -1.260 -4.235 371 H ILE 50 HN ILE 50 0.095 0.477 -4.260 372 HA ILE 50 HA ILE 50 -2.780 0.446 -4.204 373 HB ILE 50 HB ILE 50 -2.457 2.306 -2.515 374 HG12 ILE 50 HG12 ILE 50 0.440 1.452 -2.623 375 HG13 ILE 50 HG11 ILE 50 -0.161 2.922 -3.384 376 HG21 ILE 50 HG21 ILE 50 -1.677 -0.511 -2.289 377 HG22 ILE 50 HG22 ILE 50 -2.880 0.426 -1.401 378 HG23 ILE 50 HG23 ILE 50 -1.177 0.529 -0.955 379 HD11 ILE 50 HD13 ILE 50 -0.289 2.277 -0.447 380 HD12 ILE 50 HD11 ILE 50 -0.885 3.750 -1.208 381 HD13 ILE 50 HD12 ILE 50 0.841 3.388 -1.221 382 H ASP 51 HN ASP 51 -4.110 1.838 -5.082 383 HA ASP 51 HA ASP 51 -4.664 3.201 -6.904 384 HB2 ASP 51 HB2 ASP 51 -4.098 4.825 -4.441 385 HB3 ASP 51 HB1 ASP 51 -4.870 5.524 -5.867 386 H ASN 52 HN ASN 52 -3.964 4.020 -8.680 387 HA ASN 52 HA ASN 52 -1.164 4.712 -8.983 388 HB2 ASN 52 HB2 ASN 52 -2.256 3.177 -10.570 389 HB3 ASN 52 HB1 ASN 52 -3.331 4.478 -11.074 390 HD21 ASN 52 HD21 ASN 52 -2.765 5.132 -13.006 391 HD22 ASN 52 HD22 ASN 52 -1.152 5.425 -13.555 392 H ASP 53 HN ASP 53 -2.444 6.726 -7.530 393 HA ASP 53 HA ASP 53 -2.419 9.017 -7.458 394 HB2 ASP 53 HB2 ASP 53 -0.546 8.802 -9.158 395 HB3 ASP 53 HB1 ASP 53 -1.766 9.031 -10.407 396 H GLN 54 HN GLN 54 -4.721 7.821 -7.584 397 HA GLN 54 HA GLN 54 -6.584 8.231 -9.472 398 HB2 GLN 54 HB2 GLN 54 -7.028 8.774 -6.538 399 HB3 GLN 54 HB1 GLN 54 -8.277 8.397 -7.717 400 HG2 GLN 54 HG2 GLN 54 -7.541 6.185 -7.950 401 HG3 GLN 54 HG1 GLN 54 -6.005 6.519 -7.159 402 HE21 GLN 54 HE21 GLN 54 -6.115 7.132 -4.890 403 HE22 GLN 54 HE22 GLN 54 -7.281 6.360 -3.888 404 H SER 55 HN SER 55 -5.395 10.753 -7.266 405 HA SER 55 HA SER 55 -6.385 12.749 -9.138 406 HG SER 55 HG SER 55 -7.721 14.781 -6.543 407 HB2 SER 55 HB2 SER 55 -8.258 12.453 -7.569 408 HB3 SER 55 HB1 SER 55 -7.176 12.781 -6.216 409 H GLY 56 HN GLY 56 -3.756 11.916 -8.532 410 HA2 GLY 56 HA2 GLY 56 -1.836 13.362 -8.512 411 HA3 GLY 56 HA1 GLY 56 -2.729 14.464 -7.465 412 H TYR 57 HN TYR 57 -3.687 12.210 -5.854 413 HA TYR 57 HA TYR 57 -1.380 11.019 -4.603 414 HD1 TYR 57 HD1 TYR 57 -4.346 13.932 -3.322 415 HD2 TYR 57 HD2 TYR 57 -0.221 14.392 -4.160 416 HE1 TYR 57 HE1 TYR 57 -4.762 16.265 -4.028 417 HE2 TYR 57 HE2 TYR 57 -0.601 16.724 -4.853 418 HH TYR 57 HH TYR 57 -3.506 18.370 -4.232 419 HB2 TYR 57 HB2 TYR 57 -2.768 12.387 -2.482 420 HB3 TYR 57 HB1 TYR 57 -1.072 12.484 -2.904 421 H LEU 58 HN LEU 58 -2.105 9.752 -2.672 422 HA LEU 58 HA LEU 58 -4.786 8.679 -3.195 423 HG LEU 58 HG LEU 58 -1.624 7.690 -3.683 424 HB2 LEU 58 HB2 LEU 58 -2.629 7.444 -1.488 425 HB3 LEU 58 HB1 LEU 58 -4.028 6.656 -2.193 426 HD11 LEU 58 HD11 LEU 58 -2.550 5.003 -2.826 427 HD12 LEU 58 HD12 LEU 58 -0.913 5.662 -2.912 428 HD13 LEU 58 HD13 LEU 58 -1.742 5.158 -4.386 429 HD21 LEU 58 HD23 LEU 58 -2.921 6.437 -5.569 430 HD22 LEU 58 HD21 LEU 58 -3.252 8.126 -5.195 431 HD23 LEU 58 HD22 LEU 58 -4.298 6.863 -4.573 432 H ASP 59 HN ASP 59 -6.282 8.446 -1.426 433 HA ASP 59 HA ASP 59 -5.460 9.665 1.094 434 HB2 ASP 59 HB2 ASP 59 -6.268 11.522 -0.318 435 HB3 ASP 59 HB1 ASP 59 -7.821 10.700 -0.478 436 H GLY 60 HN GLY 60 -7.038 9.476 2.791 437 HA2 GLY 60 HA2 GLY 60 -7.658 6.928 3.424 438 HA3 GLY 60 HA1 GLY 60 -8.554 8.296 4.055 439 H ASP 61 HN ASP 61 -9.770 9.029 1.526 440 HA ASP 61 HA ASP 61 -11.999 7.191 1.721 441 HB2 ASP 61 HB2 ASP 61 -11.781 9.399 -0.302 442 HB3 ASP 61 HB1 ASP 61 -13.225 8.736 0.454 443 H GLU 62 HN GLU 62 -9.656 8.195 -0.672 444 HA GLU 62 HA GLU 62 -10.676 6.495 -2.722 445 HB2 GLU 62 HB2 GLU 62 -8.042 7.940 -2.652 446 HB3 GLU 62 HB1 GLU 62 -8.926 7.381 -4.068 447 HG2 GLU 62 HG2 GLU 62 -10.027 9.408 -2.175 448 HG3 GLU 62 HG1 GLU 62 -9.045 9.845 -3.571 449 H LEU 63 HN LEU 63 -8.144 6.252 -0.326 450 HA LEU 63 HA LEU 63 -6.468 4.343 -1.298 451 HG LEU 63 HG LEU 63 -6.280 6.404 1.180 452 HB2 LEU 63 HB2 LEU 63 -7.639 4.514 1.485 453 HB3 LEU 63 HB1 LEU 63 -6.347 3.422 1.056 454 HD11 LEU 63 HD11 LEU 63 -4.019 5.076 2.275 455 HD12 LEU 63 HD12 LEU 63 -5.499 4.368 2.922 456 HD13 LEU 63 HD13 LEU 63 -5.210 6.099 3.075 457 HD21 LEU 63 HD23 LEU 63 -4.314 4.607 -0.201 458 HD22 LEU 63 HD21 LEU 63 -3.992 6.283 0.241 459 HD23 LEU 63 HD22 LEU 63 -5.266 5.908 -0.922 460 H LYS 64 HN LYS 64 -9.680 3.667 0.156 461 HA LYS 64 HA LYS 64 -9.554 0.934 -0.061 462 HB2 LYS 64 HB2 LYS 64 -12.160 1.205 -0.309 463 HB3 LYS 64 HB1 LYS 64 -11.344 1.533 1.205 464 HG2 LYS 64 HG2 LYS 64 -11.427 3.903 0.781 465 HG3 LYS 64 HG1 LYS 64 -12.104 3.625 -0.826 466 HD2 LYS 64 HD2 LYS 64 -13.633 2.299 1.247 467 HD3 LYS 64 HD1 LYS 64 -13.513 4.035 1.534 468 HE2 LYS 64 HE2 LYS 64 -14.424 4.515 -0.623 469 HE3 LYS 64 HE1 LYS 64 -14.356 2.814 -1.085 470 HZ1 LYS 64 HZ3 LYS 64 -16.064 3.963 1.059 471 HZ2 LYS 64 HZ1 LYS 64 -15.995 2.328 0.628 472 HZ3 LYS 64 HZ2 LYS 64 -16.595 3.469 -0.469 473 H TYR 65 HN TYR 65 -9.743 3.174 -2.606 474 HA TYR 65 HA TYR 65 -11.089 1.442 -4.444 475 HD1 TYR 65 HD1 TYR 65 -12.248 2.822 -3.280 476 HD2 TYR 65 HD2 TYR 65 -10.892 5.837 -5.950 477 HE1 TYR 65 HE1 TYR 65 -14.052 4.313 -2.507 478 HE2 TYR 65 HE2 TYR 65 -12.693 7.328 -5.197 479 HH TYR 65 HH TYR 65 -14.908 7.155 -4.145 480 HB2 TYR 65 HB2 TYR 65 -9.394 3.860 -5.053 481 HB3 TYR 65 HB1 TYR 65 -10.501 3.061 -6.156 482 H PHE 66 HN PHE 66 -7.894 1.625 -3.245 483 HA PHE 66 HA PHE 66 -6.211 1.018 -5.298 484 HD1 PHE 66 HD2 PHE 66 -4.358 -1.349 -4.969 485 HD2 PHE 66 HD1 PHE 66 -5.850 -1.064 -0.996 486 HE1 PHE 66 HE2 PHE 66 -3.480 -3.596 -4.481 487 HE2 PHE 66 HE1 PHE 66 -4.978 -3.305 -0.499 488 HZ PHE 66 HZ PHE 66 -3.790 -4.577 -2.244 489 HB2 PHE 66 HB2 PHE 66 -4.870 0.967 -3.479 490 HB3 PHE 66 HB1 PHE 66 -6.230 0.664 -2.429 491 H LEU 67 HN LEU 67 -8.173 -1.280 -3.524 492 HA LEU 67 HA LEU 67 -7.405 -3.533 -5.122 493 HG LEU 67 HG LEU 67 -7.276 -3.733 -2.236 494 HB2 LEU 67 HB2 LEU 67 -9.474 -3.037 -3.028 495 HB3 LEU 67 HB1 LEU 67 -9.604 -4.478 -4.019 496 HD11 LEU 67 HD11 LEU 67 -9.425 -5.829 -2.001 497 HD12 LEU 67 HD12 LEU 67 -9.156 -4.446 -0.937 498 HD13 LEU 67 HD13 LEU 67 -7.980 -5.763 -0.991 499 HD21 LEU 67 HD23 LEU 67 -7.698 -6.181 -3.947 500 HD22 LEU 67 HD21 LEU 67 -6.375 -5.929 -2.809 501 HD23 LEU 67 HD22 LEU 67 -6.515 -4.904 -4.238 502 H GLN 68 HN GLN 68 -9.868 -1.132 -5.204 503 HA GLN 68 HA GLN 68 -11.508 -2.482 -7.121 504 HB2 GLN 68 HB2 GLN 68 -11.623 0.025 -5.578 505 HB3 GLN 68 HB1 GLN 68 -12.466 0.025 -7.110 506 HG2 GLN 68 HG2 GLN 68 -13.518 -2.168 -6.299 507 HG3 GLN 68 HG1 GLN 68 -12.936 -1.683 -4.708 508 HE21 GLN 68 HE21 GLN 68 -14.994 -1.464 -3.879 509 HE22 GLN 68 HE22 GLN 68 -16.041 -0.161 -4.319 510 H LYS 69 HN LYS 69 -8.567 -0.936 -7.405 511 HA LYS 69 HA LYS 69 -9.097 0.552 -9.817 512 HB2 LYS 69 HB2 LYS 69 -6.488 -0.403 -8.620 513 HB3 LYS 69 HB1 LYS 69 -6.665 0.798 -9.887 514 HG2 LYS 69 HG2 LYS 69 -7.396 1.025 -6.992 515 HG3 LYS 69 HG1 LYS 69 -6.234 1.963 -7.896 516 HD2 LYS 69 HD2 LYS 69 -9.228 2.037 -8.170 517 HD3 LYS 69 HD1 LYS 69 -8.184 3.316 -7.548 518 HE2 LYS 69 HE2 LYS 69 -7.130 3.518 -9.749 519 HE3 LYS 69 HE1 LYS 69 -8.183 2.245 -10.366 520 HZ1 LYS 69 HZ3 LYS 69 -9.108 4.854 -9.285 521 HZ2 LYS 69 HZ1 LYS 69 -10.091 3.642 -9.939 522 HZ3 LYS 69 HZ2 LYS 69 -8.993 4.466 -10.927 523 H PHE 70 HN PHE 70 -7.269 -2.287 -8.863 524 HA PHE 70 HA PHE 70 -7.155 -3.270 -11.582 525 HD1 PHE 70 HD1 PHE 70 -6.168 -4.429 -7.363 526 HD2 PHE 70 HD2 PHE 70 -5.580 -6.575 -11.002 527 HE1 PHE 70 HE1 PHE 70 -6.175 -6.546 -6.119 528 HE2 PHE 70 HE2 PHE 70 -5.589 -8.694 -9.753 529 HZ PHE 70 HZ PHE 70 -5.887 -8.680 -7.309 530 HB2 PHE 70 HB2 PHE 70 -5.225 -4.183 -10.904 531 HB3 PHE 70 HB1 PHE 70 -5.435 -3.297 -9.412 532 H GLN 71 HN GLN 71 -8.484 -4.275 -8.453 533 HA GLN 71 HA GLN 71 -9.627 -6.684 -9.597 534 HB2 GLN 71 HB2 GLN 71 -8.720 -6.318 -7.176 535 HB3 GLN 71 HB1 GLN 71 -10.320 -5.650 -6.879 536 HG2 GLN 71 HG2 GLN 71 -11.122 -7.880 -7.989 537 HG3 GLN 71 HG1 GLN 71 -9.518 -8.443 -7.531 538 HE21 GLN 71 HE21 GLN 71 -11.787 -6.266 -5.866 539 HE22 GLN 71 HE22 GLN 71 -11.906 -7.223 -4.438 540 H SER 72 HN SER 72 -10.541 -3.473 -9.563 541 HA SER 72 HA SER 72 -12.607 -2.381 -9.304 542 HG SER 72 HG SER 72 -12.093 -1.420 -11.563 543 HB2 SER 72 HB2 SER 72 -12.804 -4.149 -11.720 544 HB3 SER 72 HB1 SER 72 -13.856 -2.772 -11.419 545 H ASP 73 HN ASP 73 -12.730 -4.542 -7.529 546 HA ASP 73 HA ASP 73 -15.568 -4.843 -7.315 547 HB2 ASP 73 HB2 ASP 73 -15.037 -6.688 -8.863 548 HB3 ASP 73 HB1 ASP 73 -13.890 -7.332 -7.692 549 H ALA 74 HN ALA 74 -13.029 -3.942 -5.809 550 HA ALA 74 HA ALA 74 -12.588 -5.645 -3.629 551 HB1 ALA 74 HB3 ALA 74 -11.181 -4.046 -2.907 552 HB2 ALA 74 HB1 ALA 74 -12.337 -2.748 -3.187 553 HB3 ALA 74 HB2 ALA 74 -11.409 -3.399 -4.538 554 H ARG 75 HN ARG 75 -13.183 -5.289 -1.430 555 HA ARG 75 HA ARG 75 -15.985 -4.726 -1.109 556 HE ARG 75 HE ARG 75 -10.888 -5.668 1.234 557 HB2 ARG 75 HB2 ARG 75 -15.534 -5.319 1.275 558 HB3 ARG 75 HB1 ARG 75 -15.033 -6.562 0.137 559 HG2 ARG 75 HG2 ARG 75 -12.932 -4.636 0.785 560 HG3 ARG 75 HG1 ARG 75 -13.509 -5.565 2.168 561 HD2 ARG 75 HD2 ARG 75 -12.891 -7.601 1.211 562 HD3 ARG 75 HD1 ARG 75 -12.800 -6.920 -0.413 563 HH11 ARG 75 HH11 ARG 75 -11.542 -8.735 -0.282 564 HH12 ARG 75 HH12 ARG 75 -9.872 -9.165 -0.430 565 HH21 ARG 75 HH21 ARG 75 -8.685 -6.222 1.042 566 HH22 ARG 75 HH22 ARG 75 -8.245 -7.735 0.322 567 H GLU 76 HN GLU 76 -13.285 -2.826 -1.277 568 HA GLU 76 HA GLU 76 -13.114 -0.556 -1.081 569 HB2 GLU 76 HB2 GLU 76 -15.326 -0.587 0.970 570 HB3 GLU 76 HB1 GLU 76 -14.671 0.792 0.099 571 HG2 GLU 76 HG2 GLU 76 -15.449 -0.453 -2.010 572 HG3 GLU 76 HG1 GLU 76 -16.448 -1.385 -0.899 573 H LEU 77 HN LEU 77 -11.686 -2.451 0.060 574 HA LEU 77 HA LEU 77 -10.513 -3.194 1.922 575 HG LEU 77 HG LEU 77 -9.227 -2.816 0.059 576 HB2 LEU 77 HB2 LEU 77 -9.809 -0.384 1.249 577 HB3 LEU 77 HB1 LEU 77 -8.904 -1.241 2.475 578 HD11 LEU 77 HD11 LEU 77 -7.697 -1.548 -1.339 579 HD12 LEU 77 HD12 LEU 77 -7.734 -0.220 -0.182 580 HD13 LEU 77 HD13 LEU 77 -9.196 -0.674 -1.056 581 HD21 LEU 77 HD23 LEU 77 -6.879 -1.895 1.693 582 HD22 LEU 77 HD21 LEU 77 -6.761 -2.997 0.320 583 HD23 LEU 77 HD22 LEU 77 -7.689 -3.462 1.745 584 H THR 78 HN THR 78 -13.067 -2.501 2.782 585 HA THR 78 HA THR 78 -14.323 -1.707 4.543 586 HB THR 78 HB THR 78 -13.936 -3.010 6.462 587 HG1 THR 78 HG1 THR 78 -11.839 -3.852 6.936 588 HG21 THR 78 HG23 THR 78 -13.430 -5.199 5.607 589 HG22 THR 78 HG21 THR 78 -12.550 -4.510 4.242 590 HG23 THR 78 HG22 THR 78 -14.297 -4.303 4.359 591 H GLU 79 HN GLU 79 -13.795 -1.198 7.125 592 HA GLU 79 HA GLU 79 -12.860 1.496 7.070 593 HB2 GLU 79 HB2 GLU 79 -14.221 -0.253 8.949 594 HB3 GLU 79 HB1 GLU 79 -13.039 0.789 9.733 595 HG2 GLU 79 HG2 GLU 79 -15.169 1.874 9.725 596 HG3 GLU 79 HG1 GLU 79 -14.078 2.737 8.652 597 H SER 80 HN SER 80 -11.666 -1.532 8.449 598 HA SER 80 HA SER 80 -9.337 -0.317 9.618 599 HG SER 80 HG SER 80 -8.724 -1.416 11.322 600 HB2 SER 80 HB2 SER 80 -10.775 -2.302 10.445 601 HB3 SER 80 HB1 SER 80 -9.718 -3.255 9.416 602 H GLU 81 HN GLU 81 -9.995 -1.939 6.582 603 HA GLU 81 HA GLU 81 -7.332 -2.975 6.279 604 HB2 GLU 81 HB2 GLU 81 -9.627 -3.580 5.002 605 HB3 GLU 81 HB1 GLU 81 -8.902 -2.499 3.832 606 HG2 GLU 81 HG2 GLU 81 -7.051 -3.860 3.506 607 HG3 GLU 81 HG1 GLU 81 -7.368 -4.782 4.973 608 H THR 82 HN THR 82 -9.029 -0.108 4.949 609 HA THR 82 HA THR 82 -6.844 0.908 3.512 610 HB THR 82 HB THR 82 -7.930 3.081 3.640 611 HG1 THR 82 HG1 THR 82 -8.802 3.263 5.632 612 HG21 THR 82 HG23 THR 82 -9.739 0.729 3.135 613 HG22 THR 82 HG21 THR 82 -8.801 1.654 1.961 614 HG23 THR 82 HG22 THR 82 -10.194 2.389 2.753 615 H LYS 83 HN LYS 83 -7.331 0.611 6.891 616 HA LYS 83 HA LYS 83 -5.992 2.841 7.911 617 HB2 LYS 83 HB2 LYS 83 -7.214 1.143 9.289 618 HB3 LYS 83 HB1 LYS 83 -5.898 0.015 8.994 619 HG2 LYS 83 HG2 LYS 83 -4.356 1.436 10.175 620 HG3 LYS 83 HG1 LYS 83 -5.597 2.669 10.378 621 HD2 LYS 83 HD2 LYS 83 -5.872 -0.131 11.446 622 HD3 LYS 83 HD1 LYS 83 -5.163 1.189 12.380 623 HE2 LYS 83 HE2 LYS 83 -7.256 2.477 12.009 624 HE3 LYS 83 HE1 LYS 83 -7.956 1.044 11.261 625 HZ1 LYS 83 HZ3 LYS 83 -7.646 -0.152 13.335 626 HZ2 LYS 83 HZ1 LYS 83 -8.586 1.230 13.587 627 HZ3 LYS 83 HZ2 LYS 83 -6.961 1.216 14.056 628 H SER 84 HN SER 84 -4.851 -0.233 6.634 629 HA SER 84 HA SER 84 -2.142 -0.020 7.207 630 HG SER 84 HG SER 84 -1.125 -1.940 4.875 631 HB2 SER 84 HB2 SER 84 -3.587 -1.901 6.014 632 HB3 SER 84 HB1 SER 84 -3.011 -1.099 4.559 633 H LEU 85 HN LEU 85 -3.878 0.881 4.261 634 HA LEU 85 HA LEU 85 -1.814 2.187 2.966 635 HG LEU 85 HG LEU 85 -4.297 0.363 2.172 636 HB2 LEU 85 HB2 LEU 85 -4.801 2.579 2.869 637 HB3 LEU 85 HB1 LEU 85 -3.695 3.260 1.707 638 HD11 LEU 85 HD11 LEU 85 -4.636 2.201 -0.191 639 HD12 LEU 85 HD12 LEU 85 -5.911 1.461 0.780 640 HD13 LEU 85 HD13 LEU 85 -4.882 0.456 -0.239 641 HD21 LEU 85 HD23 LEU 85 -1.902 0.594 1.870 642 HD22 LEU 85 HD21 LEU 85 -2.160 1.569 0.423 643 HD23 LEU 85 HD22 LEU 85 -2.641 -0.128 0.441 644 H MET 86 HN MET 86 -4.213 3.351 5.240 645 HA MET 86 HA MET 86 -3.616 6.110 5.119 646 HB2 MET 86 HB2 MET 86 -4.719 4.471 7.413 647 HB3 MET 86 HB1 MET 86 -4.728 6.228 7.338 648 HG2 MET 86 HG2 MET 86 -5.926 4.957 5.004 649 HG3 MET 86 HG1 MET 86 -6.747 4.582 6.518 650 HE1 MET 86 HE3 MET 86 -4.881 8.087 6.316 651 HE2 MET 86 HE1 MET 86 -5.930 8.897 5.154 652 HE3 MET 86 HE2 MET 86 -5.008 7.474 4.667 653 H ASP 87 HN ASP 87 -2.576 3.607 7.378 654 HA ASP 87 HA ASP 87 -0.740 5.223 8.831 655 HB2 ASP 87 HB2 ASP 87 -1.236 2.261 8.687 656 HB3 ASP 87 HB1 ASP 87 -0.039 2.982 9.763 657 H ALA 88 HN ALA 88 -0.527 4.066 5.751 658 HA ALA 88 HA ALA 88 2.113 2.967 5.750 659 HB1 ALA 88 HB3 ALA 88 1.799 2.604 3.508 660 HB2 ALA 88 HB1 ALA 88 0.789 4.038 3.310 661 HB3 ALA 88 HB2 ALA 88 0.142 2.609 4.111 662 H ALA 89 HN ALA 89 0.660 6.114 5.172 663 HA ALA 89 HA ALA 89 3.113 7.474 5.546 664 HB1 ALA 89 HB3 ALA 89 2.746 6.621 2.966 665 HB2 ALA 89 HB1 ALA 89 3.722 8.010 3.451 666 HB3 ALA 89 HB2 ALA 89 2.052 8.246 2.932 667 H ASP 90 HN ASP 90 2.735 9.639 5.868 668 HA ASP 90 HA ASP 90 1.517 11.358 6.805 669 HB2 ASP 90 HB2 ASP 90 1.648 11.803 4.344 670 HB3 ASP 90 HB1 ASP 90 0.044 11.117 4.206 671 H ASN 91 HN ASN 91 0.648 9.582 8.222 672 HA ASN 91 HA ASN 91 -2.180 8.942 7.802 673 HB2 ASN 91 HB2 ASN 91 -1.367 7.698 10.177 674 HB3 ASN 91 HB1 ASN 91 -1.619 6.939 8.616 675 HD21 ASN 91 HD21 ASN 91 0.186 6.604 7.247 676 HD22 ASN 91 HD22 ASN 91 1.787 6.536 7.895 677 H ASP 92 HN ASP 92 -0.085 10.140 10.407 678 HA ASP 92 HA ASP 92 -2.323 10.890 12.025 679 HB2 ASP 92 HB2 ASP 92 0.634 11.390 12.326 680 HB3 ASP 92 HB1 ASP 92 -0.574 11.804 13.533 681 H GLY 93 HN GLY 93 -1.346 12.389 9.285 682 HA2 GLY 93 HA2 GLY 93 -1.967 15.021 10.460 683 HA3 GLY 93 HA1 GLY 93 -0.725 14.825 9.236 684 H ASP 94 HN ASP 94 -1.324 14.431 7.091 685 HA ASP 94 HA ASP 94 -3.826 15.650 6.359 686 HB2 ASP 94 HB2 ASP 94 -1.701 16.039 5.104 687 HB3 ASP 94 HB1 ASP 94 -1.776 14.373 4.542 688 H GLY 95 HN GLY 95 -2.367 12.426 5.882 689 HA2 GLY 95 HA2 GLY 95 -3.634 10.427 6.134 690 HA3 GLY 95 HA1 GLY 95 -5.085 11.334 5.747 691 H LYS 96 HN LYS 96 -2.410 11.957 3.680 692 HA LYS 96 HA LYS 96 -3.714 10.315 1.631 693 HB2 LYS 96 HB2 LYS 96 -3.453 12.008 0.159 694 HB3 LYS 96 HB1 LYS 96 -3.155 12.992 1.578 695 HG2 LYS 96 HG2 LYS 96 -1.109 11.767 -0.255 696 HG3 LYS 96 HG1 LYS 96 -1.495 13.476 -0.065 697 HD2 LYS 96 HD2 LYS 96 -0.871 12.695 2.500 698 HD3 LYS 96 HD1 LYS 96 0.261 11.763 1.511 699 HE2 LYS 96 HE2 LYS 96 1.265 13.871 2.118 700 HE3 LYS 96 HE1 LYS 96 0.946 13.847 0.385 701 HZ1 LYS 96 HZ3 LYS 96 -0.720 15.196 2.444 702 HZ2 LYS 96 HZ1 LYS 96 -1.057 15.156 0.786 703 HZ3 LYS 96 HZ2 LYS 96 0.319 15.959 1.350 704 H ILE 97 HN ILE 97 -2.349 9.182 0.037 705 HA ILE 97 HA ILE 97 0.337 8.586 1.113 706 HB ILE 97 HB ILE 97 -1.415 6.560 -0.270 707 HG12 ILE 97 HG12 ILE 97 -2.429 7.246 1.871 708 HG13 ILE 97 HG11 ILE 97 -1.837 5.590 1.895 709 HG21 ILE 97 HG21 ILE 97 0.254 5.021 0.892 710 HG22 ILE 97 HG22 ILE 97 1.224 6.473 1.146 711 HG23 ILE 97 HG23 ILE 97 0.832 5.950 -0.490 712 HD11 ILE 97 HD13 ILE 97 0.133 6.282 3.098 713 HD12 ILE 97 HD11 ILE 97 -1.329 6.771 3.957 714 HD13 ILE 97 HD12 ILE 97 -0.406 7.960 3.035 715 H GLY 98 HN GLY 98 1.437 9.821 -0.457 716 HA2 GLY 98 HA2 GLY 98 1.128 9.005 -3.239 717 HA3 GLY 98 HA1 GLY 98 1.963 10.447 -2.665 718 H ALA 99 HN ALA 99 3.246 8.883 -4.480 719 HA ALA 99 HA ALA 99 4.773 6.744 -3.521 720 HB1 ALA 99 HB3 ALA 99 5.014 7.033 -5.793 721 HB2 ALA 99 HB1 ALA 99 6.535 7.710 -5.218 722 HB3 ALA 99 HB2 ALA 99 5.204 8.780 -5.662 723 H ASP 100 HN ASP 100 5.588 10.194 -3.532 724 HA ASP 100 HA ASP 100 8.007 10.039 -2.166 725 HB2 ASP 100 HB2 ASP 100 7.136 12.072 -3.312 726 HB3 ASP 100 HB1 ASP 100 5.988 12.291 -1.996 727 H GLU 101 HN GLU 101 4.752 10.615 -0.860 728 HA GLU 101 HA GLU 101 5.466 10.770 1.863 729 HB2 GLU 101 HB2 GLU 101 3.028 10.497 0.277 730 HB3 GLU 101 HB1 GLU 101 2.922 9.662 1.817 731 HG2 GLU 101 HG2 GLU 101 2.163 12.128 1.577 732 HG3 GLU 101 HG1 GLU 101 3.008 11.592 3.019 733 H PHE 102 HN PHE 102 4.222 8.075 -0.057 734 HA PHE 102 HA PHE 102 4.352 6.054 1.834 735 HD1 PHE 102 HD1 PHE 102 6.572 4.139 -0.277 736 HD2 PHE 102 HD2 PHE 102 2.355 3.706 0.000 737 HE1 PHE 102 HE1 PHE 102 6.849 1.734 -0.076 738 HE2 PHE 102 HE2 PHE 102 2.624 1.264 0.187 739 HZ PHE 102 HZ PHE 102 4.884 0.276 0.147 740 HB2 PHE 102 HB2 PHE 102 3.241 5.796 -0.327 741 HB3 PHE 102 HB1 PHE 102 4.785 5.906 -1.166 742 H GLN 103 HN GLN 103 6.796 6.997 -0.564 743 HA GLN 103 HA GLN 103 8.721 5.093 0.248 744 HB2 GLN 103 HB2 GLN 103 10.145 6.049 -1.312 745 HB3 GLN 103 HB1 GLN 103 8.560 6.471 -1.926 746 HG2 GLN 103 HG2 GLN 103 8.728 8.629 -1.119 747 HG3 GLN 103 HG1 GLN 103 10.209 8.288 -0.255 748 HE21 GLN 103 HE21 GLN 103 9.489 7.131 -3.482 749 HE22 GLN 103 HE22 GLN 103 10.684 8.072 -4.296 750 H GLU 104 HN GLU 104 7.866 8.192 1.450 751 HA GLU 104 HA GLU 104 10.249 8.837 2.835 752 HB2 GLU 104 HB2 GLU 104 7.385 9.672 3.122 753 HB3 GLU 104 HB1 GLU 104 8.547 10.125 4.357 754 HG2 GLU 104 HG2 GLU 104 9.090 10.693 1.475 755 HG3 GLU 104 HG1 GLU 104 8.055 11.757 2.426 756 H MET 105 HN MET 105 7.468 6.864 3.629 757 HA MET 105 HA MET 105 7.954 6.487 6.363 758 HB2 MET 105 HB2 MET 105 5.923 5.839 4.850 759 HB3 MET 105 HB1 MET 105 6.782 4.316 4.672 760 HG2 MET 105 HG2 MET 105 6.085 5.522 7.329 761 HG3 MET 105 HG1 MET 105 5.045 4.390 6.474 762 HE1 MET 105 HE3 MET 105 6.428 2.131 9.321 763 HE2 MET 105 HE1 MET 105 5.003 2.479 8.342 764 HE3 MET 105 HE2 MET 105 5.736 3.753 9.315 765 H VAL 106 HN VAL 106 8.788 4.325 3.633 766 HA VAL 106 HA VAL 106 10.278 2.510 5.159 767 HB VAL 106 HB VAL 106 9.478 1.909 2.955 768 HG11 VAL 106 HG11 VAL 106 11.210 4.181 2.084 769 HG12 VAL 106 HG12 VAL 106 9.535 3.820 1.663 770 HG13 VAL 106 HG13 VAL 106 10.843 2.857 0.979 771 HG21 VAL 106 HG23 VAL 106 12.071 1.424 3.937 772 HG22 VAL 106 HG21 VAL 106 12.240 1.675 2.201 773 HG23 VAL 106 HG22 VAL 106 11.151 0.429 2.810 774 H HIS 107 HN HIS 107 11.113 5.541 3.658 775 HA HIS 107 HA HIS 107 13.954 5.175 3.935 776 HD1 HIS 107 HD1 HIS 107 15.357 6.603 1.392 777 HD2 HIS 107 HD2 HIS 107 14.531 9.235 4.499 778 HE1 HIS 107 HE1 HIS 107 17.393 8.063 1.594 779 HE2 HIS 107 HE2 HIS 107 16.911 9.581 3.546 780 HB2 HIS 107 HB2 HIS 107 12.924 6.557 2.134 781 HB3 HIS 107 HB1 HIS 107 12.419 7.714 3.361 782 H SER 108 HN SER 108 11.389 6.651 5.810 783 HA SER 108 HA SER 108 12.791 8.358 7.455 784 HG SER 108 HG SER 108 9.774 6.295 9.135 785 HB2 SER 108 HB2 SER 108 11.042 8.028 9.115 786 HB3 SER 108 HB1 SER 108 10.336 8.082 7.500 Start of MODEL 18 1 HA SER 1 HA SER 1 2.739 -2.976 -10.422 2 HG SER 1 HG SER 1 2.311 -6.233 -10.489 3 H1 SER 1 HT1 SER 1 5.289 -2.949 -11.928 4 H2 SER 1 HT2 SER 1 4.428 -1.591 -11.404 5 H3 SER 1 HT3 SER 1 3.759 -2.618 -12.570 6 HB2 SER 1 HB2 SER 1 2.920 -4.865 -11.978 7 HB3 SER 1 HB1 SER 1 4.516 -5.254 -11.337 8 H ILE 2 HN ILE 2 3.369 -4.710 -8.493 9 HA ILE 2 HA ILE 2 5.261 -3.205 -6.907 10 HB ILE 2 HB ILE 2 2.929 -4.340 -6.246 11 HG12 ILE 2 HG12 ILE 2 5.291 -3.892 -4.461 12 HG13 ILE 2 HG11 ILE 2 4.083 -2.730 -4.896 13 HG21 ILE 2 HG21 ILE 2 3.131 -6.321 -4.979 14 HG22 ILE 2 HG22 ILE 2 4.888 -6.337 -5.154 15 HG23 ILE 2 HG23 ILE 2 3.855 -6.641 -6.553 16 HD11 ILE 2 HD13 ILE 2 4.142 -4.442 -2.691 17 HD12 ILE 2 HD11 ILE 2 2.823 -4.986 -3.726 18 HD13 ILE 2 HD12 ILE 2 2.882 -3.318 -3.174 19 H THR 3 HN THR 3 4.966 -6.414 -8.285 20 HA THR 3 HA THR 3 7.223 -7.597 -7.127 21 HB THR 3 HB THR 3 7.141 -9.198 -9.002 22 HG1 THR 3 HG1 THR 3 5.462 -8.855 -10.585 23 HG21 THR 3 HG23 THR 3 4.324 -8.596 -8.142 24 HG22 THR 3 HG21 THR 3 5.530 -9.211 -7.011 25 HG23 THR 3 HG22 THR 3 5.079 -10.166 -8.424 26 H ASP 4 HN ASP 4 7.076 -5.049 -9.375 27 HA ASP 4 HA ASP 4 9.074 -5.319 -11.169 28 HB2 ASP 4 HB2 ASP 4 7.746 -3.222 -10.681 29 HB3 ASP 4 HB1 ASP 4 8.904 -2.875 -9.401 30 H ILE 5 HN ILE 5 9.708 -4.150 -7.838 31 HA ILE 5 HA ILE 5 12.259 -5.625 -7.930 32 HB ILE 5 HB ILE 5 11.969 -2.954 -6.582 33 HG12 ILE 5 HG12 ILE 5 13.602 -2.448 -8.694 34 HG13 ILE 5 HG11 ILE 5 12.438 -3.564 -9.391 35 HG21 ILE 5 HG21 ILE 5 13.747 -4.490 -5.800 36 HG22 ILE 5 HG22 ILE 5 14.365 -2.977 -6.462 37 HG23 ILE 5 HG23 ILE 5 14.434 -4.454 -7.424 38 HD11 ILE 5 HD13 ILE 5 11.587 -1.136 -7.868 39 HD12 ILE 5 HD11 ILE 5 10.634 -2.137 -8.958 40 HD13 ILE 5 HD12 ILE 5 11.913 -1.107 -9.597 41 H LEU 6 HN LEU 6 11.440 -7.236 -6.688 42 HA LEU 6 HA LEU 6 11.514 -6.893 -3.878 43 HG LEU 6 HG LEU 6 10.196 -6.204 -2.429 44 HB2 LEU 6 HB2 LEU 6 9.021 -6.334 -5.056 45 HB3 LEU 6 HB1 LEU 6 8.847 -7.866 -4.232 46 HD11 LEU 6 HD11 LEU 6 8.091 -4.750 -3.975 47 HD12 LEU 6 HD12 LEU 6 9.682 -4.193 -3.457 48 HD13 LEU 6 HD13 LEU 6 8.389 -4.384 -2.276 49 HD21 LEU 6 HD23 LEU 6 8.607 -7.926 -1.831 50 HD22 LEU 6 HD21 LEU 6 7.299 -7.011 -2.578 51 HD23 LEU 6 HD22 LEU 6 8.105 -6.381 -1.147 52 H SER 7 HN SER 7 10.919 -8.843 -2.655 53 HA SER 7 HA SER 7 11.698 -11.240 -4.090 54 HG SER 7 HG SER 7 12.946 -9.817 -1.952 55 HB2 SER 7 HB2 SER 7 10.957 -10.815 -1.181 56 HB3 SER 7 HB1 SER 7 11.598 -12.310 -1.855 57 H ALA 8 HN ALA 8 10.185 -12.438 -5.097 58 HA ALA 8 HA ALA 8 7.442 -11.762 -4.979 59 HB1 ALA 8 HB3 ALA 8 8.389 -12.657 -6.989 60 HB2 ALA 8 HB1 ALA 8 7.118 -13.738 -6.415 61 HB3 ALA 8 HB2 ALA 8 8.813 -14.163 -6.166 62 H GLU 9 HN GLU 9 9.233 -14.567 -3.609 63 HA GLU 9 HA GLU 9 6.935 -15.836 -2.590 64 HB2 GLU 9 HB2 GLU 9 9.817 -15.969 -1.713 65 HB3 GLU 9 HB1 GLU 9 8.558 -17.065 -1.151 66 HG2 GLU 9 HG2 GLU 9 8.242 -17.897 -3.389 67 HG3 GLU 9 HG1 GLU 9 9.393 -16.715 -4.008 68 H ASP 10 HN ASP 10 9.434 -13.967 -0.859 69 HA ASP 10 HA ASP 10 8.234 -13.737 1.551 70 HB2 ASP 10 HB2 ASP 10 9.840 -11.666 0.084 71 HB3 ASP 10 HB1 ASP 10 9.397 -11.516 1.778 72 H ILE 11 HN ILE 11 7.291 -12.155 -1.347 73 HA ILE 11 HA ILE 11 5.702 -10.123 -0.159 74 HB ILE 11 HB ILE 11 6.117 -11.250 -2.828 75 HG12 ILE 11 HG12 ILE 11 5.598 -8.446 -1.867 76 HG13 ILE 11 HG11 ILE 11 7.178 -9.196 -2.082 77 HG21 ILE 11 HG21 ILE 11 4.082 -9.925 -3.696 78 HG22 ILE 11 HG22 ILE 11 3.457 -10.325 -2.106 79 HG23 ILE 11 HG23 ILE 11 3.931 -11.607 -3.194 80 HD11 ILE 11 HD13 ILE 11 7.183 -8.851 -4.278 81 HD12 ILE 11 HD11 ILE 11 5.910 -7.679 -3.939 82 HD13 ILE 11 HD12 ILE 11 5.495 -9.317 -4.444 83 H ALA 12 HN ALA 12 4.948 -13.338 -1.464 84 HA ALA 12 HA ALA 12 2.204 -13.342 -0.884 85 HB1 ALA 12 HB3 ALA 12 3.795 -15.081 -2.139 86 HB2 ALA 12 HB1 ALA 12 2.217 -15.535 -1.491 87 HB3 ALA 12 HB2 ALA 12 3.680 -15.886 -0.574 88 H ALA 13 HN ALA 13 4.909 -14.645 1.049 89 HA ALA 13 HA ALA 13 3.297 -15.319 3.260 90 HB1 ALA 13 HB3 ALA 13 5.686 -16.060 2.816 91 HB2 ALA 13 HB1 ALA 13 5.312 -15.606 4.479 92 HB3 ALA 13 HB2 ALA 13 6.186 -14.485 3.436 93 H ALA 14 HN ALA 14 5.428 -12.572 2.733 94 HA ALA 14 HA ALA 14 4.915 -10.995 4.872 95 HB1 ALA 14 HB3 ALA 14 6.470 -10.173 3.300 96 HB2 ALA 14 HB1 ALA 14 5.166 -8.988 3.329 97 HB3 ALA 14 HB2 ALA 14 5.274 -10.148 1.999 98 H LEU 15 HN LEU 15 2.887 -11.221 1.972 99 HA LEU 15 HA LEU 15 0.927 -9.396 3.027 100 HG LEU 15 HG LEU 15 -0.322 -8.390 0.816 101 HB2 LEU 15 HB2 LEU 15 1.492 -9.848 0.557 102 HB3 LEU 15 HB1 LEU 15 0.497 -11.275 0.726 103 HD11 LEU 15 HD11 LEU 15 -1.410 -10.780 -0.660 104 HD12 LEU 15 HD12 LEU 15 -0.344 -9.551 -1.333 105 HD13 LEU 15 HD13 LEU 15 -1.971 -9.116 -0.814 106 HD21 LEU 15 HD23 LEU 15 -1.286 -9.452 2.812 107 HD22 LEU 15 HD21 LEU 15 -2.022 -10.682 1.783 108 HD23 LEU 15 HD22 LEU 15 -2.506 -8.993 1.628 109 H GLN 16 HN GLN 16 1.015 -12.910 2.356 110 HA GLN 16 HA GLN 16 -1.593 -13.477 3.271 111 HB2 GLN 16 HB2 GLN 16 0.830 -15.146 2.657 112 HB3 GLN 16 HB1 GLN 16 -0.701 -15.831 3.169 113 HG2 GLN 16 HG2 GLN 16 0.012 -15.538 0.626 114 HG3 GLN 16 HG1 GLN 16 -1.663 -15.531 1.175 115 HE21 GLN 16 HE21 GLN 16 -2.685 -13.461 1.453 116 HE22 GLN 16 HE22 GLN 16 -2.184 -12.124 0.485 117 H GLU 17 HN GLU 17 1.073 -12.607 5.128 118 HA GLU 17 HA GLU 17 1.190 -14.725 6.984 119 HB2 GLU 17 HB2 GLU 17 3.031 -13.321 7.037 120 HB3 GLU 17 HB1 GLU 17 2.060 -11.862 6.972 121 HG2 GLU 17 HG2 GLU 17 1.456 -12.116 9.284 122 HG3 GLU 17 HG1 GLU 17 2.257 -13.681 9.352 123 H CYS 18 HN CYS 18 0.016 -11.465 7.807 124 HA CYS 18 HA CYS 18 -1.954 -12.680 9.569 125 HG CYS 18 HG CYS 18 -0.514 -10.681 12.564 126 HB2 CYS 18 HB2 CYS 18 -0.276 -10.265 9.634 127 HB3 CYS 18 HB1 CYS 18 -1.871 -10.135 10.354 128 H GLN 19 HN GLN 19 -2.050 -11.647 6.532 129 HA GLN 19 HA GLN 19 -3.506 -9.351 6.271 130 HB2 GLN 19 HB2 GLN 19 -2.678 -10.894 4.443 131 HB3 GLN 19 HB1 GLN 19 -4.134 -11.829 4.688 132 HG2 GLN 19 HG2 GLN 19 -5.412 -9.697 4.223 133 HG3 GLN 19 HG1 GLN 19 -3.878 -9.022 3.686 134 HE21 GLN 19 HE21 GLN 19 -4.496 -8.752 1.563 135 HE22 GLN 19 HE22 GLN 19 -4.771 -10.085 0.496 136 H ASP 20 HN ASP 20 -5.530 -8.681 6.310 137 HA ASP 20 HA ASP 20 -7.922 -9.959 6.459 138 HB2 ASP 20 HB2 ASP 20 -7.191 -11.191 8.440 139 HB3 ASP 20 HB1 ASP 20 -6.751 -9.689 9.227 140 HA PRO 21 HA PRO 21 -9.015 -5.670 6.468 141 HB2 PRO 21 HB2 PRO 21 -11.598 -5.887 7.222 142 HB3 PRO 21 HB1 PRO 21 -11.048 -6.214 5.590 143 HG2 PRO 21 HG2 PRO 21 -11.624 -8.118 7.829 144 HG3 PRO 21 HG1 PRO 21 -12.060 -8.243 6.112 145 HD2 PRO 21 HD2 PRO 21 -9.972 -9.575 7.103 146 HD3 PRO 21 HD1 PRO 21 -9.921 -8.849 5.487 147 H ASP 22 HN ASP 22 -7.532 -5.478 8.331 148 HA ASP 22 HA ASP 22 -8.255 -3.925 10.352 149 HB2 ASP 22 HB2 ASP 22 -9.934 -5.283 11.256 150 HB3 ASP 22 HB1 ASP 22 -8.966 -6.730 11.064 151 H THR 23 HN THR 23 -6.260 -6.467 9.232 152 HA THR 23 HA THR 23 -4.216 -5.970 11.278 153 HB THR 23 HB THR 23 -4.802 -8.323 10.824 154 HG1 THR 23 HG1 THR 23 -2.640 -7.809 11.442 155 HG21 THR 23 HG23 THR 23 -3.455 -8.520 8.272 156 HG22 THR 23 HG21 THR 23 -4.865 -7.469 8.177 157 HG23 THR 23 HG22 THR 23 -5.036 -9.116 8.756 158 H PHE 24 HN PHE 24 -4.974 -4.309 8.811 159 HA PHE 24 HA PHE 24 -3.960 -3.239 7.050 160 HD1 PHE 24 HD2 PHE 24 -1.803 -4.304 10.477 161 HD2 PHE 24 HD1 PHE 24 -0.062 -1.769 7.524 162 HE1 PHE 24 HE2 PHE 24 0.439 -4.935 11.263 163 HE2 PHE 24 HE1 PHE 24 2.181 -2.403 8.313 164 HZ PHE 24 HZ PHE 24 2.434 -3.983 10.181 165 HB2 PHE 24 HB2 PHE 24 -2.344 -1.754 7.837 166 HB3 PHE 24 HB1 PHE 24 -3.036 -2.320 9.334 167 H GLU 25 HN GLU 25 -3.709 -4.560 5.416 168 HA GLU 25 HA GLU 25 -1.765 -6.681 5.319 169 HB2 GLU 25 HB2 GLU 25 -3.587 -5.795 3.119 170 HB3 GLU 25 HB1 GLU 25 -2.903 -7.390 3.385 171 HG2 GLU 25 HG2 GLU 25 -4.306 -7.739 5.269 172 HG3 GLU 25 HG1 GLU 25 -4.862 -6.071 5.225 173 HA PRO 26 HA PRO 26 -0.418 -4.258 1.325 174 HB2 PRO 26 HB2 PRO 26 -0.575 -1.512 1.599 175 HB3 PRO 26 HB1 PRO 26 -1.700 -2.523 0.701 176 HG2 PRO 26 HG2 PRO 26 -1.974 -1.321 3.362 177 HG3 PRO 26 HG1 PRO 26 -3.210 -1.698 2.171 178 HD2 PRO 26 HD2 PRO 26 -2.769 -3.152 4.432 179 HD3 PRO 26 HD1 PRO 26 -3.510 -3.815 2.973 180 H GLN 27 HN GLN 27 0.047 -2.055 4.101 181 HA GLN 27 HA GLN 27 2.663 -1.386 3.519 182 HB2 GLN 27 HB2 GLN 27 1.627 -0.014 5.038 183 HB3 GLN 27 HB1 GLN 27 0.875 -1.350 5.885 184 HG2 GLN 27 HG2 GLN 27 2.372 -0.486 7.378 185 HG3 GLN 27 HG1 GLN 27 3.181 -1.900 6.732 186 HE21 GLN 27 HE21 GLN 27 3.104 1.552 6.864 187 HE22 GLN 27 HE22 GLN 27 4.663 1.833 6.168 188 H LYS 28 HN LYS 28 1.342 -4.219 5.069 189 HA LYS 28 HA LYS 28 3.759 -5.161 6.230 190 HB2 LYS 28 HB2 LYS 28 1.063 -6.313 5.602 191 HB3 LYS 28 HB1 LYS 28 2.369 -7.336 6.129 192 HG2 LYS 28 HG2 LYS 28 2.014 -5.007 7.804 193 HG3 LYS 28 HG1 LYS 28 0.606 -6.066 7.764 194 HD2 LYS 28 HD2 LYS 28 2.060 -6.723 9.580 195 HD3 LYS 28 HD1 LYS 28 2.079 -7.971 8.333 196 HE2 LYS 28 HE2 LYS 28 4.326 -7.566 9.142 197 HE3 LYS 28 HE1 LYS 28 4.182 -7.046 7.464 198 HZ1 LYS 28 HZ3 LYS 28 5.393 -5.444 8.829 199 HZ2 LYS 28 HZ1 LYS 28 4.036 -5.249 9.823 200 HZ3 LYS 28 HZ2 LYS 28 3.973 -4.772 8.201 201 H PHE 29 HN PHE 29 1.952 -5.850 3.287 202 HA PHE 29 HA PHE 29 3.475 -7.840 2.137 203 HD1 PHE 29 HD1 PHE 29 4.286 -5.712 -0.717 204 HD2 PHE 29 HD2 PHE 29 0.994 -8.377 -0.602 205 HE1 PHE 29 HE1 PHE 29 4.777 -6.409 -3.008 206 HE2 PHE 29 HE2 PHE 29 1.482 -9.098 -2.890 207 HZ PHE 29 HZ PHE 29 3.377 -8.109 -4.101 208 HB2 PHE 29 HB2 PHE 29 1.358 -7.086 1.205 209 HB3 PHE 29 HB1 PHE 29 2.023 -5.497 0.877 210 H PHE 30 HN PHE 30 3.827 -4.358 1.925 211 HA PHE 30 HA PHE 30 6.061 -4.359 0.175 212 HD1 PHE 30 HD1 PHE 30 4.040 -3.910 -0.847 213 HD2 PHE 30 HD2 PHE 30 3.601 -0.676 1.886 214 HE1 PHE 30 HE1 PHE 30 1.741 -3.546 -1.642 215 HE2 PHE 30 HE2 PHE 30 1.306 -0.303 1.085 216 HZ PHE 30 HZ PHE 30 0.373 -1.741 -0.682 217 HB2 PHE 30 HB2 PHE 30 5.436 -2.121 2.067 218 HB3 PHE 30 HB1 PHE 30 6.054 -2.034 0.420 219 H GLN 31 HN GLN 31 5.793 -3.551 3.619 220 HA GLN 31 HA GLN 31 8.485 -3.182 4.094 221 HB2 GLN 31 HB2 GLN 31 6.519 -2.575 5.567 222 HB3 GLN 31 HB1 GLN 31 6.591 -4.231 6.162 223 HG2 GLN 31 HG2 GLN 31 7.786 -2.530 7.567 224 HG3 GLN 31 HG1 GLN 31 8.763 -3.907 7.058 225 HE21 GLN 31 HE21 GLN 31 10.256 -3.618 5.343 226 HE22 GLN 31 HE22 GLN 31 10.885 -2.058 4.958 227 H THR 32 HN THR 32 6.700 -6.016 5.250 228 HA THR 32 HA THR 32 8.818 -7.449 6.195 229 HB THR 32 HB THR 32 6.418 -8.587 4.763 230 HG1 THR 32 HG1 THR 32 5.383 -8.323 6.625 231 HG21 THR 32 HG23 THR 32 8.289 -9.873 6.755 232 HG22 THR 32 HG21 THR 32 8.197 -10.251 5.034 233 HG23 THR 32 HG22 THR 32 6.828 -10.604 6.090 234 H SER 33 HN SER 33 7.514 -7.780 2.892 235 HA SER 33 HA SER 33 9.719 -9.491 2.134 236 HG SER 33 HG SER 33 9.370 -9.265 -0.637 237 HB2 SER 33 HB2 SER 33 7.475 -9.983 1.338 238 HB3 SER 33 HB1 SER 33 7.431 -8.454 0.472 239 H GLY 34 HN GLY 34 8.517 -6.350 0.973 240 HA2 GLY 34 HA2 GLY 34 11.001 -6.140 -0.560 241 HA3 GLY 34 HA1 GLY 34 9.578 -5.174 -0.835 242 H LEU 35 HN LEU 35 9.110 -3.658 1.170 243 HA LEU 35 HA LEU 35 10.926 -1.613 1.007 244 HG LEU 35 HG LEU 35 9.767 0.454 2.022 245 HB2 LEU 35 HB2 LEU 35 8.542 -2.265 2.464 246 HB3 LEU 35 HB1 LEU 35 9.670 -1.448 3.539 247 HD11 LEU 35 HD11 LEU 35 7.865 -1.137 0.311 248 HD12 LEU 35 HD12 LEU 35 9.536 -0.735 -0.084 249 HD13 LEU 35 HD13 LEU 35 8.328 0.540 0.044 250 HD21 LEU 35 HD23 LEU 35 6.877 -0.282 2.388 251 HD22 LEU 35 HD21 LEU 35 7.609 1.323 2.419 252 HD23 LEU 35 HD22 LEU 35 7.919 0.185 3.732 253 H SER 36 HN SER 36 10.927 -4.366 3.109 254 HA SER 36 HA SER 36 12.419 -3.991 5.189 255 HG SER 36 HG SER 36 13.292 -7.183 2.835 256 HB2 SER 36 HB2 SER 36 13.589 -6.131 4.835 257 HB3 SER 36 HB1 SER 36 11.882 -6.224 4.398 258 H LYS 37 HN LYS 37 14.113 -4.108 1.996 259 HA LYS 37 HA LYS 37 16.099 -2.291 3.094 260 HB2 LYS 37 HB2 LYS 37 16.823 -5.099 2.291 261 HB3 LYS 37 HB1 LYS 37 17.996 -3.816 2.520 262 HG2 LYS 37 HG2 LYS 37 16.129 -4.822 4.639 263 HG3 LYS 37 HG1 LYS 37 17.810 -5.312 4.458 264 HD2 LYS 37 HD2 LYS 37 18.555 -3.048 4.850 265 HD3 LYS 37 HD1 LYS 37 16.886 -2.475 4.900 266 HE2 LYS 37 HE2 LYS 37 17.911 -2.752 7.144 267 HE3 LYS 37 HE1 LYS 37 16.457 -3.721 6.907 268 HZ1 LYS 37 HZ3 LYS 37 17.821 -5.652 6.514 269 HZ2 LYS 37 HZ1 LYS 37 18.245 -4.960 7.999 270 HZ3 LYS 37 HZ2 LYS 37 19.236 -4.737 6.647 271 H MET 38 HN MET 38 14.451 -1.719 0.995 272 HA MET 38 HA MET 38 16.203 -1.957 -1.347 273 HB2 MET 38 HB2 MET 38 13.459 -0.998 -1.763 274 HB3 MET 38 HB1 MET 38 14.393 -2.182 -2.656 275 HG2 MET 38 HG2 MET 38 13.129 -2.727 -0.003 276 HG3 MET 38 HG1 MET 38 12.352 -3.064 -1.542 277 HE1 MET 38 HE3 MET 38 13.472 -6.342 -2.545 278 HE2 MET 38 HE1 MET 38 13.849 -4.874 -3.452 279 HE3 MET 38 HE2 MET 38 12.329 -4.997 -2.567 280 H SER 39 HN SER 39 16.257 -0.116 -2.809 281 HA SER 39 HA SER 39 16.745 2.314 -1.429 282 HG SER 39 HG SER 39 18.698 1.233 -4.226 283 HB2 SER 39 HB2 SER 39 16.634 1.740 -4.397 284 HB3 SER 39 HB1 SER 39 17.263 3.218 -3.672 285 H ALA 40 HN ALA 40 15.819 4.413 -2.190 286 HA ALA 40 HA ALA 40 13.021 4.460 -1.720 287 HB1 ALA 40 HB3 ALA 40 14.736 6.636 -2.924 288 HB2 ALA 40 HB1 ALA 40 14.529 6.346 -1.197 289 HB3 ALA 40 HB2 ALA 40 13.151 6.834 -2.180 290 H SER 41 HN SER 41 14.981 4.675 -4.649 291 HA SER 41 HA SER 41 13.062 5.366 -6.494 292 HG SER 41 HG SER 41 15.084 6.257 -7.591 293 HB2 SER 41 HB2 SER 41 15.465 3.566 -6.792 294 HB3 SER 41 HB1 SER 41 14.512 4.160 -8.151 295 H GLN 42 HN GLN 42 14.084 2.023 -5.726 296 HA GLN 42 HA GLN 42 12.227 0.783 -7.398 297 HB2 GLN 42 HB2 GLN 42 12.804 -1.237 -6.392 298 HB3 GLN 42 HB1 GLN 42 14.236 -0.242 -6.213 299 HG2 GLN 42 HG2 GLN 42 14.213 -0.732 -4.059 300 HG3 GLN 42 HG1 GLN 42 12.734 0.219 -3.918 301 HE21 GLN 42 HE21 GLN 42 10.796 -0.808 -3.664 302 HE22 GLN 42 HE22 GLN 42 10.643 -2.512 -3.447 303 H VAL 43 HN VAL 43 11.927 2.060 -4.226 304 HA VAL 43 HA VAL 43 9.515 0.862 -3.438 305 HB VAL 43 HB VAL 43 10.426 3.660 -2.767 306 HG11 VAL 43 HG11 VAL 43 8.482 1.890 -1.311 307 HG12 VAL 43 HG12 VAL 43 8.013 3.196 -2.395 308 HG13 VAL 43 HG13 VAL 43 8.907 3.555 -0.916 309 HG21 VAL 43 HG23 VAL 43 11.748 1.369 -2.195 310 HG22 VAL 43 HG21 VAL 43 10.668 1.478 -0.806 311 HG23 VAL 43 HG22 VAL 43 11.773 2.801 -1.169 312 H LYS 44 HN LYS 44 10.226 3.456 -5.617 313 HA LYS 44 HA LYS 44 7.763 4.662 -5.988 314 HB2 LYS 44 HB2 LYS 44 9.806 3.946 -8.102 315 HB3 LYS 44 HB1 LYS 44 8.503 5.103 -8.312 316 HG2 LYS 44 HG2 LYS 44 9.490 6.658 -6.902 317 HG3 LYS 44 HG1 LYS 44 10.498 5.441 -6.122 318 HD2 LYS 44 HD2 LYS 44 11.715 6.971 -7.681 319 HD3 LYS 44 HD1 LYS 44 11.906 5.259 -8.032 320 HE2 LYS 44 HE2 LYS 44 11.536 6.632 -10.048 321 HE3 LYS 44 HE1 LYS 44 10.307 5.398 -9.799 322 HZ1 LYS 44 HZ3 LYS 44 9.308 7.489 -10.450 323 HZ2 LYS 44 HZ1 LYS 44 10.028 8.277 -9.136 324 HZ3 LYS 44 HZ2 LYS 44 8.848 7.095 -8.871 325 H ASP 45 HN ASP 45 9.084 1.842 -7.669 326 HA ASP 45 HA ASP 45 6.809 1.299 -9.228 327 HB2 ASP 45 HB2 ASP 45 9.393 0.338 -9.045 328 HB3 ASP 45 HB1 ASP 45 8.421 -1.020 -8.509 329 H ILE 46 HN ILE 46 7.954 0.210 -6.097 330 HA ILE 46 HA ILE 46 6.098 -1.771 -5.547 331 HB ILE 46 HB ILE 46 7.864 0.028 -4.007 332 HG12 ILE 46 HG12 ILE 46 8.788 -2.043 -3.244 333 HG13 ILE 46 HG11 ILE 46 7.418 -2.937 -3.879 334 HG21 ILE 46 HG21 ILE 46 5.568 -1.438 -2.741 335 HG22 ILE 46 HG22 ILE 46 6.085 0.231 -2.498 336 HG23 ILE 46 HG23 ILE 46 7.054 -1.094 -1.856 337 HD11 ILE 46 HD13 ILE 46 8.135 -2.100 -6.162 338 HD12 ILE 46 HD11 ILE 46 9.163 -3.306 -5.388 339 HD13 ILE 46 HD12 ILE 46 9.636 -1.612 -5.379 340 H PHE 47 HN PHE 47 6.058 1.611 -4.472 341 HA PHE 47 HA PHE 47 3.625 1.765 -3.328 342 HD1 PHE 47 HD2 PHE 47 3.469 3.375 -1.757 343 HD2 PHE 47 HD1 PHE 47 3.004 5.530 -5.382 344 HE1 PHE 47 HE2 PHE 47 1.702 4.710 -0.721 345 HE2 PHE 47 HE1 PHE 47 1.198 6.868 -4.354 346 HZ PHE 47 HZ PHE 47 0.562 6.446 -2.023 347 HB2 PHE 47 HB2 PHE 47 5.296 3.601 -3.591 348 HB3 PHE 47 HB1 PHE 47 4.649 3.883 -5.203 349 H ARG 48 HN ARG 48 4.259 1.579 -6.747 350 HA ARG 48 HA ARG 48 1.834 2.443 -7.769 351 HE ARG 48 HE ARG 48 4.442 4.596 -11.013 352 HB2 ARG 48 HB2 ARG 48 3.528 0.167 -8.811 353 HB3 ARG 48 HB1 ARG 48 2.294 1.029 -9.718 354 HG2 ARG 48 HG2 ARG 48 4.859 2.178 -8.646 355 HG3 ARG 48 HG1 ARG 48 4.467 1.851 -10.336 356 HD2 ARG 48 HD2 ARG 48 2.598 3.470 -10.163 357 HD3 ARG 48 HD1 ARG 48 3.116 3.857 -8.523 358 HH11 ARG 48 HH11 ARG 48 4.569 4.535 -7.516 359 HH12 ARG 48 HH12 ARG 48 5.753 5.792 -7.423 360 HH21 ARG 48 HH21 ARG 48 5.998 6.240 -10.876 361 HH22 ARG 48 HH22 ARG 48 6.565 6.757 -9.323 362 H PHE 49 HN PHE 49 2.548 -0.408 -5.944 363 HA PHE 49 HA PHE 49 0.433 -2.050 -6.727 364 HD1 PHE 49 HD2 PHE 49 0.742 -4.720 -5.988 365 HD2 PHE 49 HD1 PHE 49 -0.104 -2.429 -2.494 366 HE1 PHE 49 HE2 PHE 49 -0.762 -6.493 -5.187 367 HE2 PHE 49 HE1 PHE 49 -1.604 -4.200 -1.695 368 HZ PHE 49 HZ PHE 49 -1.937 -6.235 -3.040 369 HB2 PHE 49 HB2 PHE 49 2.207 -2.859 -5.251 370 HB3 PHE 49 HB1 PHE 49 1.686 -1.785 -3.969 371 H ILE 50 HN ILE 50 0.496 0.098 -3.845 372 HA ILE 50 HA ILE 50 -2.377 0.096 -3.758 373 HB ILE 50 HB ILE 50 -2.079 1.909 -2.016 374 HG12 ILE 50 HG12 ILE 50 0.827 1.091 -2.244 375 HG13 ILE 50 HG11 ILE 50 0.163 2.674 -2.658 376 HG21 ILE 50 HG21 ILE 50 -1.227 -0.913 -1.803 377 HG22 ILE 50 HG22 ILE 50 -2.606 -0.065 -1.090 378 HG23 ILE 50 HG23 ILE 50 -0.989 0.139 -0.406 379 HD11 ILE 50 HD13 ILE 50 0.448 1.415 0.051 380 HD12 ILE 50 HD11 ILE 50 -0.610 2.795 -0.239 381 HD13 ILE 50 HD12 ILE 50 1.123 2.938 -0.535 382 H ASP 51 HN ASP 51 -3.737 1.516 -4.536 383 HA ASP 51 HA ASP 51 -4.332 2.908 -6.302 384 HB2 ASP 51 HB2 ASP 51 -3.905 5.309 -4.929 385 HB3 ASP 51 HB1 ASP 51 -5.348 4.319 -4.947 386 H ASN 52 HN ASN 52 -3.581 3.525 -8.098 387 HA ASN 52 HA ASN 52 -0.824 4.419 -8.406 388 HB2 ASN 52 HB2 ASN 52 -1.835 2.586 -9.844 389 HB3 ASN 52 HB1 ASN 52 -2.783 3.837 -10.622 390 HD21 ASN 52 HD21 ASN 52 -1.735 5.408 -11.813 391 HD22 ASN 52 HD22 ASN 52 -0.156 5.154 -12.476 392 H ASP 53 HN ASP 53 -2.357 6.292 -7.191 393 HA ASP 53 HA ASP 53 -2.573 8.573 -7.285 394 HB2 ASP 53 HB2 ASP 53 -2.284 8.472 -10.287 395 HB3 ASP 53 HB1 ASP 53 -2.030 9.844 -9.216 396 H GLN 54 HN GLN 54 -4.151 10.165 -8.204 397 HA GLN 54 HA GLN 54 -6.386 9.218 -9.652 398 HB2 GLN 54 HB2 GLN 54 -7.884 9.760 -7.498 399 HB3 GLN 54 HB1 GLN 54 -7.363 8.139 -7.924 400 HG2 GLN 54 HG2 GLN 54 -5.397 9.497 -6.289 401 HG3 GLN 54 HG1 GLN 54 -6.979 9.441 -5.513 402 HE21 GLN 54 HE21 GLN 54 -6.163 8.039 -3.958 403 HE22 GLN 54 HE22 GLN 54 -5.885 6.367 -4.278 404 H SER 55 HN SER 55 -5.236 11.595 -7.282 405 HA SER 55 HA SER 55 -6.054 13.738 -9.041 406 HG SER 55 HG SER 55 -9.192 13.274 -7.362 407 HB2 SER 55 HB2 SER 55 -7.258 13.539 -6.272 408 HB3 SER 55 HB1 SER 55 -7.462 14.883 -7.394 409 H GLY 56 HN GLY 56 -3.493 13.141 -8.412 410 HA2 GLY 56 HA2 GLY 56 -1.685 14.590 -7.910 411 HA3 GLY 56 HA1 GLY 56 -2.749 15.485 -6.827 412 H TYR 57 HN TYR 57 -3.671 12.951 -5.613 413 HA TYR 57 HA TYR 57 -1.422 11.745 -4.303 414 HD1 TYR 57 HD1 TYR 57 -4.644 14.242 -2.929 415 HD2 TYR 57 HD2 TYR 57 -0.563 15.258 -3.424 416 HE1 TYR 57 HE1 TYR 57 -5.295 16.579 -3.411 417 HE2 TYR 57 HE2 TYR 57 -1.179 17.596 -3.888 418 HH TYR 57 HH TYR 57 -3.093 18.874 -4.660 419 HB2 TYR 57 HB2 TYR 57 -2.909 12.818 -2.115 420 HB3 TYR 57 HB1 TYR 57 -1.231 13.124 -2.508 421 H LEU 58 HN LEU 58 -2.240 10.279 -2.541 422 HA LEU 58 HA LEU 58 -4.889 9.288 -3.334 423 HG LEU 58 HG LEU 58 -1.658 8.412 -3.564 424 HB2 LEU 58 HB2 LEU 58 -3.019 7.726 -1.608 425 HB3 LEU 58 HB1 LEU 58 -4.250 7.152 -2.712 426 HD11 LEU 58 HD11 LEU 58 -1.931 5.960 -2.446 427 HD12 LEU 58 HD12 LEU 58 -0.695 6.391 -3.611 428 HD13 LEU 58 HD13 LEU 58 -2.164 5.591 -4.153 429 HD21 LEU 58 HD23 LEU 58 -2.277 7.468 -5.756 430 HD22 LEU 58 HD21 LEU 58 -3.283 8.807 -5.217 431 HD23 LEU 58 HD22 LEU 58 -3.874 7.162 -5.103 432 H ASP 59 HN ASP 59 -6.361 8.585 -1.622 433 HA ASP 59 HA ASP 59 -5.710 9.584 1.035 434 HB2 ASP 59 HB2 ASP 59 -6.660 11.476 -0.278 435 HB3 ASP 59 HB1 ASP 59 -8.152 10.550 -0.453 436 H GLY 60 HN GLY 60 -7.296 9.072 2.643 437 HA2 GLY 60 HA2 GLY 60 -7.779 6.435 2.953 438 HA3 GLY 60 HA1 GLY 60 -8.767 7.666 3.718 439 H ASP 61 HN ASP 61 -9.794 8.571 1.029 440 HA ASP 61 HA ASP 61 -12.053 6.757 1.012 441 HB2 ASP 61 HB2 ASP 61 -11.672 8.933 -1.003 442 HB3 ASP 61 HB1 ASP 61 -13.165 8.335 -0.288 443 H GLU 62 HN GLU 62 -9.428 7.716 -1.086 444 HA GLU 62 HA GLU 62 -10.235 6.058 -3.273 445 HB2 GLU 62 HB2 GLU 62 -7.581 7.399 -2.819 446 HB3 GLU 62 HB1 GLU 62 -8.252 6.847 -4.352 447 HG2 GLU 62 HG2 GLU 62 -9.518 8.968 -2.668 448 HG3 GLU 62 HG1 GLU 62 -8.340 9.318 -3.928 449 H LEU 63 HN LEU 63 -8.134 5.749 -0.516 450 HA LEU 63 HA LEU 63 -6.296 3.875 -1.240 451 HG LEU 63 HG LEU 63 -6.562 6.060 1.077 452 HB2 LEU 63 HB2 LEU 63 -7.858 4.096 1.333 453 HB3 LEU 63 HB1 LEU 63 -6.466 3.061 1.144 454 HD11 LEU 63 HD11 LEU 63 -4.477 4.776 2.613 455 HD12 LEU 63 HD12 LEU 63 -6.091 4.278 3.117 456 HD13 LEU 63 HD13 LEU 63 -5.660 5.989 3.098 457 HD21 LEU 63 HD23 LEU 63 -4.399 4.240 0.069 458 HD22 LEU 63 HD21 LEU 63 -4.072 5.886 0.609 459 HD23 LEU 63 HD22 LEU 63 -5.157 5.608 -0.757 460 H LYS 64 HN LYS 64 -9.636 3.158 -0.184 461 HA LYS 64 HA LYS 64 -9.589 0.444 -0.365 462 HB2 LYS 64 HB2 LYS 64 -11.874 2.240 -1.157 463 HB3 LYS 64 HB1 LYS 64 -11.975 0.605 -0.546 464 HG2 LYS 64 HG2 LYS 64 -11.891 1.275 1.562 465 HG3 LYS 64 HG1 LYS 64 -10.485 2.286 1.227 466 HD2 LYS 64 HD2 LYS 64 -12.263 3.690 2.024 467 HD3 LYS 64 HD1 LYS 64 -12.005 4.016 0.312 468 HE2 LYS 64 HE2 LYS 64 -14.385 3.898 0.870 469 HE3 LYS 64 HE1 LYS 64 -13.913 2.637 -0.266 470 HZ1 LYS 64 HZ3 LYS 64 -15.369 1.796 1.480 471 HZ2 LYS 64 HZ1 LYS 64 -14.253 2.269 2.662 472 HZ3 LYS 64 HZ2 LYS 64 -13.848 1.058 1.552 473 H TYR 65 HN TYR 65 -9.282 2.625 -2.978 474 HA TYR 65 HA TYR 65 -10.427 0.952 -5.004 475 HD1 TYR 65 HD1 TYR 65 -11.687 2.402 -4.159 476 HD2 TYR 65 HD2 TYR 65 -9.565 5.315 -6.408 477 HE1 TYR 65 HE1 TYR 65 -13.460 4.061 -3.682 478 HE2 TYR 65 HE2 TYR 65 -11.339 6.959 -5.975 479 HH TYR 65 HH TYR 65 -13.754 6.482 -3.629 480 HB2 TYR 65 HB2 TYR 65 -8.460 3.224 -5.343 481 HB3 TYR 65 HB1 TYR 65 -9.426 2.487 -6.613 482 H PHE 66 HN PHE 66 -7.382 0.989 -3.398 483 HA PHE 66 HA PHE 66 -5.609 0.132 -5.288 484 HD1 PHE 66 HD2 PHE 66 -4.012 -2.637 -4.038 485 HD2 PHE 66 HD1 PHE 66 -6.204 -1.003 -0.796 486 HE1 PHE 66 HE2 PHE 66 -3.777 -4.764 -2.801 487 HE2 PHE 66 HE1 PHE 66 -5.963 -3.110 0.444 488 HZ PHE 66 HZ PHE 66 -4.755 -4.997 -0.564 489 HB2 PHE 66 HB2 PHE 66 -4.271 -0.062 -3.507 490 HB3 PHE 66 HB1 PHE 66 -5.646 0.364 -2.523 491 H LEU 67 HN LEU 67 -7.732 -2.030 -3.371 492 HA LEU 67 HA LEU 67 -6.997 -4.391 -4.690 493 HG LEU 67 HG LEU 67 -7.644 -4.077 -1.749 494 HB2 LEU 67 HB2 LEU 67 -9.464 -3.520 -3.228 495 HB3 LEU 67 HB1 LEU 67 -9.397 -5.096 -3.990 496 HD11 LEU 67 HD11 LEU 67 -9.727 -6.242 -1.936 497 HD12 LEU 67 HD12 LEU 67 -9.764 -4.788 -0.934 498 HD13 LEU 67 HD13 LEU 67 -8.606 -6.073 -0.585 499 HD21 LEU 67 HD23 LEU 67 -7.433 -6.595 -3.386 500 HD22 LEU 67 HD21 LEU 67 -6.657 -6.381 -1.817 501 HD23 LEU 67 HD22 LEU 67 -6.211 -5.341 -3.171 502 H GLN 68 HN GLN 68 -9.330 -1.944 -5.360 503 HA GLN 68 HA GLN 68 -10.809 -3.199 -7.352 504 HB2 GLN 68 HB2 GLN 68 -10.468 -0.487 -6.301 505 HB3 GLN 68 HB1 GLN 68 -10.980 -0.546 -7.976 506 HG2 GLN 68 HG2 GLN 68 -12.841 -1.930 -7.394 507 HG3 GLN 68 HG1 GLN 68 -12.321 -1.987 -5.723 508 HE21 GLN 68 HE21 GLN 68 -12.682 -0.283 -4.392 509 HE22 GLN 68 HE22 GLN 68 -13.679 1.065 -4.818 510 H LYS 69 HN LYS 69 -7.867 -1.261 -7.478 511 HA LYS 69 HA LYS 69 -7.434 -0.933 -10.103 512 HB2 LYS 69 HB2 LYS 69 -5.460 -1.907 -8.039 513 HB3 LYS 69 HB1 LYS 69 -5.018 -1.196 -9.574 514 HG2 LYS 69 HG2 LYS 69 -6.519 0.128 -7.313 515 HG3 LYS 69 HG1 LYS 69 -4.837 0.436 -7.776 516 HD2 LYS 69 HD2 LYS 69 -7.352 1.121 -9.262 517 HD3 LYS 69 HD1 LYS 69 -6.121 2.220 -8.652 518 HE2 LYS 69 HE2 LYS 69 -5.786 0.240 -10.904 519 HE3 LYS 69 HE1 LYS 69 -5.940 1.989 -11.067 520 HZ1 LYS 69 HZ3 LYS 69 -3.729 0.570 -9.680 521 HZ2 LYS 69 HZ1 LYS 69 -3.874 2.249 -9.842 522 HZ3 LYS 69 HZ2 LYS 69 -3.635 1.284 -11.210 523 H PHE 70 HN PHE 70 -6.089 -3.653 -8.331 524 HA PHE 70 HA PHE 70 -5.313 -5.062 -10.621 525 HD1 PHE 70 HD2 PHE 70 -3.166 -4.371 -9.529 526 HD2 PHE 70 HD1 PHE 70 -5.145 -5.739 -6.021 527 HE1 PHE 70 HE2 PHE 70 -1.620 -3.047 -8.144 528 HE2 PHE 70 HE1 PHE 70 -3.609 -4.424 -4.639 529 HZ PHE 70 HZ PHE 70 -1.840 -3.079 -5.690 530 HB2 PHE 70 HB2 PHE 70 -5.892 -6.446 -8.041 531 HB3 PHE 70 HB1 PHE 70 -4.604 -6.696 -9.201 532 H GLN 71 HN GLN 71 -8.250 -5.074 -8.716 533 HA GLN 71 HA GLN 71 -9.570 -6.518 -10.874 534 HB2 GLN 71 HB2 GLN 71 -10.747 -7.929 -9.101 535 HB3 GLN 71 HB1 GLN 71 -9.089 -8.350 -9.493 536 HG2 GLN 71 HG2 GLN 71 -8.847 -8.383 -7.276 537 HG3 GLN 71 HG1 GLN 71 -8.657 -6.646 -7.487 538 HE21 GLN 71 HE21 GLN 71 -9.462 -5.933 -5.650 539 HE22 GLN 71 HE22 GLN 71 -11.083 -6.167 -5.110 540 H SER 72 HN SER 72 -11.132 -5.265 -11.419 541 HA SER 72 HA SER 72 -12.106 -3.120 -9.814 542 HG SER 72 HG SER 72 -14.043 -4.368 -13.007 543 HB2 SER 72 HB2 SER 72 -13.716 -2.779 -11.692 544 HB3 SER 72 HB1 SER 72 -12.030 -2.807 -12.205 545 H ASP 73 HN ASP 73 -12.582 -4.910 -8.110 546 HA ASP 73 HA ASP 73 -15.471 -5.257 -8.196 547 HB2 ASP 73 HB2 ASP 73 -14.688 -7.382 -9.044 548 HB3 ASP 73 HB1 ASP 73 -13.559 -7.543 -7.705 549 H ALA 74 HN ALA 74 -12.455 -5.511 -6.335 550 HA ALA 74 HA ALA 74 -12.685 -5.794 -3.869 551 HB1 ALA 74 HB3 ALA 74 -11.210 -4.203 -3.408 552 HB2 ALA 74 HB1 ALA 74 -12.224 -2.914 -4.036 553 HB3 ALA 74 HB2 ALA 74 -11.240 -3.877 -5.141 554 H ARG 75 HN ARG 75 -13.785 -5.447 -2.049 555 HA ARG 75 HA ARG 75 -16.386 -4.219 -2.304 556 HE ARG 75 HE ARG 75 -11.774 -5.796 0.583 557 HB2 ARG 75 HB2 ARG 75 -16.500 -4.911 0.197 558 HB3 ARG 75 HB1 ARG 75 -16.536 -6.154 -1.043 559 HG2 ARG 75 HG2 ARG 75 -15.086 -6.688 0.893 560 HG3 ARG 75 HG1 ARG 75 -14.239 -6.695 -0.654 561 HD2 ARG 75 HD2 ARG 75 -13.444 -4.406 -0.184 562 HD3 ARG 75 HD1 ARG 75 -14.225 -4.485 1.391 563 HH11 ARG 75 HH11 ARG 75 -14.347 -5.630 2.933 564 HH12 ARG 75 HH12 ARG 75 -13.419 -6.382 4.187 565 HH21 ARG 75 HH21 ARG 75 -10.552 -6.789 2.228 566 HH22 ARG 75 HH22 ARG 75 -11.265 -7.042 3.786 567 H GLU 76 HN GLU 76 -13.573 -2.769 -2.017 568 HA GLU 76 HA GLU 76 -13.069 -0.624 -1.497 569 HB2 GLU 76 HB2 GLU 76 -15.531 -0.501 0.231 570 HB3 GLU 76 HB1 GLU 76 -14.571 0.833 -0.376 571 HG2 GLU 76 HG2 GLU 76 -15.321 0.515 -2.585 572 HG3 GLU 76 HG1 GLU 76 -16.021 -1.054 -2.190 573 H LEU 77 HN LEU 77 -11.941 -2.705 -0.358 574 HA LEU 77 HA LEU 77 -10.929 -3.569 1.474 575 HG LEU 77 HG LEU 77 -9.203 -2.052 -0.116 576 HB2 LEU 77 HB2 LEU 77 -10.422 -0.636 1.460 577 HB3 LEU 77 HB1 LEU 77 -9.793 -1.573 2.786 578 HD11 LEU 77 HD11 LEU 77 -7.853 -0.575 2.062 579 HD12 LEU 77 HD12 LEU 77 -7.929 -0.256 0.333 580 HD13 LEU 77 HD13 LEU 77 -6.850 -1.500 0.947 581 HD21 LEU 77 HD23 LEU 77 -7.427 -3.373 1.678 582 HD22 LEU 77 HD21 LEU 77 -8.477 -4.067 0.445 583 HD23 LEU 77 HD22 LEU 77 -9.084 -3.819 2.079 584 H THR 78 HN THR 78 -11.339 -0.999 3.726 585 HA THR 78 HA THR 78 -13.785 -1.634 4.816 586 HB THR 78 HB THR 78 -13.240 -2.840 6.826 587 HG1 THR 78 HG1 THR 78 -10.996 -3.754 6.911 588 HG21 THR 78 HG23 THR 78 -12.740 -5.023 5.984 589 HG22 THR 78 HG21 THR 78 -11.983 -4.335 4.549 590 HG23 THR 78 HG22 THR 78 -13.725 -4.183 4.800 591 H GLU 79 HN GLU 79 -13.815 -0.830 7.166 592 HA GLU 79 HA GLU 79 -12.785 1.800 7.214 593 HB2 GLU 79 HB2 GLU 79 -13.790 0.093 9.505 594 HB3 GLU 79 HB1 GLU 79 -13.492 1.823 9.599 595 HG2 GLU 79 HG2 GLU 79 -15.209 2.219 7.916 596 HG3 GLU 79 HG1 GLU 79 -15.501 0.484 7.803 597 H SER 80 HN SER 80 -11.789 -1.204 8.747 598 HA SER 80 HA SER 80 -9.509 -0.067 10.087 599 HG SER 80 HG SER 80 -11.085 -3.347 9.264 600 HB2 SER 80 HB2 SER 80 -9.239 -2.202 11.058 601 HB3 SER 80 HB1 SER 80 -10.975 -1.942 10.924 602 H GLU 81 HN GLU 81 -10.032 -1.782 7.072 603 HA GLU 81 HA GLU 81 -7.348 -2.784 6.880 604 HB2 GLU 81 HB2 GLU 81 -9.403 -3.729 5.705 605 HB3 GLU 81 HB1 GLU 81 -9.179 -2.443 4.520 606 HG2 GLU 81 HG2 GLU 81 -7.241 -4.628 5.232 607 HG3 GLU 81 HG1 GLU 81 -8.155 -4.474 3.729 608 H THR 82 HN THR 82 -9.043 -0.003 5.411 609 HA THR 82 HA THR 82 -6.853 0.882 3.891 610 HB THR 82 HB THR 82 -7.921 3.006 3.734 611 HG1 THR 82 HG1 THR 82 -9.786 3.455 5.058 612 HG21 THR 82 HG23 THR 82 -9.822 0.675 3.733 613 HG22 THR 82 HG21 THR 82 -8.956 1.380 2.365 614 HG23 THR 82 HG22 THR 82 -10.272 2.273 3.138 615 H LYS 83 HN LYS 83 -7.258 0.743 7.267 616 HA LYS 83 HA LYS 83 -5.901 3.033 8.130 617 HB2 LYS 83 HB2 LYS 83 -7.120 1.382 9.596 618 HB3 LYS 83 HB1 LYS 83 -5.761 0.286 9.391 619 HG2 LYS 83 HG2 LYS 83 -4.285 1.837 10.476 620 HG3 LYS 83 HG1 LYS 83 -5.555 3.049 10.567 621 HD2 LYS 83 HD2 LYS 83 -5.799 0.344 11.854 622 HD3 LYS 83 HD1 LYS 83 -5.075 1.726 12.682 623 HE2 LYS 83 HE2 LYS 83 -7.094 2.969 12.539 624 HE3 LYS 83 HE1 LYS 83 -7.807 1.787 11.447 625 HZ1 LYS 83 HZ3 LYS 83 -7.103 1.306 14.291 626 HZ2 LYS 83 HZ1 LYS 83 -7.795 0.171 13.244 627 HZ3 LYS 83 HZ2 LYS 83 -8.666 1.549 13.692 628 H SER 84 HN SER 84 -4.856 -0.007 6.754 629 HA SER 84 HA SER 84 -2.103 0.096 7.298 630 HG SER 84 HG SER 84 -0.935 -0.943 5.358 631 HB2 SER 84 HB2 SER 84 -3.470 -1.781 6.203 632 HB3 SER 84 HB1 SER 84 -3.300 -0.886 4.707 633 H LEU 85 HN LEU 85 -3.880 0.950 4.408 634 HA LEU 85 HA LEU 85 -1.838 2.239 3.049 635 HG LEU 85 HG LEU 85 -4.395 0.362 2.643 636 HB2 LEU 85 HB2 LEU 85 -4.807 2.752 2.902 637 HB3 LEU 85 HB1 LEU 85 -3.634 3.093 1.653 638 HD11 LEU 85 HD11 LEU 85 -5.056 0.219 0.141 639 HD12 LEU 85 HD12 LEU 85 -5.146 1.974 0.258 640 HD13 LEU 85 HD13 LEU 85 -6.154 0.969 1.297 641 HD21 LEU 85 HD23 LEU 85 -2.085 0.343 2.049 642 HD22 LEU 85 HD21 LEU 85 -2.412 1.240 0.567 643 HD23 LEU 85 HD22 LEU 85 -3.002 -0.415 0.743 644 H MET 86 HN MET 86 -4.261 3.440 5.287 645 HA MET 86 HA MET 86 -3.658 6.199 5.117 646 HB2 MET 86 HB2 MET 86 -4.744 4.638 7.475 647 HB3 MET 86 HB1 MET 86 -4.807 6.384 7.290 648 HG2 MET 86 HG2 MET 86 -5.970 4.939 5.045 649 HG3 MET 86 HG1 MET 86 -6.773 4.622 6.582 650 HE1 MET 86 HE3 MET 86 -4.979 8.085 6.202 651 HE2 MET 86 HE1 MET 86 -6.081 8.928 5.114 652 HE3 MET 86 HE2 MET 86 -5.177 7.525 4.542 653 H ASP 87 HN ASP 87 -2.640 3.685 7.369 654 HA ASP 87 HA ASP 87 -0.782 5.277 8.828 655 HB2 ASP 87 HB2 ASP 87 -1.316 2.330 8.661 656 HB3 ASP 87 HB1 ASP 87 -0.065 3.003 9.701 657 H ALA 88 HN ALA 88 -0.595 4.183 5.740 658 HA ALA 88 HA ALA 88 2.011 3.029 5.688 659 HB1 ALA 88 HB3 ALA 88 1.681 2.760 3.414 660 HB2 ALA 88 HB1 ALA 88 0.584 4.141 3.312 661 HB3 ALA 88 HB2 ALA 88 0.059 2.655 4.103 662 H ALA 89 HN ALA 89 0.790 6.324 5.464 663 HA ALA 89 HA ALA 89 3.525 7.275 5.428 664 HB1 ALA 89 HB3 ALA 89 3.158 6.985 3.061 665 HB2 ALA 89 HB1 ALA 89 3.233 8.703 3.446 666 HB3 ALA 89 HB2 ALA 89 1.673 7.937 3.137 667 H ASP 90 HN ASP 90 0.694 9.080 4.311 668 HA ASP 90 HA ASP 90 1.177 10.999 6.467 669 HB2 ASP 90 HB2 ASP 90 0.658 11.471 3.858 670 HB3 ASP 90 HB1 ASP 90 -0.976 11.530 4.511 671 H ASN 91 HN ASN 91 0.420 9.581 8.074 672 HA ASN 91 HA ASN 91 -2.454 8.985 8.037 673 HB2 ASN 91 HB2 ASN 91 -1.454 7.682 10.252 674 HB3 ASN 91 HB1 ASN 91 -1.746 6.956 8.679 675 HD21 ASN 91 HD21 ASN 91 0.005 6.655 7.254 676 HD22 ASN 91 HD22 ASN 91 1.634 6.642 7.831 677 H ASP 92 HN ASP 92 0.026 10.066 10.343 678 HA ASP 92 HA ASP 92 -1.926 10.875 12.265 679 HB2 ASP 92 HB2 ASP 92 0.269 10.058 12.950 680 HB3 ASP 92 HB1 ASP 92 1.040 11.423 12.147 681 H GLY 93 HN GLY 93 -1.058 12.420 9.402 682 HA2 GLY 93 HA2 GLY 93 -1.670 15.009 10.673 683 HA3 GLY 93 HA1 GLY 93 -0.502 14.851 9.376 684 H ASP 94 HN ASP 94 -1.242 14.466 7.248 685 HA ASP 94 HA ASP 94 -3.702 15.819 6.684 686 HB2 ASP 94 HB2 ASP 94 -1.776 14.451 4.801 687 HB3 ASP 94 HB1 ASP 94 -3.078 15.538 4.333 688 H GLY 95 HN GLY 95 -2.538 12.530 5.847 689 HA2 GLY 95 HA2 GLY 95 -4.063 10.653 6.218 690 HA3 GLY 95 HA1 GLY 95 -5.377 11.720 5.749 691 H LYS 96 HN LYS 96 -2.631 12.170 3.810 692 HA LYS 96 HA LYS 96 -3.884 10.605 1.673 693 HB2 LYS 96 HB2 LYS 96 -3.695 12.520 0.515 694 HB3 LYS 96 HB1 LYS 96 -2.772 13.263 1.806 695 HG2 LYS 96 HG2 LYS 96 -1.525 11.497 -0.289 696 HG3 LYS 96 HG1 LYS 96 -1.724 13.231 -0.487 697 HD2 LYS 96 HD2 LYS 96 -0.018 11.790 1.530 698 HD3 LYS 96 HD1 LYS 96 0.480 12.917 0.271 699 HE2 LYS 96 HE2 LYS 96 -1.024 14.617 1.503 700 HE3 LYS 96 HE1 LYS 96 -0.912 13.494 2.858 701 HZ1 LYS 96 HZ3 LYS 96 1.456 13.724 2.866 702 HZ2 LYS 96 HZ1 LYS 96 0.776 15.273 2.902 703 HZ3 LYS 96 HZ2 LYS 96 1.430 14.671 1.464 704 H ILE 97 HN ILE 97 -2.506 9.439 0.185 705 HA ILE 97 HA ILE 97 0.136 8.764 1.290 706 HB ILE 97 HB ILE 97 -1.574 6.732 -0.098 707 HG12 ILE 97 HG12 ILE 97 -2.733 7.452 1.974 708 HG13 ILE 97 HG11 ILE 97 -2.121 5.807 2.065 709 HG21 ILE 97 HG21 ILE 97 0.039 5.250 1.225 710 HG22 ILE 97 HG22 ILE 97 0.965 6.730 1.497 711 HG23 ILE 97 HG23 ILE 97 0.681 6.159 -0.138 712 HD11 ILE 97 HD13 ILE 97 -0.400 6.399 3.528 713 HD12 ILE 97 HD11 ILE 97 -1.824 7.255 4.117 714 HD13 ILE 97 HD12 ILE 97 -0.595 8.117 3.192 715 H GLY 98 HN GLY 98 1.300 9.899 -0.277 716 HA2 GLY 98 HA2 GLY 98 0.903 9.066 -3.046 717 HA3 GLY 98 HA1 GLY 98 1.673 10.562 -2.532 718 H ALA 99 HN ALA 99 2.951 9.070 -4.342 719 HA ALA 99 HA ALA 99 4.626 7.012 -3.412 720 HB1 ALA 99 HB3 ALA 99 4.588 7.318 -5.738 721 HB2 ALA 99 HB1 ALA 99 6.206 7.837 -5.263 722 HB3 ALA 99 HB2 ALA 99 4.958 9.036 -5.604 723 H ASP 100 HN ASP 100 5.196 10.519 -3.521 724 HA ASP 100 HA ASP 100 7.721 10.513 -2.322 725 HB2 ASP 100 HB2 ASP 100 7.373 12.866 -1.878 726 HB3 ASP 100 HB1 ASP 100 6.683 12.476 -3.447 727 H GLU 101 HN GLU 101 4.518 10.908 -0.847 728 HA GLU 101 HA GLU 101 5.339 11.110 1.819 729 HB2 GLU 101 HB2 GLU 101 2.869 10.743 0.340 730 HB3 GLU 101 HB1 GLU 101 2.853 9.771 1.795 731 HG2 GLU 101 HG2 GLU 101 1.980 12.283 1.662 732 HG3 GLU 101 HG1 GLU 101 2.609 11.564 3.129 733 H PHE 102 HN PHE 102 4.154 8.279 0.030 734 HA PHE 102 HA PHE 102 4.611 6.325 1.937 735 HD1 PHE 102 HD1 PHE 102 6.682 4.329 -0.498 736 HD2 PHE 102 HD2 PHE 102 2.656 4.011 0.831 737 HE1 PHE 102 HE1 PHE 102 7.016 1.953 -0.055 738 HE2 PHE 102 HE2 PHE 102 2.983 1.611 1.268 739 HZ PHE 102 HZ PHE 102 5.174 0.574 0.824 740 HB2 PHE 102 HB2 PHE 102 3.403 5.985 -0.176 741 HB3 PHE 102 HB1 PHE 102 4.933 6.042 -1.060 742 H GLN 103 HN GLN 103 6.814 7.623 -0.513 743 HA GLN 103 HA GLN 103 9.015 5.972 -0.081 744 HB2 GLN 103 HB2 GLN 103 8.779 8.847 -0.944 745 HB3 GLN 103 HB1 GLN 103 10.339 8.048 -0.817 746 HG2 GLN 103 HG2 GLN 103 8.280 6.618 -2.346 747 HG3 GLN 103 HG1 GLN 103 8.854 8.135 -3.032 748 HE21 GLN 103 HE21 GLN 103 9.856 7.104 -4.745 749 HE22 GLN 103 HE22 GLN 103 11.320 6.203 -4.548 750 H GLU 104 HN GLU 104 7.796 8.670 1.771 751 HA GLU 104 HA GLU 104 10.150 9.115 3.317 752 HB2 GLU 104 HB2 GLU 104 7.261 9.793 3.884 753 HB3 GLU 104 HB1 GLU 104 8.603 10.294 4.901 754 HG2 GLU 104 HG2 GLU 104 9.575 11.406 2.855 755 HG3 GLU 104 HG1 GLU 104 8.025 11.108 2.072 756 H MET 105 HN MET 105 7.350 7.021 3.657 757 HA MET 105 HA MET 105 7.759 6.200 6.306 758 HB2 MET 105 HB2 MET 105 5.799 5.744 4.608 759 HB3 MET 105 HB1 MET 105 6.707 4.274 4.285 760 HG2 MET 105 HG2 MET 105 5.689 5.162 6.974 761 HG3 MET 105 HG1 MET 105 4.988 3.905 5.961 762 HE1 MET 105 HE3 MET 105 6.092 3.745 9.126 763 HE2 MET 105 HE1 MET 105 6.670 2.079 9.086 764 HE3 MET 105 HE2 MET 105 5.138 2.500 8.319 765 H VAL 106 HN VAL 106 8.766 4.598 3.269 766 HA VAL 106 HA VAL 106 10.200 2.532 4.479 767 HB VAL 106 HB VAL 106 9.597 2.372 2.153 768 HG11 VAL 106 HG11 VAL 106 11.183 4.885 1.884 769 HG12 VAL 106 HG12 VAL 106 9.554 4.511 1.313 770 HG13 VAL 106 HG13 VAL 106 10.956 3.811 0.504 771 HG21 VAL 106 HG23 VAL 106 12.598 2.559 2.421 772 HG22 VAL 106 HG21 VAL 106 11.728 1.689 1.159 773 HG23 VAL 106 HG22 VAL 106 11.613 1.158 2.838 774 H HIS 107 HN HIS 107 11.092 5.794 3.598 775 HA HIS 107 HA HIS 107 13.888 5.437 4.158 776 HD1 HIS 107 HD1 HIS 107 15.398 7.365 1.909 777 HD2 HIS 107 HD2 HIS 107 14.434 9.194 5.513 778 HE1 HIS 107 HE1 HIS 107 17.422 8.717 2.538 779 HE2 HIS 107 HE2 HIS 107 16.845 9.750 4.763 780 HB2 HIS 107 HB2 HIS 107 12.962 7.109 2.523 781 HB3 HIS 107 HB1 HIS 107 12.368 8.035 3.896 782 H SER 108 HN SER 108 11.068 6.229 5.981 783 HA SER 108 HA SER 108 12.117 7.734 8.065 784 HG SER 108 HG SER 108 10.633 7.685 9.985 785 HB2 SER 108 HB2 SER 108 9.727 7.371 7.835 786 HB3 SER 108 HB1 SER 108 9.926 5.647 8.142 Start of MODEL 19 1 HA SER 1 HA SER 1 1.736 -6.994 -5.092 2 HG SER 1 HG SER 1 0.256 -9.514 -7.347 3 H1 SER 1 HT1 SER 1 -0.150 -7.266 -7.357 4 H2 SER 1 HT2 SER 1 0.016 -5.933 -6.328 5 H3 SER 1 HT3 SER 1 -0.578 -7.397 -5.725 6 HB2 SER 1 HB2 SER 1 2.569 -9.219 -5.763 7 HB3 SER 1 HB1 SER 1 0.881 -9.291 -5.257 8 H ILE 2 HN ILE 2 2.888 -5.285 -5.931 9 HA ILE 2 HA ILE 2 3.552 -4.653 -8.466 10 HB ILE 2 HB ILE 2 5.697 -4.472 -6.384 11 HG12 ILE 2 HG12 ILE 2 4.328 -2.177 -6.026 12 HG13 ILE 2 HG11 ILE 2 3.000 -3.282 -6.332 13 HG21 ILE 2 HG21 ILE 2 4.992 -3.139 -8.903 14 HG22 ILE 2 HG22 ILE 2 6.571 -3.450 -8.177 15 HG23 ILE 2 HG23 ILE 2 5.592 -2.097 -7.614 16 HD11 ILE 2 HD13 ILE 2 4.249 -2.843 -3.923 17 HD12 ILE 2 HD11 ILE 2 4.934 -4.371 -4.473 18 HD13 ILE 2 HD12 ILE 2 3.186 -4.192 -4.321 19 H THR 3 HN THR 3 6.079 -6.226 -6.574 20 HA THR 3 HA THR 3 7.484 -7.936 -6.957 21 HB THR 3 HB THR 3 7.088 -9.665 -8.510 22 HG1 THR 3 HG1 THR 3 5.884 -7.703 -10.002 23 HG21 THR 3 HG23 THR 3 4.336 -8.728 -7.758 24 HG22 THR 3 HG21 THR 3 5.493 -9.345 -6.578 25 HG23 THR 3 HG22 THR 3 4.930 -10.382 -7.892 26 H ASP 4 HN ASP 4 7.233 -5.196 -8.735 27 HA ASP 4 HA ASP 4 8.907 -5.576 -10.931 28 HB2 ASP 4 HB2 ASP 4 8.612 -3.196 -9.080 29 HB3 ASP 4 HB1 ASP 4 9.564 -3.156 -10.560 30 H ILE 5 HN ILE 5 10.003 -4.038 -7.909 31 HA ILE 5 HA ILE 5 12.418 -5.732 -8.054 32 HB ILE 5 HB ILE 5 12.259 -3.013 -6.743 33 HG12 ILE 5 HG12 ILE 5 13.410 -3.631 -9.471 34 HG13 ILE 5 HG11 ILE 5 11.815 -2.925 -9.220 35 HG21 ILE 5 HG21 ILE 5 14.033 -4.502 -5.953 36 HG22 ILE 5 HG22 ILE 5 14.695 -3.120 -6.826 37 HG23 ILE 5 HG23 ILE 5 14.607 -4.697 -7.610 38 HD11 ILE 5 HD13 ILE 5 13.882 -1.422 -9.730 39 HD12 ILE 5 HD11 ILE 5 14.183 -1.602 -8.004 40 HD13 ILE 5 HD12 ILE 5 12.661 -0.909 -8.566 41 H LEU 6 HN LEU 6 11.662 -7.276 -6.814 42 HA LEU 6 HA LEU 6 11.697 -6.975 -3.967 43 HG LEU 6 HG LEU 6 10.321 -5.837 -2.861 44 HB2 LEU 6 HB2 LEU 6 9.121 -6.791 -5.329 45 HB3 LEU 6 HB1 LEU 6 9.147 -8.017 -4.079 46 HD11 LEU 6 HD11 LEU 6 8.633 -4.927 -5.031 47 HD12 LEU 6 HD12 LEU 6 9.736 -4.024 -3.993 48 HD13 LEU 6 HD13 LEU 6 8.086 -4.339 -3.461 49 HD21 LEU 6 HD23 LEU 6 8.667 -7.469 -1.952 50 HD22 LEU 6 HD21 LEU 6 7.399 -6.569 -2.783 51 HD23 LEU 6 HD22 LEU 6 8.341 -5.793 -1.512 52 H SER 7 HN SER 7 11.117 -9.031 -2.819 53 HA SER 7 HA SER 7 12.011 -11.336 -4.319 54 HG SER 7 HG SER 7 13.147 -10.535 -1.092 55 HB2 SER 7 HB2 SER 7 11.137 -11.006 -1.442 56 HB3 SER 7 HB1 SER 7 11.760 -12.507 -2.121 57 H ALA 8 HN ALA 8 10.643 -12.669 -5.364 58 HA ALA 8 HA ALA 8 7.884 -12.123 -5.525 59 HB1 ALA 8 HB3 ALA 8 9.186 -13.167 -7.331 60 HB2 ALA 8 HB1 ALA 8 7.741 -14.091 -6.919 61 HB3 ALA 8 HB2 ALA 8 9.323 -14.635 -6.363 62 H GLU 9 HN GLU 9 9.567 -14.876 -3.985 63 HA GLU 9 HA GLU 9 7.209 -16.106 -3.052 64 HB2 GLU 9 HB2 GLU 9 10.049 -16.296 -2.061 65 HB3 GLU 9 HB1 GLU 9 8.746 -17.363 -1.547 66 HG2 GLU 9 HG2 GLU 9 9.715 -17.036 -4.363 67 HG3 GLU 9 HG1 GLU 9 10.189 -18.343 -3.280 68 H ASP 10 HN ASP 10 9.659 -14.246 -1.260 69 HA ASP 10 HA ASP 10 8.336 -14.018 1.099 70 HB2 ASP 10 HB2 ASP 10 10.123 -12.012 -0.235 71 HB3 ASP 10 HB1 ASP 10 9.610 -11.886 1.440 72 H ILE 11 HN ILE 11 7.626 -12.283 -1.835 73 HA ILE 11 HA ILE 11 6.103 -10.227 -0.615 74 HB ILE 11 HB ILE 11 6.460 -11.302 -3.331 75 HG12 ILE 11 HG12 ILE 11 6.089 -8.498 -2.256 76 HG13 ILE 11 HG11 ILE 11 7.633 -9.318 -2.481 77 HG21 ILE 11 HG21 ILE 11 3.823 -10.185 -2.509 78 HG22 ILE 11 HG22 ILE 11 4.196 -11.445 -3.684 79 HG23 ILE 11 HG23 ILE 11 4.476 -9.751 -4.089 80 HD11 ILE 11 HD13 ILE 11 7.232 -7.772 -4.289 81 HD12 ILE 11 HD11 ILE 11 5.684 -8.539 -4.640 82 HD13 ILE 11 HD12 ILE 11 7.185 -9.424 -4.900 83 H ALA 12 HN ALA 12 5.152 -13.347 -2.015 84 HA ALA 12 HA ALA 12 2.425 -13.244 -1.413 85 HB1 ALA 12 HB3 ALA 12 3.934 -15.050 -2.670 86 HB2 ALA 12 HB1 ALA 12 2.334 -15.434 -2.025 87 HB3 ALA 12 HB2 ALA 12 3.779 -15.853 -1.108 88 H ALA 13 HN ALA 13 5.054 -14.669 0.525 89 HA ALA 13 HA ALA 13 3.387 -15.327 2.714 90 HB1 ALA 13 HB3 ALA 13 5.738 -16.178 2.274 91 HB2 ALA 13 HB1 ALA 13 5.377 -15.732 3.942 92 HB3 ALA 13 HB2 ALA 13 6.312 -14.640 2.921 93 H ALA 14 HN ALA 14 5.598 -12.666 2.172 94 HA ALA 14 HA ALA 14 5.207 -11.086 4.346 95 HB1 ALA 14 HB3 ALA 14 6.769 -10.340 2.745 96 HB2 ALA 14 HB1 ALA 14 5.518 -9.100 2.780 97 HB3 ALA 14 HB2 ALA 14 5.555 -10.276 1.464 98 H LEU 15 HN LEU 15 3.182 -11.128 1.434 99 HA LEU 15 HA LEU 15 1.294 -9.246 2.489 100 HG LEU 15 HG LEU 15 0.073 -8.248 0.204 101 HB2 LEU 15 HB2 LEU 15 1.848 -9.759 0.035 102 HB3 LEU 15 HB1 LEU 15 0.813 -11.151 0.217 103 HD11 LEU 15 HD11 LEU 15 -0.845 -10.716 -1.239 104 HD12 LEU 15 HD12 LEU 15 -0.112 -9.262 -1.911 105 HD13 LEU 15 HD13 LEU 15 -1.752 -9.206 -1.271 106 HD21 LEU 15 HD23 LEU 15 -1.568 -10.474 1.403 107 HD22 LEU 15 HD21 LEU 15 -2.197 -8.884 0.968 108 HD23 LEU 15 HD22 LEU 15 -0.968 -9.033 2.223 109 H GLN 16 HN GLN 16 1.205 -12.747 1.802 110 HA GLN 16 HA GLN 16 -1.386 -13.217 2.800 111 HB2 GLN 16 HB2 GLN 16 0.951 -14.983 2.131 112 HB3 GLN 16 HB1 GLN 16 -0.600 -15.604 2.660 113 HG2 GLN 16 HG2 GLN 16 0.076 -15.346 0.114 114 HG3 GLN 16 HG1 GLN 16 -1.587 -15.228 0.683 115 HE21 GLN 16 HE21 GLN 16 -2.440 -13.070 1.006 116 HE22 GLN 16 HE22 GLN 16 -1.872 -11.782 0.006 117 H GLU 17 HN GLU 17 1.330 -12.436 4.612 118 HA GLU 17 HA GLU 17 1.389 -14.580 6.452 119 HB2 GLU 17 HB2 GLU 17 3.318 -13.294 6.434 120 HB3 GLU 17 HB1 GLU 17 2.439 -11.777 6.426 121 HG2 GLU 17 HG2 GLU 17 1.924 -12.006 8.750 122 HG3 GLU 17 HG1 GLU 17 2.582 -13.637 8.776 123 H CYS 18 HN CYS 18 0.466 -11.248 7.362 124 HA CYS 18 HA CYS 18 -1.531 -12.379 9.136 125 HG CYS 18 HG CYS 18 -1.062 -11.868 11.798 126 HB2 CYS 18 HB2 CYS 18 0.303 -10.087 9.222 127 HB3 CYS 18 HB1 CYS 18 -1.280 -9.833 9.937 128 H GLN 19 HN GLN 19 -1.655 -11.301 6.114 129 HA GLN 19 HA GLN 19 -3.077 -8.970 5.954 130 HB2 GLN 19 HB2 GLN 19 -2.333 -10.250 4.005 131 HB3 GLN 19 HB1 GLN 19 -3.566 -11.454 4.319 132 HG2 GLN 19 HG2 GLN 19 -5.275 -9.670 3.996 133 HG3 GLN 19 HG1 GLN 19 -3.968 -8.598 3.497 134 HE21 GLN 19 HE21 GLN 19 -4.780 -8.335 1.439 135 HE22 GLN 19 HE22 GLN 19 -4.731 -9.589 0.252 136 H ASP 20 HN ASP 20 -5.130 -8.310 6.015 137 HA ASP 20 HA ASP 20 -7.479 -9.687 6.310 138 HB2 ASP 20 HB2 ASP 20 -6.640 -10.774 8.298 139 HB3 ASP 20 HB1 ASP 20 -6.136 -9.239 8.971 140 HA PRO 21 HA PRO 21 -8.926 -5.495 6.119 141 HB2 PRO 21 HB2 PRO 21 -11.393 -5.847 7.182 142 HB3 PRO 21 HB1 PRO 21 -10.987 -6.255 5.527 143 HG2 PRO 21 HG2 PRO 21 -11.139 -8.019 7.944 144 HG3 PRO 21 HG1 PRO 21 -11.764 -8.309 6.307 145 HD2 PRO 21 HD2 PRO 21 -9.482 -9.410 7.087 146 HD3 PRO 21 HD1 PRO 21 -9.654 -8.752 5.453 147 H ASP 22 HN ASP 22 -7.200 -5.359 8.040 148 HA ASP 22 HA ASP 22 -7.826 -3.493 9.847 149 HB2 ASP 22 HB2 ASP 22 -9.614 -4.751 10.834 150 HB3 ASP 22 HB1 ASP 22 -8.594 -6.166 11.039 151 H THR 23 HN THR 23 -5.739 -5.950 8.879 152 HA THR 23 HA THR 23 -3.952 -5.557 11.169 153 HB THR 23 HB THR 23 -4.460 -7.879 10.516 154 HG1 THR 23 HG1 THR 23 -2.501 -8.297 11.195 155 HG21 THR 23 HG23 THR 23 -4.026 -6.884 7.913 156 HG22 THR 23 HG21 THR 23 -4.442 -8.530 8.386 157 HG23 THR 23 HG22 THR 23 -2.751 -8.062 8.227 158 H PHE 24 HN PHE 24 -4.279 -4.821 7.813 159 HA PHE 24 HA PHE 24 -3.077 -3.156 6.680 160 HD1 PHE 24 HD2 PHE 24 -0.294 -2.786 5.463 161 HD2 PHE 24 HD1 PHE 24 -1.489 -0.687 8.910 162 HE1 PHE 24 HE2 PHE 24 0.419 -0.654 4.429 163 HE2 PHE 24 HE1 PHE 24 -0.776 1.434 7.921 164 HZ PHE 24 HZ PHE 24 0.185 1.437 5.663 165 HB2 PHE 24 HB2 PHE 24 -1.693 -2.889 8.928 166 HB3 PHE 24 HB1 PHE 24 -0.489 -3.784 8.006 167 H GLU 25 HN GLU 25 -3.367 -4.360 4.945 168 HA GLU 25 HA GLU 25 -1.843 -6.715 4.427 169 HB2 GLU 25 HB2 GLU 25 -3.505 -5.274 2.400 170 HB3 GLU 25 HB1 GLU 25 -3.160 -6.993 2.521 171 HG2 GLU 25 HG2 GLU 25 -4.496 -7.096 4.575 172 HG3 GLU 25 HG1 GLU 25 -4.866 -5.390 4.388 173 HA PRO 26 HA PRO 26 0.092 -4.034 0.913 174 HB2 PRO 26 HB2 PRO 26 0.401 -1.368 1.516 175 HB3 PRO 26 HB1 PRO 26 -0.867 -2.049 0.510 176 HG2 PRO 26 HG2 PRO 26 -1.002 -1.056 3.249 177 HG3 PRO 26 HG1 PRO 26 -2.269 -1.205 2.054 178 HD2 PRO 26 HD2 PRO 26 -1.888 -2.869 4.247 179 HD3 PRO 26 HD1 PRO 26 -2.920 -3.207 2.846 180 H GLN 27 HN GLN 27 0.846 -2.389 3.996 181 HA GLN 27 HA GLN 27 3.583 -2.077 3.441 182 HB2 GLN 27 HB2 GLN 27 1.990 -1.930 5.942 183 HB3 GLN 27 HB1 GLN 27 3.733 -2.019 6.074 184 HG2 GLN 27 HG2 GLN 27 3.920 -0.053 4.602 185 HG3 GLN 27 HG1 GLN 27 2.168 0.064 4.583 186 HE21 GLN 27 HE21 GLN 27 1.752 -0.622 7.303 187 HE22 GLN 27 HE22 GLN 27 2.283 0.719 8.239 188 H LYS 28 HN LYS 28 1.885 -4.788 4.933 189 HA LYS 28 HA LYS 28 4.214 -6.044 5.925 190 HB2 LYS 28 HB2 LYS 28 1.438 -6.594 5.870 191 HB3 LYS 28 HB1 LYS 28 2.301 -7.968 5.230 192 HG2 LYS 28 HG2 LYS 28 3.674 -8.107 7.201 193 HG3 LYS 28 HG1 LYS 28 2.878 -6.676 7.845 194 HD2 LYS 28 HD2 LYS 28 1.309 -9.115 7.098 195 HD3 LYS 28 HD1 LYS 28 2.096 -8.987 8.671 196 HE2 LYS 28 HE2 LYS 28 0.106 -7.020 7.550 197 HE3 LYS 28 HE1 LYS 28 -0.262 -8.277 8.730 198 HZ1 LYS 28 HZ3 LYS 28 1.582 -5.980 9.112 199 HZ2 LYS 28 HZ1 LYS 28 1.363 -7.231 10.231 200 HZ3 LYS 28 HZ2 LYS 28 0.077 -6.202 9.852 201 H PHE 29 HN PHE 29 2.364 -6.330 2.964 202 HA PHE 29 HA PHE 29 3.789 -8.291 1.639 203 HD1 PHE 29 HD1 PHE 29 4.662 -5.666 -0.870 204 HD2 PHE 29 HD2 PHE 29 1.492 -8.456 -1.277 205 HE1 PHE 29 HE1 PHE 29 5.273 -6.003 -3.224 206 HE2 PHE 29 HE2 PHE 29 2.097 -8.812 -3.630 207 HZ PHE 29 HZ PHE 29 3.989 -7.581 -4.610 208 HB2 PHE 29 HB2 PHE 29 1.751 -7.411 0.718 209 HB3 PHE 29 HB1 PHE 29 2.400 -5.783 0.669 210 H PHE 30 HN PHE 30 4.297 -4.803 1.683 211 HA PHE 30 HA PHE 30 6.633 -4.791 0.060 212 HD1 PHE 30 HD1 PHE 30 5.087 -3.923 -1.288 213 HD2 PHE 30 HD2 PHE 30 4.140 -1.201 1.824 214 HE1 PHE 30 HE1 PHE 30 3.019 -3.290 -2.475 215 HE2 PHE 30 HE2 PHE 30 2.074 -0.559 0.652 216 HZ PHE 30 HZ PHE 30 1.512 -1.606 -1.505 217 HB2 PHE 30 HB2 PHE 30 5.912 -2.673 2.081 218 HB3 PHE 30 HB1 PHE 30 6.826 -2.482 0.592 219 H GLN 31 HN GLN 31 6.215 -4.175 3.503 220 HA GLN 31 HA GLN 31 8.864 -3.870 4.192 221 HB2 GLN 31 HB2 GLN 31 6.775 -3.382 5.547 222 HB3 GLN 31 HB1 GLN 31 6.814 -5.072 6.022 223 HG2 GLN 31 HG2 GLN 31 7.939 -4.198 7.764 224 HG3 GLN 31 HG1 GLN 31 9.300 -4.447 6.671 225 HE21 GLN 31 HE21 GLN 31 8.477 -2.211 4.930 226 HE22 GLN 31 HE22 GLN 31 8.902 -0.775 5.785 227 H THR 32 HN THR 32 7.035 -6.783 4.992 228 HA THR 32 HA THR 32 9.173 -8.232 5.958 229 HB THR 32 HB THR 32 6.741 -9.280 4.517 230 HG1 THR 32 HG1 THR 32 7.336 -8.569 7.173 231 HG21 THR 32 HG23 THR 32 8.506 -10.978 4.557 232 HG22 THR 32 HG21 THR 32 7.190 -11.407 5.650 233 HG23 THR 32 HG22 THR 32 8.692 -10.746 6.296 234 H SER 33 HN SER 33 7.972 -8.211 2.602 235 HA SER 33 HA SER 33 10.132 -9.941 1.755 236 HG SER 33 HG SER 33 9.614 -9.427 -1.201 237 HB2 SER 33 HB2 SER 33 7.861 -10.234 0.867 238 HB3 SER 33 HB1 SER 33 7.973 -8.659 0.092 239 H GLY 34 HN GLY 34 9.010 -6.730 0.705 240 HA2 GLY 34 HA2 GLY 34 11.611 -6.419 -0.598 241 HA3 GLY 34 HA1 GLY 34 10.184 -5.504 -0.996 242 H LEU 35 HN LEU 35 9.472 -4.110 1.123 243 HA LEU 35 HA LEU 35 11.029 -1.896 1.073 244 HG LEU 35 HG LEU 35 9.553 -0.006 2.394 245 HB2 LEU 35 HB2 LEU 35 8.812 -2.894 2.585 246 HB3 LEU 35 HB1 LEU 35 9.881 -1.987 3.638 247 HD11 LEU 35 HD11 LEU 35 7.763 -0.640 0.338 248 HD12 LEU 35 HD12 LEU 35 9.076 -1.812 0.202 249 HD13 LEU 35 HD13 LEU 35 9.425 -0.082 0.176 250 HD21 LEU 35 HD23 LEU 35 7.679 0.002 3.623 251 HD22 LEU 35 HD21 LEU 35 7.194 -1.606 3.081 252 HD23 LEU 35 HD22 LEU 35 6.913 -0.207 2.051 253 H SER 36 HN SER 36 11.184 -4.484 3.476 254 HA SER 36 HA SER 36 12.921 -3.634 5.291 255 HG SER 36 HG SER 36 13.855 -7.125 3.736 256 HB2 SER 36 HB2 SER 36 13.839 -5.930 5.446 257 HB3 SER 36 HB1 SER 36 12.082 -5.906 5.293 258 H LYS 37 HN LYS 37 13.879 -4.159 1.909 259 HA LYS 37 HA LYS 37 16.418 -2.889 2.552 260 HB2 LYS 37 HB2 LYS 37 16.275 -5.687 1.466 261 HB3 LYS 37 HB1 LYS 37 17.726 -4.705 1.427 262 HG2 LYS 37 HG2 LYS 37 16.261 -5.511 3.917 263 HG3 LYS 37 HG1 LYS 37 17.711 -6.290 3.291 264 HD2 LYS 37 HD2 LYS 37 18.950 -4.203 3.536 265 HD3 LYS 37 HD1 LYS 37 17.497 -3.400 4.136 266 HE2 LYS 37 HE2 LYS 37 17.445 -4.899 6.053 267 HE3 LYS 37 HE1 LYS 37 18.860 -5.753 5.441 268 HZ1 LYS 37 HZ3 LYS 37 20.135 -3.705 5.666 269 HZ2 LYS 37 HZ1 LYS 37 19.476 -4.178 7.152 270 HZ3 LYS 37 HZ2 LYS 37 18.777 -2.906 6.282 271 H MET 38 HN MET 38 14.468 -1.795 0.908 272 HA MET 38 HA MET 38 15.779 -2.007 -1.724 273 HB2 MET 38 HB2 MET 38 13.431 -0.897 -2.382 274 HB3 MET 38 HB1 MET 38 13.730 -2.621 -2.405 275 HG2 MET 38 HG2 MET 38 12.459 -3.013 -0.598 276 HG3 MET 38 HG1 MET 38 12.734 -1.415 0.100 277 HE1 MET 38 HE3 MET 38 9.434 -2.860 -2.570 278 HE2 MET 38 HE1 MET 38 9.816 -3.428 -0.959 279 HE3 MET 38 HE2 MET 38 10.975 -3.682 -2.266 280 H SER 39 HN SER 39 15.994 -0.106 -2.991 281 HA SER 39 HA SER 39 16.608 2.228 -1.481 282 HG SER 39 HG SER 39 18.694 1.771 -2.632 283 HB2 SER 39 HB2 SER 39 16.535 1.778 -4.475 284 HB3 SER 39 HB1 SER 39 17.216 3.195 -3.677 285 H ALA 40 HN ALA 40 15.813 4.413 -2.387 286 HA ALA 40 HA ALA 40 13.019 4.590 -1.843 287 HB1 ALA 40 HB3 ALA 40 14.654 6.774 -3.101 288 HB2 ALA 40 HB1 ALA 40 14.787 6.356 -1.392 289 HB3 ALA 40 HB2 ALA 40 13.246 6.915 -2.045 290 H SER 41 HN SER 41 14.908 4.684 -4.840 291 HA SER 41 HA SER 41 13.095 5.654 -6.628 292 HG SER 41 HG SER 41 15.876 2.871 -7.569 293 HB2 SER 41 HB2 SER 41 14.277 4.126 -8.296 294 HB3 SER 41 HB1 SER 41 15.282 5.259 -7.392 295 H GLN 42 HN GLN 42 13.551 2.156 -6.019 296 HA GLN 42 HA GLN 42 11.429 1.370 -7.668 297 HB2 GLN 42 HB2 GLN 42 11.547 -0.793 -6.667 298 HB3 GLN 42 HB1 GLN 42 13.176 -0.160 -6.857 299 HG2 GLN 42 HG2 GLN 42 13.329 0.365 -4.582 300 HG3 GLN 42 HG1 GLN 42 11.627 0.012 -4.307 301 HE21 GLN 42 HE21 GLN 42 10.972 -2.067 -3.968 302 HE22 GLN 42 HE22 GLN 42 12.056 -3.413 -3.897 303 H VAL 43 HN VAL 43 11.471 2.593 -4.505 304 HA VAL 43 HA VAL 43 9.064 1.580 -3.491 305 HB VAL 43 HB VAL 43 9.846 4.428 -2.966 306 HG11 VAL 43 HG11 VAL 43 8.834 2.473 -0.962 307 HG12 VAL 43 HG12 VAL 43 7.722 3.188 -2.130 308 HG13 VAL 43 HG13 VAL 43 8.634 4.226 -1.028 309 HG21 VAL 43 HG23 VAL 43 11.323 3.622 -1.171 310 HG22 VAL 43 HG21 VAL 43 11.887 3.137 -2.758 311 HG23 VAL 43 HG22 VAL 43 11.076 1.968 -1.729 312 H LYS 44 HN LYS 44 9.695 4.384 -5.543 313 HA LYS 44 HA LYS 44 7.136 5.420 -5.728 314 HB2 LYS 44 HB2 LYS 44 9.326 5.234 -7.798 315 HB3 LYS 44 HB1 LYS 44 7.825 6.097 -8.084 316 HG2 LYS 44 HG2 LYS 44 8.474 7.859 -6.899 317 HG3 LYS 44 HG1 LYS 44 9.097 6.846 -5.608 318 HD2 LYS 44 HD2 LYS 44 10.840 8.228 -6.704 319 HD3 LYS 44 HD1 LYS 44 11.157 6.493 -6.778 320 HE2 LYS 44 HE2 LYS 44 10.061 6.524 -9.042 321 HE3 LYS 44 HE1 LYS 44 10.117 8.282 -8.958 322 HZ1 LYS 44 HZ3 LYS 44 12.471 6.477 -8.806 323 HZ2 LYS 44 HZ1 LYS 44 12.517 8.167 -8.752 324 HZ3 LYS 44 HZ2 LYS 44 12.014 7.378 -10.162 325 H ASP 45 HN ASP 45 8.635 2.878 -7.705 326 HA ASP 45 HA ASP 45 6.333 2.307 -9.236 327 HB2 ASP 45 HB2 ASP 45 9.027 1.308 -8.968 328 HB3 ASP 45 HB1 ASP 45 7.893 -0.031 -9.063 329 H ILE 46 HN ILE 46 7.741 0.867 -6.332 330 HA ILE 46 HA ILE 46 5.957 -1.216 -5.953 331 HB ILE 46 HB ILE 46 7.841 0.324 -4.274 332 HG12 ILE 46 HG12 ILE 46 8.893 -1.785 -4.032 333 HG13 ILE 46 HG11 ILE 46 7.465 -2.635 -4.590 334 HG21 ILE 46 HG21 ILE 46 5.692 -1.407 -3.101 335 HG22 ILE 46 HG22 ILE 46 6.185 0.222 -2.634 336 HG23 ILE 46 HG23 ILE 46 7.242 -1.149 -2.297 337 HD11 ILE 46 HD13 ILE 46 7.830 -1.477 -6.811 338 HD12 ILE 46 HD11 ILE 46 9.004 -2.710 -6.356 339 HD13 ILE 46 HD12 ILE 46 9.409 -1.006 -6.185 340 H PHE 47 HN PHE 47 5.868 2.053 -4.532 341 HA PHE 47 HA PHE 47 3.562 1.991 -3.107 342 HD1 PHE 47 HD2 PHE 47 2.193 3.212 -2.246 343 HD2 PHE 47 HD1 PHE 47 3.666 6.381 -4.668 344 HE1 PHE 47 HE2 PHE 47 0.297 4.619 -1.558 345 HE2 PHE 47 HE1 PHE 47 1.767 7.783 -3.990 346 HZ PHE 47 HZ PHE 47 0.085 6.892 -2.437 347 HB2 PHE 47 HB2 PHE 47 4.990 3.944 -3.231 348 HB3 PHE 47 HB1 PHE 47 4.534 4.214 -4.900 349 H ARG 48 HN ARG 48 3.884 1.903 -6.536 350 HA ARG 48 HA ARG 48 1.372 2.833 -7.351 351 HE ARG 48 HE ARG 48 3.046 4.901 -11.110 352 HB2 ARG 48 HB2 ARG 48 3.026 0.623 -8.584 353 HB3 ARG 48 HB1 ARG 48 1.660 1.408 -9.355 354 HG2 ARG 48 HG2 ARG 48 4.265 2.697 -8.575 355 HG3 ARG 48 HG1 ARG 48 3.698 2.344 -10.209 356 HD2 ARG 48 HD2 ARG 48 1.680 3.820 -9.586 357 HD3 ARG 48 HD1 ARG 48 2.694 4.400 -8.266 358 HH11 ARG 48 HH11 ARG 48 4.413 5.143 -7.902 359 HH12 ARG 48 HH12 ARG 48 5.524 6.394 -8.342 360 HH21 ARG 48 HH21 ARG 48 4.510 6.537 -11.681 361 HH22 ARG 48 HH22 ARG 48 5.585 7.181 -10.486 362 H PHE 49 HN PHE 49 2.306 -0.053 -5.701 363 HA PHE 49 HA PHE 49 0.352 -1.871 -6.243 364 HD1 PHE 49 HD2 PHE 49 1.171 -4.412 -5.157 365 HD2 PHE 49 HD1 PHE 49 -0.394 -1.853 -2.134 366 HE1 PHE 49 HE2 PHE 49 -0.074 -6.305 -4.201 367 HE2 PHE 49 HE1 PHE 49 -1.638 -3.744 -1.174 368 HZ PHE 49 HZ PHE 49 -1.482 -5.973 -2.209 369 HB2 PHE 49 HB2 PHE 49 2.188 -2.229 -4.645 370 HB3 PHE 49 HB1 PHE 49 1.414 -1.134 -3.506 371 H ILE 50 HN ILE 50 0.118 0.798 -3.885 372 HA ILE 50 HA ILE 50 -2.631 0.314 -3.308 373 HB ILE 50 HB ILE 50 -1.674 3.074 -2.908 374 HG12 ILE 50 HG12 ILE 50 -0.280 0.741 -1.610 375 HG13 ILE 50 HG11 ILE 50 0.446 2.113 -2.442 376 HG21 ILE 50 HG21 ILE 50 -2.724 2.842 -0.795 377 HG22 ILE 50 HG22 ILE 50 -2.827 1.107 -1.024 378 HG23 ILE 50 HG23 ILE 50 -3.779 2.172 -2.040 379 HD11 ILE 50 HD13 ILE 50 -0.169 1.793 0.333 380 HD12 ILE 50 HD11 ILE 50 -1.014 3.199 -0.316 381 HD13 ILE 50 HD12 ILE 50 0.741 3.074 -0.473 382 H ASP 51 HN ASP 51 -3.465 3.219 -3.638 383 HA ASP 51 HA ASP 51 -4.114 2.972 -6.471 384 HB2 ASP 51 HB2 ASP 51 -5.684 3.636 -4.294 385 HB3 ASP 51 HB1 ASP 51 -5.352 5.185 -5.043 386 H ASN 52 HN ASN 52 -1.606 4.191 -5.066 387 HA ASN 52 HA ASN 52 -1.064 6.674 -5.390 388 HB2 ASN 52 HB2 ASN 52 0.715 5.112 -5.056 389 HB3 ASN 52 HB1 ASN 52 0.610 4.561 -6.724 390 HD21 ASN 52 HD21 ASN 52 0.359 7.920 -5.737 391 HD22 ASN 52 HD22 ASN 52 1.842 8.436 -6.451 392 H ASP 53 HN ASP 53 -2.255 4.958 -8.154 393 HA ASP 53 HA ASP 53 -1.644 7.269 -9.853 394 HB2 ASP 53 HB2 ASP 53 -1.000 4.988 -10.667 395 HB3 ASP 53 HB1 ASP 53 -2.709 4.560 -10.621 396 H GLN 54 HN GLN 54 -3.350 8.638 -8.987 397 HA GLN 54 HA GLN 54 -5.902 8.032 -10.119 398 HB2 GLN 54 HB2 GLN 54 -7.118 8.326 -7.955 399 HB3 GLN 54 HB1 GLN 54 -6.217 6.827 -8.121 400 HG2 GLN 54 HG2 GLN 54 -4.444 7.670 -6.756 401 HG3 GLN 54 HG1 GLN 54 -5.231 9.251 -6.656 402 HE21 GLN 54 HE21 GLN 54 -5.668 9.399 -4.553 403 HE22 GLN 54 HE22 GLN 54 -6.608 8.285 -3.619 404 H SER 55 HN SER 55 -4.175 10.237 -7.888 405 HA SER 55 HA SER 55 -5.068 12.491 -9.460 406 HG SER 55 HG SER 55 -7.736 11.676 -6.993 407 HB2 SER 55 HB2 SER 55 -5.839 12.571 -6.553 408 HB3 SER 55 HB1 SER 55 -6.396 13.596 -7.877 409 H GLY 56 HN GLY 56 -2.512 11.265 -8.455 410 HA2 GLY 56 HA2 GLY 56 -0.457 12.385 -8.133 411 HA3 GLY 56 HA1 GLY 56 -1.345 13.792 -7.558 412 H TYR 57 HN TYR 57 -2.924 11.817 -5.822 413 HA TYR 57 HA TYR 57 -1.011 10.896 -3.886 414 HD1 TYR 57 HD2 TYR 57 -4.227 11.741 -1.774 415 HD2 TYR 57 HD1 TYR 57 -2.739 14.960 -4.072 416 HE1 TYR 57 HE2 TYR 57 -6.430 12.835 -1.648 417 HE2 TYR 57 HE1 TYR 57 -4.931 16.074 -3.978 418 HH TYR 57 HH TYR 57 -7.278 15.482 -3.604 419 HB2 TYR 57 HB2 TYR 57 -1.700 12.290 -2.067 420 HB3 TYR 57 HB1 TYR 57 -1.267 13.365 -3.374 421 H LEU 58 HN LEU 58 -2.160 9.851 -2.036 422 HA LEU 58 HA LEU 58 -4.790 8.936 -2.922 423 HG LEU 58 HG LEU 58 -1.770 7.671 -3.274 424 HB2 LEU 58 HB2 LEU 58 -2.956 7.360 -1.187 425 HB3 LEU 58 HB1 LEU 58 -4.371 6.801 -2.055 426 HD11 LEU 58 HD11 LEU 58 -2.316 5.320 -2.106 427 HD12 LEU 58 HD12 LEU 58 -1.218 5.500 -3.472 428 HD13 LEU 58 HD13 LEU 58 -2.889 5.004 -3.735 429 HD21 LEU 58 HD23 LEU 58 -2.725 7.366 -5.405 430 HD22 LEU 58 HD21 LEU 58 -3.888 8.317 -4.515 431 HD23 LEU 58 HD22 LEU 58 -4.155 6.606 -4.752 432 H ASP 59 HN ASP 59 -6.446 8.631 -1.406 433 HA ASP 59 HA ASP 59 -5.832 9.572 1.290 434 HB2 ASP 59 HB2 ASP 59 -6.439 11.437 -0.314 435 HB3 ASP 59 HB1 ASP 59 -8.077 10.790 -0.284 436 H GLY 60 HN GLY 60 -7.386 9.222 2.798 437 HA2 GLY 60 HA2 GLY 60 -8.261 6.732 3.182 438 HA3 GLY 60 HA1 GLY 60 -9.112 8.110 3.862 439 H ASP 61 HN ASP 61 -9.983 9.058 1.219 440 HA ASP 61 HA ASP 61 -12.430 7.572 1.108 441 HB2 ASP 61 HB2 ASP 61 -12.205 10.058 0.709 442 HB3 ASP 61 HB1 ASP 61 -11.418 9.667 -0.825 443 H GLU 62 HN GLU 62 -9.678 8.095 -1.015 444 HA GLU 62 HA GLU 62 -10.675 6.376 -3.093 445 HB2 GLU 62 HB2 GLU 62 -8.135 7.899 -2.707 446 HB3 GLU 62 HB1 GLU 62 -8.479 6.947 -4.144 447 HG2 GLU 62 HG2 GLU 62 -10.061 9.302 -3.150 448 HG3 GLU 62 HG1 GLU 62 -8.937 9.309 -4.506 449 H LEU 63 HN LEU 63 -8.544 6.056 -0.369 450 HA LEU 63 HA LEU 63 -6.659 4.258 -1.191 451 HG LEU 63 HG LEU 63 -6.875 6.411 1.106 452 HB2 LEU 63 HB2 LEU 63 -8.113 4.449 1.432 453 HB3 LEU 63 HB1 LEU 63 -6.708 3.436 1.185 454 HD11 LEU 63 HD11 LEU 63 -4.673 5.378 2.567 455 HD12 LEU 63 HD12 LEU 63 -6.160 4.590 3.095 456 HD13 LEU 63 HD13 LEU 63 -6.033 6.346 3.131 457 HD21 LEU 63 HD23 LEU 63 -4.720 4.658 0.001 458 HD22 LEU 63 HD21 LEU 63 -4.412 6.319 0.515 459 HD23 LEU 63 HD22 LEU 63 -5.563 6.000 -0.791 460 H LYS 64 HN LYS 64 -9.931 3.387 0.011 461 HA LYS 64 HA LYS 64 -9.645 0.682 -0.175 462 HB2 LYS 64 HB2 LYS 64 -12.222 0.845 -0.745 463 HB3 LYS 64 HB1 LYS 64 -11.612 1.252 0.844 464 HG2 LYS 64 HG2 LYS 64 -11.773 3.583 0.390 465 HG3 LYS 64 HG1 LYS 64 -12.091 3.286 -1.321 466 HD2 LYS 64 HD2 LYS 64 -13.977 1.936 0.427 467 HD3 LYS 64 HD1 LYS 64 -13.978 3.684 0.655 468 HE2 LYS 64 HE2 LYS 64 -14.328 3.995 -1.733 469 HE3 LYS 64 HE1 LYS 64 -14.278 2.250 -1.976 470 HZ1 LYS 64 HZ3 LYS 64 -16.296 3.701 -0.350 471 HZ2 LYS 64 HZ1 LYS 64 -16.255 2.030 -0.615 472 HZ3 LYS 64 HZ2 LYS 64 -16.548 3.085 -1.904 473 H TYR 65 HN TYR 65 -9.745 2.898 -2.798 474 HA TYR 65 HA TYR 65 -10.759 1.025 -4.721 475 HD1 TYR 65 HD1 TYR 65 -12.344 2.062 -4.108 476 HD2 TYR 65 HD2 TYR 65 -10.731 5.512 -6.005 477 HE1 TYR 65 HE1 TYR 65 -14.435 3.274 -3.669 478 HE2 TYR 65 HE2 TYR 65 -12.820 6.733 -5.571 479 HH TYR 65 HH TYR 65 -15.159 6.282 -5.120 480 HB2 TYR 65 HB2 TYR 65 -9.277 3.620 -5.165 481 HB3 TYR 65 HB1 TYR 65 -10.088 2.684 -6.410 482 H PHE 66 HN PHE 66 -7.721 1.444 -3.219 483 HA PHE 66 HA PHE 66 -5.868 0.895 -5.166 484 HD1 PHE 66 HD2 PHE 66 -3.849 -1.403 -4.499 485 HD2 PHE 66 HD1 PHE 66 -5.845 -0.931 -0.785 486 HE1 PHE 66 HE2 PHE 66 -3.009 -3.601 -3.776 487 HE2 PHE 66 HE1 PHE 66 -5.016 -3.123 -0.043 488 HZ PHE 66 HZ PHE 66 -3.592 -4.464 -1.543 489 HB2 PHE 66 HB2 PHE 66 -4.569 0.948 -3.319 490 HB3 PHE 66 HB1 PHE 66 -5.980 0.749 -2.301 491 H LEU 67 HN LEU 67 -7.651 -1.544 -3.292 492 HA LEU 67 HA LEU 67 -6.722 -3.784 -4.733 493 HG LEU 67 HG LEU 67 -6.994 -4.006 -1.858 494 HB2 LEU 67 HB2 LEU 67 -9.014 -3.213 -2.927 495 HB3 LEU 67 HB1 LEU 67 -9.117 -4.660 -3.916 496 HD11 LEU 67 HD11 LEU 67 -9.229 -6.016 -1.964 497 HD12 LEU 67 HD12 LEU 67 -8.989 -4.715 -0.797 498 HD13 LEU 67 HD13 LEU 67 -7.895 -6.098 -0.813 499 HD21 LEU 67 HD23 LEU 67 -7.216 -6.336 -3.757 500 HD22 LEU 67 HD21 LEU 67 -6.153 -6.293 -2.350 501 HD23 LEU 67 HD22 LEU 67 -5.918 -5.146 -3.666 502 H GLN 68 HN GLN 68 -9.361 -1.563 -5.158 503 HA GLN 68 HA GLN 68 -10.685 -2.908 -7.227 504 HB2 GLN 68 HB2 GLN 68 -10.640 -0.046 -6.334 505 HB3 GLN 68 HB1 GLN 68 -11.542 -0.533 -7.752 506 HG2 GLN 68 HG2 GLN 68 -12.542 -2.330 -6.137 507 HG3 GLN 68 HG1 GLN 68 -12.000 -1.200 -4.893 508 HE21 GLN 68 HE21 GLN 68 -14.705 -1.982 -5.620 509 HE22 GLN 68 HE22 GLN 68 -15.531 -0.525 -6.046 510 H LYS 69 HN LYS 69 -8.032 -0.525 -7.256 511 HA LYS 69 HA LYS 69 -7.805 -0.161 -9.977 512 HB2 LYS 69 HB2 LYS 69 -5.521 -0.418 -8.024 513 HB3 LYS 69 HB1 LYS 69 -5.496 0.454 -9.546 514 HG2 LYS 69 HG2 LYS 69 -6.838 1.164 -6.981 515 HG3 LYS 69 HG1 LYS 69 -5.696 2.105 -7.923 516 HD2 LYS 69 HD2 LYS 69 -8.557 1.499 -8.616 517 HD3 LYS 69 HD1 LYS 69 -7.895 3.063 -8.139 518 HE2 LYS 69 HE2 LYS 69 -6.531 3.124 -10.148 519 HE3 LYS 69 HE1 LYS 69 -7.118 1.531 -10.620 520 HZ1 LYS 69 HZ3 LYS 69 -9.340 2.435 -10.817 521 HZ2 LYS 69 HZ1 LYS 69 -8.271 3.312 -11.793 522 HZ3 LYS 69 HZ2 LYS 69 -8.802 3.960 -10.323 523 H PHE 70 HN PHE 70 -5.992 -2.424 -7.948 524 HA PHE 70 HA PHE 70 -4.737 -3.749 -10.099 525 HD1 PHE 70 HD2 PHE 70 -3.667 -6.635 -9.420 526 HD2 PHE 70 HD1 PHE 70 -5.716 -5.457 -5.882 527 HE1 PHE 70 HE2 PHE 70 -3.919 -9.000 -8.782 528 HE2 PHE 70 HE1 PHE 70 -5.973 -7.811 -5.236 529 HZ PHE 70 HZ PHE 70 -5.075 -9.591 -6.687 530 HB2 PHE 70 HB2 PHE 70 -3.489 -4.267 -8.315 531 HB3 PHE 70 HB1 PHE 70 -4.777 -3.844 -7.207 532 H GLN 71 HN GLN 71 -7.658 -4.397 -8.220 533 HA GLN 71 HA GLN 71 -8.610 -6.105 -10.396 534 HB2 GLN 71 HB2 GLN 71 -7.715 -7.713 -8.888 535 HB3 GLN 71 HB1 GLN 71 -8.334 -6.857 -7.487 536 HG2 GLN 71 HG2 GLN 71 -10.607 -7.482 -8.949 537 HG3 GLN 71 HG1 GLN 71 -9.578 -8.902 -9.104 538 HE21 GLN 71 HE21 GLN 71 -11.134 -6.748 -6.829 539 HE22 GLN 71 HE22 GLN 71 -11.168 -7.845 -5.503 540 H SER 72 HN SER 72 -10.461 -5.249 -10.988 541 HA SER 72 HA SER 72 -11.897 -3.279 -9.540 542 HG SER 72 HG SER 72 -13.557 -2.252 -11.118 543 HB2 SER 72 HB2 SER 72 -11.800 -3.334 -12.000 544 HB3 SER 72 HB1 SER 72 -12.738 -4.822 -11.967 545 H ASP 73 HN ASP 73 -11.893 -5.273 -7.762 546 HA ASP 73 HA ASP 73 -14.662 -5.909 -7.476 547 HB2 ASP 73 HB2 ASP 73 -12.601 -8.084 -7.849 548 HB3 ASP 73 HB1 ASP 73 -14.175 -8.361 -7.121 549 H ALA 74 HN ALA 74 -12.351 -4.463 -6.112 550 HA ALA 74 HA ALA 74 -11.576 -5.851 -3.796 551 HB1 ALA 74 HB3 ALA 74 -10.819 -3.779 -3.000 552 HB2 ALA 74 HB1 ALA 74 -12.019 -2.884 -3.926 553 HB3 ALA 74 HB2 ALA 74 -10.664 -3.646 -4.753 554 H ARG 75 HN ARG 75 -12.345 -5.556 -1.621 555 HA ARG 75 HA ARG 75 -15.236 -5.357 -1.509 556 HE ARG 75 HE ARG 75 -9.962 -5.179 0.867 557 HB2 ARG 75 HB2 ARG 75 -14.722 -5.874 1.019 558 HB3 ARG 75 HB1 ARG 75 -14.642 -7.143 -0.193 559 HG2 ARG 75 HG2 ARG 75 -12.775 -7.284 1.337 560 HG3 ARG 75 HG1 ARG 75 -12.212 -6.906 -0.287 561 HD2 ARG 75 HD2 ARG 75 -12.081 -4.522 0.357 562 HD3 ARG 75 HD1 ARG 75 -12.559 -4.965 1.996 563 HH11 ARG 75 HH11 ARG 75 -12.157 -6.731 3.086 564 HH12 ARG 75 HH12 ARG 75 -10.896 -7.464 4.019 565 HH21 ARG 75 HH21 ARG 75 -8.297 -6.130 2.099 566 HH22 ARG 75 HH22 ARG 75 -8.703 -7.116 3.465 567 H GLU 76 HN GLU 76 -12.698 -3.254 -1.294 568 HA GLU 76 HA GLU 76 -12.811 -0.968 -1.050 569 HB2 GLU 76 HB2 GLU 76 -15.221 -1.351 0.726 570 HB3 GLU 76 HB1 GLU 76 -14.603 0.153 0.073 571 HG2 GLU 76 HG2 GLU 76 -15.174 -0.478 -2.149 572 HG3 GLU 76 HG1 GLU 76 -15.600 -2.102 -1.627 573 H LEU 77 HN LEU 77 -11.227 -2.651 0.225 574 HA LEU 77 HA LEU 77 -10.119 -3.232 2.190 575 HG LEU 77 HG LEU 77 -8.731 -1.704 0.111 576 HB2 LEU 77 HB2 LEU 77 -9.939 -0.313 1.645 577 HB3 LEU 77 HB1 LEU 77 -9.068 -0.985 3.003 578 HD11 LEU 77 HD11 LEU 77 -7.348 0.018 2.036 579 HD12 LEU 77 HD12 LEU 77 -7.442 0.102 0.279 580 HD13 LEU 77 HD13 LEU 77 -6.312 -1.012 1.050 581 HD21 LEU 77 HD23 LEU 77 -6.720 -2.978 1.320 582 HD22 LEU 77 HD21 LEU 77 -8.266 -3.742 0.946 583 HD23 LEU 77 HD22 LEU 77 -7.960 -3.120 2.561 584 H THR 78 HN THR 78 -12.964 -2.836 2.802 585 HA THR 78 HA THR 78 -14.415 -2.378 4.521 586 HB THR 78 HB THR 78 -13.913 -3.509 6.518 587 HG1 THR 78 HG1 THR 78 -11.726 -3.898 7.163 588 HG21 THR 78 HG23 THR 78 -13.065 -5.600 5.822 589 HG22 THR 78 HG21 THR 78 -12.039 -4.858 4.595 590 HG23 THR 78 HG22 THR 78 -13.788 -4.888 4.379 591 H GLU 79 HN GLU 79 -14.385 -1.452 6.977 592 HA GLU 79 HA GLU 79 -13.628 1.267 6.750 593 HB2 GLU 79 HB2 GLU 79 -14.404 -0.335 9.198 594 HB3 GLU 79 HB1 GLU 79 -14.283 1.418 9.136 595 HG2 GLU 79 HG2 GLU 79 -16.068 1.472 7.458 596 HG3 GLU 79 HG1 GLU 79 -16.200 -0.284 7.558 597 H SER 80 HN SER 80 -12.390 -1.449 8.608 598 HA SER 80 HA SER 80 -10.261 -0.095 9.859 599 HG SER 80 HG SER 80 -9.560 -2.006 11.763 600 HB2 SER 80 HB2 SER 80 -11.351 -2.191 10.651 601 HB3 SER 80 HB1 SER 80 -10.488 -3.060 9.385 602 H GLU 81 HN GLU 81 -10.181 -2.284 6.984 603 HA GLU 81 HA GLU 81 -7.410 -2.401 6.822 604 HB2 GLU 81 HB2 GLU 81 -9.448 -3.493 5.360 605 HB3 GLU 81 HB1 GLU 81 -8.734 -2.376 4.218 606 HG2 GLU 81 HG2 GLU 81 -7.318 -4.584 5.656 607 HG3 GLU 81 HG1 GLU 81 -7.714 -4.513 3.940 608 H THR 82 HN THR 82 -9.561 0.011 5.224 609 HA THR 82 HA THR 82 -7.550 1.274 3.790 610 HB THR 82 HB THR 82 -8.940 3.344 3.956 611 HG1 THR 82 HG1 THR 82 -11.051 3.009 4.929 612 HG21 THR 82 HG23 THR 82 -10.383 0.816 3.174 613 HG22 THR 82 HG21 THR 82 -9.242 1.713 2.170 614 HG23 THR 82 HG22 THR 82 -10.783 2.445 2.626 615 H LYS 83 HN LYS 83 -8.178 1.266 7.192 616 HA LYS 83 HA LYS 83 -6.921 3.653 7.966 617 HB2 LYS 83 HB2 LYS 83 -8.159 2.128 9.518 618 HB3 LYS 83 HB1 LYS 83 -6.821 0.991 9.412 619 HG2 LYS 83 HG2 LYS 83 -5.337 2.546 10.468 620 HG3 LYS 83 HG1 LYS 83 -6.570 3.809 10.438 621 HD2 LYS 83 HD2 LYS 83 -7.968 2.487 11.941 622 HD3 LYS 83 HD1 LYS 83 -6.759 1.202 11.948 623 HE2 LYS 83 HE2 LYS 83 -6.293 4.023 12.905 624 HE3 LYS 83 HE1 LYS 83 -6.651 2.650 13.951 625 HZ1 LYS 83 HZ3 LYS 83 -4.627 1.580 13.178 626 HZ2 LYS 83 HZ1 LYS 83 -4.278 3.094 13.848 627 HZ3 LYS 83 HZ2 LYS 83 -4.286 2.893 12.169 628 H SER 84 HN SER 84 -5.734 0.488 7.171 629 HA SER 84 HA SER 84 -3.055 0.680 7.692 630 HG SER 84 HG SER 84 -3.888 -1.739 7.827 631 HB2 SER 84 HB2 SER 84 -4.346 -0.597 5.273 632 HB3 SER 84 HB1 SER 84 -2.806 -1.030 5.984 633 H LEU 85 HN LEU 85 -4.701 1.426 4.640 634 HA LEU 85 HA LEU 85 -2.497 2.500 3.307 635 HG LEU 85 HG LEU 85 -4.879 0.654 2.315 636 HB2 LEU 85 HB2 LEU 85 -5.471 2.800 3.036 637 HB3 LEU 85 HB1 LEU 85 -4.376 3.580 1.930 638 HD11 LEU 85 HD11 LEU 85 -4.994 2.534 -0.027 639 HD12 LEU 85 HD12 LEU 85 -6.316 1.633 0.715 640 HD13 LEU 85 HD13 LEU 85 -5.069 0.780 -0.189 641 HD21 LEU 85 HD23 LEU 85 -2.477 0.862 2.318 642 HD22 LEU 85 HD21 LEU 85 -2.533 1.889 0.886 643 HD23 LEU 85 HD22 LEU 85 -3.018 0.198 0.780 644 H MET 86 HN MET 86 -4.877 3.882 5.421 645 HA MET 86 HA MET 86 -4.228 6.616 5.090 646 HB2 MET 86 HB2 MET 86 -5.497 5.147 7.405 647 HB3 MET 86 HB1 MET 86 -5.383 6.898 7.300 648 HG2 MET 86 HG2 MET 86 -6.574 5.645 4.946 649 HG3 MET 86 HG1 MET 86 -7.481 5.392 6.438 650 HE1 MET 86 HE3 MET 86 -5.318 8.764 5.902 651 HE2 MET 86 HE1 MET 86 -6.369 9.496 4.691 652 HE3 MET 86 HE2 MET 86 -5.573 7.956 4.356 653 H ASP 87 HN ASP 87 -3.400 4.372 7.698 654 HA ASP 87 HA ASP 87 -1.755 6.077 9.176 655 HB2 ASP 87 HB2 ASP 87 -2.053 3.094 9.056 656 HB3 ASP 87 HB1 ASP 87 -0.900 3.866 10.144 657 H ALA 88 HN ALA 88 -1.047 4.057 6.407 658 HA ALA 88 HA ALA 88 1.645 3.713 6.626 659 HB1 ALA 88 HB3 ALA 88 1.447 2.853 4.590 660 HB2 ALA 88 HB1 ALA 88 0.653 4.297 3.945 661 HB3 ALA 88 HB2 ALA 88 -0.271 3.130 4.891 662 H ALA 89 HN ALA 89 0.044 6.716 5.619 663 HA ALA 89 HA ALA 89 2.535 8.091 5.761 664 HB1 ALA 89 HB3 ALA 89 1.786 7.017 3.263 665 HB2 ALA 89 HB1 ALA 89 3.129 8.097 3.635 666 HB3 ALA 89 HB2 ALA 89 1.562 8.764 3.180 667 H ASP 90 HN ASP 90 2.224 10.176 6.078 668 HA ASP 90 HA ASP 90 1.081 11.930 7.054 669 HB2 ASP 90 HB2 ASP 90 1.482 12.065 4.394 670 HB3 ASP 90 HB1 ASP 90 -0.246 12.324 4.482 671 H ASN 91 HN ASN 91 -0.348 10.546 8.376 672 HA ASN 91 HA ASN 91 -3.133 10.603 7.449 673 HB2 ASN 91 HB2 ASN 91 -3.253 8.917 9.544 674 HB3 ASN 91 HB1 ASN 91 -2.941 8.386 7.897 675 HD21 ASN 91 HD21 ASN 91 -0.908 7.672 7.325 676 HD22 ASN 91 HD22 ASN 91 0.341 7.416 8.486 677 H ASP 92 HN ASP 92 -0.947 11.372 10.067 678 HA ASP 92 HA ASP 92 -2.947 12.142 11.923 679 HB2 ASP 92 HB2 ASP 92 0.020 12.684 11.842 680 HB3 ASP 92 HB1 ASP 92 -1.026 13.051 13.205 681 H GLY 93 HN GLY 93 -1.537 13.818 9.221 682 HA2 GLY 93 HA2 GLY 93 -3.075 16.136 10.011 683 HA3 GLY 93 HA1 GLY 93 -1.344 16.392 9.927 684 H ASP 94 HN ASP 94 -3.306 14.379 7.773 685 HA ASP 94 HA ASP 94 -3.592 16.271 5.718 686 HB2 ASP 94 HB2 ASP 94 -1.035 15.847 5.767 687 HB3 ASP 94 HB1 ASP 94 -1.436 14.306 5.013 688 H GLY 95 HN GLY 95 -3.148 12.889 6.546 689 HA2 GLY 95 HA2 GLY 95 -4.377 11.030 6.021 690 HA3 GLY 95 HA1 GLY 95 -5.645 12.123 5.498 691 H LYS 96 HN LYS 96 -2.543 12.382 3.922 692 HA LYS 96 HA LYS 96 -3.735 10.999 1.644 693 HB2 LYS 96 HB2 LYS 96 -3.501 12.926 0.517 694 HB3 LYS 96 HB1 LYS 96 -2.581 13.639 1.836 695 HG2 LYS 96 HG2 LYS 96 -1.378 11.854 -0.266 696 HG3 LYS 96 HG1 LYS 96 -1.493 13.598 -0.419 697 HD2 LYS 96 HD2 LYS 96 0.215 11.991 1.495 698 HD3 LYS 96 HD1 LYS 96 0.688 13.220 0.323 699 HE2 LYS 96 HE2 LYS 96 -0.933 13.761 2.802 700 HE3 LYS 96 HE1 LYS 96 0.797 14.043 2.631 701 HZ1 LYS 96 HZ3 LYS 96 0.061 15.443 0.601 702 HZ2 LYS 96 HZ1 LYS 96 -0.073 16.099 2.155 703 HZ3 LYS 96 HZ2 LYS 96 -1.441 15.479 1.378 704 H ILE 97 HN ILE 97 -2.422 9.706 0.321 705 HA ILE 97 HA ILE 97 0.219 9.045 1.456 706 HB ILE 97 HB ILE 97 -1.369 7.122 -0.231 707 HG12 ILE 97 HG12 ILE 97 -2.773 7.535 1.699 708 HG13 ILE 97 HG11 ILE 97 -1.979 5.976 1.881 709 HG21 ILE 97 HG21 ILE 97 0.130 5.545 1.175 710 HG22 ILE 97 HG22 ILE 97 1.074 7.006 1.469 711 HG23 ILE 97 HG23 ILE 97 0.821 6.437 -0.180 712 HD11 ILE 97 HD13 ILE 97 -0.383 6.927 3.417 713 HD12 ILE 97 HD11 ILE 97 -2.030 7.237 3.967 714 HD13 ILE 97 HD12 ILE 97 -1.102 8.520 3.195 715 H GLY 98 HN GLY 98 1.434 10.371 0.099 716 HA2 GLY 98 HA2 GLY 98 1.198 9.892 -2.764 717 HA3 GLY 98 HA1 GLY 98 2.069 11.215 -1.997 718 H ALA 99 HN ALA 99 3.321 9.915 -3.937 719 HA ALA 99 HA ALA 99 4.784 7.591 -3.293 720 HB1 ALA 99 HB3 ALA 99 4.899 8.231 -5.544 721 HB2 ALA 99 HB1 ALA 99 6.509 8.602 -4.927 722 HB3 ALA 99 HB2 ALA 99 5.326 9.894 -5.144 723 H ASP 100 HN ASP 100 5.477 11.025 -2.803 724 HA ASP 100 HA ASP 100 7.963 10.749 -1.541 725 HB2 ASP 100 HB2 ASP 100 5.856 12.884 -1.130 726 HB3 ASP 100 HB1 ASP 100 7.538 13.005 -0.621 727 H GLU 101 HN GLU 101 4.714 11.099 -0.094 728 HA GLU 101 HA GLU 101 5.467 10.797 2.571 729 HB2 GLU 101 HB2 GLU 101 2.890 10.056 1.178 730 HB3 GLU 101 HB1 GLU 101 3.063 10.078 2.921 731 HG2 GLU 101 HG2 GLU 101 2.165 12.126 1.402 732 HG3 GLU 101 HG1 GLU 101 2.795 12.274 3.027 733 H PHE 102 HN PHE 102 4.212 8.366 0.304 734 HA PHE 102 HA PHE 102 4.543 6.113 1.858 735 HD1 PHE 102 HD1 PHE 102 6.736 4.391 -0.346 736 HD2 PHE 102 HD2 PHE 102 2.498 4.061 -0.117 737 HE1 PHE 102 HE1 PHE 102 6.935 1.947 -0.226 738 HE2 PHE 102 HE2 PHE 102 2.692 1.612 -0.016 739 HZ PHE 102 HZ PHE 102 4.914 0.550 -0.070 740 HB2 PHE 102 HB2 PHE 102 3.426 6.133 -0.356 741 HB3 PHE 102 HB1 PHE 102 5.001 6.267 -1.144 742 H GLN 103 HN GLN 103 6.918 7.714 -0.247 743 HA GLN 103 HA GLN 103 9.040 5.928 0.039 744 HB2 GLN 103 HB2 GLN 103 9.008 8.913 -0.363 745 HB3 GLN 103 HB1 GLN 103 10.498 7.978 -0.338 746 HG2 GLN 103 HG2 GLN 103 8.412 6.966 -2.128 747 HG3 GLN 103 HG1 GLN 103 9.067 8.547 -2.535 748 HE21 GLN 103 HE21 GLN 103 10.130 7.882 -4.354 749 HE22 GLN 103 HE22 GLN 103 11.512 6.843 -4.319 750 H GLU 104 HN GLU 104 7.842 8.425 2.183 751 HA GLU 104 HA GLU 104 10.072 8.507 3.939 752 HB2 GLU 104 HB2 GLU 104 7.171 9.205 4.430 753 HB3 GLU 104 HB1 GLU 104 8.472 9.530 5.564 754 HG2 GLU 104 HG2 GLU 104 8.285 10.641 2.776 755 HG3 GLU 104 HG1 GLU 104 7.851 11.501 4.250 756 H MET 105 HN MET 105 7.068 6.639 3.938 757 HA MET 105 HA MET 105 7.364 5.391 6.416 758 HB2 MET 105 HB2 MET 105 5.524 5.339 4.399 759 HB3 MET 105 HB1 MET 105 6.151 3.690 4.403 760 HG2 MET 105 HG2 MET 105 4.849 5.206 6.644 761 HG3 MET 105 HG1 MET 105 4.309 3.738 5.854 762 HE1 MET 105 HE3 MET 105 4.665 4.218 9.157 763 HE2 MET 105 HE1 MET 105 5.079 2.537 9.494 764 HE3 MET 105 HE2 MET 105 3.831 2.918 8.306 765 H VAL 106 HN VAL 106 8.338 4.212 3.194 766 HA VAL 106 HA VAL 106 9.578 1.849 4.034 767 HB VAL 106 HB VAL 106 9.116 2.062 1.714 768 HG11 VAL 106 HG11 VAL 106 10.926 4.467 1.689 769 HG12 VAL 106 HG12 VAL 106 9.170 4.480 1.540 770 HG13 VAL 106 HG13 VAL 106 10.150 3.741 0.285 771 HG21 VAL 106 HG23 VAL 106 11.670 1.374 2.645 772 HG22 VAL 106 HG21 VAL 106 11.936 2.329 1.188 773 HG23 VAL 106 HG22 VAL 106 10.924 0.887 1.123 774 H HIS 107 HN HIS 107 10.799 5.137 3.728 775 HA HIS 107 HA HIS 107 13.509 4.417 4.352 776 HD1 HIS 107 HD1 HIS 107 13.552 8.953 5.187 777 HD2 HIS 107 HD2 HIS 107 15.847 5.659 4.112 778 HE1 HIS 107 HE1 HIS 107 15.917 9.554 5.793 779 HE2 HIS 107 HE2 HIS 107 17.274 7.512 5.215 780 HB2 HIS 107 HB2 HIS 107 13.014 6.371 2.958 781 HB3 HIS 107 HB1 HIS 107 12.160 7.124 4.299 782 H SER 108 HN SER 108 10.684 5.279 6.147 783 HA SER 108 HA SER 108 11.791 6.305 8.479 784 HG SER 108 HG SER 108 9.669 4.555 10.269 785 HB2 SER 108 HB2 SER 108 9.397 6.336 8.115 786 HB3 SER 108 HB1 SER 108 9.335 4.573 8.124 Start of MODEL 20 1 HA SER 1 HA SER 1 2.033 -8.049 -9.290 2 HG SER 1 HG SER 1 -0.040 -10.028 -8.101 3 H1 SER 1 HT1 SER 1 1.941 -10.408 -8.843 4 H2 SER 1 HT2 SER 1 2.776 -10.193 -7.389 5 H3 SER 1 HT3 SER 1 3.541 -9.860 -8.859 6 HB2 SER 1 HB2 SER 1 0.915 -8.758 -6.565 7 HB3 SER 1 HB1 SER 1 0.487 -7.319 -7.492 8 H ILE 2 HN ILE 2 2.702 -6.003 -8.772 9 HA ILE 2 HA ILE 2 3.830 -4.320 -7.742 10 HB ILE 2 HB ILE 2 3.617 -6.186 -5.530 11 HG12 ILE 2 HG12 ILE 2 3.857 -3.234 -5.463 12 HG13 ILE 2 HG11 ILE 2 2.384 -4.036 -5.971 13 HG21 ILE 2 HG21 ILE 2 6.018 -4.381 -5.515 14 HG22 ILE 2 HG22 ILE 2 6.036 -6.144 -5.456 15 HG23 ILE 2 HG23 ILE 2 5.362 -5.224 -4.111 16 HD11 ILE 2 HD13 ILE 2 3.159 -5.194 -3.548 17 HD12 ILE 2 HD11 ILE 2 1.790 -4.127 -3.858 18 HD13 ILE 2 HD12 ILE 2 3.346 -3.453 -3.386 19 H THR 3 HN THR 3 5.572 -7.406 -7.417 20 HA THR 3 HA THR 3 7.908 -7.602 -7.384 21 HB THR 3 HB THR 3 8.469 -8.115 -9.752 22 HG1 THR 3 HG1 THR 3 5.864 -7.035 -10.178 23 HG21 THR 3 HG23 THR 3 5.761 -9.127 -8.890 24 HG22 THR 3 HG21 THR 3 7.291 -9.693 -8.215 25 HG23 THR 3 HG22 THR 3 6.928 -9.950 -9.925 26 H ASP 4 HN ASP 4 8.855 -6.312 -10.273 27 HA ASP 4 HA ASP 4 10.132 -4.553 -10.913 28 HB2 ASP 4 HB2 ASP 4 9.381 -3.227 -8.290 29 HB3 ASP 4 HB1 ASP 4 10.239 -2.474 -9.621 30 H ILE 5 HN ILE 5 10.827 -4.198 -7.408 31 HA ILE 5 HA ILE 5 13.240 -5.834 -7.819 32 HB ILE 5 HB ILE 5 13.318 -3.080 -6.614 33 HG12 ILE 5 HG12 ILE 5 14.832 -2.801 -8.782 34 HG13 ILE 5 HG11 ILE 5 13.706 -4.009 -9.368 35 HG21 ILE 5 HG21 ILE 5 14.989 -4.856 -5.872 36 HG22 ILE 5 HG22 ILE 5 15.610 -3.291 -6.401 37 HG23 ILE 5 HG23 ILE 5 15.680 -4.682 -7.487 38 HD11 ILE 5 HD13 ILE 5 12.762 -1.976 -9.995 39 HD12 ILE 5 HD11 ILE 5 13.126 -1.234 -8.438 40 HD13 ILE 5 HD12 ILE 5 11.861 -2.457 -8.555 41 H LEU 6 HN LEU 6 12.159 -7.275 -6.435 42 HA LEU 6 HA LEU 6 13.045 -7.166 -3.786 43 HG LEU 6 HG LEU 6 9.018 -6.017 -3.423 44 HB2 LEU 6 HB2 LEU 6 10.902 -7.092 -2.593 45 HB3 LEU 6 HB1 LEU 6 11.470 -5.614 -3.307 46 HD11 LEU 6 HD11 LEU 6 10.062 -5.778 -6.192 47 HD12 LEU 6 HD12 LEU 6 10.465 -4.539 -5.003 48 HD13 LEU 6 HD13 LEU 6 8.778 -4.882 -5.386 49 HD21 LEU 6 HD23 LEU 6 9.109 -8.361 -3.872 50 HD22 LEU 6 HD21 LEU 6 9.869 -8.061 -5.432 51 HD23 LEU 6 HD22 LEU 6 8.218 -7.521 -5.144 52 H SER 7 HN SER 7 12.109 -8.974 -2.353 53 HA SER 7 HA SER 7 12.323 -11.416 -3.805 54 HG SER 7 HG SER 7 13.323 -10.076 -1.087 55 HB2 SER 7 HB2 SER 7 11.332 -11.086 -0.967 56 HB3 SER 7 HB1 SER 7 12.039 -12.529 -1.687 57 H ALA 8 HN ALA 8 10.805 -12.382 -4.928 58 HA ALA 8 HA ALA 8 8.102 -11.546 -4.987 59 HB1 ALA 8 HB3 ALA 8 9.352 -12.522 -6.903 60 HB2 ALA 8 HB1 ALA 8 7.774 -13.257 -6.619 61 HB3 ALA 8 HB2 ALA 8 9.240 -14.095 -6.110 62 H GLU 9 HN GLU 9 9.624 -14.488 -3.642 63 HA GLU 9 HA GLU 9 7.220 -15.755 -2.918 64 HB2 GLU 9 HB2 GLU 9 10.010 -16.017 -1.816 65 HB3 GLU 9 HB1 GLU 9 8.685 -17.095 -1.389 66 HG2 GLU 9 HG2 GLU 9 9.746 -16.648 -4.156 67 HG3 GLU 9 HG1 GLU 9 10.166 -18.012 -3.120 68 H ASP 10 HN ASP 10 9.546 -14.048 -0.813 69 HA ASP 10 HA ASP 10 8.084 -14.008 1.463 70 HB2 ASP 10 HB2 ASP 10 9.947 -11.926 0.348 71 HB3 ASP 10 HB1 ASP 10 9.280 -11.825 1.974 72 H ILE 11 HN ILE 11 7.407 -12.270 -1.411 73 HA ILE 11 HA ILE 11 5.872 -10.198 -0.171 74 HB ILE 11 HB ILE 11 6.488 -11.081 -2.888 75 HG12 ILE 11 HG12 ILE 11 6.017 -8.425 -1.538 76 HG13 ILE 11 HG11 ILE 11 7.564 -9.173 -1.916 77 HG21 ILE 11 HG21 ILE 11 3.773 -9.947 -2.319 78 HG22 ILE 11 HG22 ILE 11 4.210 -11.308 -3.350 79 HG23 ILE 11 HG23 ILE 11 4.581 -9.662 -3.860 80 HD11 ILE 11 HD13 ILE 11 7.049 -7.352 -3.435 81 HD12 ILE 11 HD11 ILE 11 5.569 -8.168 -3.924 82 HD13 ILE 11 HD12 ILE 11 7.126 -8.889 -4.289 83 H ALA 12 HN ALA 12 5.071 -13.294 -1.715 84 HA ALA 12 HA ALA 12 2.296 -13.182 -1.375 85 HB1 ALA 12 HB3 ALA 12 3.931 -14.983 -2.502 86 HB2 ALA 12 HB1 ALA 12 2.265 -15.352 -2.042 87 HB3 ALA 12 HB2 ALA 12 3.594 -15.798 -0.973 88 H ALA 13 HN ALA 13 4.782 -14.618 0.735 89 HA ALA 13 HA ALA 13 2.962 -15.290 2.798 90 HB1 ALA 13 HB3 ALA 13 5.336 -16.148 2.504 91 HB2 ALA 13 HB1 ALA 13 4.861 -15.727 4.150 92 HB3 ALA 13 HB2 ALA 13 5.869 -14.624 3.215 93 H ALA 14 HN ALA 14 5.274 -12.644 2.533 94 HA ALA 14 HA ALA 14 4.667 -11.121 4.686 95 HB1 ALA 14 HB3 ALA 14 6.386 -10.326 3.288 96 HB2 ALA 14 HB1 ALA 14 5.137 -9.083 3.219 97 HB3 ALA 14 HB2 ALA 14 5.319 -10.228 1.885 98 H LEU 15 HN LEU 15 2.853 -11.223 1.655 99 HA LEU 15 HA LEU 15 0.895 -9.309 2.528 100 HG LEU 15 HG LEU 15 -0.520 -8.514 0.531 101 HB2 LEU 15 HB2 LEU 15 1.536 -9.793 0.122 102 HB3 LEU 15 HB1 LEU 15 0.644 -11.291 0.273 103 HD11 LEU 15 HD11 LEU 15 -1.532 -10.249 -1.570 104 HD12 LEU 15 HD12 LEU 15 0.180 -9.870 -1.756 105 HD13 LEU 15 HD13 LEU 15 -1.004 -8.567 -1.640 106 HD21 LEU 15 HD23 LEU 15 -1.827 -9.884 1.924 107 HD22 LEU 15 HD21 LEU 15 -1.755 -11.237 0.800 108 HD23 LEU 15 HD22 LEU 15 -2.700 -9.809 0.393 109 H GLN 16 HN GLN 16 0.859 -12.830 1.922 110 HA GLN 16 HA GLN 16 -1.804 -13.268 2.735 111 HB2 GLN 16 HB2 GLN 16 0.564 -14.977 2.112 112 HB3 GLN 16 HB1 GLN 16 -0.915 -15.674 2.750 113 HG2 GLN 16 HG2 GLN 16 -0.316 -15.231 0.118 114 HG3 GLN 16 HG1 GLN 16 -1.897 -15.607 0.793 115 HE21 GLN 16 HE21 GLN 16 0.099 -13.216 -0.669 116 HE22 GLN 16 HE22 GLN 16 -1.123 -12.007 -0.856 117 H GLU 17 HN GLU 17 0.823 -12.532 4.709 118 HA GLU 17 HA GLU 17 0.690 -14.631 6.593 119 HB2 GLU 17 HB2 GLU 17 2.635 -13.273 6.552 120 HB3 GLU 17 HB1 GLU 17 1.701 -11.802 6.768 121 HG2 GLU 17 HG2 GLU 17 1.116 -12.545 9.038 122 HG3 GLU 17 HG1 GLU 17 2.116 -13.975 8.801 123 H CYS 18 HN CYS 18 -0.234 -11.265 7.338 124 HA CYS 18 HA CYS 18 -2.356 -12.312 9.039 125 HG CYS 18 HG CYS 18 -3.573 -10.928 10.801 126 HB2 CYS 18 HB2 CYS 18 -0.469 -10.926 9.986 127 HB3 CYS 18 HB1 CYS 18 -1.144 -9.561 9.110 128 H GLN 19 HN GLN 19 -2.239 -11.301 5.996 129 HA GLN 19 HA GLN 19 -3.630 -8.968 5.660 130 HB2 GLN 19 HB2 GLN 19 -2.756 -10.185 3.784 131 HB3 GLN 19 HB1 GLN 19 -3.855 -11.513 4.085 132 HG2 GLN 19 HG2 GLN 19 -5.748 -10.013 3.570 133 HG3 GLN 19 HG1 GLN 19 -4.590 -8.742 3.177 134 HE21 GLN 19 HE21 GLN 19 -5.190 -8.579 1.020 135 HE22 GLN 19 HE22 GLN 19 -4.858 -9.828 -0.131 136 H ASP 20 HN ASP 20 -5.673 -8.336 5.455 137 HA ASP 20 HA ASP 20 -8.038 -9.691 5.595 138 HB2 ASP 20 HB2 ASP 20 -6.681 -9.784 8.123 139 HB3 ASP 20 HB1 ASP 20 -8.160 -8.845 8.295 140 HA PRO 21 HA PRO 21 -9.561 -5.534 5.517 141 HB2 PRO 21 HB2 PRO 21 -11.941 -5.613 6.656 142 HB3 PRO 21 HB1 PRO 21 -11.625 -6.539 5.198 143 HG2 PRO 21 HG2 PRO 21 -11.667 -7.429 8.059 144 HG3 PRO 21 HG1 PRO 21 -12.399 -8.203 6.639 145 HD2 PRO 21 HD2 PRO 21 -10.007 -8.960 7.685 146 HD3 PRO 21 HD1 PRO 21 -10.428 -9.128 5.974 147 H ASP 22 HN ASP 22 -7.684 -5.642 7.548 148 HA ASP 22 HA ASP 22 -7.969 -3.397 9.021 149 HB2 ASP 22 HB2 ASP 22 -8.658 -4.259 11.322 150 HB3 ASP 22 HB1 ASP 22 -9.940 -4.061 10.138 151 H THR 23 HN THR 23 -6.289 -6.239 8.481 152 HA THR 23 HA THR 23 -4.645 -6.077 10.857 153 HB THR 23 HB THR 23 -3.492 -8.020 9.891 154 HG1 THR 23 HG1 THR 23 -3.697 -7.639 7.697 155 HG21 THR 23 HG23 THR 23 -5.242 -8.710 11.238 156 HG22 THR 23 HG21 THR 23 -5.654 -9.470 9.702 157 HG23 THR 23 HG22 THR 23 -6.464 -7.984 10.193 158 H PHE 24 HN PHE 24 -4.303 -5.541 7.389 159 HA PHE 24 HA PHE 24 -2.722 -3.662 6.835 160 HD1 PHE 24 HD1 PHE 24 -1.081 -2.024 6.878 161 HD2 PHE 24 HD2 PHE 24 -0.602 -4.218 10.497 162 HE1 PHE 24 HE1 PHE 24 -0.753 0.078 8.108 163 HE2 PHE 24 HE2 PHE 24 -0.276 -2.116 11.730 164 HZ PHE 24 HZ PHE 24 -0.352 0.035 10.537 165 HB2 PHE 24 HB2 PHE 24 -0.976 -5.374 8.544 166 HB3 PHE 24 HB1 PHE 24 -0.249 -4.635 7.132 167 H GLU 25 HN GLU 25 -3.774 -4.664 4.955 168 HA GLU 25 HA GLU 25 -2.518 -6.887 3.679 169 HB2 GLU 25 HB2 GLU 25 -4.747 -6.673 3.087 170 HB3 GLU 25 HB1 GLU 25 -4.640 -4.929 2.925 171 HG2 GLU 25 HG2 GLU 25 -4.945 -6.042 0.771 172 HG3 GLU 25 HG1 GLU 25 -3.433 -5.147 0.879 173 HA PRO 26 HA PRO 26 -0.591 -3.512 0.895 174 HB2 PRO 26 HB2 PRO 26 -0.550 -0.973 1.973 175 HB3 PRO 26 HB1 PRO 26 -1.638 -1.592 0.752 176 HG2 PRO 26 HG2 PRO 26 -2.216 -0.894 3.449 177 HG3 PRO 26 HG1 PRO 26 -3.318 -1.344 2.148 178 HD2 PRO 26 HD2 PRO 26 -2.421 -2.919 4.390 179 HD3 PRO 26 HD1 PRO 26 -3.648 -3.300 3.171 180 H GLN 27 HN GLN 27 -0.106 -1.908 4.010 181 HA GLN 27 HA GLN 27 2.606 -1.476 3.660 182 HB2 GLN 27 HB2 GLN 27 1.791 -0.019 5.155 183 HB3 GLN 27 HB1 GLN 27 0.574 -1.137 5.736 184 HG2 GLN 27 HG2 GLN 27 1.910 -1.954 7.379 185 HG3 GLN 27 HG1 GLN 27 3.394 -1.567 6.515 186 HE21 GLN 27 HE21 GLN 27 0.776 0.716 6.901 187 HE22 GLN 27 HE22 GLN 27 1.605 1.786 7.966 188 H LYS 28 HN LYS 28 1.009 -4.248 5.209 189 HA LYS 28 HA LYS 28 3.365 -5.238 6.468 190 HB2 LYS 28 HB2 LYS 28 1.110 -5.994 7.105 191 HB3 LYS 28 HB1 LYS 28 0.926 -6.766 5.539 192 HG2 LYS 28 HG2 LYS 28 1.624 -8.592 6.613 193 HG3 LYS 28 HG1 LYS 28 3.223 -7.879 6.423 194 HD2 LYS 28 HD2 LYS 28 1.424 -7.655 8.825 195 HD3 LYS 28 HD1 LYS 28 2.935 -8.557 8.711 196 HE2 LYS 28 HE2 LYS 28 4.152 -6.466 8.344 197 HE3 LYS 28 HE1 LYS 28 2.640 -5.566 8.461 198 HZ1 LYS 28 HZ3 LYS 28 3.882 -7.184 10.621 199 HZ2 LYS 28 HZ1 LYS 28 2.401 -6.373 10.741 200 HZ3 LYS 28 HZ2 LYS 28 3.832 -5.495 10.543 201 H PHE 29 HN PHE 29 1.818 -5.849 3.392 202 HA PHE 29 HA PHE 29 3.298 -7.885 2.317 203 HD1 PHE 29 HD1 PHE 29 4.627 -5.847 -0.338 204 HD2 PHE 29 HD2 PHE 29 0.962 -7.962 -0.672 205 HE1 PHE 29 HE1 PHE 29 5.236 -6.531 -2.606 206 HE2 PHE 29 HE2 PHE 29 1.556 -8.649 -2.949 207 HZ PHE 29 HZ PHE 29 3.689 -7.926 -3.926 208 HB2 PHE 29 HB2 PHE 29 1.360 -6.883 1.234 209 HB3 PHE 29 HB1 PHE 29 2.211 -5.367 1.034 210 H PHE 30 HN PHE 30 3.992 -4.467 2.319 211 HA PHE 30 HA PHE 30 6.341 -4.598 0.711 212 HD1 PHE 30 HD1 PHE 30 4.686 -3.962 -0.572 213 HD2 PHE 30 HD2 PHE 30 3.851 -0.923 2.282 214 HE1 PHE 30 HE1 PHE 30 2.520 -3.546 -1.652 215 HE2 PHE 30 HE2 PHE 30 1.680 -0.502 1.200 216 HZ PHE 30 HZ PHE 30 1.018 -1.827 -0.768 217 HB2 PHE 30 HB2 PHE 30 5.670 -2.360 2.600 218 HB3 PHE 30 HB1 PHE 30 6.500 -2.275 1.044 219 H GLN 31 HN GLN 31 5.919 -3.897 4.158 220 HA GLN 31 HA GLN 31 8.540 -3.644 4.849 221 HB2 GLN 31 HB2 GLN 31 6.262 -4.759 6.482 222 HB3 GLN 31 HB1 GLN 31 7.760 -4.133 7.121 223 HG2 GLN 31 HG2 GLN 31 6.069 -2.400 5.404 224 HG3 GLN 31 HG1 GLN 31 5.654 -2.641 7.101 225 HE21 GLN 31 HE21 GLN 31 8.304 -1.740 4.989 226 HE22 GLN 31 HE22 GLN 31 9.037 -0.609 6.067 227 H THR 32 HN THR 32 6.631 -6.529 5.590 228 HA THR 32 HA THR 32 8.655 -8.095 6.543 229 HB THR 32 HB THR 32 6.271 -9.005 4.931 230 HG1 THR 32 HG1 THR 32 5.493 -9.403 7.147 231 HG21 THR 32 HG23 THR 32 8.039 -10.562 6.824 232 HG22 THR 32 HG21 THR 32 7.961 -10.771 5.074 233 HG23 THR 32 HG22 THR 32 6.559 -11.160 6.072 234 H SER 33 HN SER 33 7.510 -8.110 3.161 235 HA SER 33 HA SER 33 9.661 -9.851 2.374 236 HG SER 33 HG SER 33 6.382 -8.452 0.932 237 HB2 SER 33 HB2 SER 33 8.603 -9.793 0.172 238 HB3 SER 33 HB1 SER 33 7.447 -10.177 1.443 239 H GLY 34 HN GLY 34 8.600 -6.625 1.303 240 HA2 GLY 34 HA2 GLY 34 11.177 -6.486 -0.085 241 HA3 GLY 34 HA1 GLY 34 9.766 -5.575 -0.540 242 H LEU 35 HN LEU 35 9.108 -3.998 1.453 243 HA LEU 35 HA LEU 35 10.726 -1.848 1.213 244 HG LEU 35 HG LEU 35 9.594 0.237 2.483 245 HB2 LEU 35 HB2 LEU 35 8.504 -2.551 2.810 246 HB3 LEU 35 HB1 LEU 35 9.672 -1.706 3.812 247 HD11 LEU 35 HD11 LEU 35 8.249 -1.500 0.434 248 HD12 LEU 35 HD12 LEU 35 9.717 -0.530 0.257 249 HD13 LEU 35 HD13 LEU 35 8.141 0.257 0.378 250 HD21 LEU 35 HD23 LEU 35 6.749 -0.730 2.463 251 HD22 LEU 35 HD21 LEU 35 7.340 0.920 2.655 252 HD23 LEU 35 HD22 LEU 35 7.593 -0.262 3.939 253 H SER 36 HN SER 36 11.060 -4.253 3.779 254 HA SER 36 HA SER 36 12.758 -3.317 5.534 255 HG SER 36 HG SER 36 12.478 -6.443 3.466 256 HB2 SER 36 HB2 SER 36 13.966 -5.471 5.599 257 HB3 SER 36 HB1 SER 36 12.223 -5.678 5.438 258 H LYS 37 HN LYS 37 13.779 -3.674 2.160 259 HA LYS 37 HA LYS 37 16.246 -2.245 2.878 260 HB2 LYS 37 HB2 LYS 37 17.555 -3.622 1.359 261 HB3 LYS 37 HB1 LYS 37 16.860 -4.557 2.673 262 HG2 LYS 37 HG2 LYS 37 15.170 -5.413 1.232 263 HG3 LYS 37 HG1 LYS 37 15.699 -4.374 -0.091 264 HD2 LYS 37 HD2 LYS 37 16.800 -6.280 -0.673 265 HD3 LYS 37 HD1 LYS 37 18.001 -5.565 0.404 266 HE2 LYS 37 HE2 LYS 37 17.184 -6.931 2.247 267 HE3 LYS 37 HE1 LYS 37 15.947 -7.626 1.200 268 HZ1 LYS 37 HZ3 LYS 37 17.702 -8.565 -0.179 269 HZ2 LYS 37 HZ1 LYS 37 17.834 -9.106 1.419 270 HZ3 LYS 37 HZ2 LYS 37 18.882 -7.911 0.841 271 H MET 38 HN MET 38 13.700 -2.661 0.659 272 HA MET 38 HA MET 38 14.412 -1.837 -1.778 273 HB2 MET 38 HB2 MET 38 12.084 -0.544 -0.387 274 HB3 MET 38 HB1 MET 38 12.239 -0.941 -2.082 275 HG2 MET 38 HG2 MET 38 12.299 -3.357 -1.404 276 HG3 MET 38 HG1 MET 38 11.916 -2.803 0.193 277 HE1 MET 38 HE3 MET 38 10.211 -3.681 -3.339 278 HE2 MET 38 HE1 MET 38 8.981 -4.412 -2.311 279 HE3 MET 38 HE2 MET 38 10.693 -4.734 -2.008 280 H SER 39 HN SER 39 15.294 -0.138 -2.777 281 HA SER 39 HA SER 39 15.987 2.213 -1.288 282 HG SER 39 HG SER 39 16.901 3.252 -4.734 283 HB2 SER 39 HB2 SER 39 17.639 1.629 -2.853 284 HB3 SER 39 HB1 SER 39 16.456 1.293 -4.117 285 H ALA 40 HN ALA 40 15.555 4.367 -2.714 286 HA ALA 40 HA ALA 40 12.768 4.807 -2.453 287 HB1 ALA 40 HB3 ALA 40 14.395 6.660 -4.113 288 HB2 ALA 40 HB1 ALA 40 14.777 6.495 -2.397 289 HB3 ALA 40 HB2 ALA 40 13.160 7.004 -2.895 290 H SER 41 HN SER 41 14.826 4.304 -5.310 291 HA SER 41 HA SER 41 13.099 4.871 -7.333 292 HG SER 41 HG SER 41 16.385 4.300 -7.175 293 HB2 SER 41 HB2 SER 41 15.112 2.621 -7.200 294 HB3 SER 41 HB1 SER 41 14.363 3.211 -8.683 295 H GLN 42 HN GLN 42 13.507 1.576 -5.994 296 HA GLN 42 HA GLN 42 11.380 0.488 -7.486 297 HB2 GLN 42 HB2 GLN 42 11.472 -1.432 -5.966 298 HB3 GLN 42 HB1 GLN 42 13.085 -0.926 -6.470 299 HG2 GLN 42 HG2 GLN 42 13.215 0.376 -4.340 300 HG3 GLN 42 HG1 GLN 42 11.747 -0.464 -3.843 301 HE21 GLN 42 HE21 GLN 42 11.821 -2.596 -3.272 302 HE22 GLN 42 HE22 GLN 42 13.305 -3.480 -3.124 303 H VAL 43 HN VAL 43 11.486 2.190 -4.494 304 HA VAL 43 HA VAL 43 8.976 1.483 -3.443 305 HB VAL 43 HB VAL 43 10.334 4.167 -3.191 306 HG11 VAL 43 HG11 VAL 43 8.507 3.133 -1.123 307 HG12 VAL 43 HG12 VAL 43 7.787 3.751 -2.604 308 HG13 VAL 43 HG13 VAL 43 8.824 4.787 -1.634 309 HG21 VAL 43 HG23 VAL 43 10.417 2.533 -0.840 310 HG22 VAL 43 HG21 VAL 43 11.750 3.249 -1.742 311 HG23 VAL 43 HG22 VAL 43 11.118 1.670 -2.200 312 H LYS 44 HN LYS 44 9.928 4.018 -5.733 313 HA LYS 44 HA LYS 44 7.485 5.277 -6.099 314 HB2 LYS 44 HB2 LYS 44 9.783 4.724 -7.958 315 HB3 LYS 44 HB1 LYS 44 8.335 5.521 -8.554 316 HG2 LYS 44 HG2 LYS 44 8.968 7.469 -7.705 317 HG3 LYS 44 HG1 LYS 44 9.274 6.756 -6.121 318 HD2 LYS 44 HD2 LYS 44 11.287 7.787 -7.123 319 HD3 LYS 44 HD1 LYS 44 11.479 6.061 -6.816 320 HE2 LYS 44 HE2 LYS 44 12.377 6.753 -9.009 321 HE3 LYS 44 HE1 LYS 44 11.088 5.557 -9.141 322 HZ1 LYS 44 HZ3 LYS 44 9.543 7.327 -9.681 323 HZ2 LYS 44 HZ1 LYS 44 10.841 7.333 -10.765 324 HZ3 LYS 44 HZ2 LYS 44 10.766 8.485 -9.529 325 H ASP 45 HN ASP 45 8.744 2.301 -7.459 326 HA ASP 45 HA ASP 45 6.530 1.755 -9.154 327 HB2 ASP 45 HB2 ASP 45 9.048 0.541 -8.482 328 HB3 ASP 45 HB1 ASP 45 7.779 -0.668 -8.375 329 H ILE 46 HN ILE 46 7.566 0.527 -5.987 330 HA ILE 46 HA ILE 46 5.477 -1.140 -5.389 331 HB ILE 46 HB ILE 46 7.382 0.471 -3.796 332 HG12 ILE 46 HG12 ILE 46 8.177 -1.641 -3.107 333 HG13 ILE 46 HG11 ILE 46 6.695 -2.443 -3.602 334 HG21 ILE 46 HG21 ILE 46 4.894 -0.715 -2.646 335 HG22 ILE 46 HG22 ILE 46 5.656 0.843 -2.323 336 HG23 ILE 46 HG23 ILE 46 6.385 -0.637 -1.702 337 HD11 ILE 46 HD13 ILE 46 7.297 -1.852 -5.966 338 HD12 ILE 46 HD11 ILE 46 8.357 -3.014 -5.173 339 HD13 ILE 46 HD12 ILE 46 8.868 -1.341 -5.352 340 H PHE 47 HN PHE 47 5.684 2.342 -4.599 341 HA PHE 47 HA PHE 47 3.337 2.949 -3.482 342 HD1 PHE 47 HD1 PHE 47 2.073 5.525 -3.558 343 HD2 PHE 47 HD2 PHE 47 4.027 5.388 -7.337 344 HE1 PHE 47 HE1 PHE 47 0.387 7.062 -4.489 345 HE2 PHE 47 HE2 PHE 47 2.352 6.930 -8.266 346 HZ PHE 47 HZ PHE 47 0.528 7.768 -6.840 347 HB2 PHE 47 HB2 PHE 47 4.605 4.818 -3.950 348 HB3 PHE 47 HB1 PHE 47 4.976 4.300 -5.572 349 H ARG 48 HN ARG 48 3.804 2.134 -6.822 350 HA ARG 48 HA ARG 48 1.330 2.825 -7.881 351 HE ARG 48 HE ARG 48 4.506 5.266 -9.402 352 HB2 ARG 48 HB2 ARG 48 3.045 0.489 -8.716 353 HB3 ARG 48 HB1 ARG 48 1.797 1.265 -9.683 354 HG2 ARG 48 HG2 ARG 48 4.416 2.428 -8.791 355 HG3 ARG 48 HG1 ARG 48 3.881 2.100 -10.441 356 HD2 ARG 48 HD2 ARG 48 2.128 3.804 -10.191 357 HD3 ARG 48 HD1 ARG 48 2.682 4.130 -8.548 358 HH11 ARG 48 HH11 ARG 48 2.760 3.705 -11.994 359 HH12 ARG 48 HH12 ARG 48 3.556 4.609 -13.237 360 HH21 ARG 48 HH21 ARG 48 5.550 6.451 -11.039 361 HH22 ARG 48 HH22 ARG 48 5.136 6.169 -12.696 362 H PHE 49 HN PHE 49 2.160 0.145 -5.804 363 HA PHE 49 HA PHE 49 0.190 -1.665 -6.336 364 HD1 PHE 49 HD1 PHE 49 -1.263 -1.866 -2.951 365 HD2 PHE 49 HD2 PHE 49 2.470 0.188 -2.861 366 HE1 PHE 49 HE1 PHE 49 -1.925 -0.761 -0.878 367 HE2 PHE 49 HE2 PHE 49 1.816 1.282 -0.756 368 HZ PHE 49 HZ PHE 49 -0.384 0.811 0.241 369 HB2 PHE 49 HB2 PHE 49 0.722 -2.575 -4.309 370 HB3 PHE 49 HB1 PHE 49 2.091 -1.498 -4.462 371 H ILE 50 HN ILE 50 -0.067 1.143 -4.138 372 HA ILE 50 HA ILE 50 -2.818 0.794 -3.657 373 HB ILE 50 HB ILE 50 -2.505 3.490 -3.235 374 HG12 ILE 50 HG12 ILE 50 0.164 2.215 -2.695 375 HG13 ILE 50 HG11 ILE 50 -0.159 3.606 -3.718 376 HG21 ILE 50 HG21 ILE 50 -1.650 2.150 -0.910 377 HG22 ILE 50 HG22 ILE 50 -2.885 1.192 -1.715 378 HG23 ILE 50 HG23 ILE 50 -3.215 2.861 -1.276 379 HD11 ILE 50 HD13 ILE 50 -0.681 3.584 -0.758 380 HD12 ILE 50 HD11 ILE 50 -0.622 4.971 -1.838 381 HD13 ILE 50 HD12 ILE 50 0.854 4.089 -1.458 382 H ASP 51 HN ASP 51 -3.851 3.519 -4.307 383 HA ASP 51 HA ASP 51 -4.815 2.922 -6.866 384 HB2 ASP 51 HB2 ASP 51 -5.682 4.547 -4.954 385 HB3 ASP 51 HB1 ASP 51 -4.787 5.740 -5.887 386 H ASN 52 HN ASN 52 -4.620 4.826 -8.590 387 HA ASN 52 HA ASN 52 -1.864 4.740 -9.447 388 HB2 ASN 52 HB2 ASN 52 -3.663 4.322 -11.058 389 HB3 ASN 52 HB1 ASN 52 -4.277 5.952 -10.802 390 HD21 ASN 52 HD21 ASN 52 -4.006 6.585 -12.911 391 HD22 ASN 52 HD22 ASN 52 -2.453 6.837 -13.624 392 H ASP 53 HN ASP 53 -4.177 7.232 -8.554 393 HA ASP 53 HA ASP 53 -2.315 9.007 -7.494 394 HB2 ASP 53 HB2 ASP 53 -1.550 9.213 -9.854 395 HB3 ASP 53 HB1 ASP 53 -3.165 9.751 -10.305 396 H GLN 54 HN GLN 54 -5.287 8.619 -9.271 397 HA GLN 54 HA GLN 54 -7.412 9.232 -8.922 398 HB2 GLN 54 HB2 GLN 54 -6.611 10.066 -6.158 399 HB3 GLN 54 HB1 GLN 54 -8.132 9.380 -6.707 400 HG2 GLN 54 HG2 GLN 54 -7.078 7.241 -7.108 401 HG3 GLN 54 HG1 GLN 54 -5.508 7.902 -6.657 402 HE21 GLN 54 HE21 GLN 54 -6.536 9.412 -4.419 403 HE22 GLN 54 HE22 GLN 54 -6.818 8.252 -3.184 404 H SER 55 HN SER 55 -5.496 11.598 -7.081 405 HA SER 55 HA SER 55 -6.346 13.707 -8.872 406 HG SER 55 HG SER 55 -8.902 13.115 -6.413 407 HB2 SER 55 HB2 SER 55 -7.011 13.877 -5.923 408 HB3 SER 55 HB1 SER 55 -7.361 15.090 -7.156 409 H GLY 56 HN GLY 56 -3.824 12.528 -8.239 410 HA2 GLY 56 HA2 GLY 56 -1.746 13.735 -8.250 411 HA3 GLY 56 HA1 GLY 56 -2.481 14.932 -7.188 412 H TYR 57 HN TYR 57 -3.669 12.595 -5.647 413 HA TYR 57 HA TYR 57 -1.419 11.279 -4.441 414 HD1 TYR 57 HD2 TYR 57 0.128 14.211 -3.938 415 HD2 TYR 57 HD1 TYR 57 -3.996 14.594 -3.049 416 HE1 TYR 57 HE2 TYR 57 0.224 16.580 -4.600 417 HE2 TYR 57 HE1 TYR 57 -3.934 16.971 -3.718 418 HH TYR 57 HH TYR 57 -1.245 18.343 -5.345 419 HB2 TYR 57 HB2 TYR 57 -2.829 12.715 -2.327 420 HB3 TYR 57 HB1 TYR 57 -1.105 12.534 -2.585 421 H LEU 58 HN LEU 58 -2.168 9.934 -2.559 422 HA LEU 58 HA LEU 58 -4.867 8.977 -3.139 423 HG LEU 58 HG LEU 58 -1.773 8.008 -3.748 424 HB2 LEU 58 HB2 LEU 58 -2.784 7.499 -1.569 425 HB3 LEU 58 HB1 LEU 58 -4.194 6.846 -2.383 426 HD11 LEU 58 HD11 LEU 58 -2.364 5.365 -2.777 427 HD12 LEU 58 HD12 LEU 58 -0.869 5.991 -3.484 428 HD13 LEU 58 HD13 LEU 58 -2.153 5.366 -4.528 429 HD21 LEU 58 HD23 LEU 58 -3.094 6.720 -5.675 430 HD22 LEU 58 HD21 LEU 58 -3.300 8.437 -5.326 431 HD23 LEU 58 HD22 LEU 58 -4.445 7.265 -4.681 432 H ASP 59 HN ASP 59 -6.367 8.519 -1.386 433 HA ASP 59 HA ASP 59 -5.534 9.509 1.234 434 HB2 ASP 59 HB2 ASP 59 -6.458 11.424 -0.065 435 HB3 ASP 59 HB1 ASP 59 -7.993 10.570 -0.147 436 H GLY 60 HN GLY 60 -6.912 9.009 2.902 437 HA2 GLY 60 HA2 GLY 60 -7.532 6.370 3.177 438 HA3 GLY 60 HA1 GLY 60 -8.265 7.636 4.149 439 H ASP 61 HN ASP 61 -9.547 8.771 1.693 440 HA ASP 61 HA ASP 61 -12.000 7.307 1.931 441 HB2 ASP 61 HB2 ASP 61 -11.251 9.526 0.011 442 HB3 ASP 61 HB1 ASP 61 -12.885 8.958 0.355 443 H GLU 62 HN GLU 62 -9.688 7.959 -0.622 444 HA GLU 62 HA GLU 62 -10.942 6.235 -2.534 445 HB2 GLU 62 HB2 GLU 62 -8.323 7.664 -2.545 446 HB3 GLU 62 HB1 GLU 62 -8.998 6.820 -3.930 447 HG2 GLU 62 HG2 GLU 62 -10.247 9.161 -2.531 448 HG3 GLU 62 HG1 GLU 62 -9.344 9.240 -4.041 449 H LEU 63 HN LEU 63 -8.386 5.931 -0.228 450 HA LEU 63 HA LEU 63 -6.673 4.108 -1.218 451 HG LEU 63 HG LEU 63 -6.496 6.204 1.015 452 HB2 LEU 63 HB2 LEU 63 -7.841 4.339 1.540 453 HB3 LEU 63 HB1 LEU 63 -6.542 3.232 1.171 454 HD11 LEU 63 HD11 LEU 63 -4.296 5.151 2.408 455 HD12 LEU 63 HD12 LEU 63 -5.762 4.395 3.035 456 HD13 LEU 63 HD13 LEU 63 -5.612 6.149 3.014 457 HD21 LEU 63 HD23 LEU 63 -4.700 4.236 -0.264 458 HD22 LEU 63 HD21 LEU 63 -4.017 5.732 0.378 459 HD23 LEU 63 HD22 LEU 63 -5.276 5.800 -0.863 460 H LYS 64 HN LYS 64 -9.966 3.266 -0.046 461 HA LYS 64 HA LYS 64 -9.699 0.552 -0.054 462 HB2 LYS 64 HB2 LYS 64 -12.103 2.107 -0.992 463 HB3 LYS 64 HB1 LYS 64 -12.101 0.472 -0.371 464 HG2 LYS 64 HG2 LYS 64 -11.573 1.208 1.819 465 HG3 LYS 64 HG1 LYS 64 -11.242 2.844 1.246 466 HD2 LYS 64 HD2 LYS 64 -13.932 1.591 0.847 467 HD3 LYS 64 HD1 LYS 64 -13.516 2.366 2.378 468 HE2 LYS 64 HE2 LYS 64 -13.031 4.446 1.196 469 HE3 LYS 64 HE1 LYS 64 -13.405 3.669 -0.342 470 HZ1 LYS 64 HZ3 LYS 64 -15.317 4.072 1.895 471 HZ2 LYS 64 HZ1 LYS 64 -15.674 3.339 0.411 472 HZ3 LYS 64 HZ2 LYS 64 -15.266 4.980 0.469 473 H TYR 65 HN TYR 65 -9.865 2.661 -2.812 474 HA TYR 65 HA TYR 65 -10.708 0.631 -4.654 475 HD1 TYR 65 HD1 TYR 65 -12.351 1.726 -3.941 476 HD2 TYR 65 HD2 TYR 65 -10.727 5.210 -5.766 477 HE1 TYR 65 HE1 TYR 65 -14.290 3.027 -3.166 478 HE2 TYR 65 HE2 TYR 65 -12.666 6.519 -5.004 479 HH TYR 65 HH TYR 65 -14.996 6.136 -4.330 480 HB2 TYR 65 HB2 TYR 65 -9.344 3.219 -5.366 481 HB3 TYR 65 HB1 TYR 65 -10.397 2.244 -6.380 482 H PHE 66 HN PHE 66 -7.727 1.260 -3.181 483 HA PHE 66 HA PHE 66 -5.820 0.779 -5.092 484 HD1 PHE 66 HD2 PHE 66 -3.712 -1.431 -4.318 485 HD2 PHE 66 HD1 PHE 66 -5.796 -0.904 -0.664 486 HE1 PHE 66 HE2 PHE 66 -2.800 -3.567 -3.497 487 HE2 PHE 66 HE1 PHE 66 -4.912 -3.040 0.174 488 HZ PHE 66 HZ PHE 66 -3.401 -4.375 -1.247 489 HB2 PHE 66 HB2 PHE 66 -4.585 0.946 -3.205 490 HB3 PHE 66 HB1 PHE 66 -6.001 0.679 -2.234 491 H LEU 67 HN LEU 67 -7.597 -1.652 -3.260 492 HA LEU 67 HA LEU 67 -6.479 -3.914 -4.589 493 HG LEU 67 HG LEU 67 -6.790 -3.996 -1.688 494 HB2 LEU 67 HB2 LEU 67 -8.858 -3.458 -2.845 495 HB3 LEU 67 HB1 LEU 67 -8.771 -4.950 -3.769 496 HD11 LEU 67 HD11 LEU 67 -8.782 -6.258 -1.722 497 HD12 LEU 67 HD12 LEU 67 -8.809 -4.830 -0.685 498 HD13 LEU 67 HD13 LEU 67 -7.535 -6.035 -0.494 499 HD21 LEU 67 HD23 LEU 67 -6.764 -6.448 -3.439 500 HD22 LEU 67 HD21 LEU 67 -5.728 -6.209 -2.032 501 HD23 LEU 67 HD22 LEU 67 -5.586 -5.135 -3.423 502 H GLN 68 HN GLN 68 -9.182 -1.814 -5.124 503 HA GLN 68 HA GLN 68 -10.460 -3.338 -7.120 504 HB2 GLN 68 HB2 GLN 68 -10.572 -0.431 -6.351 505 HB3 GLN 68 HB1 GLN 68 -11.549 -1.096 -7.648 506 HG2 GLN 68 HG2 GLN 68 -12.275 -2.841 -5.891 507 HG3 GLN 68 HG1 GLN 68 -11.664 -1.670 -4.725 508 HE21 GLN 68 HE21 GLN 68 -14.363 -2.657 -5.201 509 HE22 GLN 68 HE22 GLN 68 -15.335 -1.260 -5.510 510 H LYS 69 HN LYS 69 -8.037 -0.704 -7.300 511 HA LYS 69 HA LYS 69 -7.910 -0.514 -10.032 512 HB2 LYS 69 HB2 LYS 69 -5.636 -0.339 -8.056 513 HB3 LYS 69 HB1 LYS 69 -5.644 0.344 -9.673 514 HG2 LYS 69 HG2 LYS 69 -6.906 1.293 -7.201 515 HG3 LYS 69 HG1 LYS 69 -6.267 2.208 -8.557 516 HD2 LYS 69 HD2 LYS 69 -8.316 1.338 -9.835 517 HD3 LYS 69 HD1 LYS 69 -8.938 0.901 -8.245 518 HE2 LYS 69 HE2 LYS 69 -9.800 2.989 -8.974 519 HE3 LYS 69 HE1 LYS 69 -8.791 3.219 -7.551 520 HZ1 LYS 69 HZ3 LYS 69 -8.340 4.935 -9.166 521 HZ2 LYS 69 HZ1 LYS 69 -8.038 3.788 -10.372 522 HZ3 LYS 69 HZ2 LYS 69 -6.989 3.925 -9.055 523 H PHE 70 HN PHE 70 -5.990 -2.462 -7.850 524 HA PHE 70 HA PHE 70 -4.403 -3.784 -9.697 525 HD1 PHE 70 HD2 PHE 70 -3.470 -6.509 -9.052 526 HD2 PHE 70 HD1 PHE 70 -5.510 -5.548 -5.444 527 HE1 PHE 70 HE2 PHE 70 -3.492 -8.891 -8.432 528 HE2 PHE 70 HE1 PHE 70 -5.536 -7.919 -4.815 529 HZ PHE 70 HZ PHE 70 -4.527 -9.601 -6.311 530 HB2 PHE 70 HB2 PHE 70 -3.461 -4.080 -7.705 531 HB3 PHE 70 HB1 PHE 70 -4.978 -3.869 -6.858 532 H GLN 71 HN GLN 71 -7.659 -4.709 -8.547 533 HA GLN 71 HA GLN 71 -7.804 -6.567 -10.768 534 HB2 GLN 71 HB2 GLN 71 -8.319 -8.511 -9.411 535 HB3 GLN 71 HB1 GLN 71 -6.725 -7.882 -9.007 536 HG2 GLN 71 HG2 GLN 71 -7.377 -7.932 -6.895 537 HG3 GLN 71 HG1 GLN 71 -8.389 -6.544 -7.288 538 HE21 GLN 71 HE21 GLN 71 -10.061 -6.982 -5.931 539 HE22 GLN 71 HE22 GLN 71 -11.081 -8.371 -6.081 540 H SER 72 HN SER 72 -9.257 -4.285 -10.358 541 HA SER 72 HA SER 72 -11.378 -3.501 -9.470 542 HG SER 72 HG SER 72 -10.147 -3.095 -11.978 543 HB2 SER 72 HB2 SER 72 -11.563 -4.890 -12.130 544 HB3 SER 72 HB1 SER 72 -12.837 -3.857 -11.484 545 H ASP 73 HN ASP 73 -11.253 -5.591 -7.835 546 HA ASP 73 HA ASP 73 -14.016 -6.454 -7.809 547 HB2 ASP 73 HB2 ASP 73 -11.724 -8.405 -7.996 548 HB3 ASP 73 HB1 ASP 73 -13.328 -8.854 -7.434 549 H ALA 74 HN ALA 74 -11.795 -4.970 -6.165 550 HA ALA 74 HA ALA 74 -11.348 -6.361 -3.793 551 HB1 ALA 74 HB3 ALA 74 -10.560 -4.368 -2.946 552 HB2 ALA 74 HB1 ALA 74 -11.743 -3.404 -3.827 553 HB3 ALA 74 HB2 ALA 74 -10.381 -4.116 -4.682 554 H ARG 75 HN ARG 75 -12.452 -6.513 -1.898 555 HA ARG 75 HA ARG 75 -15.275 -5.966 -2.002 556 HE ARG 75 HE ARG 75 -10.521 -6.154 1.485 557 HB2 ARG 75 HB2 ARG 75 -15.180 -6.836 0.415 558 HB3 ARG 75 HB1 ARG 75 -14.811 -7.971 -0.872 559 HG2 ARG 75 HG2 ARG 75 -13.299 -8.233 1.010 560 HG3 ARG 75 HG1 ARG 75 -12.426 -7.712 -0.428 561 HD2 ARG 75 HD2 ARG 75 -12.384 -5.432 0.403 562 HD3 ARG 75 HD1 ARG 75 -13.330 -5.901 1.810 563 HH11 ARG 75 HH11 ARG 75 -13.297 -7.722 2.888 564 HH12 ARG 75 HH12 ARG 75 -12.383 -8.523 4.121 565 HH21 ARG 75 HH21 ARG 75 -9.308 -7.203 3.105 566 HH22 ARG 75 HH22 ARG 75 -10.114 -8.227 4.246 567 H GLU 76 HN GLU 76 -12.601 -4.179 -1.360 568 HA GLU 76 HA GLU 76 -12.537 -1.916 -0.923 569 HB2 GLU 76 HB2 GLU 76 -14.977 -2.255 0.826 570 HB3 GLU 76 HB1 GLU 76 -14.233 -0.748 0.309 571 HG2 GLU 76 HG2 GLU 76 -14.714 -1.670 -2.081 572 HG3 GLU 76 HG1 GLU 76 -15.902 -2.656 -1.240 573 H LEU 77 HN LEU 77 -11.297 -1.002 0.660 574 HA LEU 77 HA LEU 77 -10.233 -2.810 2.594 575 HG LEU 77 HG LEU 77 -8.695 -1.297 0.260 576 HB2 LEU 77 HB2 LEU 77 -9.675 0.053 1.902 577 HB3 LEU 77 HB1 LEU 77 -8.834 -0.764 3.198 578 HD11 LEU 77 HD11 LEU 77 -6.915 -0.317 2.382 579 HD12 LEU 77 HD12 LEU 77 -6.989 0.089 0.668 580 HD13 LEU 77 HD13 LEU 77 -6.191 -1.393 1.186 581 HD21 LEU 77 HD23 LEU 77 -7.156 -3.234 1.020 582 HD22 LEU 77 HD21 LEU 77 -8.898 -3.488 0.923 583 HD23 LEU 77 HD22 LEU 77 -8.137 -3.187 2.477 584 H THR 78 HN THR 78 -13.060 -1.915 3.039 585 HA THR 78 HA THR 78 -14.438 -0.993 4.599 586 HB THR 78 HB THR 78 -14.237 -2.109 6.707 587 HG1 THR 78 HG1 THR 78 -12.303 -3.057 7.366 588 HG21 THR 78 HG23 THR 78 -14.215 -4.342 6.009 589 HG22 THR 78 HG21 THR 78 -12.982 -4.046 4.782 590 HG23 THR 78 HG22 THR 78 -14.627 -3.452 4.543 591 H GLU 79 HN GLU 79 -14.304 -0.212 7.069 592 HA GLU 79 HA GLU 79 -13.117 2.372 6.972 593 HB2 GLU 79 HB2 GLU 79 -14.239 0.855 9.338 594 HB3 GLU 79 HB1 GLU 79 -13.867 2.575 9.313 595 HG2 GLU 79 HG2 GLU 79 -15.557 2.925 7.593 596 HG3 GLU 79 HG1 GLU 79 -15.922 1.201 7.595 597 H SER 80 HN SER 80 -12.384 -0.637 8.612 598 HA SER 80 HA SER 80 -10.134 0.319 10.057 599 HG SER 80 HG SER 80 -9.422 -1.366 11.583 600 HB2 SER 80 HB2 SER 80 -11.563 -1.571 10.778 601 HB3 SER 80 HB1 SER 80 -10.900 -2.533 9.458 602 H GLU 81 HN GLU 81 -10.299 -1.911 7.178 603 HA GLU 81 HA GLU 81 -7.582 -2.343 7.032 604 HB2 GLU 81 HB2 GLU 81 -9.772 -3.139 5.574 605 HB3 GLU 81 HB1 GLU 81 -8.882 -2.166 4.425 606 HG2 GLU 81 HG2 GLU 81 -7.858 -4.554 5.903 607 HG3 GLU 81 HG1 GLU 81 -8.198 -4.431 4.178 608 H THR 82 HN THR 82 -9.427 0.323 5.487 609 HA THR 82 HA THR 82 -7.316 1.330 3.990 610 HB THR 82 HB THR 82 -8.437 3.527 4.127 611 HG1 THR 82 HG1 THR 82 -9.942 3.902 5.592 612 HG21 THR 82 HG23 THR 82 -10.236 1.166 3.597 613 HG22 THR 82 HG21 THR 82 -9.154 1.951 2.444 614 HG23 THR 82 HG22 THR 82 -10.557 2.818 3.071 615 H LYS 83 HN LYS 83 -7.763 1.266 7.395 616 HA LYS 83 HA LYS 83 -6.291 3.517 8.190 617 HB2 LYS 83 HB2 LYS 83 -7.619 2.037 9.713 618 HB3 LYS 83 HB1 LYS 83 -6.370 0.810 9.545 619 HG2 LYS 83 HG2 LYS 83 -4.739 2.347 10.535 620 HG3 LYS 83 HG1 LYS 83 -6.010 3.556 10.725 621 HD2 LYS 83 HD2 LYS 83 -7.250 1.989 12.166 622 HD3 LYS 83 HD1 LYS 83 -5.932 0.827 12.009 623 HE2 LYS 83 HE2 LYS 83 -5.748 3.583 13.223 624 HE3 LYS 83 HE1 LYS 83 -5.758 2.056 14.103 625 HZ1 LYS 83 HZ3 LYS 83 -3.517 2.876 13.870 626 HZ2 LYS 83 HZ1 LYS 83 -3.676 2.953 12.186 627 HZ3 LYS 83 HZ2 LYS 83 -3.693 1.455 12.970 628 H SER 84 HN SER 84 -5.373 0.290 7.170 629 HA SER 84 HA SER 84 -2.679 0.268 7.740 630 HG SER 84 HG SER 84 -3.345 -2.070 7.867 631 HB2 SER 84 HB2 SER 84 -4.214 -0.922 5.423 632 HB3 SER 84 HB1 SER 84 -2.573 -1.352 5.855 633 H LEU 85 HN LEU 85 -4.252 1.197 4.674 634 HA LEU 85 HA LEU 85 -1.964 2.191 3.432 635 HG LEU 85 HG LEU 85 -4.307 0.468 2.402 636 HB2 LEU 85 HB2 LEU 85 -4.910 2.680 3.075 637 HB3 LEU 85 HB1 LEU 85 -3.719 3.385 2.011 638 HD11 LEU 85 HD11 LEU 85 -4.528 2.333 0.050 639 HD12 LEU 85 HD12 LEU 85 -5.838 1.537 0.914 640 HD13 LEU 85 HD13 LEU 85 -4.712 0.582 -0.043 641 HD21 LEU 85 HD23 LEU 85 -1.928 0.691 2.262 642 HD22 LEU 85 HD21 LEU 85 -2.069 1.794 0.898 643 HD23 LEU 85 HD22 LEU 85 -2.540 0.108 0.724 644 H MET 86 HN MET 86 -4.365 3.661 5.501 645 HA MET 86 HA MET 86 -3.581 6.346 5.272 646 HB2 MET 86 HB2 MET 86 -4.685 4.899 7.694 647 HB3 MET 86 HB1 MET 86 -4.648 6.645 7.481 648 HG2 MET 86 HG2 MET 86 -5.925 5.381 5.240 649 HG3 MET 86 HG1 MET 86 -6.683 4.884 6.750 650 HE1 MET 86 HE3 MET 86 -5.007 8.582 6.393 651 HE2 MET 86 HE1 MET 86 -6.201 9.178 5.241 652 HE3 MET 86 HE2 MET 86 -5.205 7.775 4.837 653 H ASP 87 HN ASP 87 -2.619 3.820 7.541 654 HA ASP 87 HA ASP 87 -0.591 5.318 8.873 655 HB2 ASP 87 HB2 ASP 87 -1.302 2.404 8.770 656 HB3 ASP 87 HB1 ASP 87 0.038 3.013 9.738 657 H ALA 88 HN ALA 88 -0.633 4.197 5.787 658 HA ALA 88 HA ALA 88 1.858 2.838 5.586 659 HB1 ALA 88 HB3 ALA 88 1.383 2.611 3.347 660 HB2 ALA 88 HB1 ALA 88 0.467 4.119 3.282 661 HB3 ALA 88 HB2 ALA 88 -0.215 2.708 4.089 662 H ALA 89 HN ALA 89 0.912 6.226 5.421 663 HA ALA 89 HA ALA 89 3.700 6.962 5.337 664 HB1 ALA 89 HB3 ALA 89 3.255 6.627 2.960 665 HB2 ALA 89 HB1 ALA 89 3.590 8.320 3.318 666 HB3 ALA 89 HB2 ALA 89 1.930 7.792 3.026 667 H ASP 90 HN ASP 90 0.977 8.909 4.191 668 HA ASP 90 HA ASP 90 1.600 10.884 6.248 669 HB2 ASP 90 HB2 ASP 90 1.020 11.242 3.638 670 HB3 ASP 90 HB1 ASP 90 -0.592 11.389 4.326 671 H ASN 91 HN ASN 91 0.815 9.490 7.934 672 HA ASN 91 HA ASN 91 -2.083 9.053 7.978 673 HB2 ASN 91 HB2 ASN 91 -1.134 7.848 10.265 674 HB3 ASN 91 HB1 ASN 91 -1.468 7.041 8.743 675 HD21 ASN 91 HD21 ASN 91 0.265 6.576 7.332 676 HD22 ASN 91 HD22 ASN 91 1.889 6.507 7.915 677 H ASP 92 HN ASP 92 0.447 10.195 10.202 678 HA ASP 92 HA ASP 92 -1.423 11.133 12.119 679 HB2 ASP 92 HB2 ASP 92 0.489 11.907 13.323 680 HB3 ASP 92 HB1 ASP 92 0.890 10.358 12.598 681 H GLY 93 HN GLY 93 -0.189 12.613 9.227 682 HA2 GLY 93 HA2 GLY 93 -0.972 15.231 10.324 683 HA3 GLY 93 HA1 GLY 93 0.166 15.001 9.014 684 H ASP 94 HN ASP 94 -0.638 14.438 6.933 685 HA ASP 94 HA ASP 94 -3.045 15.853 6.314 686 HB2 ASP 94 HB2 ASP 94 -1.263 14.214 4.507 687 HB3 ASP 94 HB1 ASP 94 -2.506 15.345 3.986 688 H GLY 95 HN GLY 95 -2.076 12.445 5.770 689 HA2 GLY 95 HA2 GLY 95 -3.644 10.671 6.299 690 HA3 GLY 95 HA1 GLY 95 -4.945 11.770 5.873 691 H LYS 96 HN LYS 96 -2.304 11.960 3.736 692 HA LYS 96 HA LYS 96 -3.762 10.310 1.798 693 HB2 LYS 96 HB2 LYS 96 -3.610 12.016 0.313 694 HB3 LYS 96 HB1 LYS 96 -3.089 13.001 1.663 695 HG2 LYS 96 HG2 LYS 96 -1.269 11.537 -0.238 696 HG3 LYS 96 HG1 LYS 96 -1.632 13.259 -0.272 697 HD2 LYS 96 HD2 LYS 96 -0.817 12.936 2.302 698 HD3 LYS 96 HD1 LYS 96 0.189 11.750 1.457 699 HE2 LYS 96 HE2 LYS 96 1.184 13.373 0.114 700 HE3 LYS 96 HE1 LYS 96 -0.103 14.541 0.404 701 HZ1 LYS 96 HZ3 LYS 96 1.622 13.637 2.618 702 HZ2 LYS 96 HZ1 LYS 96 0.729 15.066 2.482 703 HZ3 LYS 96 HZ2 LYS 96 2.141 14.862 1.574 704 H ILE 97 HN ILE 97 -2.462 9.117 0.204 705 HA ILE 97 HA ILE 97 0.267 8.537 1.148 706 HB ILE 97 HB ILE 97 -1.538 6.486 -0.100 707 HG12 ILE 97 HG12 ILE 97 -2.438 7.139 2.089 708 HG13 ILE 97 HG11 ILE 97 -1.761 5.516 2.112 709 HG21 ILE 97 HG21 ILE 97 0.231 4.977 0.950 710 HG22 ILE 97 HG22 ILE 97 1.193 6.447 1.142 711 HG23 ILE 97 HG23 ILE 97 0.705 5.917 -0.466 712 HD11 ILE 97 HD13 ILE 97 0.241 6.347 3.202 713 HD12 ILE 97 HD11 ILE 97 -1.202 6.754 4.130 714 HD13 ILE 97 HD12 ILE 97 -0.406 7.986 3.153 715 H GLY 98 HN GLY 98 1.375 9.685 -0.416 716 HA2 GLY 98 HA2 GLY 98 0.925 8.886 -3.197 717 HA3 GLY 98 HA1 GLY 98 1.698 10.378 -2.675 718 H ALA 99 HN ALA 99 2.980 8.944 -4.524 719 HA ALA 99 HA ALA 99 4.679 6.870 -3.673 720 HB1 ALA 99 HB3 ALA 99 5.925 7.220 -5.621 721 HB2 ALA 99 HB1 ALA 99 5.592 8.953 -5.636 722 HB3 ALA 99 HB2 ALA 99 4.317 7.808 -6.045 723 H ASP 100 HN ASP 100 5.185 10.378 -3.670 724 HA ASP 100 HA ASP 100 7.756 10.394 -2.552 725 HB2 ASP 100 HB2 ASP 100 6.729 12.369 -3.608 726 HB3 ASP 100 HB1 ASP 100 5.576 12.478 -2.284 727 H GLU 101 HN GLU 101 4.601 10.824 -0.991 728 HA GLU 101 HA GLU 101 5.459 10.957 1.649 729 HB2 GLU 101 HB2 GLU 101 2.962 10.557 0.206 730 HB3 GLU 101 HB1 GLU 101 2.989 9.626 1.690 731 HG2 GLU 101 HG2 GLU 101 2.065 12.075 1.578 732 HG3 GLU 101 HG1 GLU 101 2.885 11.466 3.001 733 H PHE 102 HN PHE 102 4.259 8.173 -0.187 734 HA PHE 102 HA PHE 102 4.728 6.196 1.667 735 HD1 PHE 102 HD1 PHE 102 6.948 4.343 -0.465 736 HD2 PHE 102 HD2 PHE 102 2.793 3.724 0.165 737 HE1 PHE 102 HE1 PHE 102 7.373 1.972 -0.069 738 HE2 PHE 102 HE2 PHE 102 3.211 1.329 0.562 739 HZ PHE 102 HZ PHE 102 5.507 0.449 0.444 740 HB2 PHE 102 HB2 PHE 102 3.535 5.814 -0.450 741 HB3 PHE 102 HB1 PHE 102 5.053 5.946 -1.342 742 H GLN 103 HN GLN 103 7.019 7.643 -0.644 743 HA GLN 103 HA GLN 103 9.196 5.962 -0.178 744 HB2 GLN 103 HB2 GLN 103 9.168 8.918 -0.808 745 HB3 GLN 103 HB1 GLN 103 10.634 7.947 -0.774 746 HG2 GLN 103 HG2 GLN 103 8.944 6.551 -2.451 747 HG3 GLN 103 HG1 GLN 103 8.641 8.243 -2.825 748 HE21 GLN 103 HE21 GLN 103 9.943 6.165 -4.405 749 HE22 GLN 103 HE22 GLN 103 11.509 6.785 -4.792 750 H GLU 104 HN GLU 104 7.888 8.587 1.707 751 HA GLU 104 HA GLU 104 10.071 8.993 3.445 752 HB2 GLU 104 HB2 GLU 104 7.132 9.315 4.077 753 HB3 GLU 104 HB1 GLU 104 8.471 10.056 4.942 754 HG2 GLU 104 HG2 GLU 104 7.678 10.600 2.090 755 HG3 GLU 104 HG1 GLU 104 7.398 11.655 3.476 756 H MET 105 HN MET 105 7.335 6.766 3.600 757 HA MET 105 HA MET 105 7.750 5.760 6.170 758 HB2 MET 105 HB2 MET 105 5.834 5.383 4.420 759 HB3 MET 105 HB1 MET 105 6.782 3.967 3.991 760 HG2 MET 105 HG2 MET 105 5.767 4.596 6.751 761 HG3 MET 105 HG1 MET 105 5.016 3.475 5.621 762 HE1 MET 105 HE3 MET 105 6.498 1.061 8.291 763 HE2 MET 105 HE1 MET 105 5.115 1.346 7.235 764 HE3 MET 105 HE2 MET 105 5.574 2.557 8.430 765 H VAL 106 HN VAL 106 8.844 4.370 3.067 766 HA VAL 106 HA VAL 106 10.288 2.247 4.158 767 HB VAL 106 HB VAL 106 9.755 2.316 1.791 768 HG11 VAL 106 HG11 VAL 106 11.507 4.746 1.817 769 HG12 VAL 106 HG12 VAL 106 9.867 4.562 1.195 770 HG13 VAL 106 HG13 VAL 106 11.223 3.833 0.338 771 HG21 VAL 106 HG23 VAL 106 12.730 2.329 2.296 772 HG22 VAL 106 HG21 VAL 106 11.944 1.668 0.861 773 HG23 VAL 106 HG22 VAL 106 11.648 0.946 2.443 774 H HIS 107 HN HIS 107 11.087 5.598 3.765 775 HA HIS 107 HA HIS 107 13.906 5.246 4.246 776 HD1 HIS 107 HD1 HIS 107 15.630 7.557 2.756 777 HD2 HIS 107 HD2 HIS 107 13.793 9.000 6.192 778 HE1 HIS 107 HE1 HIS 107 17.339 9.035 3.862 779 HE2 HIS 107 HE2 HIS 107 16.240 9.813 5.992 780 HB2 HIS 107 HB2 HIS 107 13.123 7.088 2.842 781 HB3 HIS 107 HB1 HIS 107 12.214 7.752 4.195 782 H SER 108 HN SER 108 11.072 6.130 6.143 783 HA SER 108 HA SER 108 12.249 7.184 8.401 784 HG SER 108 HG SER 108 9.089 4.813 9.021 785 HB2 SER 108 HB2 SER 108 10.285 6.450 9.639 786 HB3 SER 108 HB1 SER 108 9.809 7.042 8.049
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